USER MOD reduce.3.24.130724 H: found=0, std=0, add=1306, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1309 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 136 LYS NZ :NH3+ -147:sc= 0 (180deg=-0.95) USER MOD Set 1.2: A 155 SER OG : rot 180:sc= -2.1! USER MOD Set 2.1: A 77 ASN : amide:sc=-0.00643 K(o=-5.5,f=-0.12) USER MOD Set 2.2: A 82 GLN : amide:sc= -2.98 K(o=-5.5,f=-0.12) USER MOD Set 2.3: A 109 ASN : amide:sc= -2.53 K(o=-5.5,f=-0.12) USER MOD Set 3.1: A 61 TYR OH : rot 180:sc= 0.199 USER MOD Set 3.2: A 65 LYS NZ :NH3+ 158:sc= 0.211 (180deg=-1.03) USER MOD Set 4.1: A 49 TYR OH : rot 180:sc= 0 USER MOD Set 4.2: A 51 LYS NZ :NH3+ 168:sc=-0.00187 (180deg=-0.136) USER MOD Set 4.3: A 86 ASN : amide:sc= 0.624 K(o=-0.71,f=0.39) USER MOD Set 4.4: A 138 ASN : amide:sc= -1.33! K(o=-0.71!,f=0.39) USER MOD Set 5.1: A 28 TYR OH : rot -127:sc= 1.26 USER MOD Set 5.2: A 29 ASN : amide:sc= -5.96! C(o=-11!,f=-11!) USER MOD Set 5.3: A 32 GLN : amide:sc= -0.712 K(o=-11,f=-12!) USER MOD Set 5.4: A 33 HIS : no HE2:sc= -4.89! C(o=-11!,f=-26!) USER MOD Set 5.5: A 70 THR OG1 : rot 45:sc= -0.462! USER MOD Single : A 11 MET CE :methyl 158:sc= -0.18 (180deg=-0.808) USER MOD Single : A 13 SER OG : rot -72:sc= 0.261 USER MOD Single : A 14 SER OG : rot -20:sc= 0.44 USER MOD Single : A 25 HIS : no HD1:sc= -3.91! C(o=-3.9!,f=-3.9!) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 SER OG : rot 140:sc= 0.693 USER MOD Single : A 41 TYR OH : rot -1:sc= -2.64! USER MOD Single : A 42 ASN : amide:sc= -9.47! C(o=-9.5!,f=-13!) USER MOD Single : A 45 SER OG : rot -87:sc= 0.969 USER MOD Single : A 46 LYS NZ :NH3+ -173:sc= 1.51 (180deg=1.41) USER MOD Single : A 47 CYS SG : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot -137:sc= 1.01 USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 78:sc= -1.15! USER MOD Single : A 58 THR OG1 : rot 72:sc= 0.501 USER MOD Single : A 59 THR OG1 : rot 87:sc= 1.17 USER MOD Single : A 62 ASN : amide:sc= -0.189 X(o=-0.19,f=0) USER MOD Single : A 63 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0774) USER MOD Single : A 64 TYR OH : rot 148:sc= 1.06 USER MOD Single : A 66 SER OG : rot 117:sc= 0.919 USER MOD Single : A 67 GLN : amide:sc= -2.58! C(o=-2.6!,f=-13!) USER MOD Single : A 76 SER OG : rot 73:sc= 1.28 USER MOD Single : A 78 GLN : amide:sc= -6.11! C(o=-6.1!,f=-2.8!) USER MOD Single : A 91 LYS NZ :NH3+ -130:sc= 1.25 (180deg=0.665) USER MOD Single : A 95 CYS SG : rot 68:sc= -1.24! USER MOD Single : A 96 THR OG1 : rot 31:sc= 0.62 USER MOD Single : A 97 LYS NZ :NH3+ -166:sc= -0.0888 (180deg=-0.454) USER MOD Single : A 99 LYS NZ :NH3+ -167:sc= -0.0126 (180deg=-0.151) USER MOD Single : A 105 MET CE :methyl 154:sc= -4.16! (180deg=-5.85!) USER MOD Single : A 107 LYS NZ :NH3+ 173:sc= 1.22 (180deg=1.1) USER MOD Single : A 111 ASN : amide:sc= -0.257 K(o=-0.26,f=-4.2!) USER MOD Single : A 114 ASN : amide:sc= -1.28! K(o=-1.3!,f=-0.035) USER MOD Single : A 116 HIS : no HD1:sc= -5.84! C(o=-5.8!,f=-12!) USER MOD Single : A 119 TYR OH : rot 178:sc= 0.0203! USER MOD Single : A 121 TYR OH : rot 26:sc= 0.0158 USER MOD Single : A 122 MET CE :methyl -115:sc= -5.85! (180deg=-9.65!) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 THR OG1 : rot 63:sc= 1.26 USER MOD Single : A 126 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0268) USER MOD Single : A 132 THR OG1 : rot 180:sc= -0.598 USER MOD Single : A 133 LYS NZ :NH3+ -166:sc= -0.0697 (180deg=-0.26) USER MOD Single : A 140 THR OG1 : rot 63:sc= -0.958! USER MOD Single : A 141 SER OG : rot -118:sc= 1.5 USER MOD Single : A 159 SER OG : rot 180:sc= 0 USER MOD Single : A 161 LYS NZ :NH3+ -147:sc= -0.191 (180deg=-2.28!) USER MOD Single : A 166 LYS NZ :NH3+ -173:sc= 0.339 (180deg=0.191) USER MOD Single : A 173 SER OG : rot 10:sc= 0.449 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 10 -12.638 18.242 -0.898 1.00 5.22 N ATOM 2 CA GLY A 10 -11.834 19.015 -1.875 1.00 4.42 C ATOM 3 C GLY A 10 -10.466 18.406 -2.081 1.00 3.29 C ATOM 4 O GLY A 10 -10.344 17.350 -2.703 1.00 3.60 O ATOM 0 HA2 GLY A 10 -12.361 19.056 -2.828 1.00 4.42 H new ATOM 0 HA3 GLY A 10 -11.726 20.042 -1.526 1.00 4.42 H new ATOM 10 N MET A 11 -9.435 19.055 -1.557 1.00 2.49 N ATOM 11 CA MET A 11 -8.077 18.536 -1.672 1.00 1.84 C ATOM 12 C MET A 11 -7.853 17.412 -0.670 1.00 1.40 C ATOM 13 O MET A 11 -7.408 17.644 0.456 1.00 2.20 O ATOM 14 CB MET A 11 -7.041 19.643 -1.452 1.00 2.43 C ATOM 15 CG MET A 11 -5.606 19.178 -1.666 1.00 3.11 C ATOM 16 SD MET A 11 -4.390 20.463 -1.313 1.00 4.02 S ATOM 17 CE MET A 11 -4.708 20.763 0.424 1.00 4.85 C ATOM 0 H MET A 11 -9.511 19.937 -1.051 1.00 2.49 H new ATOM 0 HA MET A 11 -7.953 18.146 -2.682 1.00 1.84 H new ATOM 0 HB2 MET A 11 -7.253 20.469 -2.131 1.00 2.43 H new ATOM 0 HB3 MET A 11 -7.143 20.030 -0.438 1.00 2.43 H new ATOM 0 HG2 MET A 11 -5.410 18.315 -1.029 1.00 3.11 H new ATOM 0 HG3 MET A 11 -5.487 18.846 -2.697 1.00 3.11 H new ATOM 0 HE1 MET A 11 -3.828 21.214 0.882 1.00 4.85 H new ATOM 0 HE2 MET A 11 -5.558 21.438 0.527 1.00 4.85 H new ATOM 0 HE3 MET A 11 -4.932 19.819 0.921 1.00 4.85 H new ATOM 27 N GLY A 12 -8.174 16.197 -1.077 1.00 0.92 N ATOM 28 CA GLY A 12 -7.979 15.058 -0.213 1.00 0.85 C ATOM 29 C GLY A 12 -9.284 14.488 0.296 1.00 0.79 C ATOM 30 O GLY A 12 -9.466 14.302 1.498 1.00 1.55 O ATOM 0 H GLY A 12 -8.567 15.979 -1.993 1.00 0.92 H new ATOM 0 HA2 GLY A 12 -7.435 14.284 -0.754 1.00 0.85 H new ATOM 0 HA3 GLY A 12 -7.359 15.351 0.634 1.00 0.85 H new ATOM 34 N SER A 13 -10.194 14.205 -0.616 1.00 0.52 N ATOM 35 CA SER A 13 -11.469 13.601 -0.256 1.00 0.53 C ATOM 36 C SER A 13 -11.340 12.087 -0.279 1.00 0.41 C ATOM 37 O SER A 13 -12.059 11.375 0.426 1.00 0.53 O ATOM 38 CB SER A 13 -12.547 14.059 -1.236 1.00 0.79 C ATOM 39 OG SER A 13 -12.411 15.444 -1.542 1.00 1.58 O ATOM 0 H SER A 13 -10.077 14.383 -1.614 1.00 0.52 H new ATOM 0 HA SER A 13 -11.752 13.914 0.749 1.00 0.53 H new ATOM 0 HB2 SER A 13 -12.481 13.473 -2.153 1.00 0.79 H new ATOM 0 HB3 SER A 13 -13.533 13.873 -0.809 1.00 0.79 H new ATOM 0 HG SER A 13 -12.681 15.978 -0.766 1.00 1.58 H new ATOM 45 N SER A 14 -10.389 11.611 -1.070 1.00 0.32 N ATOM 46 CA SER A 14 -10.142 10.216 -1.275 1.00 0.22 C ATOM 47 C SER A 14 -8.801 10.142 -1.941 1.00 0.21 C ATOM 48 O SER A 14 -8.329 11.126 -2.508 1.00 0.35 O ATOM 49 CB SER A 14 -11.227 9.582 -2.155 1.00 0.25 C ATOM 50 OG SER A 14 -12.524 9.825 -1.631 1.00 1.17 O ATOM 0 H SER A 14 -9.757 12.214 -1.596 1.00 0.32 H new ATOM 0 HA SER A 14 -10.158 9.665 -0.334 1.00 0.22 H new ATOM 0 HB2 SER A 14 -11.160 9.985 -3.166 1.00 0.25 H new ATOM 0 HB3 SER A 14 -11.057 8.508 -2.228 1.00 0.25 H new ATOM 0 HG SER A 14 -12.455 10.057 -0.681 1.00 1.17 H new ATOM 56 N ILE A 15 -8.182 9.003 -1.851 1.00 0.18 N ATOM 57 CA ILE A 15 -6.857 8.807 -2.378 1.00 0.18 C ATOM 58 C ILE A 15 -6.812 9.060 -3.884 1.00 0.17 C ATOM 59 O ILE A 15 -5.762 9.345 -4.444 1.00 0.19 O ATOM 60 CB ILE A 15 -6.395 7.384 -2.075 1.00 0.17 C ATOM 61 CG1 ILE A 15 -7.408 6.383 -2.628 1.00 0.18 C ATOM 62 CG2 ILE A 15 -6.232 7.199 -0.582 1.00 0.23 C ATOM 63 CD1 ILE A 15 -6.817 5.039 -2.973 1.00 0.38 C ATOM 0 H ILE A 15 -8.581 8.176 -1.408 1.00 0.18 H new ATOM 0 HA ILE A 15 -6.189 9.523 -1.900 1.00 0.18 H new ATOM 0 HB ILE A 15 -5.431 7.210 -2.554 1.00 0.17 H new ATOM 0 HG12 ILE A 15 -8.202 6.242 -1.894 1.00 0.18 H new ATOM 0 HG13 ILE A 15 -7.870 6.805 -3.520 1.00 0.18 H new ATOM 0 HG21 ILE A 15 -5.902 6.181 -0.375 1.00 0.23 H new ATOM 0 HG22 ILE A 15 -5.490 7.904 -0.207 1.00 0.23 H new ATOM 0 HG23 ILE A 15 -7.186 7.379 -0.087 1.00 0.23 H new ATOM 0 HD11 ILE A 15 -7.600 4.386 -3.359 1.00 0.38 H new ATOM 0 HD12 ILE A 15 -6.044 5.165 -3.731 1.00 0.38 H new ATOM 0 HD13 ILE A 15 -6.380 4.593 -2.079 1.00 0.38 H new ATOM 75 N PHE A 16 -7.972 8.998 -4.525 1.00 0.18 N ATOM 76 CA PHE A 16 -8.077 9.217 -5.962 1.00 0.19 C ATOM 77 C PHE A 16 -7.794 10.667 -6.331 1.00 0.21 C ATOM 78 O PHE A 16 -7.779 11.032 -7.507 1.00 0.30 O ATOM 79 CB PHE A 16 -9.454 8.837 -6.436 1.00 0.20 C ATOM 80 CG PHE A 16 -9.817 7.432 -6.094 1.00 0.19 C ATOM 81 CD1 PHE A 16 -9.057 6.371 -6.535 1.00 0.22 C ATOM 82 CD2 PHE A 16 -10.919 7.184 -5.305 1.00 0.18 C ATOM 83 CE1 PHE A 16 -9.390 5.083 -6.178 1.00 0.22 C ATOM 84 CE2 PHE A 16 -11.261 5.901 -4.957 1.00 0.19 C ATOM 85 CZ PHE A 16 -10.488 4.815 -5.537 1.00 0.19 C ATOM 0 H PHE A 16 -8.861 8.796 -4.067 1.00 0.18 H new ATOM 0 HA PHE A 16 -7.329 8.592 -6.450 1.00 0.19 H new ATOM 0 HB2 PHE A 16 -10.185 9.514 -5.994 1.00 0.20 H new ATOM 0 HB3 PHE A 16 -9.510 8.969 -7.517 1.00 0.20 H new ATOM 0 HD1 PHE A 16 -8.197 6.550 -7.163 1.00 0.22 H new ATOM 0 HD2 PHE A 16 -11.521 8.010 -4.956 1.00 0.18 H new ATOM 0 HE1 PHE A 16 -8.722 4.275 -6.437 1.00 0.22 H new ATOM 0 HE2 PHE A 16 -12.076 5.705 -4.276 1.00 0.19 H new ATOM 0 HZ PHE A 16 -10.824 3.793 -5.436 1.00 0.19 H new ATOM 95 N ASP A 17 -7.563 11.481 -5.313 1.00 0.21 N ATOM 96 CA ASP A 17 -7.123 12.852 -5.495 1.00 0.26 C ATOM 97 C ASP A 17 -5.730 12.834 -6.077 1.00 0.25 C ATOM 98 O ASP A 17 -5.211 13.852 -6.538 1.00 0.32 O ATOM 99 CB ASP A 17 -7.086 13.586 -4.150 1.00 0.32 C ATOM 100 CG ASP A 17 -8.191 14.607 -3.985 1.00 1.13 C ATOM 101 OD1 ASP A 17 -8.050 15.737 -4.505 1.00 1.30 O ATOM 102 OD2 ASP A 17 -9.218 14.274 -3.359 1.00 2.11 O ATOM 0 H ASP A 17 -7.676 11.208 -4.337 1.00 0.21 H new ATOM 0 HA ASP A 17 -7.816 13.367 -6.160 1.00 0.26 H new ATOM 0 HB2 ASP A 17 -7.156 12.855 -3.345 1.00 0.32 H new ATOM 0 HB3 ASP A 17 -6.123 14.085 -4.045 1.00 0.32 H new ATOM 107 N PHE A 18 -5.125 11.654 -6.038 1.00 0.22 N ATOM 108 CA PHE A 18 -3.755 11.494 -6.426 1.00 0.23 C ATOM 109 C PHE A 18 -3.605 10.369 -7.401 1.00 0.26 C ATOM 110 O PHE A 18 -3.829 9.204 -7.079 1.00 0.29 O ATOM 111 CB PHE A 18 -2.900 11.255 -5.207 1.00 0.21 C ATOM 112 CG PHE A 18 -2.987 12.397 -4.257 1.00 0.22 C ATOM 113 CD1 PHE A 18 -2.544 13.656 -4.626 1.00 0.27 C ATOM 114 CD2 PHE A 18 -3.546 12.225 -3.014 1.00 0.23 C ATOM 115 CE1 PHE A 18 -2.651 14.720 -3.759 1.00 0.31 C ATOM 116 CE2 PHE A 18 -3.663 13.282 -2.148 1.00 0.29 C ATOM 117 CZ PHE A 18 -3.214 14.535 -2.514 1.00 0.31 C ATOM 0 H PHE A 18 -5.579 10.792 -5.736 1.00 0.22 H new ATOM 0 HA PHE A 18 -3.424 12.410 -6.916 1.00 0.23 H new ATOM 0 HB2 PHE A 18 -3.219 10.339 -4.709 1.00 0.21 H new ATOM 0 HB3 PHE A 18 -1.863 11.108 -5.510 1.00 0.21 H new ATOM 0 HD1 PHE A 18 -2.110 13.805 -5.604 1.00 0.27 H new ATOM 0 HD2 PHE A 18 -3.897 11.248 -2.716 1.00 0.23 H new ATOM 0 HE1 PHE A 18 -2.295 15.696 -4.053 1.00 0.31 H new ATOM 0 HE2 PHE A 18 -4.108 13.133 -1.175 1.00 0.29 H new ATOM 0 HZ PHE A 18 -3.303 15.365 -1.829 1.00 0.31 H new ATOM 127 N GLU A 19 -3.281 10.755 -8.604 1.00 0.35 N ATOM 128 CA GLU A 19 -2.927 9.819 -9.642 1.00 0.43 C ATOM 129 C GLU A 19 -1.847 8.862 -9.140 1.00 0.34 C ATOM 130 O GLU A 19 -1.013 9.214 -8.295 1.00 0.37 O ATOM 131 CB GLU A 19 -2.436 10.569 -10.884 1.00 0.63 C ATOM 132 CG GLU A 19 -2.314 9.688 -12.115 1.00 1.08 C ATOM 133 CD GLU A 19 -3.629 9.033 -12.479 1.00 2.04 C ATOM 134 OE1 GLU A 19 -4.022 8.064 -11.799 1.00 2.86 O ATOM 135 OE2 GLU A 19 -4.284 9.492 -13.439 1.00 2.30 O ATOM 0 H GLU A 19 -3.254 11.732 -8.896 1.00 0.35 H new ATOM 0 HA GLU A 19 -3.811 9.240 -9.911 1.00 0.43 H new ATOM 0 HB2 GLU A 19 -3.123 11.388 -11.099 1.00 0.63 H new ATOM 0 HB3 GLU A 19 -1.465 11.016 -10.669 1.00 0.63 H new ATOM 0 HG2 GLU A 19 -1.963 10.287 -12.955 1.00 1.08 H new ATOM 0 HG3 GLU A 19 -1.563 8.918 -11.936 1.00 1.08 H new ATOM 142 N VAL A 20 -1.861 7.665 -9.676 1.00 0.29 N ATOM 143 CA VAL A 20 -0.923 6.638 -9.279 1.00 0.26 C ATOM 144 C VAL A 20 0.029 6.378 -10.420 1.00 0.25 C ATOM 145 O VAL A 20 -0.267 6.700 -11.559 1.00 0.28 O ATOM 146 CB VAL A 20 -1.656 5.334 -8.863 1.00 0.31 C ATOM 147 CG1 VAL A 20 -0.720 4.143 -8.787 1.00 0.67 C ATOM 148 CG2 VAL A 20 -2.321 5.547 -7.527 1.00 0.49 C ATOM 0 H VAL A 20 -2.520 7.374 -10.398 1.00 0.29 H new ATOM 0 HA VAL A 20 -0.365 6.983 -8.409 1.00 0.26 H new ATOM 0 HB VAL A 20 -2.398 5.110 -9.629 1.00 0.31 H new ATOM 0 HG11 VAL A 20 -1.282 3.257 -8.492 1.00 0.67 H new ATOM 0 HG12 VAL A 20 -0.264 3.976 -9.763 1.00 0.67 H new ATOM 0 HG13 VAL A 20 0.060 4.339 -8.051 1.00 0.67 H new ATOM 0 HG21 VAL A 20 -2.838 4.635 -7.228 1.00 0.49 H new ATOM 0 HG22 VAL A 20 -1.567 5.797 -6.781 1.00 0.49 H new ATOM 0 HG23 VAL A 20 -3.040 6.363 -7.604 1.00 0.49 H new ATOM 158 N LEU A 21 1.190 5.850 -10.107 1.00 0.28 N ATOM 159 CA LEU A 21 2.206 5.611 -11.097 1.00 0.35 C ATOM 160 C LEU A 21 2.589 4.154 -11.119 1.00 0.38 C ATOM 161 O LEU A 21 3.114 3.651 -10.137 1.00 0.58 O ATOM 162 CB LEU A 21 3.428 6.465 -10.776 1.00 0.45 C ATOM 163 CG LEU A 21 3.172 7.960 -10.865 1.00 0.46 C ATOM 164 CD1 LEU A 21 4.392 8.749 -10.442 1.00 0.69 C ATOM 165 CD2 LEU A 21 2.774 8.300 -12.278 1.00 0.68 C ATOM 0 H LEU A 21 1.453 5.576 -9.160 1.00 0.28 H new ATOM 0 HA LEU A 21 1.818 5.879 -12.080 1.00 0.35 H new ATOM 0 HB2 LEU A 21 3.774 6.224 -9.771 1.00 0.45 H new ATOM 0 HB3 LEU A 21 4.234 6.202 -11.462 1.00 0.45 H new ATOM 0 HG LEU A 21 2.365 8.229 -10.184 1.00 0.46 H new ATOM 0 HD11 LEU A 21 4.179 9.815 -10.516 1.00 0.69 H new ATOM 0 HD12 LEU A 21 4.647 8.500 -9.412 1.00 0.69 H new ATOM 0 HD13 LEU A 21 5.230 8.500 -11.093 1.00 0.69 H new ATOM 0 HD21 LEU A 21 2.587 9.371 -12.356 1.00 0.68 H new ATOM 0 HD22 LEU A 21 3.578 8.022 -12.959 1.00 0.68 H new ATOM 0 HD23 LEU A 21 1.869 7.754 -12.542 1.00 0.68 H new ATOM 177 N ASP A 22 2.329 3.485 -12.241 1.00 0.33 N ATOM 178 CA ASP A 22 2.767 2.103 -12.434 1.00 0.37 C ATOM 179 C ASP A 22 4.279 2.075 -12.288 1.00 0.35 C ATOM 180 O ASP A 22 4.893 3.137 -12.232 1.00 0.40 O ATOM 181 CB ASP A 22 2.352 1.596 -13.823 1.00 0.50 C ATOM 182 CG ASP A 22 2.276 0.081 -13.915 1.00 1.16 C ATOM 183 OD1 ASP A 22 3.314 -0.580 -13.700 1.00 1.87 O ATOM 184 OD2 ASP A 22 1.184 -0.456 -14.190 1.00 1.48 O ATOM 0 H ASP A 22 1.817 3.878 -13.031 1.00 0.33 H new ATOM 0 HA ASP A 22 2.302 1.451 -11.695 1.00 0.37 H new ATOM 0 HB2 ASP A 22 1.380 2.017 -14.080 1.00 0.50 H new ATOM 0 HB3 ASP A 22 3.064 1.962 -14.563 1.00 0.50 H new ATOM 189 N ALA A 23 4.889 0.910 -12.240 1.00 0.39 N ATOM 190 CA ALA A 23 6.296 0.815 -11.859 1.00 0.42 C ATOM 191 C ALA A 23 7.201 1.710 -12.721 1.00 0.47 C ATOM 192 O ALA A 23 8.251 2.167 -12.266 1.00 0.59 O ATOM 193 CB ALA A 23 6.765 -0.632 -11.917 1.00 0.52 C ATOM 0 H ALA A 23 4.444 0.018 -12.457 1.00 0.39 H new ATOM 0 HA ALA A 23 6.375 1.177 -10.834 1.00 0.42 H new ATOM 0 HB1 ALA A 23 7.815 -0.686 -11.630 1.00 0.52 H new ATOM 0 HB2 ALA A 23 6.170 -1.235 -11.231 1.00 0.52 H new ATOM 0 HB3 ALA A 23 6.646 -1.013 -12.931 1.00 0.52 H new ATOM 199 N ASP A 24 6.764 1.991 -13.945 1.00 0.46 N ATOM 200 CA ASP A 24 7.540 2.803 -14.874 1.00 0.54 C ATOM 201 C ASP A 24 7.419 4.294 -14.536 1.00 0.51 C ATOM 202 O ASP A 24 8.111 5.124 -15.123 1.00 0.62 O ATOM 203 CB ASP A 24 7.057 2.553 -16.305 1.00 0.69 C ATOM 204 CG ASP A 24 8.057 2.989 -17.356 1.00 1.43 C ATOM 205 OD1 ASP A 24 8.966 2.205 -17.692 1.00 1.51 O ATOM 206 OD2 ASP A 24 7.942 4.134 -17.842 1.00 2.34 O ATOM 0 H ASP A 24 5.872 1.666 -14.317 1.00 0.46 H new ATOM 0 HA ASP A 24 8.588 2.518 -14.787 1.00 0.54 H new ATOM 0 HB2 ASP A 24 6.847 1.491 -16.431 1.00 0.69 H new ATOM 0 HB3 ASP A 24 6.118 3.084 -16.463 1.00 0.69 H new ATOM 211 N HIS A 25 6.531 4.620 -13.584 1.00 0.43 N ATOM 212 CA HIS A 25 6.249 6.002 -13.169 1.00 0.44 C ATOM 213 C HIS A 25 5.304 6.626 -14.175 1.00 0.47 C ATOM 214 O HIS A 25 5.183 7.845 -14.287 1.00 0.54 O ATOM 215 CB HIS A 25 7.517 6.865 -12.982 1.00 0.54 C ATOM 216 CG HIS A 25 8.426 6.385 -11.884 1.00 0.64 C ATOM 217 ND1 HIS A 25 8.541 7.000 -10.652 1.00 0.73 N ATOM 218 CD2 HIS A 25 9.262 5.329 -11.848 1.00 1.47 C ATOM 219 CE1 HIS A 25 9.411 6.334 -9.909 1.00 0.59 C ATOM 220 NE2 HIS A 25 9.865 5.316 -10.613 1.00 1.26 N ATOM 0 H HIS A 25 5.984 3.925 -13.076 1.00 0.43 H new ATOM 0 HA HIS A 25 5.785 5.966 -12.183 1.00 0.44 H new ATOM 0 HB2 HIS A 25 8.074 6.883 -13.919 1.00 0.54 H new ATOM 0 HB3 HIS A 25 7.218 7.891 -12.770 1.00 0.54 H new ATOM 0 HD2 HIS A 25 9.428 4.620 -12.646 1.00 1.47 H new ATOM 0 HE1 HIS A 25 9.700 6.582 -8.898 1.00 0.59 H new ATOM 0 HE2 HIS A 25 10.551 4.632 -10.294 1.00 1.26 H new ATOM 229 N LYS A 26 4.643 5.748 -14.911 1.00 0.48 N ATOM 230 CA LYS A 26 3.583 6.122 -15.823 1.00 0.53 C ATOM 231 C LYS A 26 2.252 5.853 -15.146 1.00 0.41 C ATOM 232 O LYS A 26 2.041 4.767 -14.612 1.00 0.38 O ATOM 233 CB LYS A 26 3.707 5.318 -17.115 1.00 0.67 C ATOM 234 CG LYS A 26 4.997 5.580 -17.883 1.00 1.00 C ATOM 235 CD LYS A 26 4.992 6.920 -18.625 1.00 2.12 C ATOM 236 CE LYS A 26 5.055 8.117 -17.683 1.00 3.15 C ATOM 237 NZ LYS A 26 5.097 9.408 -18.422 1.00 4.25 N ATOM 0 H LYS A 26 4.832 4.746 -14.889 1.00 0.48 H new ATOM 0 HA LYS A 26 3.653 7.180 -16.076 1.00 0.53 H new ATOM 0 HB2 LYS A 26 3.646 4.256 -16.878 1.00 0.67 H new ATOM 0 HB3 LYS A 26 2.859 5.550 -17.759 1.00 0.67 H new ATOM 0 HG2 LYS A 26 5.837 5.559 -17.189 1.00 1.00 H new ATOM 0 HG3 LYS A 26 5.156 4.775 -18.600 1.00 1.00 H new ATOM 0 HD2 LYS A 26 5.841 6.955 -19.307 1.00 2.12 H new ATOM 0 HD3 LYS A 26 4.091 6.990 -19.234 1.00 2.12 H new ATOM 0 HE2 LYS A 26 4.187 8.105 -17.024 1.00 3.15 H new ATOM 0 HE3 LYS A 26 5.938 8.033 -17.049 1.00 3.15 H new ATOM 0 HZ1 LYS A 26 5.139 10.195 -17.744 1.00 4.25 H new ATOM 0 HZ2 LYS A 26 5.939 9.431 -19.032 1.00 4.25 H new ATOM 0 HZ3 LYS A 26 4.242 9.501 -19.007 1.00 4.25 H new ATOM 251 N PRO A 27 1.360 6.849 -15.133 1.00 0.41 N ATOM 252 CA PRO A 27 0.124 6.809 -14.342 1.00 0.37 C ATOM 253 C PRO A 27 -0.675 5.508 -14.456 1.00 0.32 C ATOM 254 O PRO A 27 -1.166 5.138 -15.526 1.00 0.36 O ATOM 255 CB PRO A 27 -0.669 7.985 -14.906 1.00 0.46 C ATOM 256 CG PRO A 27 0.384 8.957 -15.295 1.00 0.54 C ATOM 257 CD PRO A 27 1.490 8.121 -15.871 1.00 0.50 C ATOM 0 HA PRO A 27 0.340 6.866 -13.275 1.00 0.37 H new ATOM 0 HB2 PRO A 27 -1.276 7.687 -15.761 1.00 0.46 H new ATOM 0 HB3 PRO A 27 -1.348 8.404 -14.164 1.00 0.46 H new ATOM 0 HG2 PRO A 27 0.009 9.674 -16.026 1.00 0.54 H new ATOM 0 HG3 PRO A 27 0.729 9.530 -14.435 1.00 0.54 H new ATOM 0 HD2 PRO A 27 1.372 7.979 -16.945 1.00 0.50 H new ATOM 0 HD3 PRO A 27 2.466 8.580 -15.716 1.00 0.50 H new ATOM 265 N TYR A 28 -0.765 4.826 -13.322 1.00 0.28 N ATOM 266 CA TYR A 28 -1.691 3.718 -13.117 1.00 0.26 C ATOM 267 C TYR A 28 -3.081 4.242 -12.809 1.00 0.25 C ATOM 268 O TYR A 28 -3.240 5.279 -12.170 1.00 0.37 O ATOM 269 CB TYR A 28 -1.198 2.852 -11.956 1.00 0.30 C ATOM 270 CG TYR A 28 -2.156 1.791 -11.457 1.00 0.37 C ATOM 271 CD1 TYR A 28 -2.615 0.764 -12.275 1.00 0.50 C ATOM 272 CD2 TYR A 28 -2.574 1.810 -10.141 1.00 0.82 C ATOM 273 CE1 TYR A 28 -3.466 -0.211 -11.778 1.00 0.64 C ATOM 274 CE2 TYR A 28 -3.417 0.851 -9.640 1.00 1.10 C ATOM 275 CZ TYR A 28 -3.862 -0.161 -10.456 1.00 0.92 C ATOM 276 OH TYR A 28 -4.703 -1.125 -9.947 1.00 1.20 O ATOM 0 H TYR A 28 -0.188 5.029 -12.506 1.00 0.28 H new ATOM 0 HA TYR A 28 -1.736 3.120 -14.027 1.00 0.26 H new ATOM 0 HB2 TYR A 28 -0.274 2.362 -12.263 1.00 0.30 H new ATOM 0 HB3 TYR A 28 -0.949 3.508 -11.122 1.00 0.30 H new ATOM 0 HD1 TYR A 28 -2.305 0.726 -13.309 1.00 0.50 H new ATOM 0 HD2 TYR A 28 -2.229 2.600 -9.490 1.00 0.82 H new ATOM 0 HE1 TYR A 28 -3.817 -1.005 -12.421 1.00 0.64 H new ATOM 0 HE2 TYR A 28 -3.730 0.891 -8.607 1.00 1.10 H new ATOM 0 HH TYR A 28 -5.477 -0.695 -9.527 1.00 1.20 H new ATOM 286 N ASN A 29 -4.079 3.509 -13.257 1.00 0.34 N ATOM 287 CA ASN A 29 -5.461 3.874 -13.027 1.00 0.42 C ATOM 288 C ASN A 29 -5.859 3.546 -11.590 1.00 0.34 C ATOM 289 O ASN A 29 -6.297 2.435 -11.296 1.00 0.44 O ATOM 290 CB ASN A 29 -6.365 3.136 -14.020 1.00 0.67 C ATOM 291 CG ASN A 29 -7.826 3.525 -13.902 1.00 0.73 C ATOM 292 OD1 ASN A 29 -8.715 2.722 -14.181 1.00 1.18 O ATOM 293 ND2 ASN A 29 -8.088 4.757 -13.497 1.00 1.51 N ATOM 0 H ASN A 29 -3.956 2.647 -13.789 1.00 0.34 H new ATOM 0 HA ASN A 29 -5.579 4.947 -13.179 1.00 0.42 H new ATOM 0 HB2 ASN A 29 -6.022 3.340 -15.034 1.00 0.67 H new ATOM 0 HB3 ASN A 29 -6.268 2.062 -13.861 1.00 0.67 H new ATOM 0 HD21 ASN A 29 -9.055 5.070 -13.407 1.00 1.51 H new ATOM 0 HD22 ASN A 29 -7.323 5.394 -13.275 1.00 1.51 H new ATOM 300 N LEU A 30 -5.684 4.510 -10.693 1.00 0.25 N ATOM 301 CA LEU A 30 -6.049 4.317 -9.296 1.00 0.20 C ATOM 302 C LEU A 30 -7.564 4.241 -9.154 1.00 0.19 C ATOM 303 O LEU A 30 -8.099 3.345 -8.498 1.00 0.19 O ATOM 304 CB LEU A 30 -5.530 5.467 -8.413 1.00 0.22 C ATOM 305 CG LEU A 30 -6.010 5.446 -6.963 1.00 0.22 C ATOM 306 CD1 LEU A 30 -5.535 4.190 -6.256 1.00 0.23 C ATOM 307 CD2 LEU A 30 -5.520 6.679 -6.229 1.00 0.28 C ATOM 0 H LEU A 30 -5.294 5.428 -10.907 1.00 0.25 H new ATOM 0 HA LEU A 30 -5.591 3.384 -8.967 1.00 0.20 H new ATOM 0 HB2 LEU A 30 -4.440 5.443 -8.418 1.00 0.22 H new ATOM 0 HB3 LEU A 30 -5.830 6.413 -8.864 1.00 0.22 H new ATOM 0 HG LEU A 30 -7.100 5.447 -6.964 1.00 0.22 H new ATOM 0 HD11 LEU A 30 -5.889 4.197 -5.225 1.00 0.23 H new ATOM 0 HD12 LEU A 30 -5.929 3.313 -6.769 1.00 0.23 H new ATOM 0 HD13 LEU A 30 -4.446 4.157 -6.266 1.00 0.23 H new ATOM 0 HD21 LEU A 30 -5.869 6.651 -5.197 1.00 0.28 H new ATOM 0 HD22 LEU A 30 -4.430 6.702 -6.243 1.00 0.28 H new ATOM 0 HD23 LEU A 30 -5.908 7.572 -6.719 1.00 0.28 H new ATOM 319 N VAL A 31 -8.245 5.180 -9.808 1.00 0.20 N ATOM 320 CA VAL A 31 -9.690 5.375 -9.646 1.00 0.19 C ATOM 321 C VAL A 31 -10.520 4.202 -10.166 1.00 0.20 C ATOM 322 O VAL A 31 -11.744 4.247 -10.118 1.00 0.23 O ATOM 323 CB VAL A 31 -10.184 6.668 -10.324 1.00 0.22 C ATOM 324 CG1 VAL A 31 -10.398 7.776 -9.320 1.00 1.02 C ATOM 325 CG2 VAL A 31 -9.206 7.129 -11.368 1.00 0.87 C ATOM 0 H VAL A 31 -7.813 5.829 -10.466 1.00 0.20 H new ATOM 0 HA VAL A 31 -9.837 5.450 -8.569 1.00 0.19 H new ATOM 0 HB VAL A 31 -11.139 6.436 -10.796 1.00 0.22 H new ATOM 0 HG11 VAL A 31 -10.746 8.671 -9.835 1.00 1.02 H new ATOM 0 HG12 VAL A 31 -11.144 7.465 -8.588 1.00 1.02 H new ATOM 0 HG13 VAL A 31 -9.459 7.992 -8.811 1.00 1.02 H new ATOM 0 HG21 VAL A 31 -9.575 8.043 -11.834 1.00 0.87 H new ATOM 0 HG22 VAL A 31 -8.240 7.324 -10.901 1.00 0.87 H new ATOM 0 HG23 VAL A 31 -9.093 6.355 -12.127 1.00 0.87 H new ATOM 335 N GLN A 32 -9.876 3.164 -10.676 1.00 0.21 N ATOM 336 CA GLN A 32 -10.603 1.957 -11.039 1.00 0.23 C ATOM 337 C GLN A 32 -11.034 1.234 -9.770 1.00 0.22 C ATOM 338 O GLN A 32 -11.905 0.370 -9.796 1.00 0.28 O ATOM 339 CB GLN A 32 -9.752 1.030 -11.905 1.00 0.26 C ATOM 340 CG GLN A 32 -8.570 0.422 -11.172 1.00 0.29 C ATOM 341 CD GLN A 32 -7.829 -0.610 -11.995 1.00 0.35 C ATOM 342 OE1 GLN A 32 -7.261 -1.554 -11.450 1.00 1.02 O ATOM 343 NE2 GLN A 32 -7.830 -0.444 -13.307 1.00 0.75 N ATOM 0 H GLN A 32 -8.871 3.131 -10.846 1.00 0.21 H new ATOM 0 HA GLN A 32 -11.478 2.242 -11.623 1.00 0.23 H new ATOM 0 HB2 GLN A 32 -10.382 0.227 -12.289 1.00 0.26 H new ATOM 0 HB3 GLN A 32 -9.386 1.588 -12.767 1.00 0.26 H new ATOM 0 HG2 GLN A 32 -7.879 1.216 -10.887 1.00 0.29 H new ATOM 0 HG3 GLN A 32 -8.921 -0.041 -10.250 1.00 0.29 H new ATOM 0 HE21 GLN A 32 -8.314 0.353 -13.720 1.00 0.75 H new ATOM 0 HE22 GLN A 32 -7.347 -1.113 -13.906 1.00 0.75 H new ATOM 352 N HIS A 33 -10.414 1.609 -8.653 1.00 0.17 N ATOM 353 CA HIS A 33 -10.755 1.033 -7.357 1.00 0.16 C ATOM 354 C HIS A 33 -11.776 1.912 -6.671 1.00 0.16 C ATOM 355 O HIS A 33 -11.911 1.917 -5.452 1.00 0.17 O ATOM 356 CB HIS A 33 -9.484 0.834 -6.522 1.00 0.16 C ATOM 357 CG HIS A 33 -8.512 -0.026 -7.246 1.00 0.16 C ATOM 358 ND1 HIS A 33 -8.800 -1.327 -7.565 1.00 0.21 N ATOM 359 CD2 HIS A 33 -7.299 0.244 -7.801 1.00 0.22 C ATOM 360 CE1 HIS A 33 -7.827 -1.828 -8.281 1.00 0.27 C ATOM 361 NE2 HIS A 33 -6.901 -0.898 -8.449 1.00 0.28 N ATOM 0 H HIS A 33 -9.673 2.309 -8.621 1.00 0.17 H new ATOM 0 HA HIS A 33 -11.205 0.049 -7.485 1.00 0.16 H new ATOM 0 HB2 HIS A 33 -9.030 1.801 -6.304 1.00 0.16 H new ATOM 0 HB3 HIS A 33 -9.739 0.378 -5.565 1.00 0.16 H new ATOM 0 HD1 HIS A 33 -9.644 -1.828 -7.287 1.00 0.21 H new ATOM 0 HD2 HIS A 33 -6.756 1.176 -7.743 1.00 0.22 H new ATOM 0 HE1 HIS A 33 -7.786 -2.834 -8.671 1.00 0.27 H new ATOM 370 N LYS A 34 -12.479 2.673 -7.494 1.00 0.19 N ATOM 371 CA LYS A 34 -13.642 3.400 -7.059 1.00 0.19 C ATOM 372 C LYS A 34 -14.847 2.481 -7.125 1.00 0.21 C ATOM 373 O LYS A 34 -15.296 2.100 -8.208 1.00 0.33 O ATOM 374 CB LYS A 34 -13.878 4.623 -7.939 1.00 0.22 C ATOM 375 CG LYS A 34 -12.945 5.780 -7.654 1.00 0.28 C ATOM 376 CD LYS A 34 -13.568 7.100 -8.060 1.00 0.69 C ATOM 377 CE LYS A 34 -14.026 7.050 -9.497 1.00 1.01 C ATOM 378 NZ LYS A 34 -14.925 8.182 -9.834 1.00 1.56 N ATOM 0 H LYS A 34 -12.253 2.799 -8.481 1.00 0.19 H new ATOM 0 HA LYS A 34 -13.486 3.743 -6.036 1.00 0.19 H new ATOM 0 HB2 LYS A 34 -13.769 4.332 -8.984 1.00 0.22 H new ATOM 0 HB3 LYS A 34 -14.907 4.959 -7.807 1.00 0.22 H new ATOM 0 HG2 LYS A 34 -12.702 5.801 -6.592 1.00 0.28 H new ATOM 0 HG3 LYS A 34 -12.008 5.636 -8.192 1.00 0.28 H new ATOM 0 HD2 LYS A 34 -14.414 7.324 -7.410 1.00 0.69 H new ATOM 0 HD3 LYS A 34 -12.845 7.905 -7.931 1.00 0.69 H new ATOM 0 HE2 LYS A 34 -13.157 7.069 -10.155 1.00 1.01 H new ATOM 0 HE3 LYS A 34 -14.544 6.109 -9.680 1.00 1.01 H new ATOM 0 HZ1 LYS A 34 -15.216 8.110 -10.830 1.00 1.56 H new ATOM 0 HZ2 LYS A 34 -15.767 8.150 -9.224 1.00 1.56 H new ATOM 0 HZ3 LYS A 34 -14.423 9.080 -9.685 1.00 1.56 H new ATOM 392 N GLY A 35 -15.348 2.110 -5.969 1.00 0.18 N ATOM 393 CA GLY A 35 -16.474 1.216 -5.902 1.00 0.20 C ATOM 394 C GLY A 35 -16.229 0.079 -4.943 1.00 0.17 C ATOM 395 O GLY A 35 -17.140 -0.354 -4.238 1.00 0.20 O ATOM 0 H GLY A 35 -14.991 2.415 -5.064 1.00 0.18 H new ATOM 0 HA2 GLY A 35 -17.360 1.770 -5.591 1.00 0.20 H new ATOM 0 HA3 GLY A 35 -16.680 0.816 -6.895 1.00 0.20 H new ATOM 399 N SER A 36 -15.005 -0.425 -4.916 1.00 0.16 N ATOM 400 CA SER A 36 -14.625 -1.390 -3.924 1.00 0.16 C ATOM 401 C SER A 36 -13.290 -1.001 -3.352 1.00 0.14 C ATOM 402 O SER A 36 -12.398 -0.573 -4.085 1.00 0.16 O ATOM 403 CB SER A 36 -14.554 -2.780 -4.533 1.00 0.20 C ATOM 404 OG SER A 36 -15.780 -3.111 -5.166 1.00 0.29 O ATOM 0 H SER A 36 -14.266 -0.175 -5.573 1.00 0.16 H new ATOM 0 HA SER A 36 -15.372 -1.408 -3.130 1.00 0.16 H new ATOM 0 HB2 SER A 36 -13.741 -2.824 -5.257 1.00 0.20 H new ATOM 0 HB3 SER A 36 -14.330 -3.512 -3.757 1.00 0.20 H new ATOM 0 HG SER A 36 -15.598 -3.579 -6.008 1.00 0.29 H new ATOM 410 N PRO A 37 -13.165 -1.107 -2.030 1.00 0.12 N ATOM 411 CA PRO A 37 -11.944 -0.813 -1.303 1.00 0.12 C ATOM 412 C PRO A 37 -10.722 -1.414 -1.942 1.00 0.12 C ATOM 413 O PRO A 37 -10.794 -2.385 -2.686 1.00 0.15 O ATOM 414 CB PRO A 37 -12.186 -1.440 0.079 1.00 0.15 C ATOM 415 CG PRO A 37 -13.422 -2.237 -0.075 1.00 0.18 C ATOM 416 CD PRO A 37 -14.214 -1.517 -1.107 1.00 0.15 C ATOM 0 HA PRO A 37 -11.746 0.259 -1.275 1.00 0.12 H new ATOM 0 HB2 PRO A 37 -11.347 -2.067 0.381 1.00 0.15 H new ATOM 0 HB3 PRO A 37 -12.303 -0.674 0.845 1.00 0.15 H new ATOM 0 HG2 PRO A 37 -13.198 -3.257 -0.389 1.00 0.18 H new ATOM 0 HG3 PRO A 37 -13.968 -2.305 0.866 1.00 0.18 H new ATOM 0 HD2 PRO A 37 -14.953 -2.162 -1.583 1.00 0.15 H new ATOM 0 HD3 PRO A 37 -14.754 -0.666 -0.692 1.00 0.15 H new ATOM 424 N LEU A 38 -9.613 -0.806 -1.633 1.00 0.14 N ATOM 425 CA LEU A 38 -8.330 -1.226 -2.110 1.00 0.13 C ATOM 426 C LEU A 38 -7.354 -1.048 -0.957 1.00 0.13 C ATOM 427 O LEU A 38 -7.523 -0.169 -0.139 1.00 0.20 O ATOM 428 CB LEU A 38 -7.903 -0.413 -3.340 1.00 0.16 C ATOM 429 CG LEU A 38 -7.936 1.112 -3.214 1.00 0.20 C ATOM 430 CD1 LEU A 38 -7.210 1.737 -4.383 1.00 0.31 C ATOM 431 CD2 LEU A 38 -9.364 1.645 -3.171 1.00 0.26 C ATOM 0 H LEU A 38 -9.577 0.015 -1.028 1.00 0.14 H new ATOM 0 HA LEU A 38 -8.356 -2.267 -2.431 1.00 0.13 H new ATOM 0 HB2 LEU A 38 -6.888 -0.709 -3.605 1.00 0.16 H new ATOM 0 HB3 LEU A 38 -8.546 -0.698 -4.173 1.00 0.16 H new ATOM 0 HG LEU A 38 -7.444 1.376 -2.278 1.00 0.20 H new ATOM 0 HD11 LEU A 38 -7.236 2.823 -4.289 1.00 0.31 H new ATOM 0 HD12 LEU A 38 -6.174 1.398 -4.391 1.00 0.31 H new ATOM 0 HD13 LEU A 38 -7.696 1.441 -5.313 1.00 0.31 H new ATOM 0 HD21 LEU A 38 -9.344 2.731 -3.081 1.00 0.26 H new ATOM 0 HD22 LEU A 38 -9.884 1.366 -4.087 1.00 0.26 H new ATOM 0 HD23 LEU A 38 -9.886 1.219 -2.314 1.00 0.26 H new ATOM 443 N LEU A 39 -6.384 -1.906 -0.845 1.00 0.18 N ATOM 444 CA LEU A 39 -5.385 -1.767 0.183 1.00 0.19 C ATOM 445 C LEU A 39 -4.111 -1.321 -0.461 1.00 0.18 C ATOM 446 O LEU A 39 -3.509 -2.060 -1.235 1.00 0.21 O ATOM 447 CB LEU A 39 -5.119 -3.081 0.899 1.00 0.23 C ATOM 448 CG LEU A 39 -5.862 -3.347 2.217 1.00 0.35 C ATOM 449 CD1 LEU A 39 -5.186 -2.642 3.376 1.00 1.10 C ATOM 450 CD2 LEU A 39 -7.315 -2.926 2.128 1.00 1.19 C ATOM 0 H LEU A 39 -6.259 -2.715 -1.454 1.00 0.18 H new ATOM 0 HA LEU A 39 -5.748 -1.046 0.916 1.00 0.19 H new ATOM 0 HB2 LEU A 39 -5.360 -3.891 0.211 1.00 0.23 H new ATOM 0 HB3 LEU A 39 -4.049 -3.141 1.101 1.00 0.23 H new ATOM 0 HG LEU A 39 -5.828 -4.422 2.395 1.00 0.35 H new ATOM 0 HD11 LEU A 39 -5.733 -2.848 4.296 1.00 1.10 H new ATOM 0 HD12 LEU A 39 -4.162 -3.003 3.474 1.00 1.10 H new ATOM 0 HD13 LEU A 39 -5.176 -1.568 3.192 1.00 1.10 H new ATOM 0 HD21 LEU A 39 -7.811 -3.128 3.077 1.00 1.19 H new ATOM 0 HD22 LEU A 39 -7.372 -1.860 1.908 1.00 1.19 H new ATOM 0 HD23 LEU A 39 -7.808 -3.487 1.334 1.00 1.19 H new ATOM 462 N ILE A 40 -3.713 -0.119 -0.182 1.00 0.19 N ATOM 463 CA ILE A 40 -2.472 0.360 -0.720 1.00 0.20 C ATOM 464 C ILE A 40 -1.359 0.156 0.287 1.00 0.18 C ATOM 465 O ILE A 40 -1.457 0.580 1.438 1.00 0.20 O ATOM 466 CB ILE A 40 -2.572 1.824 -1.132 1.00 0.23 C ATOM 467 CG1 ILE A 40 -3.904 2.071 -1.832 1.00 0.30 C ATOM 468 CG2 ILE A 40 -1.422 2.192 -2.050 1.00 0.37 C ATOM 469 CD1 ILE A 40 -3.967 3.441 -2.442 1.00 0.35 C ATOM 0 H ILE A 40 -4.219 0.543 0.407 1.00 0.19 H new ATOM 0 HA ILE A 40 -2.244 -0.214 -1.618 1.00 0.20 H new ATOM 0 HB ILE A 40 -2.516 2.448 -0.240 1.00 0.23 H new ATOM 0 HG12 ILE A 40 -4.051 1.320 -2.608 1.00 0.30 H new ATOM 0 HG13 ILE A 40 -4.718 1.954 -1.117 1.00 0.30 H new ATOM 0 HG21 ILE A 40 -1.506 3.240 -2.336 1.00 0.37 H new ATOM 0 HG22 ILE A 40 -0.477 2.032 -1.531 1.00 0.37 H new ATOM 0 HG23 ILE A 40 -1.455 1.568 -2.943 1.00 0.37 H new ATOM 0 HD11 ILE A 40 -4.932 3.578 -2.931 1.00 0.35 H new ATOM 0 HD12 ILE A 40 -3.846 4.193 -1.662 1.00 0.35 H new ATOM 0 HD13 ILE A 40 -3.169 3.549 -3.177 1.00 0.35 H new ATOM 481 N TYR A 41 -0.327 -0.535 -0.150 1.00 0.18 N ATOM 482 CA TYR A 41 0.763 -0.910 0.711 1.00 0.19 C ATOM 483 C TYR A 41 2.000 -0.074 0.396 1.00 0.20 C ATOM 484 O TYR A 41 2.454 -0.035 -0.752 1.00 0.27 O ATOM 485 CB TYR A 41 1.105 -2.408 0.540 1.00 0.20 C ATOM 486 CG TYR A 41 0.050 -3.400 1.017 1.00 0.20 C ATOM 487 CD1 TYR A 41 -1.307 -3.185 0.758 1.00 0.27 C ATOM 488 CD2 TYR A 41 0.392 -4.524 1.748 1.00 0.29 C ATOM 489 CE1 TYR A 41 -2.275 -4.062 1.220 1.00 0.32 C ATOM 490 CE2 TYR A 41 -0.571 -5.400 2.201 1.00 0.35 C ATOM 491 CZ TYR A 41 -1.855 -5.256 1.836 1.00 0.33 C ATOM 492 OH TYR A 41 -2.841 -6.032 2.418 1.00 0.42 O ATOM 0 H TYR A 41 -0.225 -0.851 -1.115 1.00 0.18 H new ATOM 0 HA TYR A 41 0.454 -0.730 1.741 1.00 0.19 H new ATOM 0 HB2 TYR A 41 1.299 -2.596 -0.516 1.00 0.20 H new ATOM 0 HB3 TYR A 41 2.032 -2.611 1.076 1.00 0.20 H new ATOM 0 HD1 TYR A 41 -1.606 -2.319 0.187 1.00 0.27 H new ATOM 0 HD2 TYR A 41 1.431 -4.718 1.967 1.00 0.29 H new ATOM 0 HE1 TYR A 41 -3.325 -3.835 1.110 1.00 0.32 H new ATOM 0 HE2 TYR A 41 -0.290 -6.211 2.857 1.00 0.35 H new ATOM 0 HH TYR A 41 -3.710 -5.594 2.307 1.00 0.42 H new ATOM 502 N ASN A 42 2.533 0.597 1.406 1.00 0.28 N ATOM 503 CA ASN A 42 3.831 1.254 1.282 1.00 0.34 C ATOM 504 C ASN A 42 4.868 0.182 1.458 1.00 0.37 C ATOM 505 O ASN A 42 5.335 -0.064 2.563 1.00 0.54 O ATOM 506 CB ASN A 42 4.046 2.299 2.386 1.00 0.46 C ATOM 507 CG ASN A 42 2.864 3.224 2.615 1.00 1.50 C ATOM 508 OD1 ASN A 42 1.706 2.819 2.553 1.00 2.27 O ATOM 509 ND2 ASN A 42 3.147 4.488 2.882 1.00 2.35 N ATOM 0 H ASN A 42 2.091 0.702 2.319 1.00 0.28 H new ATOM 0 HA ASN A 42 3.892 1.759 0.318 1.00 0.34 H new ATOM 0 HB2 ASN A 42 4.273 1.783 3.319 1.00 0.46 H new ATOM 0 HB3 ASN A 42 4.919 2.901 2.134 1.00 0.46 H new ATOM 0 HD21 ASN A 42 2.393 5.156 3.043 1.00 2.35 H new ATOM 0 HD22 ASN A 42 4.119 4.795 2.927 1.00 2.35 H new ATOM 516 N VAL A 43 5.257 -0.427 0.377 1.00 0.36 N ATOM 517 CA VAL A 43 6.018 -1.645 0.467 1.00 0.38 C ATOM 518 C VAL A 43 7.457 -1.405 0.106 1.00 0.42 C ATOM 519 O VAL A 43 7.749 -0.670 -0.821 1.00 0.50 O ATOM 520 CB VAL A 43 5.411 -2.730 -0.444 1.00 0.39 C ATOM 521 CG1 VAL A 43 5.296 -2.226 -1.860 1.00 1.03 C ATOM 522 CG2 VAL A 43 6.235 -4.004 -0.411 1.00 0.98 C ATOM 0 H VAL A 43 5.064 -0.106 -0.572 1.00 0.36 H new ATOM 0 HA VAL A 43 5.978 -1.994 1.499 1.00 0.38 H new ATOM 0 HB VAL A 43 4.415 -2.960 -0.066 1.00 0.39 H new ATOM 0 HG11 VAL A 43 4.866 -3.005 -2.490 1.00 1.03 H new ATOM 0 HG12 VAL A 43 4.654 -1.346 -1.882 1.00 1.03 H new ATOM 0 HG13 VAL A 43 6.285 -1.963 -2.234 1.00 1.03 H new ATOM 0 HG21 VAL A 43 5.780 -4.749 -1.064 1.00 0.98 H new ATOM 0 HG22 VAL A 43 7.248 -3.791 -0.754 1.00 0.98 H new ATOM 0 HG23 VAL A 43 6.270 -4.388 0.608 1.00 0.98 H new ATOM 532 N ALA A 44 8.349 -1.996 0.874 1.00 0.50 N ATOM 533 CA ALA A 44 9.754 -1.960 0.555 1.00 0.59 C ATOM 534 C ALA A 44 10.082 -3.066 -0.433 1.00 0.58 C ATOM 535 O ALA A 44 9.836 -4.247 -0.159 1.00 0.88 O ATOM 536 CB ALA A 44 10.589 -2.100 1.820 1.00 0.83 C ATOM 0 H ALA A 44 8.121 -2.508 1.726 1.00 0.50 H new ATOM 0 HA ALA A 44 9.993 -1.000 0.098 1.00 0.59 H new ATOM 0 HB1 ALA A 44 11.648 -2.071 1.562 1.00 0.83 H new ATOM 0 HB2 ALA A 44 10.359 -1.280 2.501 1.00 0.83 H new ATOM 0 HB3 ALA A 44 10.359 -3.049 2.304 1.00 0.83 H new ATOM 542 N SER A 45 10.556 -2.664 -1.603 1.00 0.57 N ATOM 543 CA SER A 45 11.125 -3.586 -2.583 1.00 0.63 C ATOM 544 C SER A 45 12.115 -4.514 -1.896 1.00 1.01 C ATOM 545 O SER A 45 12.746 -4.132 -0.917 1.00 1.78 O ATOM 546 CB SER A 45 11.798 -2.803 -3.715 1.00 0.73 C ATOM 547 OG SER A 45 12.347 -1.584 -3.242 1.00 1.62 O ATOM 0 H SER A 45 10.558 -1.689 -1.903 1.00 0.57 H new ATOM 0 HA SER A 45 10.329 -4.190 -3.019 1.00 0.63 H new ATOM 0 HB2 SER A 45 12.585 -3.410 -4.162 1.00 0.73 H new ATOM 0 HB3 SER A 45 11.070 -2.596 -4.500 1.00 0.73 H new ATOM 0 HG SER A 45 11.662 -0.884 -3.271 1.00 1.62 H new ATOM 553 N LYS A 46 12.248 -5.734 -2.387 1.00 1.32 N ATOM 554 CA LYS A 46 12.935 -6.746 -1.611 1.00 1.69 C ATOM 555 C LYS A 46 13.485 -7.865 -2.474 1.00 1.14 C ATOM 556 O LYS A 46 13.136 -8.007 -3.648 1.00 1.47 O ATOM 557 CB LYS A 46 11.962 -7.351 -0.594 1.00 2.68 C ATOM 558 CG LYS A 46 11.025 -8.406 -1.184 1.00 3.45 C ATOM 559 CD LYS A 46 9.925 -7.796 -2.040 1.00 4.39 C ATOM 560 CE LYS A 46 8.908 -7.055 -1.188 1.00 5.19 C ATOM 561 NZ LYS A 46 8.224 -7.964 -0.230 1.00 5.84 N ATOM 0 H LYS A 46 11.899 -6.041 -3.295 1.00 1.32 H new ATOM 0 HA LYS A 46 13.774 -6.258 -1.115 1.00 1.69 H new ATOM 0 HB2 LYS A 46 12.534 -7.800 0.218 1.00 2.68 H new ATOM 0 HB3 LYS A 46 11.364 -6.551 -0.158 1.00 2.68 H new ATOM 0 HG2 LYS A 46 11.604 -9.105 -1.787 1.00 3.45 H new ATOM 0 HG3 LYS A 46 10.574 -8.980 -0.375 1.00 3.45 H new ATOM 0 HD2 LYS A 46 10.364 -7.110 -2.765 1.00 4.39 H new ATOM 0 HD3 LYS A 46 9.425 -8.581 -2.606 1.00 4.39 H new ATOM 0 HE2 LYS A 46 9.407 -6.256 -0.639 1.00 5.19 H new ATOM 0 HE3 LYS A 46 8.167 -6.583 -1.834 1.00 5.19 H new ATOM 0 HZ1 LYS A 46 7.457 -7.450 0.249 1.00 5.84 H new ATOM 0 HZ2 LYS A 46 7.828 -8.776 -0.745 1.00 5.84 H new ATOM 0 HZ3 LYS A 46 8.908 -8.302 0.476 1.00 5.84 H new ATOM 575 N CYS A 47 14.352 -8.650 -1.865 1.00 1.21 N ATOM 576 CA CYS A 47 14.740 -9.933 -2.400 1.00 1.53 C ATOM 577 C CYS A 47 14.510 -10.975 -1.316 1.00 1.99 C ATOM 578 O CYS A 47 15.174 -10.949 -0.281 1.00 2.46 O ATOM 579 CB CYS A 47 16.214 -9.905 -2.823 1.00 2.04 C ATOM 580 SG CYS A 47 16.826 -11.457 -3.521 1.00 3.55 S ATOM 0 H CYS A 47 14.806 -8.412 -0.983 1.00 1.21 H new ATOM 0 HA CYS A 47 14.149 -10.176 -3.283 1.00 1.53 H new ATOM 0 HB2 CYS A 47 16.353 -9.112 -3.558 1.00 2.04 H new ATOM 0 HB3 CYS A 47 16.822 -9.647 -1.956 1.00 2.04 H new ATOM 0 HG CYS A 47 18.078 -11.323 -3.845 1.00 3.55 H new ATOM 586 N GLY A 48 13.569 -11.880 -1.557 1.00 2.39 N ATOM 587 CA GLY A 48 13.226 -12.892 -0.570 1.00 2.91 C ATOM 588 C GLY A 48 12.858 -12.305 0.787 1.00 2.40 C ATOM 589 O GLY A 48 13.268 -12.832 1.822 1.00 2.46 O ATOM 0 H GLY A 48 13.033 -11.933 -2.423 1.00 2.39 H new ATOM 0 HA2 GLY A 48 12.390 -13.484 -0.942 1.00 2.91 H new ATOM 0 HA3 GLY A 48 14.069 -13.572 -0.448 1.00 2.91 H new ATOM 593 N TYR A 49 12.080 -11.224 0.794 1.00 2.15 N ATOM 594 CA TYR A 49 11.739 -10.554 2.045 1.00 1.79 C ATOM 595 C TYR A 49 10.236 -10.274 2.143 1.00 1.42 C ATOM 596 O TYR A 49 9.614 -9.760 1.209 1.00 1.67 O ATOM 597 CB TYR A 49 12.530 -9.245 2.193 1.00 2.10 C ATOM 598 CG TYR A 49 12.346 -8.562 3.535 1.00 2.40 C ATOM 599 CD1 TYR A 49 11.292 -7.682 3.757 1.00 3.01 C ATOM 600 CD2 TYR A 49 13.225 -8.804 4.583 1.00 2.66 C ATOM 601 CE1 TYR A 49 11.120 -7.067 4.982 1.00 3.74 C ATOM 602 CE2 TYR A 49 13.061 -8.191 5.811 1.00 3.26 C ATOM 603 CZ TYR A 49 12.006 -7.324 6.006 1.00 3.76 C ATOM 604 OH TYR A 49 11.838 -6.714 7.229 1.00 4.63 O ATOM 0 H TYR A 49 11.679 -10.799 -0.042 1.00 2.15 H new ATOM 0 HA TYR A 49 12.011 -11.226 2.859 1.00 1.79 H new ATOM 0 HB2 TYR A 49 13.590 -9.454 2.045 1.00 2.10 H new ATOM 0 HB3 TYR A 49 12.227 -8.558 1.403 1.00 2.10 H new ATOM 0 HD1 TYR A 49 10.596 -7.476 2.958 1.00 3.01 H new ATOM 0 HD2 TYR A 49 14.052 -9.483 4.436 1.00 2.66 H new ATOM 0 HE1 TYR A 49 10.295 -6.388 5.137 1.00 3.74 H new ATOM 0 HE2 TYR A 49 13.755 -8.390 6.614 1.00 3.26 H new ATOM 0 HH TYR A 49 12.548 -7.004 7.839 1.00 4.63 H new ATOM 614 N THR A 50 9.673 -10.616 3.290 1.00 1.05 N ATOM 615 CA THR A 50 8.280 -10.340 3.614 1.00 0.81 C ATOM 616 C THR A 50 8.110 -10.467 5.128 1.00 0.77 C ATOM 617 O THR A 50 8.997 -10.977 5.810 1.00 1.44 O ATOM 618 CB THR A 50 7.313 -11.321 2.907 1.00 1.09 C ATOM 619 OG1 THR A 50 5.952 -11.000 3.245 1.00 1.93 O ATOM 620 CG2 THR A 50 7.610 -12.763 3.291 1.00 1.87 C ATOM 0 H THR A 50 10.176 -11.100 4.034 1.00 1.05 H new ATOM 0 HA THR A 50 8.035 -9.335 3.269 1.00 0.81 H new ATOM 0 HB THR A 50 7.457 -11.217 1.832 1.00 1.09 H new ATOM 0 HG1 THR A 50 5.458 -11.825 3.431 1.00 1.93 H new ATOM 0 HG21 THR A 50 6.914 -13.427 2.778 1.00 1.87 H new ATOM 0 HG22 THR A 50 8.631 -13.014 3.002 1.00 1.87 H new ATOM 0 HG23 THR A 50 7.498 -12.883 4.369 1.00 1.87 H new ATOM 628 N LYS A 51 6.993 -9.990 5.652 1.00 0.61 N ATOM 629 CA LYS A 51 6.700 -10.098 7.065 1.00 0.56 C ATOM 630 C LYS A 51 5.304 -10.682 7.229 1.00 0.76 C ATOM 631 O LYS A 51 4.733 -10.673 8.317 1.00 1.55 O ATOM 632 CB LYS A 51 6.810 -8.713 7.722 1.00 0.59 C ATOM 633 CG LYS A 51 8.170 -8.058 7.515 1.00 1.22 C ATOM 634 CD LYS A 51 8.277 -6.730 8.246 1.00 1.39 C ATOM 635 CE LYS A 51 8.318 -6.925 9.751 1.00 1.46 C ATOM 636 NZ LYS A 51 9.590 -7.553 10.196 1.00 2.01 N ATOM 0 H LYS A 51 6.269 -9.519 5.109 1.00 0.61 H new ATOM 0 HA LYS A 51 7.416 -10.757 7.556 1.00 0.56 H new ATOM 0 HB2 LYS A 51 6.035 -8.063 7.316 1.00 0.59 H new ATOM 0 HB3 LYS A 51 6.619 -8.809 8.791 1.00 0.59 H new ATOM 0 HG2 LYS A 51 8.953 -8.730 7.866 1.00 1.22 H new ATOM 0 HG3 LYS A 51 8.339 -7.901 6.450 1.00 1.22 H new ATOM 0 HD2 LYS A 51 9.176 -6.206 7.921 1.00 1.39 H new ATOM 0 HD3 LYS A 51 7.428 -6.099 7.983 1.00 1.39 H new ATOM 0 HE2 LYS A 51 8.197 -5.961 10.245 1.00 1.46 H new ATOM 0 HE3 LYS A 51 7.479 -7.548 10.059 1.00 1.46 H new ATOM 0 HZ1 LYS A 51 9.668 -7.484 11.231 1.00 2.01 H new ATOM 0 HZ2 LYS A 51 9.600 -8.554 9.914 1.00 2.01 H new ATOM 0 HZ3 LYS A 51 10.393 -7.061 9.755 1.00 2.01 H new ATOM 650 N GLY A 52 4.771 -11.214 6.127 1.00 0.45 N ATOM 651 CA GLY A 52 3.414 -11.707 6.113 1.00 0.51 C ATOM 652 C GLY A 52 2.562 -10.966 5.104 1.00 0.41 C ATOM 653 O GLY A 52 1.629 -11.525 4.537 1.00 0.41 O ATOM 0 H GLY A 52 5.266 -11.309 5.240 1.00 0.45 H new ATOM 0 HA2 GLY A 52 3.415 -12.771 5.877 1.00 0.51 H new ATOM 0 HA3 GLY A 52 2.978 -11.601 7.106 1.00 0.51 H new ATOM 657 N GLY A 53 2.911 -9.713 4.858 1.00 0.44 N ATOM 658 CA GLY A 53 2.113 -8.860 3.996 1.00 0.50 C ATOM 659 C GLY A 53 2.247 -9.164 2.515 1.00 0.36 C ATOM 660 O GLY A 53 1.419 -8.727 1.732 1.00 0.32 O ATOM 0 H GLY A 53 3.742 -9.265 5.244 1.00 0.44 H new ATOM 0 HA2 GLY A 53 1.065 -8.955 4.281 1.00 0.50 H new ATOM 0 HA3 GLY A 53 2.397 -7.822 4.169 1.00 0.50 H new ATOM 664 N TYR A 54 3.284 -9.890 2.109 1.00 0.37 N ATOM 665 CA TYR A 54 3.435 -10.247 0.708 1.00 0.36 C ATOM 666 C TYR A 54 2.384 -11.280 0.341 1.00 0.26 C ATOM 667 O TYR A 54 1.555 -11.057 -0.541 1.00 0.25 O ATOM 668 CB TYR A 54 4.828 -10.819 0.455 1.00 0.45 C ATOM 669 CG TYR A 54 5.268 -10.808 -0.992 1.00 0.41 C ATOM 670 CD1 TYR A 54 4.354 -10.878 -2.042 1.00 0.45 C ATOM 671 CD2 TYR A 54 6.613 -10.720 -1.302 1.00 0.53 C ATOM 672 CE1 TYR A 54 4.776 -10.863 -3.359 1.00 0.46 C ATOM 673 CE2 TYR A 54 7.044 -10.702 -2.606 1.00 0.65 C ATOM 674 CZ TYR A 54 6.126 -10.774 -3.636 1.00 0.56 C ATOM 675 OH TYR A 54 6.556 -10.747 -4.940 1.00 0.70 O ATOM 0 H TYR A 54 4.021 -10.237 2.722 1.00 0.37 H new ATOM 0 HA TYR A 54 3.307 -9.355 0.095 1.00 0.36 H new ATOM 0 HB2 TYR A 54 5.550 -10.252 1.043 1.00 0.45 H new ATOM 0 HB3 TYR A 54 4.855 -11.846 0.820 1.00 0.45 H new ATOM 0 HD1 TYR A 54 3.298 -10.945 -1.823 1.00 0.45 H new ATOM 0 HD2 TYR A 54 7.338 -10.664 -0.504 1.00 0.53 H new ATOM 0 HE1 TYR A 54 4.057 -10.920 -4.163 1.00 0.46 H new ATOM 0 HE2 TYR A 54 8.099 -10.632 -2.826 1.00 0.65 H new ATOM 0 HH TYR A 54 7.534 -10.681 -4.961 1.00 0.70 H new ATOM 685 N GLU A 55 2.419 -12.396 1.049 1.00 0.25 N ATOM 686 CA GLU A 55 1.472 -13.479 0.855 1.00 0.27 C ATOM 687 C GLU A 55 0.053 -13.004 1.173 1.00 0.22 C ATOM 688 O GLU A 55 -0.933 -13.535 0.651 1.00 0.25 O ATOM 689 CB GLU A 55 1.865 -14.680 1.731 1.00 0.36 C ATOM 690 CG GLU A 55 2.200 -14.327 3.175 1.00 1.14 C ATOM 691 CD GLU A 55 3.663 -13.954 3.371 1.00 1.92 C ATOM 692 OE1 GLU A 55 4.026 -12.798 3.081 1.00 2.61 O ATOM 693 OE2 GLU A 55 4.457 -14.813 3.822 1.00 2.39 O ATOM 0 H GLU A 55 3.109 -12.576 1.778 1.00 0.25 H new ATOM 0 HA GLU A 55 1.494 -13.794 -0.188 1.00 0.27 H new ATOM 0 HB2 GLU A 55 1.046 -15.400 1.727 1.00 0.36 H new ATOM 0 HB3 GLU A 55 2.726 -15.174 1.282 1.00 0.36 H new ATOM 0 HG2 GLU A 55 1.572 -13.495 3.495 1.00 1.14 H new ATOM 0 HG3 GLU A 55 1.958 -15.174 3.816 1.00 1.14 H new ATOM 700 N THR A 56 -0.026 -11.971 1.998 1.00 0.25 N ATOM 701 CA THR A 56 -1.284 -11.357 2.366 1.00 0.24 C ATOM 702 C THR A 56 -1.817 -10.526 1.221 1.00 0.21 C ATOM 703 O THR A 56 -2.910 -10.773 0.724 1.00 0.22 O ATOM 704 CB THR A 56 -1.098 -10.490 3.623 1.00 0.26 C ATOM 705 OG1 THR A 56 -0.917 -11.343 4.754 1.00 0.33 O ATOM 706 CG2 THR A 56 -2.275 -9.566 3.857 1.00 0.25 C ATOM 0 H THR A 56 0.788 -11.536 2.431 1.00 0.25 H new ATOM 0 HA THR A 56 -2.009 -12.140 2.587 1.00 0.24 H new ATOM 0 HB THR A 56 -0.219 -9.862 3.476 1.00 0.26 H new ATOM 0 HG1 THR A 56 -0.001 -11.691 4.758 1.00 0.33 H new ATOM 0 HG21 THR A 56 -2.100 -8.974 4.755 1.00 0.25 H new ATOM 0 HG22 THR A 56 -2.392 -8.902 3.001 1.00 0.25 H new ATOM 0 HG23 THR A 56 -3.182 -10.157 3.984 1.00 0.25 H new ATOM 714 N ALA A 57 -1.021 -9.574 0.787 1.00 0.19 N ATOM 715 CA ALA A 57 -1.391 -8.702 -0.303 1.00 0.20 C ATOM 716 C ALA A 57 -1.693 -9.502 -1.563 1.00 0.19 C ATOM 717 O ALA A 57 -2.649 -9.206 -2.281 1.00 0.22 O ATOM 718 CB ALA A 57 -0.270 -7.718 -0.548 1.00 0.22 C ATOM 0 H ALA A 57 -0.099 -9.383 1.180 1.00 0.19 H new ATOM 0 HA ALA A 57 -2.298 -8.159 -0.037 1.00 0.20 H new ATOM 0 HB1 ALA A 57 -0.541 -7.055 -1.370 1.00 0.22 H new ATOM 0 HB2 ALA A 57 -0.100 -7.128 0.353 1.00 0.22 H new ATOM 0 HB3 ALA A 57 0.640 -8.260 -0.804 1.00 0.22 H new ATOM 724 N THR A 58 -0.882 -10.526 -1.809 1.00 0.17 N ATOM 725 CA THR A 58 -1.052 -11.379 -2.974 1.00 0.17 C ATOM 726 C THR A 58 -2.453 -11.994 -2.989 1.00 0.17 C ATOM 727 O THR A 58 -3.225 -11.819 -3.944 1.00 0.19 O ATOM 728 CB THR A 58 -0.011 -12.515 -2.985 1.00 0.20 C ATOM 729 OG1 THR A 58 1.311 -11.970 -2.973 1.00 0.24 O ATOM 730 CG2 THR A 58 -0.177 -13.404 -4.206 1.00 0.26 C ATOM 0 H THR A 58 -0.097 -10.784 -1.211 1.00 0.17 H new ATOM 0 HA THR A 58 -0.913 -10.756 -3.858 1.00 0.17 H new ATOM 0 HB THR A 58 -0.169 -13.119 -2.092 1.00 0.20 H new ATOM 0 HG1 THR A 58 1.502 -11.594 -2.088 1.00 0.24 H new ATOM 0 HG21 THR A 58 0.572 -14.196 -4.184 1.00 0.26 H new ATOM 0 HG22 THR A 58 -1.173 -13.847 -4.201 1.00 0.26 H new ATOM 0 HG23 THR A 58 -0.049 -12.808 -5.110 1.00 0.26 H new ATOM 738 N THR A 59 -2.779 -12.682 -1.899 1.00 0.16 N ATOM 739 CA THR A 59 -4.037 -13.398 -1.777 1.00 0.17 C ATOM 740 C THR A 59 -5.218 -12.437 -1.664 1.00 0.16 C ATOM 741 O THR A 59 -6.276 -12.678 -2.238 1.00 0.19 O ATOM 742 CB THR A 59 -4.008 -14.330 -0.548 1.00 0.20 C ATOM 743 OG1 THR A 59 -2.824 -15.140 -0.585 1.00 0.48 O ATOM 744 CG2 THR A 59 -5.236 -15.227 -0.506 1.00 0.46 C ATOM 0 H THR A 59 -2.177 -12.757 -1.079 1.00 0.16 H new ATOM 0 HA THR A 59 -4.165 -13.993 -2.681 1.00 0.17 H new ATOM 0 HB THR A 59 -4.007 -13.710 0.348 1.00 0.20 H new ATOM 0 HG1 THR A 59 -2.086 -14.661 -0.152 1.00 0.48 H new ATOM 0 HG21 THR A 59 -5.186 -15.872 0.371 1.00 0.46 H new ATOM 0 HG22 THR A 59 -6.134 -14.612 -0.453 1.00 0.46 H new ATOM 0 HG23 THR A 59 -5.269 -15.841 -1.406 1.00 0.46 H new ATOM 752 N LEU A 60 -5.019 -11.333 -0.955 1.00 0.13 N ATOM 753 CA LEU A 60 -6.071 -10.364 -0.727 1.00 0.13 C ATOM 754 C LEU A 60 -6.533 -9.780 -2.031 1.00 0.13 C ATOM 755 O LEU A 60 -7.724 -9.744 -2.333 1.00 0.15 O ATOM 756 CB LEU A 60 -5.560 -9.259 0.167 1.00 0.13 C ATOM 757 CG LEU A 60 -5.688 -9.553 1.642 1.00 0.14 C ATOM 758 CD1 LEU A 60 -5.047 -8.452 2.457 1.00 0.43 C ATOM 759 CD2 LEU A 60 -7.154 -9.693 2.004 1.00 0.35 C ATOM 0 H LEU A 60 -4.126 -11.089 -0.526 1.00 0.13 H new ATOM 0 HA LEU A 60 -6.911 -10.865 -0.246 1.00 0.13 H new ATOM 0 HB2 LEU A 60 -4.512 -9.073 -0.066 1.00 0.13 H new ATOM 0 HB3 LEU A 60 -6.104 -8.342 -0.059 1.00 0.13 H new ATOM 0 HG LEU A 60 -5.173 -10.487 1.866 1.00 0.14 H new ATOM 0 HD11 LEU A 60 -5.148 -8.679 3.518 1.00 0.43 H new ATOM 0 HD12 LEU A 60 -3.990 -8.378 2.201 1.00 0.43 H new ATOM 0 HD13 LEU A 60 -5.540 -7.505 2.240 1.00 0.43 H new ATOM 0 HD21 LEU A 60 -7.247 -9.905 3.069 1.00 0.35 H new ATOM 0 HD22 LEU A 60 -7.676 -8.765 1.772 1.00 0.35 H new ATOM 0 HD23 LEU A 60 -7.594 -10.510 1.431 1.00 0.35 H new ATOM 771 N TYR A 61 -5.564 -9.341 -2.805 1.00 0.14 N ATOM 772 CA TYR A 61 -5.832 -8.741 -4.079 1.00 0.15 C ATOM 773 C TYR A 61 -6.604 -9.688 -4.975 1.00 0.17 C ATOM 774 O TYR A 61 -7.628 -9.331 -5.488 1.00 0.22 O ATOM 775 CB TYR A 61 -4.540 -8.341 -4.758 1.00 0.17 C ATOM 776 CG TYR A 61 -4.795 -7.708 -6.092 1.00 0.18 C ATOM 777 CD1 TYR A 61 -5.862 -6.868 -6.290 1.00 0.16 C ATOM 778 CD2 TYR A 61 -3.942 -7.947 -7.145 1.00 0.28 C ATOM 779 CE1 TYR A 61 -6.091 -6.279 -7.513 1.00 0.18 C ATOM 780 CE2 TYR A 61 -4.157 -7.370 -8.376 1.00 0.31 C ATOM 781 CZ TYR A 61 -5.297 -6.541 -8.550 1.00 0.23 C ATOM 782 OH TYR A 61 -5.449 -5.939 -9.779 1.00 0.28 O ATOM 0 H TYR A 61 -4.574 -9.393 -2.563 1.00 0.14 H new ATOM 0 HA TYR A 61 -6.438 -7.852 -3.906 1.00 0.15 H new ATOM 0 HB2 TYR A 61 -3.994 -7.645 -4.122 1.00 0.17 H new ATOM 0 HB3 TYR A 61 -3.907 -9.219 -4.886 1.00 0.17 H new ATOM 0 HD1 TYR A 61 -6.535 -6.665 -5.470 1.00 0.16 H new ATOM 0 HD2 TYR A 61 -3.091 -8.597 -7.003 1.00 0.28 H new ATOM 0 HE1 TYR A 61 -6.921 -5.599 -7.633 1.00 0.18 H new ATOM 0 HE2 TYR A 61 -3.473 -7.544 -9.193 1.00 0.31 H new ATOM 0 HH TYR A 61 -4.763 -6.273 -10.394 1.00 0.28 H new ATOM 792 N ASN A 62 -6.126 -10.898 -5.130 1.00 0.18 N ATOM 793 CA ASN A 62 -6.707 -11.834 -6.074 1.00 0.22 C ATOM 794 C ASN A 62 -8.028 -12.366 -5.572 1.00 0.20 C ATOM 795 O ASN A 62 -8.880 -12.776 -6.361 1.00 0.24 O ATOM 796 CB ASN A 62 -5.727 -12.961 -6.390 1.00 0.27 C ATOM 797 CG ASN A 62 -4.789 -12.565 -7.509 1.00 0.75 C ATOM 798 OD1 ASN A 62 -4.926 -13.017 -8.647 1.00 1.21 O ATOM 799 ND2 ASN A 62 -3.858 -11.678 -7.207 1.00 1.12 N ATOM 0 H ASN A 62 -5.328 -11.265 -4.611 1.00 0.18 H new ATOM 0 HA ASN A 62 -6.908 -11.301 -7.003 1.00 0.22 H new ATOM 0 HB2 ASN A 62 -5.151 -13.208 -5.498 1.00 0.27 H new ATOM 0 HB3 ASN A 62 -6.278 -13.858 -6.672 1.00 0.27 H new ATOM 0 HD21 ASN A 62 -3.220 -11.343 -7.929 1.00 1.12 H new ATOM 0 HD22 ASN A 62 -3.777 -11.328 -6.252 1.00 1.12 H new ATOM 806 N LYS A 63 -8.218 -12.342 -4.260 1.00 0.18 N ATOM 807 CA LYS A 63 -9.447 -12.836 -3.700 1.00 0.20 C ATOM 808 C LYS A 63 -10.504 -11.761 -3.835 1.00 0.18 C ATOM 809 O LYS A 63 -11.696 -12.055 -3.941 1.00 0.22 O ATOM 810 CB LYS A 63 -9.246 -13.234 -2.230 1.00 0.26 C ATOM 811 CG LYS A 63 -10.489 -13.791 -1.547 1.00 0.29 C ATOM 812 CD LYS A 63 -10.154 -14.375 -0.182 1.00 0.64 C ATOM 813 CE LYS A 63 -9.261 -15.603 -0.289 1.00 0.91 C ATOM 814 NZ LYS A 63 -9.971 -16.759 -0.905 1.00 1.54 N ATOM 0 H LYS A 63 -7.543 -11.990 -3.581 1.00 0.18 H new ATOM 0 HA LYS A 63 -9.769 -13.728 -4.237 1.00 0.20 H new ATOM 0 HB2 LYS A 63 -8.452 -13.979 -2.174 1.00 0.26 H new ATOM 0 HB3 LYS A 63 -8.903 -12.361 -1.675 1.00 0.26 H new ATOM 0 HG2 LYS A 63 -11.230 -13.000 -1.435 1.00 0.29 H new ATOM 0 HG3 LYS A 63 -10.937 -14.561 -2.175 1.00 0.29 H new ATOM 0 HD2 LYS A 63 -9.657 -13.617 0.424 1.00 0.64 H new ATOM 0 HD3 LYS A 63 -11.076 -14.642 0.334 1.00 0.64 H new ATOM 0 HE2 LYS A 63 -8.380 -15.360 -0.884 1.00 0.91 H new ATOM 0 HE3 LYS A 63 -8.908 -15.882 0.704 1.00 0.91 H new ATOM 0 HZ1 LYS A 63 -9.376 -17.609 -0.836 1.00 1.54 H new ATOM 0 HZ2 LYS A 63 -10.868 -16.923 -0.404 1.00 1.54 H new ATOM 0 HZ3 LYS A 63 -10.166 -16.553 -1.906 1.00 1.54 H new ATOM 828 N TYR A 64 -10.062 -10.503 -3.882 1.00 0.16 N ATOM 829 CA TYR A 64 -11.004 -9.414 -3.791 1.00 0.16 C ATOM 830 C TYR A 64 -10.956 -8.407 -4.934 1.00 0.17 C ATOM 831 O TYR A 64 -11.783 -7.493 -4.983 1.00 0.17 O ATOM 832 CB TYR A 64 -10.878 -8.765 -2.428 1.00 0.15 C ATOM 833 CG TYR A 64 -11.328 -9.707 -1.344 1.00 0.17 C ATOM 834 CD1 TYR A 64 -12.605 -10.246 -1.325 1.00 0.19 C ATOM 835 CD2 TYR A 64 -10.460 -10.034 -0.316 1.00 0.19 C ATOM 836 CE1 TYR A 64 -13.000 -11.089 -0.305 1.00 0.23 C ATOM 837 CE2 TYR A 64 -10.838 -10.875 0.699 1.00 0.23 C ATOM 838 CZ TYR A 64 -12.204 -11.482 0.598 1.00 0.24 C ATOM 839 OH TYR A 64 -12.500 -12.239 1.726 1.00 0.31 O ATOM 0 H TYR A 64 -9.084 -10.229 -3.980 1.00 0.16 H new ATOM 0 HA TYR A 64 -11.998 -9.847 -3.903 1.00 0.16 H new ATOM 0 HB2 TYR A 64 -9.843 -8.471 -2.254 1.00 0.15 H new ATOM 0 HB3 TYR A 64 -11.477 -7.855 -2.397 1.00 0.15 H new ATOM 0 HD1 TYR A 64 -13.299 -10.004 -2.117 1.00 0.19 H new ATOM 0 HD2 TYR A 64 -9.463 -9.618 -0.314 1.00 0.19 H new ATOM 0 HE1 TYR A 64 -14.026 -11.426 -0.276 1.00 0.23 H new ATOM 0 HE2 TYR A 64 -10.183 -11.089 1.531 1.00 0.23 H new ATOM 0 HH TYR A 64 -11.732 -12.805 1.951 1.00 0.31 H new ATOM 849 N LYS A 65 -10.054 -8.585 -5.886 1.00 0.20 N ATOM 850 CA LYS A 65 -10.114 -7.799 -7.111 1.00 0.23 C ATOM 851 C LYS A 65 -11.384 -8.175 -7.829 1.00 0.20 C ATOM 852 O LYS A 65 -11.926 -7.407 -8.621 1.00 0.22 O ATOM 853 CB LYS A 65 -8.879 -7.984 -8.011 1.00 0.34 C ATOM 854 CG LYS A 65 -8.430 -9.420 -8.232 1.00 0.29 C ATOM 855 CD LYS A 65 -7.030 -9.470 -8.828 1.00 0.38 C ATOM 856 CE LYS A 65 -7.030 -9.435 -10.354 1.00 0.80 C ATOM 857 NZ LYS A 65 -7.386 -8.098 -10.905 1.00 1.35 N ATOM 0 H LYS A 65 -9.285 -9.253 -5.839 1.00 0.20 H new ATOM 0 HA LYS A 65 -10.115 -6.740 -6.854 1.00 0.23 H new ATOM 0 HB2 LYS A 65 -9.090 -7.536 -8.982 1.00 0.34 H new ATOM 0 HB3 LYS A 65 -8.049 -7.427 -7.576 1.00 0.34 H new ATOM 0 HG2 LYS A 65 -8.445 -9.959 -7.285 1.00 0.29 H new ATOM 0 HG3 LYS A 65 -9.130 -9.925 -8.897 1.00 0.29 H new ATOM 0 HD2 LYS A 65 -6.450 -8.628 -8.451 1.00 0.38 H new ATOM 0 HD3 LYS A 65 -6.530 -10.378 -8.491 1.00 0.38 H new ATOM 0 HE2 LYS A 65 -6.043 -9.721 -10.719 1.00 0.80 H new ATOM 0 HE3 LYS A 65 -7.736 -10.176 -10.729 1.00 0.80 H new ATOM 0 HZ1 LYS A 65 -7.022 -8.014 -11.876 1.00 1.35 H new ATOM 0 HZ2 LYS A 65 -8.420 -7.990 -10.912 1.00 1.35 H new ATOM 0 HZ3 LYS A 65 -6.964 -7.355 -10.312 1.00 1.35 H new ATOM 871 N SER A 66 -11.878 -9.352 -7.463 1.00 0.23 N ATOM 872 CA SER A 66 -13.185 -9.826 -7.904 1.00 0.26 C ATOM 873 C SER A 66 -14.248 -8.732 -7.748 1.00 0.25 C ATOM 874 O SER A 66 -15.067 -8.517 -8.642 1.00 0.31 O ATOM 875 CB SER A 66 -13.594 -11.028 -7.059 1.00 0.32 C ATOM 876 OG SER A 66 -12.453 -11.775 -6.663 1.00 1.28 O ATOM 0 H SER A 66 -11.385 -10.004 -6.853 1.00 0.23 H new ATOM 0 HA SER A 66 -13.113 -10.101 -8.956 1.00 0.26 H new ATOM 0 HB2 SER A 66 -14.138 -10.690 -6.177 1.00 0.32 H new ATOM 0 HB3 SER A 66 -14.272 -11.664 -7.627 1.00 0.32 H new ATOM 0 HG SER A 66 -12.375 -11.760 -5.686 1.00 1.28 H new ATOM 882 N GLN A 67 -14.233 -8.049 -6.605 1.00 0.21 N ATOM 883 CA GLN A 67 -15.171 -6.964 -6.356 1.00 0.20 C ATOM 884 C GLN A 67 -14.654 -5.629 -6.906 1.00 0.20 C ATOM 885 O GLN A 67 -15.437 -4.800 -7.370 1.00 0.27 O ATOM 886 CB GLN A 67 -15.455 -6.835 -4.854 1.00 0.21 C ATOM 887 CG GLN A 67 -16.097 -8.072 -4.240 1.00 0.38 C ATOM 888 CD GLN A 67 -15.092 -9.064 -3.687 1.00 0.52 C ATOM 889 OE1 GLN A 67 -13.969 -9.178 -4.171 1.00 1.11 O ATOM 890 NE2 GLN A 67 -15.499 -9.797 -2.667 1.00 0.46 N ATOM 0 H GLN A 67 -13.582 -8.229 -5.840 1.00 0.21 H new ATOM 0 HA GLN A 67 -16.096 -7.207 -6.878 1.00 0.20 H new ATOM 0 HB2 GLN A 67 -14.520 -6.626 -4.334 1.00 0.21 H new ATOM 0 HB3 GLN A 67 -16.109 -5.979 -4.690 1.00 0.21 H new ATOM 0 HG2 GLN A 67 -16.769 -7.763 -3.439 1.00 0.38 H new ATOM 0 HG3 GLN A 67 -16.707 -8.568 -4.995 1.00 0.38 H new ATOM 0 HE21 GLN A 67 -16.440 -9.673 -2.293 1.00 0.46 H new ATOM 0 HE22 GLN A 67 -14.873 -10.487 -2.253 1.00 0.46 H new ATOM 899 N GLY A 68 -13.337 -5.444 -6.877 1.00 0.17 N ATOM 900 CA GLY A 68 -12.737 -4.178 -7.257 1.00 0.18 C ATOM 901 C GLY A 68 -11.528 -3.854 -6.399 1.00 0.15 C ATOM 902 O GLY A 68 -10.860 -2.835 -6.597 1.00 0.17 O ATOM 0 H GLY A 68 -12.668 -6.159 -6.593 1.00 0.17 H new ATOM 0 HA2 GLY A 68 -12.441 -4.215 -8.305 1.00 0.18 H new ATOM 0 HA3 GLY A 68 -13.475 -3.382 -7.162 1.00 0.18 H new ATOM 906 N PHE A 69 -11.248 -4.741 -5.450 1.00 0.14 N ATOM 907 CA PHE A 69 -10.146 -4.575 -4.507 1.00 0.13 C ATOM 908 C PHE A 69 -8.799 -4.700 -5.205 1.00 0.14 C ATOM 909 O PHE A 69 -8.649 -5.491 -6.126 1.00 0.18 O ATOM 910 CB PHE A 69 -10.251 -5.644 -3.415 1.00 0.14 C ATOM 911 CG PHE A 69 -9.226 -5.526 -2.343 1.00 0.12 C ATOM 912 CD1 PHE A 69 -8.961 -4.320 -1.711 1.00 0.14 C ATOM 913 CD2 PHE A 69 -8.527 -6.632 -1.974 1.00 0.14 C ATOM 914 CE1 PHE A 69 -7.997 -4.244 -0.727 1.00 0.16 C ATOM 915 CE2 PHE A 69 -7.579 -6.574 -1.011 1.00 0.16 C ATOM 916 CZ PHE A 69 -7.354 -5.238 -0.339 1.00 0.14 C ATOM 0 H PHE A 69 -11.781 -5.600 -5.312 1.00 0.14 H new ATOM 0 HA PHE A 69 -10.215 -3.579 -4.070 1.00 0.13 H new ATOM 0 HB2 PHE A 69 -11.241 -5.589 -2.963 1.00 0.14 H new ATOM 0 HB3 PHE A 69 -10.166 -6.628 -3.876 1.00 0.14 H new ATOM 0 HD1 PHE A 69 -9.513 -3.435 -1.991 1.00 0.14 H new ATOM 0 HD2 PHE A 69 -8.733 -7.575 -2.459 1.00 0.14 H new ATOM 0 HE1 PHE A 69 -7.792 -3.285 -0.275 1.00 0.16 H new ATOM 0 HE2 PHE A 69 -7.006 -7.446 -0.733 1.00 0.16 H new ATOM 0 HZ PHE A 69 -6.643 -5.147 0.469 1.00 0.14 H new ATOM 926 N THR A 70 -7.830 -3.900 -4.784 1.00 0.13 N ATOM 927 CA THR A 70 -6.477 -4.055 -5.215 1.00 0.12 C ATOM 928 C THR A 70 -5.608 -3.965 -4.012 1.00 0.12 C ATOM 929 O THR A 70 -5.942 -3.284 -3.057 1.00 0.19 O ATOM 930 CB THR A 70 -6.068 -2.960 -6.207 1.00 0.15 C ATOM 931 OG1 THR A 70 -4.972 -3.400 -7.007 1.00 0.20 O ATOM 932 CG2 THR A 70 -5.689 -1.666 -5.499 1.00 0.19 C ATOM 0 H THR A 70 -7.976 -3.128 -4.133 1.00 0.13 H new ATOM 0 HA THR A 70 -6.373 -5.016 -5.719 1.00 0.12 H new ATOM 0 HB THR A 70 -6.932 -2.761 -6.841 1.00 0.15 H new ATOM 0 HG1 THR A 70 -5.138 -4.316 -7.314 1.00 0.20 H new ATOM 0 HG21 THR A 70 -5.406 -0.916 -6.238 1.00 0.19 H new ATOM 0 HG22 THR A 70 -6.540 -1.304 -4.923 1.00 0.19 H new ATOM 0 HG23 THR A 70 -4.849 -1.850 -4.829 1.00 0.19 H new ATOM 940 N VAL A 71 -4.539 -4.677 -4.020 1.00 0.13 N ATOM 941 CA VAL A 71 -3.466 -4.305 -3.184 1.00 0.13 C ATOM 942 C VAL A 71 -2.481 -3.559 -4.028 1.00 0.13 C ATOM 943 O VAL A 71 -1.699 -4.147 -4.769 1.00 0.15 O ATOM 944 CB VAL A 71 -2.813 -5.504 -2.517 1.00 0.15 C ATOM 945 CG1 VAL A 71 -1.474 -5.102 -1.911 1.00 0.16 C ATOM 946 CG2 VAL A 71 -3.740 -6.069 -1.460 1.00 0.17 C ATOM 0 H VAL A 71 -4.388 -5.509 -4.590 1.00 0.13 H new ATOM 0 HA VAL A 71 -3.836 -3.678 -2.372 1.00 0.13 H new ATOM 0 HB VAL A 71 -2.628 -6.277 -3.263 1.00 0.15 H new ATOM 0 HG11 VAL A 71 -1.015 -5.969 -1.436 1.00 0.16 H new ATOM 0 HG12 VAL A 71 -0.817 -4.728 -2.696 1.00 0.16 H new ATOM 0 HG13 VAL A 71 -1.631 -4.321 -1.167 1.00 0.16 H new ATOM 0 HG21 VAL A 71 -3.268 -6.929 -0.984 1.00 0.17 H new ATOM 0 HG22 VAL A 71 -3.944 -5.305 -0.709 1.00 0.17 H new ATOM 0 HG23 VAL A 71 -4.675 -6.380 -1.925 1.00 0.17 H new ATOM 956 N LEU A 72 -2.547 -2.255 -3.941 1.00 0.17 N ATOM 957 CA LEU A 72 -1.626 -1.444 -4.668 1.00 0.22 C ATOM 958 C LEU A 72 -0.378 -1.315 -3.847 1.00 0.19 C ATOM 959 O LEU A 72 -0.417 -0.779 -2.757 1.00 0.28 O ATOM 960 CB LEU A 72 -2.201 -0.053 -4.907 1.00 0.43 C ATOM 961 CG LEU A 72 -2.671 0.246 -6.311 1.00 0.34 C ATOM 962 CD1 LEU A 72 -3.251 1.649 -6.378 1.00 1.04 C ATOM 963 CD2 LEU A 72 -1.513 0.095 -7.277 1.00 1.00 C ATOM 0 H LEU A 72 -3.225 -1.743 -3.377 1.00 0.17 H new ATOM 0 HA LEU A 72 -1.421 -1.906 -5.634 1.00 0.22 H new ATOM 0 HB2 LEU A 72 -3.041 0.091 -4.227 1.00 0.43 H new ATOM 0 HB3 LEU A 72 -1.442 0.682 -4.637 1.00 0.43 H new ATOM 0 HG LEU A 72 -3.453 -0.460 -6.591 1.00 0.34 H new ATOM 0 HD11 LEU A 72 -3.587 1.856 -7.394 1.00 1.04 H new ATOM 0 HD12 LEU A 72 -4.096 1.727 -5.693 1.00 1.04 H new ATOM 0 HD13 LEU A 72 -2.487 2.373 -6.095 1.00 1.04 H new ATOM 0 HD21 LEU A 72 -1.853 0.311 -8.290 1.00 1.00 H new ATOM 0 HD22 LEU A 72 -0.719 0.791 -7.005 1.00 1.00 H new ATOM 0 HD23 LEU A 72 -1.132 -0.925 -7.232 1.00 1.00 H new ATOM 975 N ALA A 73 0.719 -1.779 -4.360 1.00 0.22 N ATOM 976 CA ALA A 73 1.947 -1.692 -3.621 1.00 0.30 C ATOM 977 C ALA A 73 2.952 -0.812 -4.341 1.00 0.23 C ATOM 978 O ALA A 73 3.421 -1.144 -5.425 1.00 0.32 O ATOM 979 CB ALA A 73 2.502 -3.080 -3.382 1.00 0.51 C ATOM 0 H ALA A 73 0.793 -2.218 -5.278 1.00 0.22 H new ATOM 0 HA ALA A 73 1.745 -1.230 -2.655 1.00 0.30 H new ATOM 0 HB1 ALA A 73 3.434 -3.008 -2.821 1.00 0.51 H new ATOM 0 HB2 ALA A 73 1.781 -3.667 -2.814 1.00 0.51 H new ATOM 0 HB3 ALA A 73 2.692 -3.566 -4.339 1.00 0.51 H new ATOM 985 N PHE A 74 3.262 0.329 -3.758 1.00 0.29 N ATOM 986 CA PHE A 74 4.317 1.174 -4.283 1.00 0.33 C ATOM 987 C PHE A 74 5.621 0.783 -3.581 1.00 0.35 C ATOM 988 O PHE A 74 5.781 1.038 -2.387 1.00 0.37 O ATOM 989 CB PHE A 74 4.016 2.657 -4.051 1.00 0.44 C ATOM 990 CG PHE A 74 2.816 3.248 -4.780 1.00 0.36 C ATOM 991 CD1 PHE A 74 1.703 2.492 -5.145 1.00 0.43 C ATOM 992 CD2 PHE A 74 2.800 4.609 -5.052 1.00 0.41 C ATOM 993 CE1 PHE A 74 0.622 3.084 -5.770 1.00 0.41 C ATOM 994 CE2 PHE A 74 1.714 5.206 -5.674 1.00 0.43 C ATOM 995 CZ PHE A 74 0.624 4.438 -6.033 1.00 0.35 C ATOM 0 H PHE A 74 2.801 0.692 -2.924 1.00 0.29 H new ATOM 0 HA PHE A 74 4.398 1.029 -5.360 1.00 0.33 H new ATOM 0 HB2 PHE A 74 3.869 2.808 -2.982 1.00 0.44 H new ATOM 0 HB3 PHE A 74 4.899 3.229 -4.336 1.00 0.44 H new ATOM 0 HD1 PHE A 74 1.685 1.432 -4.937 1.00 0.43 H new ATOM 0 HD2 PHE A 74 3.650 5.215 -4.774 1.00 0.41 H new ATOM 0 HE1 PHE A 74 -0.229 2.483 -6.054 1.00 0.41 H new ATOM 0 HE2 PHE A 74 1.721 6.267 -5.877 1.00 0.43 H new ATOM 0 HZ PHE A 74 -0.225 4.896 -6.519 1.00 0.35 H new ATOM 1005 N PRO A 75 6.556 0.157 -4.318 1.00 0.37 N ATOM 1006 CA PRO A 75 7.720 -0.556 -3.745 1.00 0.46 C ATOM 1007 C PRO A 75 8.828 0.312 -3.143 1.00 0.61 C ATOM 1008 O PRO A 75 9.999 -0.047 -3.243 1.00 1.30 O ATOM 1009 CB PRO A 75 8.264 -1.345 -4.933 1.00 0.54 C ATOM 1010 CG PRO A 75 7.862 -0.554 -6.124 1.00 0.44 C ATOM 1011 CD PRO A 75 6.534 0.072 -5.782 1.00 0.38 C ATOM 0 HA PRO A 75 7.394 -1.146 -2.888 1.00 0.46 H new ATOM 0 HB2 PRO A 75 9.347 -1.452 -4.875 1.00 0.54 H new ATOM 0 HB3 PRO A 75 7.846 -2.351 -4.966 1.00 0.54 H new ATOM 0 HG2 PRO A 75 8.605 0.210 -6.353 1.00 0.44 H new ATOM 0 HG3 PRO A 75 7.777 -1.191 -7.004 1.00 0.44 H new ATOM 0 HD2 PRO A 75 6.426 1.056 -6.239 1.00 0.38 H new ATOM 0 HD3 PRO A 75 5.702 -0.537 -6.135 1.00 0.38 H new ATOM 1019 N SER A 76 8.418 1.366 -2.431 1.00 0.41 N ATOM 1020 CA SER A 76 9.310 2.277 -1.691 1.00 0.37 C ATOM 1021 C SER A 76 10.536 2.763 -2.447 1.00 0.50 C ATOM 1022 O SER A 76 11.110 2.103 -3.304 1.00 0.74 O ATOM 1023 CB SER A 76 9.702 1.626 -0.355 1.00 0.53 C ATOM 1024 OG SER A 76 10.869 2.202 0.198 1.00 1.44 O ATOM 0 H SER A 76 7.433 1.619 -2.348 1.00 0.41 H new ATOM 0 HA SER A 76 8.734 3.188 -1.527 1.00 0.37 H new ATOM 0 HB2 SER A 76 8.879 1.728 0.352 1.00 0.53 H new ATOM 0 HB3 SER A 76 9.862 0.559 -0.506 1.00 0.53 H new ATOM 0 HG SER A 76 10.661 3.096 0.542 1.00 1.44 H new ATOM 1030 N ASN A 77 10.946 3.956 -2.099 1.00 0.52 N ATOM 1031 CA ASN A 77 12.118 4.524 -2.691 1.00 0.72 C ATOM 1032 C ASN A 77 13.247 4.390 -1.697 1.00 0.70 C ATOM 1033 O ASN A 77 13.885 5.365 -1.289 1.00 0.75 O ATOM 1034 CB ASN A 77 11.863 5.963 -3.102 1.00 0.93 C ATOM 1035 CG ASN A 77 13.028 6.581 -3.853 1.00 0.96 C ATOM 1036 OD1 ASN A 77 13.717 5.909 -4.623 1.00 1.81 O ATOM 1037 ND2 ASN A 77 13.273 7.859 -3.611 1.00 1.46 N ATOM 0 H ASN A 77 10.483 4.548 -1.409 1.00 0.52 H new ATOM 0 HA ASN A 77 12.391 3.997 -3.605 1.00 0.72 H new ATOM 0 HB2 ASN A 77 10.972 6.004 -3.728 1.00 0.93 H new ATOM 0 HB3 ASN A 77 11.655 6.558 -2.212 1.00 0.93 H new ATOM 0 HD21 ASN A 77 14.057 8.324 -4.069 1.00 1.46 H new ATOM 0 HD22 ASN A 77 12.678 8.379 -2.966 1.00 1.46 H new ATOM 1044 N GLN A 78 13.450 3.135 -1.293 1.00 0.85 N ATOM 1045 CA GLN A 78 14.543 2.731 -0.415 1.00 0.98 C ATOM 1046 C GLN A 78 15.870 3.219 -0.965 1.00 0.98 C ATOM 1047 O GLN A 78 16.880 3.267 -0.263 1.00 1.12 O ATOM 1048 CB GLN A 78 14.541 1.201 -0.254 1.00 1.35 C ATOM 1049 CG GLN A 78 14.226 0.442 -1.540 1.00 2.07 C ATOM 1050 CD GLN A 78 15.360 0.459 -2.552 1.00 2.74 C ATOM 1051 OE1 GLN A 78 15.130 0.463 -3.761 1.00 3.34 O ATOM 1052 NE2 GLN A 78 16.593 0.454 -2.067 1.00 3.30 N ATOM 0 H GLN A 78 12.848 2.360 -1.573 1.00 0.85 H new ATOM 0 HA GLN A 78 14.401 3.183 0.567 1.00 0.98 H new ATOM 0 HB2 GLN A 78 15.517 0.883 0.114 1.00 1.35 H new ATOM 0 HB3 GLN A 78 13.809 0.927 0.506 1.00 1.35 H new ATOM 0 HG2 GLN A 78 13.987 -0.592 -1.292 1.00 2.07 H new ATOM 0 HG3 GLN A 78 13.336 0.874 -1.998 1.00 2.07 H new ATOM 0 HE21 GLN A 78 16.744 0.451 -1.058 1.00 3.30 H new ATOM 0 HE22 GLN A 78 17.391 0.453 -2.702 1.00 3.30 H new ATOM 1061 N PHE A 79 15.834 3.607 -2.228 1.00 0.98 N ATOM 1062 CA PHE A 79 17.016 4.076 -2.929 1.00 1.19 C ATOM 1063 C PHE A 79 17.509 5.390 -2.330 1.00 1.20 C ATOM 1064 O PHE A 79 18.668 5.769 -2.496 1.00 1.54 O ATOM 1065 CB PHE A 79 16.702 4.245 -4.410 1.00 1.32 C ATOM 1066 CG PHE A 79 17.774 3.704 -5.311 1.00 1.57 C ATOM 1067 CD1 PHE A 79 18.858 4.491 -5.667 1.00 1.82 C ATOM 1068 CD2 PHE A 79 17.696 2.415 -5.809 1.00 2.02 C ATOM 1069 CE1 PHE A 79 19.845 4.000 -6.500 1.00 2.25 C ATOM 1070 CE2 PHE A 79 18.681 1.918 -6.643 1.00 2.64 C ATOM 1071 CZ PHE A 79 19.762 2.696 -6.971 1.00 2.68 C ATOM 0 H PHE A 79 14.986 3.606 -2.795 1.00 0.98 H new ATOM 0 HA PHE A 79 17.810 3.337 -2.819 1.00 1.19 H new ATOM 0 HB2 PHE A 79 15.761 3.742 -4.634 1.00 1.32 H new ATOM 0 HB3 PHE A 79 16.557 5.304 -4.625 1.00 1.32 H new ATOM 0 HD1 PHE A 79 18.932 5.500 -5.289 1.00 1.82 H new ATOM 0 HD2 PHE A 79 16.856 1.790 -5.543 1.00 2.02 H new ATOM 0 HE1 PHE A 79 20.677 4.627 -6.784 1.00 2.25 H new ATOM 0 HE2 PHE A 79 18.599 0.916 -7.037 1.00 2.64 H new ATOM 0 HZ PHE A 79 20.547 2.295 -7.595 1.00 2.68 H new ATOM 1081 N GLY A 80 16.620 6.072 -1.627 1.00 1.10 N ATOM 1082 CA GLY A 80 16.997 7.273 -0.910 1.00 1.22 C ATOM 1083 C GLY A 80 17.774 6.937 0.345 1.00 1.24 C ATOM 1084 O GLY A 80 18.984 7.149 0.414 1.00 1.98 O ATOM 0 H GLY A 80 15.637 5.814 -1.539 1.00 1.10 H new ATOM 0 HA2 GLY A 80 17.601 7.911 -1.555 1.00 1.22 H new ATOM 0 HA3 GLY A 80 16.103 7.839 -0.648 1.00 1.22 H new ATOM 1088 N GLY A 81 17.078 6.385 1.329 1.00 1.18 N ATOM 1089 CA GLY A 81 17.729 5.967 2.553 1.00 1.21 C ATOM 1090 C GLY A 81 17.012 6.451 3.789 1.00 1.14 C ATOM 1091 O GLY A 81 17.643 6.854 4.764 1.00 1.49 O ATOM 0 H GLY A 81 16.072 6.219 1.301 1.00 1.18 H new ATOM 0 HA2 GLY A 81 17.788 4.879 2.575 1.00 1.21 H new ATOM 0 HA3 GLY A 81 18.752 6.342 2.562 1.00 1.21 H new ATOM 1095 N GLN A 82 15.688 6.408 3.754 1.00 0.86 N ATOM 1096 CA GLN A 82 14.885 6.817 4.893 1.00 0.82 C ATOM 1097 C GLN A 82 13.596 6.038 4.949 1.00 0.77 C ATOM 1098 O GLN A 82 12.614 6.487 5.523 1.00 0.91 O ATOM 1099 CB GLN A 82 14.583 8.327 4.869 1.00 0.80 C ATOM 1100 CG GLN A 82 13.808 8.839 3.646 1.00 0.75 C ATOM 1101 CD GLN A 82 14.494 8.573 2.322 1.00 1.09 C ATOM 1102 OE1 GLN A 82 15.397 9.299 1.912 1.00 1.74 O ATOM 1103 NE2 GLN A 82 14.009 7.569 1.609 1.00 1.14 N ATOM 0 H GLN A 82 15.148 6.093 2.948 1.00 0.86 H new ATOM 0 HA GLN A 82 15.470 6.603 5.788 1.00 0.82 H new ATOM 0 HB2 GLN A 82 14.016 8.578 5.765 1.00 0.80 H new ATOM 0 HB3 GLN A 82 15.528 8.867 4.928 1.00 0.80 H new ATOM 0 HG2 GLN A 82 12.823 8.373 3.632 1.00 0.75 H new ATOM 0 HG3 GLN A 82 13.651 9.912 3.752 1.00 0.75 H new ATOM 0 HE21 GLN A 82 13.259 6.991 1.987 1.00 1.14 H new ATOM 0 HE22 GLN A 82 14.385 7.374 0.681 1.00 1.14 H new ATOM 1112 N GLU A 83 13.623 4.863 4.371 1.00 0.75 N ATOM 1113 CA GLU A 83 12.430 4.066 4.204 1.00 0.74 C ATOM 1114 C GLU A 83 12.212 3.138 5.397 1.00 0.72 C ATOM 1115 O GLU A 83 13.165 2.746 6.074 1.00 0.88 O ATOM 1116 CB GLU A 83 12.558 3.313 2.891 1.00 0.87 C ATOM 1117 CG GLU A 83 12.832 4.267 1.742 1.00 1.16 C ATOM 1118 CD GLU A 83 11.662 5.181 1.446 1.00 2.33 C ATOM 1119 OE1 GLU A 83 11.611 6.274 2.043 1.00 2.83 O ATOM 1120 OE2 GLU A 83 10.805 4.811 0.613 1.00 3.07 O ATOM 0 H GLU A 83 14.471 4.431 4.003 1.00 0.75 H new ATOM 0 HA GLU A 83 11.545 4.702 4.167 1.00 0.74 H new ATOM 0 HB2 GLU A 83 13.365 2.583 2.963 1.00 0.87 H new ATOM 0 HB3 GLU A 83 11.641 2.756 2.696 1.00 0.87 H new ATOM 0 HG2 GLU A 83 13.708 4.871 1.978 1.00 1.16 H new ATOM 0 HG3 GLU A 83 13.073 3.692 0.848 1.00 1.16 H new ATOM 1127 N PRO A 84 10.945 2.793 5.670 1.00 0.63 N ATOM 1128 CA PRO A 84 10.559 2.044 6.865 1.00 0.75 C ATOM 1129 C PRO A 84 10.950 0.570 6.790 1.00 1.00 C ATOM 1130 O PRO A 84 10.636 -0.126 5.821 1.00 1.75 O ATOM 1131 CB PRO A 84 9.041 2.202 6.909 1.00 1.02 C ATOM 1132 CG PRO A 84 8.612 2.494 5.515 1.00 0.72 C ATOM 1133 CD PRO A 84 9.791 3.086 4.800 1.00 0.61 C ATOM 0 HA PRO A 84 11.064 2.416 7.757 1.00 0.75 H new ATOM 0 HB2 PRO A 84 8.566 1.294 7.280 1.00 1.02 H new ATOM 0 HB3 PRO A 84 8.753 3.010 7.582 1.00 1.02 H new ATOM 0 HG2 PRO A 84 8.278 1.584 5.017 1.00 0.72 H new ATOM 0 HG3 PRO A 84 7.771 3.187 5.509 1.00 0.72 H new ATOM 0 HD2 PRO A 84 9.918 2.643 3.812 1.00 0.61 H new ATOM 0 HD3 PRO A 84 9.668 4.159 4.655 1.00 0.61 H new ATOM 1141 N GLY A 85 11.646 0.107 7.817 1.00 1.45 N ATOM 1142 CA GLY A 85 12.067 -1.275 7.871 1.00 1.82 C ATOM 1143 C GLY A 85 13.376 -1.506 7.145 1.00 1.61 C ATOM 1144 O GLY A 85 14.382 -1.860 7.759 1.00 2.20 O ATOM 0 H GLY A 85 11.928 0.670 8.620 1.00 1.45 H new ATOM 0 HA2 GLY A 85 12.173 -1.580 8.912 1.00 1.82 H new ATOM 0 HA3 GLY A 85 11.294 -1.905 7.431 1.00 1.82 H new ATOM 1148 N ASN A 86 13.364 -1.292 5.836 1.00 1.49 N ATOM 1149 CA ASN A 86 14.543 -1.511 5.008 1.00 2.04 C ATOM 1150 C ASN A 86 14.739 -0.351 4.051 1.00 1.94 C ATOM 1151 O ASN A 86 13.821 0.018 3.321 1.00 2.70 O ATOM 1152 CB ASN A 86 14.416 -2.813 4.210 1.00 2.78 C ATOM 1153 CG ASN A 86 14.376 -4.041 5.094 1.00 3.58 C ATOM 1154 OD1 ASN A 86 13.305 -4.482 5.512 1.00 4.07 O ATOM 1155 ND2 ASN A 86 15.540 -4.600 5.387 1.00 4.20 N ATOM 0 H ASN A 86 12.546 -0.965 5.322 1.00 1.49 H new ATOM 0 HA ASN A 86 15.407 -1.585 5.669 1.00 2.04 H new ATOM 0 HB2 ASN A 86 13.510 -2.776 3.605 1.00 2.78 H new ATOM 0 HB3 ASN A 86 15.256 -2.895 3.520 1.00 2.78 H new ATOM 0 HD21 ASN A 86 15.573 -5.429 5.980 1.00 4.20 H new ATOM 0 HD22 ASN A 86 16.404 -4.202 5.019 1.00 4.20 H new ATOM 1162 N GLU A 87 15.930 0.225 4.060 1.00 1.52 N ATOM 1163 CA GLU A 87 16.242 1.328 3.168 1.00 1.46 C ATOM 1164 C GLU A 87 17.470 1.009 2.304 1.00 1.60 C ATOM 1165 O GLU A 87 17.369 0.925 1.082 1.00 2.15 O ATOM 1166 CB GLU A 87 16.413 2.656 3.945 1.00 1.61 C ATOM 1167 CG GLU A 87 17.578 2.718 4.935 1.00 2.19 C ATOM 1168 CD GLU A 87 17.511 1.653 6.004 1.00 2.58 C ATOM 1169 OE1 GLU A 87 16.845 1.892 7.032 1.00 2.84 O ATOM 1170 OE2 GLU A 87 18.134 0.585 5.835 1.00 3.02 O ATOM 0 H GLU A 87 16.695 -0.053 4.674 1.00 1.52 H new ATOM 0 HA GLU A 87 15.395 1.461 2.495 1.00 1.46 H new ATOM 0 HB2 GLU A 87 16.536 3.462 3.222 1.00 1.61 H new ATOM 0 HB3 GLU A 87 15.490 2.855 4.490 1.00 1.61 H new ATOM 0 HG2 GLU A 87 18.516 2.616 4.389 1.00 2.19 H new ATOM 0 HG3 GLU A 87 17.591 3.699 5.410 1.00 2.19 H new ATOM 1177 N GLU A 88 18.614 0.783 2.931 1.00 1.57 N ATOM 1178 CA GLU A 88 19.856 0.603 2.187 1.00 1.77 C ATOM 1179 C GLU A 88 20.187 -0.871 1.987 1.00 1.62 C ATOM 1180 O GLU A 88 21.046 -1.204 1.173 1.00 1.62 O ATOM 1181 CB GLU A 88 21.004 1.331 2.880 1.00 2.18 C ATOM 1182 CG GLU A 88 20.730 2.815 3.048 1.00 2.68 C ATOM 1183 CD GLU A 88 21.992 3.641 3.068 1.00 3.33 C ATOM 1184 OE1 GLU A 88 22.489 3.980 1.976 1.00 3.92 O ATOM 1185 OE2 GLU A 88 22.487 3.963 4.166 1.00 3.66 O ATOM 0 H GLU A 88 18.711 0.720 3.944 1.00 1.57 H new ATOM 0 HA GLU A 88 19.716 1.039 1.198 1.00 1.77 H new ATOM 0 HB2 GLU A 88 21.177 0.883 3.859 1.00 2.18 H new ATOM 0 HB3 GLU A 88 21.918 1.196 2.302 1.00 2.18 H new ATOM 0 HG2 GLU A 88 20.090 3.157 2.235 1.00 2.68 H new ATOM 0 HG3 GLU A 88 20.180 2.976 3.975 1.00 2.68 H new ATOM 1192 N GLU A 89 19.495 -1.756 2.706 1.00 1.62 N ATOM 1193 CA GLU A 89 19.662 -3.193 2.495 1.00 1.59 C ATOM 1194 C GLU A 89 19.277 -3.551 1.068 1.00 1.49 C ATOM 1195 O GLU A 89 19.921 -4.364 0.424 1.00 1.59 O ATOM 1196 CB GLU A 89 18.812 -4.000 3.485 1.00 1.70 C ATOM 1197 CG GLU A 89 18.942 -5.514 3.333 1.00 1.75 C ATOM 1198 CD GLU A 89 18.325 -6.275 4.490 1.00 2.11 C ATOM 1199 OE1 GLU A 89 18.614 -5.925 5.653 1.00 2.45 O ATOM 1200 OE2 GLU A 89 17.567 -7.235 4.244 1.00 2.65 O ATOM 0 H GLU A 89 18.822 -1.507 3.431 1.00 1.62 H new ATOM 0 HA GLU A 89 20.709 -3.445 2.664 1.00 1.59 H new ATOM 0 HB2 GLU A 89 19.095 -3.722 4.500 1.00 1.70 H new ATOM 0 HB3 GLU A 89 17.766 -3.722 3.359 1.00 1.70 H new ATOM 0 HG2 GLU A 89 18.464 -5.824 2.404 1.00 1.75 H new ATOM 0 HG3 GLU A 89 19.997 -5.777 3.252 1.00 1.75 H new ATOM 1207 N ILE A 90 18.250 -2.888 0.568 1.00 1.43 N ATOM 1208 CA ILE A 90 17.748 -3.135 -0.779 1.00 1.39 C ATOM 1209 C ILE A 90 18.706 -2.547 -1.814 1.00 1.49 C ATOM 1210 O ILE A 90 18.602 -2.813 -3.010 1.00 1.57 O ATOM 1211 CB ILE A 90 16.361 -2.496 -0.956 1.00 1.45 C ATOM 1212 CG1 ILE A 90 15.551 -2.614 0.340 1.00 1.74 C ATOM 1213 CG2 ILE A 90 15.615 -3.134 -2.120 1.00 1.76 C ATOM 1214 CD1 ILE A 90 15.260 -4.035 0.770 1.00 2.15 C ATOM 0 H ILE A 90 17.740 -2.166 1.078 1.00 1.43 H new ATOM 0 HA ILE A 90 17.671 -4.213 -0.925 1.00 1.39 H new ATOM 0 HB ILE A 90 16.496 -1.439 -1.184 1.00 1.45 H new ATOM 0 HG12 ILE A 90 16.093 -2.109 1.140 1.00 1.74 H new ATOM 0 HG13 ILE A 90 14.606 -2.086 0.213 1.00 1.74 H new ATOM 0 HG21 ILE A 90 14.636 -2.666 -2.226 1.00 1.76 H new ATOM 0 HG22 ILE A 90 16.185 -2.994 -3.038 1.00 1.76 H new ATOM 0 HG23 ILE A 90 15.488 -4.200 -1.931 1.00 1.76 H new ATOM 0 HD11 ILE A 90 14.683 -4.024 1.695 1.00 2.15 H new ATOM 0 HD12 ILE A 90 14.688 -4.541 -0.008 1.00 2.15 H new ATOM 0 HD13 ILE A 90 16.198 -4.565 0.933 1.00 2.15 H new ATOM 1226 N LYS A 91 19.635 -1.737 -1.331 1.00 1.71 N ATOM 1227 CA LYS A 91 20.634 -1.110 -2.179 1.00 1.89 C ATOM 1228 C LYS A 91 21.900 -1.958 -2.228 1.00 1.98 C ATOM 1229 O LYS A 91 22.442 -2.220 -3.301 1.00 2.17 O ATOM 1230 CB LYS A 91 20.960 0.292 -1.656 1.00 2.00 C ATOM 1231 CG LYS A 91 19.834 1.302 -1.841 1.00 2.10 C ATOM 1232 CD LYS A 91 20.085 2.582 -1.048 1.00 2.33 C ATOM 1233 CE LYS A 91 21.539 3.017 -1.136 1.00 2.39 C ATOM 1234 NZ LYS A 91 21.775 4.359 -0.538 1.00 2.79 N ATOM 0 H LYS A 91 19.717 -1.497 -0.343 1.00 1.71 H new ATOM 0 HA LYS A 91 20.232 -1.028 -3.189 1.00 1.89 H new ATOM 0 HB2 LYS A 91 21.203 0.225 -0.596 1.00 2.00 H new ATOM 0 HB3 LYS A 91 21.851 0.660 -2.165 1.00 2.00 H new ATOM 0 HG2 LYS A 91 19.733 1.544 -2.899 1.00 2.10 H new ATOM 0 HG3 LYS A 91 18.891 0.857 -1.524 1.00 2.10 H new ATOM 0 HD2 LYS A 91 19.443 3.377 -1.426 1.00 2.33 H new ATOM 0 HD3 LYS A 91 19.814 2.423 -0.004 1.00 2.33 H new ATOM 0 HE2 LYS A 91 22.165 2.283 -0.629 1.00 2.39 H new ATOM 0 HE3 LYS A 91 21.847 3.031 -2.181 1.00 2.39 H new ATOM 0 HZ1 LYS A 91 22.305 4.950 -1.210 1.00 2.79 H new ATOM 0 HZ2 LYS A 91 20.862 4.810 -0.326 1.00 2.79 H new ATOM 0 HZ3 LYS A 91 22.323 4.256 0.340 1.00 2.79 H new ATOM 1248 N GLU A 92 22.360 -2.393 -1.060 1.00 2.07 N ATOM 1249 CA GLU A 92 23.579 -3.187 -0.966 1.00 2.27 C ATOM 1250 C GLU A 92 23.312 -4.645 -1.311 1.00 2.10 C ATOM 1251 O GLU A 92 24.238 -5.404 -1.607 1.00 2.26 O ATOM 1252 CB GLU A 92 24.188 -3.076 0.433 1.00 2.54 C ATOM 1253 CG GLU A 92 23.312 -3.648 1.534 1.00 2.47 C ATOM 1254 CD GLU A 92 23.999 -3.634 2.880 1.00 2.96 C ATOM 1255 OE1 GLU A 92 25.111 -4.193 2.987 1.00 3.29 O ATOM 1256 OE2 GLU A 92 23.441 -3.058 3.833 1.00 3.20 O ATOM 0 H GLU A 92 21.907 -2.209 -0.165 1.00 2.07 H new ATOM 0 HA GLU A 92 24.291 -2.791 -1.690 1.00 2.27 H new ATOM 0 HB2 GLU A 92 25.148 -3.591 0.442 1.00 2.54 H new ATOM 0 HB3 GLU A 92 24.387 -2.026 0.649 1.00 2.54 H new ATOM 0 HG2 GLU A 92 22.387 -3.074 1.595 1.00 2.47 H new ATOM 0 HG3 GLU A 92 23.036 -4.671 1.280 1.00 2.47 H new ATOM 1263 N PHE A 93 22.051 -5.034 -1.268 1.00 1.86 N ATOM 1264 CA PHE A 93 21.661 -6.386 -1.609 1.00 1.75 C ATOM 1265 C PHE A 93 20.896 -6.371 -2.920 1.00 1.59 C ATOM 1266 O PHE A 93 20.074 -5.483 -3.148 1.00 1.69 O ATOM 1267 CB PHE A 93 20.788 -6.962 -0.498 1.00 1.73 C ATOM 1268 CG PHE A 93 20.702 -8.455 -0.506 1.00 2.09 C ATOM 1269 CD1 PHE A 93 21.793 -9.234 -0.163 1.00 2.34 C ATOM 1270 CD2 PHE A 93 19.525 -9.078 -0.870 1.00 2.65 C ATOM 1271 CE1 PHE A 93 21.709 -10.613 -0.180 1.00 2.87 C ATOM 1272 CE2 PHE A 93 19.432 -10.457 -0.891 1.00 3.40 C ATOM 1273 CZ PHE A 93 20.559 -11.227 -0.497 1.00 3.42 C ATOM 0 H PHE A 93 21.277 -4.427 -0.998 1.00 1.86 H new ATOM 0 HA PHE A 93 22.549 -7.009 -1.719 1.00 1.75 H new ATOM 0 HB2 PHE A 93 21.181 -6.636 0.465 1.00 1.73 H new ATOM 0 HB3 PHE A 93 19.783 -6.550 -0.589 1.00 1.73 H new ATOM 0 HD1 PHE A 93 22.720 -8.759 0.121 1.00 2.34 H new ATOM 0 HD2 PHE A 93 18.667 -8.481 -1.142 1.00 2.65 H new ATOM 0 HE1 PHE A 93 22.579 -11.204 0.065 1.00 2.87 H new ATOM 0 HE2 PHE A 93 18.518 -10.941 -1.202 1.00 3.40 H new ATOM 0 HZ PHE A 93 20.490 -12.304 -0.453 1.00 3.42 H new ATOM 1283 N VAL A 94 21.173 -7.332 -3.790 1.00 1.62 N ATOM 1284 CA VAL A 94 20.458 -7.423 -5.051 1.00 1.68 C ATOM 1285 C VAL A 94 19.009 -7.794 -4.789 1.00 1.54 C ATOM 1286 O VAL A 94 18.709 -8.919 -4.390 1.00 1.74 O ATOM 1287 CB VAL A 94 21.087 -8.463 -5.999 1.00 2.11 C ATOM 1288 CG1 VAL A 94 20.263 -8.597 -7.272 1.00 2.63 C ATOM 1289 CG2 VAL A 94 22.523 -8.088 -6.329 1.00 2.56 C ATOM 0 H VAL A 94 21.881 -8.052 -3.647 1.00 1.62 H new ATOM 0 HA VAL A 94 20.519 -6.448 -5.535 1.00 1.68 H new ATOM 0 HB VAL A 94 21.093 -9.428 -5.492 1.00 2.11 H new ATOM 0 HG11 VAL A 94 20.724 -9.336 -7.928 1.00 2.63 H new ATOM 0 HG12 VAL A 94 19.252 -8.917 -7.019 1.00 2.63 H new ATOM 0 HG13 VAL A 94 20.222 -7.635 -7.782 1.00 2.63 H new ATOM 0 HG21 VAL A 94 22.949 -8.835 -6.999 1.00 2.56 H new ATOM 0 HG22 VAL A 94 22.542 -7.112 -6.814 1.00 2.56 H new ATOM 0 HG23 VAL A 94 23.109 -8.048 -5.411 1.00 2.56 H new ATOM 1299 N CYS A 95 18.119 -6.845 -5.023 1.00 1.47 N ATOM 1300 CA CYS A 95 16.711 -7.046 -4.753 1.00 1.46 C ATOM 1301 C CYS A 95 15.876 -6.655 -5.948 1.00 1.37 C ATOM 1302 O CYS A 95 16.099 -5.618 -6.576 1.00 1.52 O ATOM 1303 CB CYS A 95 16.277 -6.228 -3.535 1.00 1.77 C ATOM 1304 SG CYS A 95 17.342 -6.425 -2.088 1.00 2.83 S ATOM 0 H CYS A 95 18.350 -5.926 -5.401 1.00 1.47 H new ATOM 0 HA CYS A 95 16.557 -8.105 -4.546 1.00 1.46 H new ATOM 0 HB2 CYS A 95 16.250 -5.174 -3.811 1.00 1.77 H new ATOM 0 HB3 CYS A 95 15.260 -6.513 -3.265 1.00 1.77 H new ATOM 0 HG CYS A 95 18.508 -5.905 -2.333 1.00 2.83 H new ATOM 1310 N THR A 96 14.934 -7.517 -6.278 1.00 1.52 N ATOM 1311 CA THR A 96 13.925 -7.193 -7.252 1.00 1.59 C ATOM 1312 C THR A 96 13.096 -6.023 -6.744 1.00 1.08 C ATOM 1313 O THR A 96 12.854 -5.905 -5.541 1.00 1.31 O ATOM 1314 CB THR A 96 13.016 -8.407 -7.511 1.00 2.27 C ATOM 1315 OG1 THR A 96 12.769 -9.097 -6.276 1.00 2.76 O ATOM 1316 CG2 THR A 96 13.653 -9.359 -8.511 1.00 2.98 C ATOM 0 H THR A 96 14.851 -8.452 -5.879 1.00 1.52 H new ATOM 0 HA THR A 96 14.409 -6.920 -8.190 1.00 1.59 H new ATOM 0 HB THR A 96 12.074 -8.050 -7.928 1.00 2.27 H new ATOM 0 HG1 THR A 96 12.772 -8.455 -5.536 1.00 2.76 H new ATOM 0 HG21 THR A 96 12.991 -10.209 -8.677 1.00 2.98 H new ATOM 0 HG22 THR A 96 13.819 -8.838 -9.454 1.00 2.98 H new ATOM 0 HG23 THR A 96 14.607 -9.713 -8.120 1.00 2.98 H new ATOM 1324 N LYS A 97 12.653 -5.168 -7.649 1.00 1.14 N ATOM 1325 CA LYS A 97 11.886 -3.983 -7.268 1.00 1.11 C ATOM 1326 C LYS A 97 10.450 -4.355 -6.906 1.00 1.04 C ATOM 1327 O LYS A 97 9.540 -3.537 -7.027 1.00 1.76 O ATOM 1328 CB LYS A 97 11.903 -2.935 -8.386 1.00 1.47 C ATOM 1329 CG LYS A 97 11.394 -3.441 -9.725 1.00 1.47 C ATOM 1330 CD LYS A 97 11.424 -2.343 -10.774 1.00 1.89 C ATOM 1331 CE LYS A 97 11.040 -2.865 -12.147 1.00 2.34 C ATOM 1332 NZ LYS A 97 11.942 -3.959 -12.592 1.00 2.72 N ATOM 0 H LYS A 97 12.808 -5.267 -8.652 1.00 1.14 H new ATOM 0 HA LYS A 97 12.360 -3.550 -6.387 1.00 1.11 H new ATOM 0 HB2 LYS A 97 11.297 -2.083 -8.079 1.00 1.47 H new ATOM 0 HB3 LYS A 97 12.923 -2.572 -8.512 1.00 1.47 H new ATOM 0 HG2 LYS A 97 12.005 -4.281 -10.056 1.00 1.47 H new ATOM 0 HG3 LYS A 97 10.376 -3.813 -9.613 1.00 1.47 H new ATOM 0 HD2 LYS A 97 10.741 -1.545 -10.484 1.00 1.89 H new ATOM 0 HD3 LYS A 97 12.423 -1.908 -10.817 1.00 1.89 H new ATOM 0 HE2 LYS A 97 10.012 -3.228 -12.124 1.00 2.34 H new ATOM 0 HE3 LYS A 97 11.074 -2.049 -12.869 1.00 2.34 H new ATOM 0 HZ1 LYS A 97 11.807 -4.128 -13.609 1.00 2.72 H new ATOM 0 HZ2 LYS A 97 12.930 -3.688 -12.414 1.00 2.72 H new ATOM 0 HZ3 LYS A 97 11.721 -4.828 -12.065 1.00 2.72 H new ATOM 1346 N PHE A 98 10.287 -5.600 -6.459 1.00 0.89 N ATOM 1347 CA PHE A 98 9.011 -6.142 -6.019 1.00 0.92 C ATOM 1348 C PHE A 98 8.020 -6.246 -7.176 1.00 1.11 C ATOM 1349 O PHE A 98 7.589 -5.249 -7.752 1.00 2.12 O ATOM 1350 CB PHE A 98 8.440 -5.309 -4.866 1.00 1.15 C ATOM 1351 CG PHE A 98 7.128 -5.807 -4.324 1.00 0.75 C ATOM 1352 CD1 PHE A 98 6.748 -7.140 -4.435 1.00 1.02 C ATOM 1353 CD2 PHE A 98 6.267 -4.929 -3.701 1.00 0.96 C ATOM 1354 CE1 PHE A 98 5.533 -7.569 -3.932 1.00 0.94 C ATOM 1355 CE2 PHE A 98 5.059 -5.356 -3.201 1.00 0.87 C ATOM 1356 CZ PHE A 98 4.695 -6.673 -3.318 1.00 0.45 C ATOM 0 H PHE A 98 11.055 -6.268 -6.393 1.00 0.89 H new ATOM 0 HA PHE A 98 9.183 -7.154 -5.652 1.00 0.92 H new ATOM 0 HB2 PHE A 98 9.168 -5.287 -4.055 1.00 1.15 H new ATOM 0 HB3 PHE A 98 8.311 -4.282 -5.206 1.00 1.15 H new ATOM 0 HD1 PHE A 98 7.407 -7.846 -4.918 1.00 1.02 H new ATOM 0 HD2 PHE A 98 6.545 -3.890 -3.604 1.00 0.96 H new ATOM 0 HE1 PHE A 98 5.245 -8.606 -4.022 1.00 0.94 H new ATOM 0 HE2 PHE A 98 4.397 -4.654 -2.716 1.00 0.87 H new ATOM 0 HZ PHE A 98 3.746 -7.006 -2.925 1.00 0.45 H new ATOM 1366 N LYS A 99 7.680 -7.472 -7.523 1.00 0.80 N ATOM 1367 CA LYS A 99 6.665 -7.731 -8.522 1.00 0.78 C ATOM 1368 C LYS A 99 5.827 -8.913 -8.082 1.00 0.79 C ATOM 1369 O LYS A 99 6.319 -10.035 -7.975 1.00 1.43 O ATOM 1370 CB LYS A 99 7.304 -7.982 -9.889 1.00 1.02 C ATOM 1371 CG LYS A 99 6.304 -8.314 -10.985 1.00 1.34 C ATOM 1372 CD LYS A 99 6.974 -8.344 -12.348 1.00 1.63 C ATOM 1373 CE LYS A 99 7.386 -6.950 -12.798 1.00 2.05 C ATOM 1374 NZ LYS A 99 6.206 -6.093 -13.103 1.00 2.69 N ATOM 0 H LYS A 99 8.098 -8.312 -7.122 1.00 0.80 H new ATOM 0 HA LYS A 99 6.020 -6.858 -8.621 1.00 0.78 H new ATOM 0 HB2 LYS A 99 7.870 -7.098 -10.183 1.00 1.02 H new ATOM 0 HB3 LYS A 99 8.017 -8.802 -9.801 1.00 1.02 H new ATOM 0 HG2 LYS A 99 5.845 -9.281 -10.781 1.00 1.34 H new ATOM 0 HG3 LYS A 99 5.503 -7.575 -10.987 1.00 1.34 H new ATOM 0 HD2 LYS A 99 7.852 -8.989 -12.309 1.00 1.63 H new ATOM 0 HD3 LYS A 99 6.292 -8.777 -13.080 1.00 1.63 H new ATOM 0 HE2 LYS A 99 7.985 -6.479 -12.018 1.00 2.05 H new ATOM 0 HE3 LYS A 99 8.018 -7.026 -13.683 1.00 2.05 H new ATOM 0 HZ1 LYS A 99 6.518 -5.240 -13.609 1.00 2.69 H new ATOM 0 HZ2 LYS A 99 5.536 -6.623 -13.697 1.00 2.69 H new ATOM 0 HZ3 LYS A 99 5.739 -5.817 -12.216 1.00 2.69 H new ATOM 1388 N ALA A 100 4.569 -8.644 -7.797 1.00 0.51 N ATOM 1389 CA ALA A 100 3.682 -9.639 -7.239 1.00 0.43 C ATOM 1390 C ALA A 100 2.498 -9.876 -8.146 1.00 0.40 C ATOM 1391 O ALA A 100 2.487 -9.436 -9.295 1.00 0.55 O ATOM 1392 CB ALA A 100 3.194 -9.175 -5.886 1.00 0.43 C ATOM 0 H ALA A 100 4.136 -7.733 -7.946 1.00 0.51 H new ATOM 0 HA ALA A 100 4.232 -10.574 -7.137 1.00 0.43 H new ATOM 0 HB1 ALA A 100 2.525 -9.925 -5.464 1.00 0.43 H new ATOM 0 HB2 ALA A 100 4.046 -9.033 -5.221 1.00 0.43 H new ATOM 0 HB3 ALA A 100 2.659 -8.232 -5.996 1.00 0.43 H new ATOM 1398 N GLU A 101 1.490 -10.550 -7.618 1.00 0.34 N ATOM 1399 CA GLU A 101 0.261 -10.748 -8.354 1.00 0.40 C ATOM 1400 C GLU A 101 -0.699 -9.588 -8.117 1.00 0.43 C ATOM 1401 O GLU A 101 -1.877 -9.661 -8.465 1.00 0.67 O ATOM 1402 CB GLU A 101 -0.397 -12.074 -7.983 1.00 0.50 C ATOM 1403 CG GLU A 101 0.315 -13.282 -8.564 1.00 0.67 C ATOM 1404 CD GLU A 101 0.257 -13.307 -10.078 1.00 1.24 C ATOM 1405 OE1 GLU A 101 1.170 -12.743 -10.718 1.00 1.99 O ATOM 1406 OE2 GLU A 101 -0.691 -13.898 -10.636 1.00 1.57 O ATOM 0 H GLU A 101 1.502 -10.966 -6.687 1.00 0.34 H new ATOM 0 HA GLU A 101 0.508 -10.782 -9.415 1.00 0.40 H new ATOM 0 HB2 GLU A 101 -0.426 -12.166 -6.897 1.00 0.50 H new ATOM 0 HB3 GLU A 101 -1.430 -12.068 -8.330 1.00 0.50 H new ATOM 0 HG2 GLU A 101 1.356 -13.277 -8.242 1.00 0.67 H new ATOM 0 HG3 GLU A 101 -0.137 -14.192 -8.170 1.00 0.67 H new ATOM 1413 N PHE A 102 -0.179 -8.523 -7.519 1.00 0.38 N ATOM 1414 CA PHE A 102 -0.917 -7.306 -7.312 1.00 0.40 C ATOM 1415 C PHE A 102 -0.080 -6.147 -7.836 1.00 0.45 C ATOM 1416 O PHE A 102 1.129 -6.291 -8.023 1.00 0.80 O ATOM 1417 CB PHE A 102 -1.305 -7.135 -5.834 1.00 0.84 C ATOM 1418 CG PHE A 102 -0.215 -7.374 -4.862 1.00 0.45 C ATOM 1419 CD1 PHE A 102 0.061 -8.645 -4.425 1.00 0.52 C ATOM 1420 CD2 PHE A 102 0.537 -6.325 -4.397 1.00 0.62 C ATOM 1421 CE1 PHE A 102 1.084 -8.871 -3.532 1.00 0.59 C ATOM 1422 CE2 PHE A 102 1.560 -6.534 -3.503 1.00 0.58 C ATOM 1423 CZ PHE A 102 1.798 -7.835 -3.033 1.00 0.44 C ATOM 0 H PHE A 102 0.777 -8.490 -7.165 1.00 0.38 H new ATOM 0 HA PHE A 102 -1.858 -7.336 -7.861 1.00 0.40 H new ATOM 0 HB2 PHE A 102 -1.683 -6.123 -5.689 1.00 0.84 H new ATOM 0 HB3 PHE A 102 -2.125 -7.817 -5.610 1.00 0.84 H new ATOM 0 HD1 PHE A 102 -0.529 -9.475 -4.785 1.00 0.52 H new ATOM 0 HD2 PHE A 102 0.323 -5.323 -4.738 1.00 0.62 H new ATOM 0 HE1 PHE A 102 1.318 -9.880 -3.228 1.00 0.59 H new ATOM 0 HE2 PHE A 102 2.171 -5.710 -3.167 1.00 0.58 H new ATOM 0 HZ PHE A 102 2.548 -8.009 -2.276 1.00 0.44 H new ATOM 1433 N PRO A 103 -0.714 -5.003 -8.104 1.00 0.33 N ATOM 1434 CA PRO A 103 -0.079 -3.865 -8.788 1.00 0.39 C ATOM 1435 C PRO A 103 1.067 -3.250 -7.993 1.00 0.41 C ATOM 1436 O PRO A 103 0.838 -2.526 -7.025 1.00 0.62 O ATOM 1437 CB PRO A 103 -1.235 -2.868 -8.924 1.00 0.42 C ATOM 1438 CG PRO A 103 -2.133 -3.223 -7.798 1.00 0.58 C ATOM 1439 CD PRO A 103 -2.108 -4.702 -7.745 1.00 0.27 C ATOM 0 HA PRO A 103 0.378 -4.160 -9.733 1.00 0.39 H new ATOM 0 HB2 PRO A 103 -0.887 -1.838 -8.850 1.00 0.42 H new ATOM 0 HB3 PRO A 103 -1.739 -2.966 -9.886 1.00 0.42 H new ATOM 0 HG2 PRO A 103 -1.784 -2.788 -6.862 1.00 0.58 H new ATOM 0 HG3 PRO A 103 -3.144 -2.850 -7.966 1.00 0.58 H new ATOM 0 HD2 PRO A 103 -2.363 -5.078 -6.754 1.00 0.27 H new ATOM 0 HD3 PRO A 103 -2.814 -5.146 -8.447 1.00 0.27 H new ATOM 1447 N ILE A 104 2.303 -3.532 -8.404 1.00 0.35 N ATOM 1448 CA ILE A 104 3.455 -2.917 -7.766 1.00 0.35 C ATOM 1449 C ILE A 104 3.921 -1.784 -8.638 1.00 0.33 C ATOM 1450 O ILE A 104 4.264 -1.980 -9.805 1.00 0.44 O ATOM 1451 CB ILE A 104 4.647 -3.856 -7.507 1.00 0.41 C ATOM 1452 CG1 ILE A 104 4.193 -5.202 -6.935 1.00 0.52 C ATOM 1453 CG2 ILE A 104 5.628 -3.162 -6.561 1.00 0.45 C ATOM 1454 CD1 ILE A 104 3.136 -5.088 -5.874 1.00 1.34 C ATOM 0 H ILE A 104 2.526 -4.173 -9.165 1.00 0.35 H new ATOM 0 HA ILE A 104 3.117 -2.593 -6.781 1.00 0.35 H new ATOM 0 HB ILE A 104 5.141 -4.069 -8.455 1.00 0.41 H new ATOM 0 HG12 ILE A 104 3.813 -5.821 -7.748 1.00 0.52 H new ATOM 0 HG13 ILE A 104 5.058 -5.719 -6.518 1.00 0.52 H new ATOM 0 HG21 ILE A 104 6.477 -3.819 -6.371 1.00 0.45 H new ATOM 0 HG22 ILE A 104 5.980 -2.237 -7.017 1.00 0.45 H new ATOM 0 HG23 ILE A 104 5.127 -2.935 -5.620 1.00 0.45 H new ATOM 0 HD11 ILE A 104 2.868 -6.083 -5.519 1.00 1.34 H new ATOM 0 HD12 ILE A 104 3.518 -4.497 -5.042 1.00 1.34 H new ATOM 0 HD13 ILE A 104 2.254 -4.601 -6.290 1.00 1.34 H new ATOM 1466 N MET A 105 3.927 -0.608 -8.070 1.00 0.29 N ATOM 1467 CA MET A 105 4.003 0.596 -8.850 1.00 0.30 C ATOM 1468 C MET A 105 5.406 1.157 -8.948 1.00 0.27 C ATOM 1469 O MET A 105 6.390 0.446 -8.754 1.00 0.35 O ATOM 1470 CB MET A 105 3.065 1.618 -8.247 1.00 0.43 C ATOM 1471 CG MET A 105 1.636 1.145 -8.180 1.00 1.50 C ATOM 1472 SD MET A 105 0.818 1.059 -9.790 1.00 2.49 S ATOM 1473 CE MET A 105 1.381 -0.515 -10.429 1.00 3.03 C ATOM 0 H MET A 105 3.880 -0.459 -7.062 1.00 0.29 H new ATOM 0 HA MET A 105 3.708 0.354 -9.871 1.00 0.30 H new ATOM 0 HB2 MET A 105 3.406 1.867 -7.242 1.00 0.43 H new ATOM 0 HB3 MET A 105 3.110 2.535 -8.835 1.00 0.43 H new ATOM 0 HG2 MET A 105 1.611 0.158 -7.717 1.00 1.50 H new ATOM 0 HG3 MET A 105 1.072 1.815 -7.532 1.00 1.50 H new ATOM 0 HE1 MET A 105 0.649 -0.903 -11.137 1.00 3.03 H new ATOM 0 HE2 MET A 105 2.338 -0.382 -10.933 1.00 3.03 H new ATOM 0 HE3 MET A 105 1.499 -1.220 -9.606 1.00 3.03 H new ATOM 1483 N ALA A 106 5.481 2.437 -9.265 1.00 0.33 N ATOM 1484 CA ALA A 106 6.740 3.111 -9.530 1.00 0.52 C ATOM 1485 C ALA A 106 7.715 3.006 -8.369 1.00 0.66 C ATOM 1486 O ALA A 106 8.921 2.971 -8.582 1.00 1.46 O ATOM 1487 CB ALA A 106 6.465 4.568 -9.839 1.00 0.70 C ATOM 0 H ALA A 106 4.664 3.043 -9.346 1.00 0.33 H new ATOM 0 HA ALA A 106 7.207 2.618 -10.383 1.00 0.52 H new ATOM 0 HB1 ALA A 106 7.406 5.081 -10.039 1.00 0.70 H new ATOM 0 HB2 ALA A 106 5.820 4.639 -10.714 1.00 0.70 H new ATOM 0 HB3 ALA A 106 5.972 5.034 -8.986 1.00 0.70 H new ATOM 1493 N LYS A 107 7.144 2.869 -7.170 1.00 0.40 N ATOM 1494 CA LYS A 107 7.813 3.090 -5.881 1.00 0.36 C ATOM 1495 C LYS A 107 7.923 4.548 -5.644 1.00 0.38 C ATOM 1496 O LYS A 107 8.266 5.336 -6.527 1.00 0.59 O ATOM 1497 CB LYS A 107 9.216 2.463 -5.709 1.00 0.49 C ATOM 1498 CG LYS A 107 10.379 3.262 -6.295 1.00 0.84 C ATOM 1499 CD LYS A 107 11.679 2.473 -6.255 1.00 0.83 C ATOM 1500 CE LYS A 107 11.546 1.159 -7.005 1.00 0.95 C ATOM 1501 NZ LYS A 107 11.194 1.371 -8.436 1.00 1.76 N ATOM 0 H LYS A 107 6.168 2.591 -7.064 1.00 0.40 H new ATOM 0 HA LYS A 107 7.183 2.577 -5.155 1.00 0.36 H new ATOM 0 HB2 LYS A 107 9.400 2.318 -4.645 1.00 0.49 H new ATOM 0 HB3 LYS A 107 9.210 1.475 -6.169 1.00 0.49 H new ATOM 0 HG2 LYS A 107 10.151 3.535 -7.325 1.00 0.84 H new ATOM 0 HG3 LYS A 107 10.500 4.191 -5.738 1.00 0.84 H new ATOM 0 HD2 LYS A 107 12.481 3.066 -6.694 1.00 0.83 H new ATOM 0 HD3 LYS A 107 11.957 2.277 -5.219 1.00 0.83 H new ATOM 0 HE2 LYS A 107 12.484 0.607 -6.939 1.00 0.95 H new ATOM 0 HE3 LYS A 107 10.781 0.545 -6.530 1.00 0.95 H new ATOM 0 HZ1 LYS A 107 11.228 0.462 -8.940 1.00 1.76 H new ATOM 0 HZ2 LYS A 107 10.235 1.768 -8.502 1.00 1.76 H new ATOM 0 HZ3 LYS A 107 11.872 2.031 -8.866 1.00 1.76 H new ATOM 1515 N ILE A 108 7.581 4.899 -4.457 1.00 0.31 N ATOM 1516 CA ILE A 108 7.749 6.239 -4.018 1.00 0.35 C ATOM 1517 C ILE A 108 8.357 6.210 -2.636 1.00 0.36 C ATOM 1518 O ILE A 108 8.342 5.180 -1.960 1.00 0.42 O ATOM 1519 CB ILE A 108 6.427 7.043 -4.034 1.00 0.48 C ATOM 1520 CG1 ILE A 108 5.580 6.751 -2.790 1.00 0.82 C ATOM 1521 CG2 ILE A 108 5.639 6.742 -5.316 1.00 0.68 C ATOM 1522 CD1 ILE A 108 5.156 5.322 -2.647 1.00 0.64 C ATOM 0 H ILE A 108 7.178 4.269 -3.764 1.00 0.31 H new ATOM 0 HA ILE A 108 8.413 6.755 -4.712 1.00 0.35 H new ATOM 0 HB ILE A 108 6.675 8.104 -4.018 1.00 0.48 H new ATOM 0 HG12 ILE A 108 6.147 7.039 -1.905 1.00 0.82 H new ATOM 0 HG13 ILE A 108 4.690 7.380 -2.817 1.00 0.82 H new ATOM 0 HG21 ILE A 108 4.711 7.314 -5.315 1.00 0.68 H new ATOM 0 HG22 ILE A 108 6.236 7.021 -6.184 1.00 0.68 H new ATOM 0 HG23 ILE A 108 5.409 5.677 -5.360 1.00 0.68 H new ATOM 0 HD11 ILE A 108 4.562 5.208 -1.740 1.00 0.64 H new ATOM 0 HD12 ILE A 108 4.559 5.031 -3.511 1.00 0.64 H new ATOM 0 HD13 ILE A 108 6.038 4.685 -2.585 1.00 0.64 H new ATOM 1534 N ASN A 109 8.893 7.326 -2.243 1.00 0.38 N ATOM 1535 CA ASN A 109 9.678 7.432 -1.025 1.00 0.44 C ATOM 1536 C ASN A 109 8.791 7.435 0.209 1.00 0.47 C ATOM 1537 O ASN A 109 8.667 8.463 0.873 1.00 0.76 O ATOM 1538 CB ASN A 109 10.476 8.725 -1.098 1.00 0.53 C ATOM 1539 CG ASN A 109 11.704 8.727 -0.224 1.00 0.98 C ATOM 1540 OD1 ASN A 109 12.806 8.442 -0.695 1.00 1.73 O ATOM 1541 ND2 ASN A 109 11.528 9.030 1.051 1.00 1.16 N ATOM 0 H ASN A 109 8.804 8.203 -2.755 1.00 0.38 H new ATOM 0 HA ASN A 109 10.341 6.571 -0.943 1.00 0.44 H new ATOM 0 HB2 ASN A 109 10.776 8.899 -2.131 1.00 0.53 H new ATOM 0 HB3 ASN A 109 9.833 9.556 -0.808 1.00 0.53 H new ATOM 0 HD21 ASN A 109 12.324 9.034 1.689 1.00 1.16 H new ATOM 0 HD22 ASN A 109 10.596 9.260 1.397 1.00 1.16 H new ATOM 1548 N VAL A 110 8.172 6.294 0.527 1.00 0.41 N ATOM 1549 CA VAL A 110 7.210 6.265 1.616 1.00 0.42 C ATOM 1550 C VAL A 110 7.895 6.412 2.958 1.00 0.44 C ATOM 1551 O VAL A 110 8.262 5.431 3.603 1.00 0.48 O ATOM 1552 CB VAL A 110 6.410 4.944 1.621 1.00 0.43 C ATOM 1553 CG1 VAL A 110 5.303 4.991 0.596 1.00 0.60 C ATOM 1554 CG2 VAL A 110 7.317 3.750 1.351 1.00 0.77 C ATOM 0 H VAL A 110 8.319 5.402 0.055 1.00 0.41 H new ATOM 0 HA VAL A 110 6.532 7.104 1.456 1.00 0.42 H new ATOM 0 HB VAL A 110 5.972 4.825 2.612 1.00 0.43 H new ATOM 0 HG11 VAL A 110 4.750 4.052 0.614 1.00 0.60 H new ATOM 0 HG12 VAL A 110 4.627 5.814 0.828 1.00 0.60 H new ATOM 0 HG13 VAL A 110 5.731 5.141 -0.395 1.00 0.60 H new ATOM 0 HG21 VAL A 110 6.726 2.834 1.361 1.00 0.77 H new ATOM 0 HG22 VAL A 110 7.791 3.866 0.376 1.00 0.77 H new ATOM 0 HG23 VAL A 110 8.085 3.694 2.123 1.00 0.77 H new ATOM 1564 N ASN A 111 7.998 7.652 3.388 1.00 0.48 N ATOM 1565 CA ASN A 111 8.402 7.992 4.731 1.00 0.56 C ATOM 1566 C ASN A 111 8.525 9.495 4.829 1.00 0.62 C ATOM 1567 O ASN A 111 8.330 10.198 3.832 1.00 0.67 O ATOM 1568 CB ASN A 111 9.726 7.331 5.122 1.00 0.65 C ATOM 1569 CG ASN A 111 9.674 6.819 6.552 1.00 1.20 C ATOM 1570 OD1 ASN A 111 8.996 7.394 7.407 1.00 1.90 O ATOM 1571 ND2 ASN A 111 10.379 5.737 6.827 1.00 1.72 N ATOM 0 H ASN A 111 7.800 8.463 2.803 1.00 0.48 H new ATOM 0 HA ASN A 111 7.646 7.621 5.423 1.00 0.56 H new ATOM 0 HB2 ASN A 111 9.939 6.505 4.443 1.00 0.65 H new ATOM 0 HB3 ASN A 111 10.540 8.048 5.017 1.00 0.65 H new ATOM 0 HD21 ASN A 111 10.374 5.351 7.771 1.00 1.72 H new ATOM 0 HD22 ASN A 111 10.929 5.287 6.095 1.00 1.72 H new ATOM 1578 N GLY A 112 8.844 9.964 6.023 1.00 0.73 N ATOM 1579 CA GLY A 112 9.285 11.329 6.224 1.00 0.85 C ATOM 1580 C GLY A 112 8.490 12.384 5.479 1.00 0.93 C ATOM 1581 O GLY A 112 7.294 12.572 5.717 1.00 1.47 O ATOM 0 H GLY A 112 8.804 9.409 6.878 1.00 0.73 H new ATOM 0 HA2 GLY A 112 9.245 11.553 7.290 1.00 0.85 H new ATOM 0 HA3 GLY A 112 10.330 11.404 5.922 1.00 0.85 H new ATOM 1585 N GLU A 113 9.170 13.062 4.565 1.00 0.88 N ATOM 1586 CA GLU A 113 8.652 14.282 3.972 1.00 1.23 C ATOM 1587 C GLU A 113 8.169 14.127 2.532 1.00 1.10 C ATOM 1588 O GLU A 113 7.496 15.022 2.020 1.00 1.39 O ATOM 1589 CB GLU A 113 9.706 15.391 4.045 1.00 1.61 C ATOM 1590 CG GLU A 113 11.142 14.924 3.818 1.00 1.83 C ATOM 1591 CD GLU A 113 11.340 14.164 2.520 1.00 2.29 C ATOM 1592 OE1 GLU A 113 11.509 14.806 1.461 1.00 2.65 O ATOM 1593 OE2 GLU A 113 11.325 12.916 2.560 1.00 2.81 O ATOM 0 H GLU A 113 10.088 12.783 4.218 1.00 0.88 H new ATOM 0 HA GLU A 113 7.773 14.545 4.560 1.00 1.23 H new ATOM 0 HB2 GLU A 113 9.465 16.152 3.303 1.00 1.61 H new ATOM 0 HB3 GLU A 113 9.644 15.868 5.023 1.00 1.61 H new ATOM 0 HG2 GLU A 113 11.802 15.792 3.825 1.00 1.83 H new ATOM 0 HG3 GLU A 113 11.443 14.288 4.650 1.00 1.83 H new ATOM 1600 N ASN A 114 8.503 13.029 1.863 1.00 0.79 N ATOM 1601 CA ASN A 114 8.267 12.978 0.426 1.00 0.79 C ATOM 1602 C ASN A 114 7.178 11.992 0.041 1.00 0.79 C ATOM 1603 O ASN A 114 6.374 12.318 -0.827 1.00 1.22 O ATOM 1604 CB ASN A 114 9.559 12.605 -0.308 1.00 0.87 C ATOM 1605 CG ASN A 114 9.477 12.855 -1.804 1.00 1.45 C ATOM 1606 OD1 ASN A 114 10.084 12.137 -2.600 1.00 2.06 O ATOM 1607 ND2 ASN A 114 8.743 13.885 -2.199 1.00 2.16 N ATOM 0 H ASN A 114 8.921 12.194 2.272 1.00 0.79 H new ATOM 0 HA ASN A 114 7.933 13.973 0.132 1.00 0.79 H new ATOM 0 HB2 ASN A 114 10.387 13.180 0.107 1.00 0.87 H new ATOM 0 HB3 ASN A 114 9.781 11.553 -0.131 1.00 0.87 H new ATOM 0 HD21 ASN A 114 8.666 14.106 -3.192 1.00 2.16 H new ATOM 0 HD22 ASN A 114 8.254 14.457 -1.510 1.00 2.16 H new ATOM 1614 N ALA A 115 7.118 10.840 0.736 1.00 0.59 N ATOM 1615 CA ALA A 115 6.187 9.751 0.414 1.00 0.61 C ATOM 1616 C ALA A 115 5.722 9.814 -1.039 1.00 0.68 C ATOM 1617 O ALA A 115 6.485 9.530 -1.965 1.00 1.26 O ATOM 1618 CB ALA A 115 5.004 9.746 1.374 1.00 0.86 C ATOM 0 H ALA A 115 7.717 10.642 1.538 1.00 0.59 H new ATOM 0 HA ALA A 115 6.726 8.811 0.537 1.00 0.61 H new ATOM 0 HB1 ALA A 115 4.329 8.931 1.115 1.00 0.86 H new ATOM 0 HB2 ALA A 115 5.364 9.609 2.394 1.00 0.86 H new ATOM 0 HB3 ALA A 115 4.472 10.695 1.301 1.00 0.86 H new ATOM 1624 N HIS A 116 4.475 10.215 -1.215 1.00 0.42 N ATOM 1625 CA HIS A 116 3.917 10.544 -2.491 1.00 0.35 C ATOM 1626 C HIS A 116 2.580 11.165 -2.206 1.00 0.29 C ATOM 1627 O HIS A 116 1.917 10.702 -1.304 1.00 0.29 O ATOM 1628 CB HIS A 116 3.792 9.277 -3.347 1.00 0.35 C ATOM 1629 CG HIS A 116 2.889 9.420 -4.513 1.00 0.31 C ATOM 1630 ND1 HIS A 116 1.561 9.564 -4.329 1.00 0.33 N ATOM 1631 CD2 HIS A 116 3.104 9.538 -5.843 1.00 0.31 C ATOM 1632 CE1 HIS A 116 0.974 9.786 -5.460 1.00 0.32 C ATOM 1633 NE2 HIS A 116 1.879 9.775 -6.420 1.00 0.32 N ATOM 0 H HIS A 116 3.814 10.320 -0.445 1.00 0.42 H new ATOM 0 HA HIS A 116 4.544 11.235 -3.055 1.00 0.35 H new ATOM 0 HB2 HIS A 116 4.783 8.992 -3.701 1.00 0.35 H new ATOM 0 HB3 HIS A 116 3.431 8.462 -2.720 1.00 0.35 H new ATOM 0 HD2 HIS A 116 4.053 9.461 -6.352 1.00 0.31 H new ATOM 0 HE1 HIS A 116 -0.084 9.953 -5.596 1.00 0.32 H new ATOM 0 HE2 HIS A 116 1.701 9.917 -7.414 1.00 0.32 H new ATOM 1642 N PRO A 117 2.181 12.218 -2.938 1.00 0.31 N ATOM 1643 CA PRO A 117 0.908 12.913 -2.742 1.00 0.31 C ATOM 1644 C PRO A 117 -0.209 11.993 -2.229 1.00 0.26 C ATOM 1645 O PRO A 117 -0.873 12.298 -1.249 1.00 0.27 O ATOM 1646 CB PRO A 117 0.591 13.430 -4.149 1.00 0.37 C ATOM 1647 CG PRO A 117 1.881 13.400 -4.921 1.00 0.40 C ATOM 1648 CD PRO A 117 2.951 12.856 -4.008 1.00 0.38 C ATOM 0 HA PRO A 117 0.976 13.692 -1.983 1.00 0.31 H new ATOM 0 HB2 PRO A 117 -0.162 12.806 -4.630 1.00 0.37 H new ATOM 0 HB3 PRO A 117 0.188 14.442 -4.108 1.00 0.37 H new ATOM 0 HG2 PRO A 117 1.781 12.774 -5.808 1.00 0.40 H new ATOM 0 HG3 PRO A 117 2.144 14.400 -5.265 1.00 0.40 H new ATOM 0 HD2 PRO A 117 3.595 12.142 -4.522 1.00 0.38 H new ATOM 0 HD3 PRO A 117 3.595 13.648 -3.625 1.00 0.38 H new ATOM 1656 N LEU A 118 -0.372 10.854 -2.895 1.00 0.24 N ATOM 1657 CA LEU A 118 -1.332 9.821 -2.504 1.00 0.23 C ATOM 1658 C LEU A 118 -1.080 9.296 -1.083 1.00 0.27 C ATOM 1659 O LEU A 118 -1.977 9.272 -0.246 1.00 0.28 O ATOM 1660 CB LEU A 118 -1.251 8.683 -3.509 1.00 0.24 C ATOM 1661 CG LEU A 118 -2.086 7.455 -3.197 1.00 0.25 C ATOM 1662 CD1 LEU A 118 -3.554 7.779 -3.359 1.00 0.39 C ATOM 1663 CD2 LEU A 118 -1.690 6.297 -4.096 1.00 0.27 C ATOM 0 H LEU A 118 0.163 10.617 -3.730 1.00 0.24 H new ATOM 0 HA LEU A 118 -2.330 10.260 -2.501 1.00 0.23 H new ATOM 0 HB2 LEU A 118 -1.553 9.065 -4.484 1.00 0.24 H new ATOM 0 HB3 LEU A 118 -0.209 8.376 -3.596 1.00 0.24 H new ATOM 0 HG LEU A 118 -1.904 7.157 -2.164 1.00 0.25 H new ATOM 0 HD11 LEU A 118 -4.149 6.894 -3.134 1.00 0.39 H new ATOM 0 HD12 LEU A 118 -3.827 8.583 -2.676 1.00 0.39 H new ATOM 0 HD13 LEU A 118 -3.746 8.094 -4.385 1.00 0.39 H new ATOM 0 HD21 LEU A 118 -2.300 5.426 -3.857 1.00 0.27 H new ATOM 0 HD22 LEU A 118 -1.847 6.575 -5.138 1.00 0.27 H new ATOM 0 HD23 LEU A 118 -0.638 6.058 -3.939 1.00 0.27 H new ATOM 1675 N TYR A 119 0.151 8.888 -0.814 1.00 0.32 N ATOM 1676 CA TYR A 119 0.508 8.336 0.488 1.00 0.42 C ATOM 1677 C TYR A 119 0.632 9.413 1.533 1.00 0.40 C ATOM 1678 O TYR A 119 0.295 9.192 2.692 1.00 0.41 O ATOM 1679 CB TYR A 119 1.814 7.584 0.416 1.00 0.57 C ATOM 1680 CG TYR A 119 1.692 6.254 -0.242 1.00 0.54 C ATOM 1681 CD1 TYR A 119 1.348 5.134 0.488 1.00 1.09 C ATOM 1682 CD2 TYR A 119 1.943 6.112 -1.585 1.00 0.92 C ATOM 1683 CE1 TYR A 119 1.263 3.897 -0.108 1.00 1.88 C ATOM 1684 CE2 TYR A 119 1.867 4.886 -2.187 1.00 1.74 C ATOM 1685 CZ TYR A 119 1.529 3.776 -1.447 1.00 2.20 C ATOM 1686 OH TYR A 119 1.482 2.543 -2.046 1.00 3.04 O ATOM 0 H TYR A 119 0.922 8.928 -1.480 1.00 0.32 H new ATOM 0 HA TYR A 119 -0.296 7.656 0.770 1.00 0.42 H new ATOM 0 HB2 TYR A 119 2.542 8.185 -0.128 1.00 0.57 H new ATOM 0 HB3 TYR A 119 2.203 7.448 1.425 1.00 0.57 H new ATOM 0 HD1 TYR A 119 1.142 5.230 1.544 1.00 1.09 H new ATOM 0 HD2 TYR A 119 2.204 6.979 -2.173 1.00 0.92 H new ATOM 0 HE1 TYR A 119 0.989 3.029 0.474 1.00 1.88 H new ATOM 0 HE2 TYR A 119 2.072 4.789 -3.243 1.00 1.74 H new ATOM 0 HH TYR A 119 1.664 2.638 -3.004 1.00 3.04 H new ATOM 1696 N GLU A 120 1.146 10.566 1.130 1.00 0.40 N ATOM 1697 CA GLU A 120 1.148 11.722 1.993 1.00 0.42 C ATOM 1698 C GLU A 120 -0.271 11.978 2.390 1.00 0.37 C ATOM 1699 O GLU A 120 -0.544 12.325 3.527 1.00 0.43 O ATOM 1700 CB GLU A 120 1.705 12.963 1.288 1.00 0.50 C ATOM 1701 CG GLU A 120 3.150 12.856 0.840 1.00 0.76 C ATOM 1702 CD GLU A 120 3.596 14.102 0.102 1.00 1.58 C ATOM 1703 OE1 GLU A 120 3.864 15.127 0.756 1.00 1.93 O ATOM 1704 OE2 GLU A 120 3.715 14.046 -1.139 1.00 2.44 O ATOM 0 H GLU A 120 1.564 10.719 0.212 1.00 0.40 H new ATOM 0 HA GLU A 120 1.786 11.526 2.855 1.00 0.42 H new ATOM 0 HB2 GLU A 120 1.086 13.175 0.416 1.00 0.50 H new ATOM 0 HB3 GLU A 120 1.612 13.816 1.960 1.00 0.50 H new ATOM 0 HG2 GLU A 120 3.790 12.697 1.708 1.00 0.76 H new ATOM 0 HG3 GLU A 120 3.268 11.987 0.193 1.00 0.76 H new ATOM 1711 N TYR A 121 -1.183 11.750 1.452 1.00 0.29 N ATOM 1712 CA TYR A 121 -2.595 11.880 1.770 1.00 0.28 C ATOM 1713 C TYR A 121 -3.047 10.783 2.733 1.00 0.27 C ATOM 1714 O TYR A 121 -3.924 10.997 3.570 1.00 0.29 O ATOM 1715 CB TYR A 121 -3.460 11.848 0.513 1.00 0.28 C ATOM 1716 CG TYR A 121 -4.921 11.668 0.821 1.00 0.30 C ATOM 1717 CD1 TYR A 121 -5.663 12.696 1.378 1.00 0.39 C ATOM 1718 CD2 TYR A 121 -5.546 10.455 0.590 1.00 0.33 C ATOM 1719 CE1 TYR A 121 -6.992 12.519 1.691 1.00 0.46 C ATOM 1720 CE2 TYR A 121 -6.872 10.271 0.905 1.00 0.41 C ATOM 1721 CZ TYR A 121 -7.594 11.304 1.455 1.00 0.46 C ATOM 1722 OH TYR A 121 -8.918 11.120 1.778 1.00 0.56 O ATOM 0 H TYR A 121 -0.976 11.481 0.490 1.00 0.29 H new ATOM 0 HA TYR A 121 -2.723 12.849 2.252 1.00 0.28 H new ATOM 0 HB2 TYR A 121 -3.321 12.775 -0.043 1.00 0.28 H new ATOM 0 HB3 TYR A 121 -3.126 11.036 -0.133 1.00 0.28 H new ATOM 0 HD1 TYR A 121 -5.193 13.649 1.569 1.00 0.39 H new ATOM 0 HD2 TYR A 121 -4.984 9.641 0.156 1.00 0.33 H new ATOM 0 HE1 TYR A 121 -7.560 13.331 2.120 1.00 0.46 H new ATOM 0 HE2 TYR A 121 -7.345 9.318 0.721 1.00 0.41 H new ATOM 0 HH TYR A 121 -9.382 11.983 1.763 1.00 0.56 H new ATOM 1732 N MET A 122 -2.426 9.623 2.643 1.00 0.27 N ATOM 1733 CA MET A 122 -2.899 8.466 3.387 1.00 0.29 C ATOM 1734 C MET A 122 -2.547 8.614 4.850 1.00 0.33 C ATOM 1735 O MET A 122 -3.416 8.585 5.723 1.00 0.35 O ATOM 1736 CB MET A 122 -2.318 7.167 2.838 1.00 0.33 C ATOM 1737 CG MET A 122 -3.398 6.178 2.452 1.00 0.71 C ATOM 1738 SD MET A 122 -2.901 5.090 1.113 1.00 0.56 S ATOM 1739 CE MET A 122 -3.047 6.230 -0.249 1.00 0.55 C ATOM 0 H MET A 122 -1.600 9.454 2.069 1.00 0.27 H new ATOM 0 HA MET A 122 -3.982 8.418 3.276 1.00 0.29 H new ATOM 0 HB2 MET A 122 -1.700 7.386 1.967 1.00 0.33 H new ATOM 0 HB3 MET A 122 -1.666 6.717 3.587 1.00 0.33 H new ATOM 0 HG2 MET A 122 -3.662 5.578 3.323 1.00 0.71 H new ATOM 0 HG3 MET A 122 -4.295 6.723 2.157 1.00 0.71 H new ATOM 0 HE1 MET A 122 -3.836 5.894 -0.922 1.00 0.55 H new ATOM 0 HE2 MET A 122 -3.292 7.222 0.131 1.00 0.55 H new ATOM 0 HE3 MET A 122 -2.102 6.272 -0.791 1.00 0.55 H new ATOM 1749 N LYS A 123 -1.262 8.793 5.105 1.00 0.37 N ATOM 1750 CA LYS A 123 -0.771 8.974 6.455 1.00 0.45 C ATOM 1751 C LYS A 123 -1.137 10.339 7.024 1.00 0.47 C ATOM 1752 O LYS A 123 -1.179 10.502 8.241 1.00 0.54 O ATOM 1753 CB LYS A 123 0.731 8.693 6.559 1.00 0.53 C ATOM 1754 CG LYS A 123 1.562 9.196 5.396 1.00 0.48 C ATOM 1755 CD LYS A 123 1.916 10.670 5.529 1.00 1.00 C ATOM 1756 CE LYS A 123 2.808 10.925 6.734 1.00 1.05 C ATOM 1757 NZ LYS A 123 3.230 12.346 6.824 1.00 1.46 N ATOM 0 H LYS A 123 -0.538 8.816 4.387 1.00 0.37 H new ATOM 0 HA LYS A 123 -1.277 8.233 7.074 1.00 0.45 H new ATOM 0 HB2 LYS A 123 1.107 9.146 7.476 1.00 0.53 H new ATOM 0 HB3 LYS A 123 0.878 7.617 6.652 1.00 0.53 H new ATOM 0 HG2 LYS A 123 2.479 8.610 5.328 1.00 0.48 H new ATOM 0 HG3 LYS A 123 1.014 9.039 4.467 1.00 0.48 H new ATOM 0 HD2 LYS A 123 2.421 11.007 4.624 1.00 1.00 H new ATOM 0 HD3 LYS A 123 1.002 11.257 5.621 1.00 1.00 H new ATOM 0 HE2 LYS A 123 2.276 10.647 7.644 1.00 1.05 H new ATOM 0 HE3 LYS A 123 3.690 10.288 6.673 1.00 1.05 H new ATOM 0 HZ1 LYS A 123 3.836 12.476 7.659 1.00 1.46 H new ATOM 0 HZ2 LYS A 123 3.760 12.606 5.968 1.00 1.46 H new ATOM 0 HZ3 LYS A 123 2.390 12.953 6.908 1.00 1.46 H new ATOM 1771 N LYS A 124 -1.375 11.339 6.169 1.00 0.43 N ATOM 1772 CA LYS A 124 -1.813 12.625 6.693 1.00 0.50 C ATOM 1773 C LYS A 124 -3.211 12.483 7.269 1.00 0.49 C ATOM 1774 O LYS A 124 -3.558 13.122 8.263 1.00 0.57 O ATOM 1775 CB LYS A 124 -1.794 13.763 5.660 1.00 0.56 C ATOM 1776 CG LYS A 124 -2.947 13.737 4.666 1.00 0.59 C ATOM 1777 CD LYS A 124 -3.157 15.096 4.016 1.00 0.97 C ATOM 1778 CE LYS A 124 -3.623 16.124 5.036 1.00 1.41 C ATOM 1779 NZ LYS A 124 -3.831 17.467 4.433 1.00 1.99 N ATOM 0 H LYS A 124 -1.276 11.285 5.155 1.00 0.43 H new ATOM 0 HA LYS A 124 -1.095 12.904 7.464 1.00 0.50 H new ATOM 0 HB2 LYS A 124 -1.809 14.716 6.189 1.00 0.56 H new ATOM 0 HB3 LYS A 124 -0.855 13.719 5.108 1.00 0.56 H new ATOM 0 HG2 LYS A 124 -2.747 12.992 3.896 1.00 0.59 H new ATOM 0 HG3 LYS A 124 -3.861 13.432 5.176 1.00 0.59 H new ATOM 0 HD2 LYS A 124 -2.227 15.431 3.557 1.00 0.97 H new ATOM 0 HD3 LYS A 124 -3.894 15.011 3.218 1.00 0.97 H new ATOM 0 HE2 LYS A 124 -4.554 15.785 5.490 1.00 1.41 H new ATOM 0 HE3 LYS A 124 -2.886 16.198 5.836 1.00 1.41 H new ATOM 0 HZ1 LYS A 124 -4.148 18.132 5.167 1.00 1.99 H new ATOM 0 HZ2 LYS A 124 -2.938 17.805 4.022 1.00 1.99 H new ATOM 0 HZ3 LYS A 124 -4.553 17.405 3.687 1.00 1.99 H new ATOM 1793 N THR A 125 -4.000 11.626 6.633 1.00 0.42 N ATOM 1794 CA THR A 125 -5.353 11.351 7.086 1.00 0.44 C ATOM 1795 C THR A 125 -5.323 10.419 8.295 1.00 0.44 C ATOM 1796 O THR A 125 -6.028 10.636 9.281 1.00 0.56 O ATOM 1797 CB THR A 125 -6.202 10.733 5.954 1.00 0.49 C ATOM 1798 OG1 THR A 125 -6.161 11.589 4.805 1.00 0.57 O ATOM 1799 CG2 THR A 125 -7.648 10.541 6.389 1.00 0.59 C ATOM 0 H THR A 125 -3.722 11.109 5.799 1.00 0.42 H new ATOM 0 HA THR A 125 -5.814 12.295 7.377 1.00 0.44 H new ATOM 0 HB THR A 125 -5.785 9.756 5.710 1.00 0.49 H new ATOM 0 HG1 THR A 125 -5.241 11.646 4.472 1.00 0.57 H new ATOM 0 HG21 THR A 125 -8.219 10.104 5.570 1.00 0.59 H new ATOM 0 HG22 THR A 125 -7.683 9.875 7.251 1.00 0.59 H new ATOM 0 HG23 THR A 125 -8.078 11.506 6.658 1.00 0.59 H new ATOM 1807 N LYS A 126 -4.489 9.388 8.220 1.00 0.44 N ATOM 1808 CA LYS A 126 -4.303 8.479 9.338 1.00 0.54 C ATOM 1809 C LYS A 126 -2.827 8.193 9.563 1.00 0.57 C ATOM 1810 O LYS A 126 -2.216 7.404 8.839 1.00 0.68 O ATOM 1811 CB LYS A 126 -5.055 7.176 9.122 1.00 0.78 C ATOM 1812 CG LYS A 126 -6.560 7.328 9.182 1.00 1.26 C ATOM 1813 CD LYS A 126 -7.212 5.974 9.250 1.00 0.92 C ATOM 1814 CE LYS A 126 -7.131 5.375 10.648 1.00 1.27 C ATOM 1815 NZ LYS A 126 -8.091 6.011 11.587 1.00 1.85 N ATOM 0 H LYS A 126 -3.932 9.163 7.395 1.00 0.44 H new ATOM 0 HA LYS A 126 -4.707 8.967 10.225 1.00 0.54 H new ATOM 0 HB2 LYS A 126 -4.778 6.763 8.152 1.00 0.78 H new ATOM 0 HB3 LYS A 126 -4.741 6.455 9.877 1.00 0.78 H new ATOM 0 HG2 LYS A 126 -6.839 7.919 10.054 1.00 1.26 H new ATOM 0 HG3 LYS A 126 -6.914 7.868 8.304 1.00 1.26 H new ATOM 0 HD2 LYS A 126 -8.257 6.059 8.951 1.00 0.92 H new ATOM 0 HD3 LYS A 126 -6.730 5.303 8.539 1.00 0.92 H new ATOM 0 HE2 LYS A 126 -7.332 4.305 10.595 1.00 1.27 H new ATOM 0 HE3 LYS A 126 -6.118 5.491 11.033 1.00 1.27 H new ATOM 0 HZ1 LYS A 126 -8.074 5.506 12.496 1.00 1.85 H new ATOM 0 HZ2 LYS A 126 -7.823 7.005 11.738 1.00 1.85 H new ATOM 0 HZ3 LYS A 126 -9.049 5.968 11.186 1.00 1.85 H new ATOM 1829 N PRO A 127 -2.255 8.817 10.593 1.00 0.77 N ATOM 1830 CA PRO A 127 -0.833 8.716 10.910 1.00 1.04 C ATOM 1831 C PRO A 127 -0.481 7.368 11.529 1.00 1.27 C ATOM 1832 O PRO A 127 0.419 6.674 11.056 1.00 1.69 O ATOM 1833 CB PRO A 127 -0.602 9.859 11.917 1.00 1.28 C ATOM 1834 CG PRO A 127 -1.876 10.647 11.929 1.00 1.22 C ATOM 1835 CD PRO A 127 -2.953 9.678 11.541 1.00 0.95 C ATOM 0 HA PRO A 127 -0.207 8.793 10.021 1.00 1.04 H new ATOM 0 HB2 PRO A 127 -0.373 9.468 12.908 1.00 1.28 H new ATOM 0 HB3 PRO A 127 0.241 10.481 11.617 1.00 1.28 H new ATOM 0 HG2 PRO A 127 -2.066 11.070 12.915 1.00 1.22 H new ATOM 0 HG3 PRO A 127 -1.828 11.481 11.229 1.00 1.22 H new ATOM 0 HD2 PRO A 127 -3.329 9.121 12.399 1.00 0.95 H new ATOM 0 HD3 PRO A 127 -3.808 10.178 11.086 1.00 0.95 H new ATOM 1843 N GLY A 128 -1.192 6.990 12.578 1.00 1.55 N ATOM 1844 CA GLY A 128 -0.949 5.707 13.193 1.00 1.96 C ATOM 1845 C GLY A 128 -2.098 5.242 14.054 1.00 2.13 C ATOM 1846 O GLY A 128 -2.956 6.031 14.441 1.00 2.59 O ATOM 0 H GLY A 128 -1.929 7.546 13.012 1.00 1.55 H new ATOM 0 HA2 GLY A 128 -0.761 4.967 12.415 1.00 1.96 H new ATOM 0 HA3 GLY A 128 -0.046 5.766 13.801 1.00 1.96 H new ATOM 1850 N ILE A 129 -2.139 3.946 14.319 1.00 2.17 N ATOM 1851 CA ILE A 129 -3.073 3.397 15.291 1.00 2.46 C ATOM 1852 C ILE A 129 -2.322 3.121 16.586 1.00 2.36 C ATOM 1853 O ILE A 129 -2.912 2.900 17.641 1.00 2.70 O ATOM 1854 CB ILE A 129 -3.759 2.108 14.785 1.00 2.91 C ATOM 1855 CG1 ILE A 129 -2.718 1.069 14.355 1.00 3.06 C ATOM 1856 CG2 ILE A 129 -4.706 2.430 13.635 1.00 3.44 C ATOM 1857 CD1 ILE A 129 -3.318 -0.251 13.914 1.00 3.58 C ATOM 0 H ILE A 129 -1.536 3.254 13.875 1.00 2.17 H new ATOM 0 HA ILE A 129 -3.865 4.128 15.456 1.00 2.46 H new ATOM 0 HB ILE A 129 -4.340 1.683 15.604 1.00 2.91 H new ATOM 0 HG12 ILE A 129 -2.125 1.479 13.538 1.00 3.06 H new ATOM 0 HG13 ILE A 129 -2.035 0.888 15.185 1.00 3.06 H new ATOM 0 HG21 ILE A 129 -5.182 1.513 13.288 1.00 3.44 H new ATOM 0 HG22 ILE A 129 -5.470 3.129 13.977 1.00 3.44 H new ATOM 0 HG23 ILE A 129 -4.144 2.879 12.816 1.00 3.44 H new ATOM 0 HD11 ILE A 129 -2.520 -0.935 13.625 1.00 3.58 H new ATOM 0 HD12 ILE A 129 -3.887 -0.685 14.736 1.00 3.58 H new ATOM 0 HD13 ILE A 129 -3.979 -0.084 13.063 1.00 3.58 H new ATOM 1869 N LEU A 130 -1.001 3.150 16.474 1.00 2.12 N ATOM 1870 CA LEU A 130 -0.108 3.035 17.614 1.00 2.29 C ATOM 1871 C LEU A 130 0.886 4.191 17.561 1.00 2.20 C ATOM 1872 O LEU A 130 0.541 5.271 17.081 1.00 2.44 O ATOM 1873 CB LEU A 130 0.626 1.681 17.605 1.00 2.58 C ATOM 1874 CG LEU A 130 1.513 1.392 16.382 1.00 2.89 C ATOM 1875 CD1 LEU A 130 2.537 0.319 16.719 1.00 3.36 C ATOM 1876 CD2 LEU A 130 0.680 0.946 15.190 1.00 3.47 C ATOM 0 H LEU A 130 -0.518 3.255 15.582 1.00 2.12 H new ATOM 0 HA LEU A 130 -0.683 3.082 18.539 1.00 2.29 H new ATOM 0 HB2 LEU A 130 1.247 1.623 18.499 1.00 2.58 H new ATOM 0 HB3 LEU A 130 -0.118 0.888 17.682 1.00 2.58 H new ATOM 0 HG LEU A 130 2.027 2.316 16.117 1.00 2.89 H new ATOM 0 HD11 LEU A 130 3.159 0.123 15.846 1.00 3.36 H new ATOM 0 HD12 LEU A 130 3.164 0.661 17.542 1.00 3.36 H new ATOM 0 HD13 LEU A 130 2.022 -0.596 17.011 1.00 3.36 H new ATOM 0 HD21 LEU A 130 1.335 0.749 14.341 1.00 3.47 H new ATOM 0 HD22 LEU A 130 0.135 0.037 15.446 1.00 3.47 H new ATOM 0 HD23 LEU A 130 -0.028 1.731 14.927 1.00 3.47 H new ATOM 1888 N ALA A 131 2.101 3.985 18.049 1.00 2.45 N ATOM 1889 CA ALA A 131 3.157 4.973 17.878 1.00 2.67 C ATOM 1890 C ALA A 131 3.594 5.010 16.415 1.00 2.55 C ATOM 1891 O ALA A 131 4.561 4.359 16.022 1.00 3.21 O ATOM 1892 CB ALA A 131 4.336 4.661 18.788 1.00 3.28 C ATOM 0 H ALA A 131 2.379 3.149 18.563 1.00 2.45 H new ATOM 0 HA ALA A 131 2.773 5.955 18.155 1.00 2.67 H new ATOM 0 HB1 ALA A 131 5.114 5.411 18.645 1.00 3.28 H new ATOM 0 HB2 ALA A 131 4.007 4.673 19.827 1.00 3.28 H new ATOM 0 HB3 ALA A 131 4.733 3.675 18.545 1.00 3.28 H new ATOM 1898 N THR A 132 2.851 5.743 15.600 1.00 2.02 N ATOM 1899 CA THR A 132 3.103 5.795 14.172 1.00 2.10 C ATOM 1900 C THR A 132 2.678 7.145 13.606 1.00 1.56 C ATOM 1901 O THR A 132 1.722 7.752 14.085 1.00 2.12 O ATOM 1902 CB THR A 132 2.335 4.677 13.443 1.00 2.73 C ATOM 1903 OG1 THR A 132 2.520 3.431 14.120 1.00 3.34 O ATOM 1904 CG2 THR A 132 2.801 4.536 12.004 1.00 3.56 C ATOM 0 H THR A 132 2.063 6.313 15.908 1.00 2.02 H new ATOM 0 HA THR A 132 4.173 5.656 14.015 1.00 2.10 H new ATOM 0 HB THR A 132 1.279 4.946 13.443 1.00 2.73 H new ATOM 0 HG1 THR A 132 2.027 2.727 13.650 1.00 3.34 H new ATOM 0 HG21 THR A 132 2.240 3.739 11.516 1.00 3.56 H new ATOM 0 HG22 THR A 132 2.634 5.474 11.474 1.00 3.56 H new ATOM 0 HG23 THR A 132 3.864 4.294 11.988 1.00 3.56 H new ATOM 1912 N LYS A 133 3.400 7.607 12.595 1.00 1.29 N ATOM 1913 CA LYS A 133 3.095 8.878 11.951 1.00 1.47 C ATOM 1914 C LYS A 133 2.913 8.701 10.446 1.00 1.14 C ATOM 1915 O LYS A 133 2.693 9.671 9.720 1.00 1.58 O ATOM 1916 CB LYS A 133 4.220 9.871 12.216 1.00 2.24 C ATOM 1917 CG LYS A 133 4.291 10.351 13.657 1.00 3.04 C ATOM 1918 CD LYS A 133 5.355 11.420 13.833 1.00 3.81 C ATOM 1919 CE LYS A 133 5.423 11.923 15.269 1.00 4.63 C ATOM 1920 NZ LYS A 133 4.122 12.474 15.734 1.00 5.17 N ATOM 0 H LYS A 133 4.204 7.119 12.201 1.00 1.29 H new ATOM 0 HA LYS A 133 2.162 9.257 12.368 1.00 1.47 H new ATOM 0 HB2 LYS A 133 5.170 9.408 11.950 1.00 2.24 H new ATOM 0 HB3 LYS A 133 4.092 10.733 11.562 1.00 2.24 H new ATOM 0 HG2 LYS A 133 3.321 10.748 13.958 1.00 3.04 H new ATOM 0 HG3 LYS A 133 4.508 9.508 14.313 1.00 3.04 H new ATOM 0 HD2 LYS A 133 6.326 11.017 13.543 1.00 3.81 H new ATOM 0 HD3 LYS A 133 5.144 12.255 13.165 1.00 3.81 H new ATOM 0 HE2 LYS A 133 5.725 11.106 15.924 1.00 4.63 H new ATOM 0 HE3 LYS A 133 6.190 12.693 15.346 1.00 4.63 H new ATOM 0 HZ1 LYS A 133 4.267 13.013 16.612 1.00 5.17 H new ATOM 0 HZ2 LYS A 133 3.730 13.101 15.003 1.00 5.17 H new ATOM 0 HZ3 LYS A 133 3.458 11.693 15.913 1.00 5.17 H new ATOM 1934 N ALA A 134 2.993 7.460 9.985 1.00 0.92 N ATOM 1935 CA ALA A 134 2.898 7.167 8.562 1.00 0.77 C ATOM 1936 C ALA A 134 2.374 5.751 8.335 1.00 0.81 C ATOM 1937 O ALA A 134 1.170 5.533 8.241 1.00 1.59 O ATOM 1938 CB ALA A 134 4.252 7.361 7.892 1.00 1.02 C ATOM 0 H ALA A 134 3.124 6.640 10.577 1.00 0.92 H new ATOM 0 HA ALA A 134 2.189 7.862 8.111 1.00 0.77 H new ATOM 0 HB1 ALA A 134 4.167 7.139 6.828 1.00 1.02 H new ATOM 0 HB2 ALA A 134 4.578 8.393 8.022 1.00 1.02 H new ATOM 0 HB3 ALA A 134 4.982 6.690 8.346 1.00 1.02 H new ATOM 1944 N ILE A 135 3.292 4.797 8.254 1.00 0.69 N ATOM 1945 CA ILE A 135 2.949 3.384 8.115 1.00 0.74 C ATOM 1946 C ILE A 135 3.614 2.576 9.216 1.00 1.09 C ATOM 1947 O ILE A 135 3.008 1.657 9.722 1.00 2.00 O ATOM 1948 CB ILE A 135 3.317 2.783 6.728 1.00 0.86 C ATOM 1949 CG1 ILE A 135 4.604 3.362 6.107 1.00 0.88 C ATOM 1950 CG2 ILE A 135 2.153 2.944 5.780 1.00 1.54 C ATOM 1951 CD1 ILE A 135 4.497 4.797 5.620 1.00 0.89 C ATOM 0 H ILE A 135 4.295 4.979 8.283 1.00 0.69 H new ATOM 0 HA ILE A 135 1.864 3.325 8.200 1.00 0.74 H new ATOM 0 HB ILE A 135 3.527 1.727 6.897 1.00 0.86 H new ATOM 0 HG12 ILE A 135 5.403 3.304 6.846 1.00 0.88 H new ATOM 0 HG13 ILE A 135 4.900 2.731 5.268 1.00 0.88 H new ATOM 0 HG21 ILE A 135 2.413 2.522 4.809 1.00 1.54 H new ATOM 0 HG22 ILE A 135 1.283 2.423 6.180 1.00 1.54 H new ATOM 0 HG23 ILE A 135 1.921 4.003 5.665 1.00 1.54 H new ATOM 0 HD11 ILE A 135 5.453 5.111 5.201 1.00 0.89 H new ATOM 0 HD12 ILE A 135 3.725 4.864 4.854 1.00 0.89 H new ATOM 0 HD13 ILE A 135 4.236 5.446 6.456 1.00 0.89 H new ATOM 1963 N LYS A 136 4.807 3.041 9.632 1.00 0.85 N ATOM 1964 CA LYS A 136 5.757 2.355 10.549 1.00 1.14 C ATOM 1965 C LYS A 136 6.783 1.547 9.760 1.00 0.75 C ATOM 1966 O LYS A 136 7.963 1.887 9.729 1.00 0.78 O ATOM 1967 CB LYS A 136 5.130 1.466 11.692 1.00 1.71 C ATOM 1968 CG LYS A 136 4.498 0.129 11.275 1.00 2.72 C ATOM 1969 CD LYS A 136 3.943 -0.657 12.458 1.00 3.21 C ATOM 1970 CE LYS A 136 5.038 -1.076 13.421 1.00 4.09 C ATOM 1971 NZ LYS A 136 4.521 -1.914 14.532 1.00 4.81 N ATOM 0 H LYS A 136 5.158 3.949 9.327 1.00 0.85 H new ATOM 0 HA LYS A 136 6.231 3.179 11.082 1.00 1.14 H new ATOM 0 HB2 LYS A 136 5.910 1.257 12.424 1.00 1.71 H new ATOM 0 HB3 LYS A 136 4.367 2.057 12.199 1.00 1.71 H new ATOM 0 HG2 LYS A 136 3.696 0.318 10.562 1.00 2.72 H new ATOM 0 HG3 LYS A 136 5.245 -0.476 10.761 1.00 2.72 H new ATOM 0 HD2 LYS A 136 3.208 -0.049 12.986 1.00 3.21 H new ATOM 0 HD3 LYS A 136 3.421 -1.542 12.094 1.00 3.21 H new ATOM 0 HE2 LYS A 136 5.804 -1.629 12.878 1.00 4.09 H new ATOM 0 HE3 LYS A 136 5.517 -0.187 13.832 1.00 4.09 H new ATOM 0 HZ1 LYS A 136 5.071 -1.726 15.394 1.00 4.81 H new ATOM 0 HZ2 LYS A 136 3.521 -1.685 14.703 1.00 4.81 H new ATOM 0 HZ3 LYS A 136 4.608 -2.919 14.278 1.00 4.81 H new ATOM 1985 N TRP A 137 6.312 0.503 9.121 1.00 0.69 N ATOM 1986 CA TRP A 137 7.145 -0.576 8.621 1.00 0.45 C ATOM 1987 C TRP A 137 7.094 -0.616 7.107 1.00 0.43 C ATOM 1988 O TRP A 137 6.553 0.298 6.490 1.00 0.55 O ATOM 1989 CB TRP A 137 6.677 -1.921 9.211 1.00 0.42 C ATOM 1990 CG TRP A 137 7.406 -2.381 10.434 1.00 0.62 C ATOM 1991 CD1 TRP A 137 7.747 -3.658 10.741 1.00 0.93 C ATOM 1992 CD2 TRP A 137 7.866 -1.582 11.519 1.00 1.00 C ATOM 1993 NE1 TRP A 137 8.388 -3.688 11.949 1.00 1.11 N ATOM 1994 CE2 TRP A 137 8.485 -2.426 12.435 1.00 1.16 C ATOM 1995 CE3 TRP A 137 7.818 -0.237 11.786 1.00 1.47 C ATOM 1996 CZ2 TRP A 137 9.051 -1.958 13.610 1.00 1.59 C ATOM 1997 CZ3 TRP A 137 8.377 0.249 12.946 1.00 1.97 C ATOM 1998 CH2 TRP A 137 8.999 -0.614 13.849 1.00 1.97 C ATOM 0 H TRP A 137 5.319 0.373 8.928 1.00 0.69 H new ATOM 0 HA TRP A 137 8.176 -0.400 8.929 1.00 0.45 H new ATOM 0 HB2 TRP A 137 5.617 -1.843 9.450 1.00 0.42 H new ATOM 0 HB3 TRP A 137 6.774 -2.688 8.442 1.00 0.42 H new ATOM 0 HD1 TRP A 137 7.543 -4.521 10.124 1.00 0.93 H new ATOM 0 HE1 TRP A 137 8.738 -4.527 12.411 1.00 1.11 H new ATOM 0 HE3 TRP A 137 7.343 0.438 11.089 1.00 1.47 H new ATOM 0 HZ2 TRP A 137 9.517 -2.633 14.313 1.00 1.59 H new ATOM 0 HZ3 TRP A 137 8.334 1.307 13.159 1.00 1.97 H new ATOM 0 HH2 TRP A 137 9.445 -0.214 14.748 1.00 1.97 H new ATOM 2009 N ASN A 138 7.800 -1.600 6.553 1.00 0.37 N ATOM 2010 CA ASN A 138 7.653 -2.082 5.159 1.00 0.38 C ATOM 2011 C ASN A 138 6.188 -2.057 4.672 1.00 0.31 C ATOM 2012 O ASN A 138 5.402 -1.248 5.100 1.00 0.30 O ATOM 2013 CB ASN A 138 8.190 -3.515 5.062 1.00 0.41 C ATOM 2014 CG ASN A 138 9.552 -3.688 5.711 1.00 1.06 C ATOM 2015 OD1 ASN A 138 9.642 -3.943 6.908 1.00 2.04 O ATOM 2016 ND2 ASN A 138 10.615 -3.559 4.929 1.00 1.40 N ATOM 0 H ASN A 138 8.517 -2.108 7.070 1.00 0.37 H new ATOM 0 HA ASN A 138 8.222 -1.407 4.520 1.00 0.38 H new ATOM 0 HB2 ASN A 138 7.481 -4.195 5.534 1.00 0.41 H new ATOM 0 HB3 ASN A 138 8.256 -3.801 4.012 1.00 0.41 H new ATOM 0 HD21 ASN A 138 11.551 -3.672 5.318 1.00 1.40 H new ATOM 0 HD22 ASN A 138 10.497 -3.347 3.938 1.00 1.40 H new ATOM 2023 N PHE A 139 5.877 -2.908 3.697 1.00 0.34 N ATOM 2024 CA PHE A 139 4.596 -2.912 2.943 1.00 0.36 C ATOM 2025 C PHE A 139 3.321 -2.452 3.700 1.00 0.32 C ATOM 2026 O PHE A 139 2.362 -2.157 3.019 1.00 0.57 O ATOM 2027 CB PHE A 139 4.380 -4.288 2.305 1.00 0.55 C ATOM 2028 CG PHE A 139 4.997 -5.413 3.043 1.00 0.55 C ATOM 2029 CD1 PHE A 139 6.323 -5.714 2.858 1.00 0.61 C ATOM 2030 CD2 PHE A 139 4.240 -6.160 3.941 1.00 1.23 C ATOM 2031 CE1 PHE A 139 6.902 -6.750 3.552 1.00 1.22 C ATOM 2032 CE2 PHE A 139 4.817 -7.195 4.638 1.00 1.93 C ATOM 2033 CZ PHE A 139 6.141 -7.526 4.391 1.00 1.89 C ATOM 0 H PHE A 139 6.518 -3.640 3.390 1.00 0.34 H new ATOM 0 HA PHE A 139 4.727 -2.133 2.191 1.00 0.36 H new ATOM 0 HB2 PHE A 139 3.309 -4.470 2.220 1.00 0.55 H new ATOM 0 HB3 PHE A 139 4.782 -4.271 1.292 1.00 0.55 H new ATOM 0 HD1 PHE A 139 6.914 -5.135 2.164 1.00 0.61 H new ATOM 0 HD2 PHE A 139 3.196 -5.926 4.091 1.00 1.23 H new ATOM 0 HE1 PHE A 139 7.956 -6.954 3.437 1.00 1.22 H new ATOM 0 HE2 PHE A 139 4.245 -7.745 5.371 1.00 1.93 H new ATOM 0 HZ PHE A 139 6.575 -8.397 4.860 1.00 1.89 H new ATOM 2043 N THR A 140 3.277 -2.477 5.055 1.00 0.25 N ATOM 2044 CA THR A 140 2.246 -1.789 5.866 1.00 0.25 C ATOM 2045 C THR A 140 1.139 -1.147 5.041 1.00 0.22 C ATOM 2046 O THR A 140 1.342 -0.168 4.317 1.00 0.29 O ATOM 2047 CB THR A 140 2.875 -0.702 6.748 1.00 0.37 C ATOM 2048 OG1 THR A 140 4.070 -1.198 7.359 1.00 0.48 O ATOM 2049 CG2 THR A 140 1.903 -0.262 7.824 1.00 0.60 C ATOM 0 H THR A 140 3.962 -2.980 5.619 1.00 0.25 H new ATOM 0 HA THR A 140 1.798 -2.575 6.474 1.00 0.25 H new ATOM 0 HB THR A 140 3.117 0.154 6.118 1.00 0.37 H new ATOM 0 HG1 THR A 140 4.726 -1.416 6.665 1.00 0.48 H new ATOM 0 HG21 THR A 140 2.366 0.509 8.440 1.00 0.60 H new ATOM 0 HG22 THR A 140 1.002 0.138 7.359 1.00 0.60 H new ATOM 0 HG23 THR A 140 1.641 -1.116 8.449 1.00 0.60 H new ATOM 2057 N SER A 141 -0.035 -1.678 5.222 1.00 0.19 N ATOM 2058 CA SER A 141 -1.141 -1.447 4.316 1.00 0.20 C ATOM 2059 C SER A 141 -2.002 -0.297 4.801 1.00 0.22 C ATOM 2060 O SER A 141 -1.936 0.039 5.962 1.00 0.39 O ATOM 2061 CB SER A 141 -1.952 -2.722 4.286 1.00 0.26 C ATOM 2062 OG SER A 141 -1.173 -3.813 4.743 1.00 0.62 O ATOM 0 H SER A 141 -0.262 -2.290 6.006 1.00 0.19 H new ATOM 0 HA SER A 141 -0.775 -1.185 3.323 1.00 0.20 H new ATOM 0 HB2 SER A 141 -2.838 -2.612 4.912 1.00 0.26 H new ATOM 0 HB3 SER A 141 -2.300 -2.915 3.271 1.00 0.26 H new ATOM 0 HG SER A 141 -1.076 -4.470 4.022 1.00 0.62 H new ATOM 2068 N PHE A 142 -2.793 0.308 3.921 1.00 0.19 N ATOM 2069 CA PHE A 142 -3.836 1.225 4.334 1.00 0.18 C ATOM 2070 C PHE A 142 -5.115 0.680 3.786 1.00 0.18 C ATOM 2071 O PHE A 142 -5.212 0.425 2.600 1.00 0.21 O ATOM 2072 CB PHE A 142 -3.639 2.629 3.767 1.00 0.22 C ATOM 2073 CG PHE A 142 -2.625 3.488 4.465 1.00 0.26 C ATOM 2074 CD1 PHE A 142 -2.965 4.243 5.577 1.00 0.35 C ATOM 2075 CD2 PHE A 142 -1.307 3.488 4.037 1.00 0.42 C ATOM 2076 CE1 PHE A 142 -2.008 4.977 6.244 1.00 0.50 C ATOM 2077 CE2 PHE A 142 -0.350 4.232 4.696 1.00 0.55 C ATOM 2078 CZ PHE A 142 -0.803 5.175 5.704 1.00 0.57 C ATOM 0 H PHE A 142 -2.726 0.175 2.912 1.00 0.19 H new ATOM 0 HA PHE A 142 -3.829 1.308 5.421 1.00 0.18 H new ATOM 0 HB2 PHE A 142 -3.349 2.538 2.720 1.00 0.22 H new ATOM 0 HB3 PHE A 142 -4.599 3.145 3.789 1.00 0.22 H new ATOM 0 HD1 PHE A 142 -3.988 4.256 5.923 1.00 0.35 H new ATOM 0 HD2 PHE A 142 -1.025 2.898 3.177 1.00 0.42 H new ATOM 0 HE1 PHE A 142 -2.235 5.396 7.213 1.00 0.50 H new ATOM 0 HE2 PHE A 142 0.700 4.117 4.470 1.00 0.55 H new ATOM 0 HZ PHE A 142 -0.186 6.008 6.006 1.00 0.57 H new ATOM 2088 N LEU A 143 -6.097 0.472 4.606 1.00 0.17 N ATOM 2089 CA LEU A 143 -7.332 0.014 4.065 1.00 0.16 C ATOM 2090 C LEU A 143 -8.075 1.191 3.506 1.00 0.15 C ATOM 2091 O LEU A 143 -8.590 2.044 4.227 1.00 0.18 O ATOM 2092 CB LEU A 143 -8.158 -0.750 5.074 1.00 0.21 C ATOM 2093 CG LEU A 143 -9.654 -0.773 4.771 1.00 0.23 C ATOM 2094 CD1 LEU A 143 -9.956 -1.536 3.490 1.00 0.41 C ATOM 2095 CD2 LEU A 143 -10.427 -1.365 5.924 1.00 0.43 C ATOM 0 H LEU A 143 -6.071 0.607 5.617 1.00 0.17 H new ATOM 0 HA LEU A 143 -7.125 -0.698 3.266 1.00 0.16 H new ATOM 0 HB2 LEU A 143 -7.793 -1.776 5.123 1.00 0.21 H new ATOM 0 HB3 LEU A 143 -8.005 -0.310 6.059 1.00 0.21 H new ATOM 0 HG LEU A 143 -9.971 0.260 4.629 1.00 0.23 H new ATOM 0 HD11 LEU A 143 -11.031 -1.530 3.308 1.00 0.41 H new ATOM 0 HD12 LEU A 143 -9.444 -1.060 2.654 1.00 0.41 H new ATOM 0 HD13 LEU A 143 -9.610 -2.565 3.589 1.00 0.41 H new ATOM 0 HD21 LEU A 143 -11.490 -1.371 5.684 1.00 0.43 H new ATOM 0 HD22 LEU A 143 -10.090 -2.386 6.102 1.00 0.43 H new ATOM 0 HD23 LEU A 143 -10.260 -0.766 6.820 1.00 0.43 H new ATOM 2107 N ILE A 144 -8.065 1.227 2.205 1.00 0.14 N ATOM 2108 CA ILE A 144 -8.675 2.259 1.443 1.00 0.14 C ATOM 2109 C ILE A 144 -10.082 1.808 1.124 1.00 0.15 C ATOM 2110 O ILE A 144 -10.304 0.634 0.855 1.00 0.19 O ATOM 2111 CB ILE A 144 -7.885 2.476 0.146 1.00 0.15 C ATOM 2112 CG1 ILE A 144 -6.407 2.724 0.427 1.00 0.17 C ATOM 2113 CG2 ILE A 144 -8.483 3.616 -0.644 1.00 0.17 C ATOM 2114 CD1 ILE A 144 -6.142 3.959 1.223 1.00 0.19 C ATOM 0 H ILE A 144 -7.615 0.512 1.634 1.00 0.14 H new ATOM 0 HA ILE A 144 -8.689 3.198 1.996 1.00 0.14 H new ATOM 0 HB ILE A 144 -7.954 1.565 -0.449 1.00 0.15 H new ATOM 0 HG12 ILE A 144 -5.999 1.865 0.960 1.00 0.17 H new ATOM 0 HG13 ILE A 144 -5.873 2.793 -0.521 1.00 0.17 H new ATOM 0 HG21 ILE A 144 -7.914 3.760 -1.562 1.00 0.17 H new ATOM 0 HG22 ILE A 144 -9.519 3.383 -0.892 1.00 0.17 H new ATOM 0 HG23 ILE A 144 -8.449 4.528 -0.049 1.00 0.17 H new ATOM 0 HD11 ILE A 144 -5.069 4.066 1.382 1.00 0.19 H new ATOM 0 HD12 ILE A 144 -6.518 4.828 0.683 1.00 0.19 H new ATOM 0 HD13 ILE A 144 -6.646 3.886 2.187 1.00 0.19 H new ATOM 2126 N ASP A 145 -11.020 2.717 1.161 1.00 0.14 N ATOM 2127 CA ASP A 145 -12.430 2.339 1.078 1.00 0.15 C ATOM 2128 C ASP A 145 -12.935 2.353 -0.370 1.00 0.14 C ATOM 2129 O ASP A 145 -12.162 2.630 -1.283 1.00 0.15 O ATOM 2130 CB ASP A 145 -13.237 3.249 2.016 1.00 0.19 C ATOM 2131 CG ASP A 145 -14.582 3.706 1.478 1.00 0.58 C ATOM 2132 OD1 ASP A 145 -14.634 4.768 0.827 1.00 0.98 O ATOM 2133 OD2 ASP A 145 -15.593 3.018 1.723 1.00 0.75 O ATOM 0 H ASP A 145 -10.849 3.719 1.247 1.00 0.14 H new ATOM 0 HA ASP A 145 -12.561 1.309 1.409 1.00 0.15 H new ATOM 0 HB2 ASP A 145 -13.400 2.721 2.956 1.00 0.19 H new ATOM 0 HB3 ASP A 145 -12.638 4.130 2.245 1.00 0.19 H new ATOM 2138 N ARG A 146 -14.207 2.006 -0.574 1.00 0.17 N ATOM 2139 CA ARG A 146 -14.817 1.976 -1.901 1.00 0.17 C ATOM 2140 C ARG A 146 -14.571 3.274 -2.654 1.00 0.18 C ATOM 2141 O ARG A 146 -14.260 3.268 -3.842 1.00 0.22 O ATOM 2142 CB ARG A 146 -16.322 1.766 -1.778 1.00 0.19 C ATOM 2143 CG ARG A 146 -16.716 0.556 -0.961 1.00 0.24 C ATOM 2144 CD ARG A 146 -18.213 0.513 -0.764 1.00 0.29 C ATOM 2145 NE ARG A 146 -18.703 1.774 -0.201 1.00 1.00 N ATOM 2146 CZ ARG A 146 -19.598 1.858 0.779 1.00 1.46 C ATOM 2147 NH1 ARG A 146 -20.185 0.764 1.241 1.00 1.63 N ATOM 2148 NH2 ARG A 146 -19.918 3.044 1.282 1.00 2.22 N ATOM 0 H ARG A 146 -14.842 1.738 0.178 1.00 0.17 H new ATOM 0 HA ARG A 146 -14.362 1.154 -2.453 1.00 0.17 H new ATOM 0 HB2 ARG A 146 -16.766 2.654 -1.328 1.00 0.19 H new ATOM 0 HB3 ARG A 146 -16.747 1.669 -2.777 1.00 0.19 H new ATOM 0 HG2 ARG A 146 -16.383 -0.353 -1.463 1.00 0.24 H new ATOM 0 HG3 ARG A 146 -16.217 0.586 0.008 1.00 0.24 H new ATOM 0 HD2 ARG A 146 -18.704 0.321 -1.718 1.00 0.29 H new ATOM 0 HD3 ARG A 146 -18.473 -0.312 -0.100 1.00 0.29 H new ATOM 0 HE ARG A 146 -18.334 2.644 -0.586 1.00 1.00 H new ATOM 0 HH11 ARG A 146 -19.951 -0.146 0.845 1.00 1.63 H new ATOM 0 HH12 ARG A 146 -20.871 0.832 1.993 1.00 1.63 H new ATOM 0 HH21 ARG A 146 -19.478 3.888 0.917 1.00 2.22 H new ATOM 0 HH22 ARG A 146 -20.604 3.111 2.034 1.00 2.22 H new ATOM 2162 N ASP A 147 -14.689 4.391 -1.952 1.00 0.18 N ATOM 2163 CA ASP A 147 -14.557 5.687 -2.582 1.00 0.21 C ATOM 2164 C ASP A 147 -13.136 6.164 -2.455 1.00 0.18 C ATOM 2165 O ASP A 147 -12.833 7.310 -2.739 1.00 0.24 O ATOM 2166 CB ASP A 147 -15.522 6.703 -1.967 1.00 0.28 C ATOM 2167 CG ASP A 147 -16.942 6.522 -2.461 1.00 1.09 C ATOM 2168 OD1 ASP A 147 -17.304 7.112 -3.501 1.00 1.19 O ATOM 2169 OD2 ASP A 147 -17.711 5.782 -1.810 1.00 2.00 O ATOM 0 H ASP A 147 -14.875 4.422 -0.950 1.00 0.18 H new ATOM 0 HA ASP A 147 -14.812 5.589 -3.637 1.00 0.21 H new ATOM 0 HB2 ASP A 147 -15.503 6.607 -0.881 1.00 0.28 H new ATOM 0 HB3 ASP A 147 -15.183 7.712 -2.204 1.00 0.28 H new ATOM 2174 N GLY A 148 -12.265 5.250 -2.064 1.00 0.16 N ATOM 2175 CA GLY A 148 -10.870 5.554 -1.939 1.00 0.16 C ATOM 2176 C GLY A 148 -10.526 6.351 -0.705 1.00 0.15 C ATOM 2177 O GLY A 148 -9.597 7.146 -0.735 1.00 0.17 O ATOM 0 H GLY A 148 -12.512 4.289 -1.829 1.00 0.16 H new ATOM 0 HA2 GLY A 148 -10.305 4.622 -1.927 1.00 0.16 H new ATOM 0 HA3 GLY A 148 -10.549 6.110 -2.820 1.00 0.16 H new ATOM 2181 N VAL A 149 -11.239 6.167 0.390 1.00 0.17 N ATOM 2182 CA VAL A 149 -10.834 6.847 1.605 1.00 0.18 C ATOM 2183 C VAL A 149 -10.245 5.878 2.633 1.00 0.17 C ATOM 2184 O VAL A 149 -10.930 5.008 3.163 1.00 0.24 O ATOM 2185 CB VAL A 149 -11.944 7.736 2.217 1.00 0.28 C ATOM 2186 CG1 VAL A 149 -13.218 6.972 2.497 1.00 0.97 C ATOM 2187 CG2 VAL A 149 -11.445 8.427 3.477 1.00 1.12 C ATOM 0 H VAL A 149 -12.068 5.578 0.465 1.00 0.17 H new ATOM 0 HA VAL A 149 -10.040 7.532 1.308 1.00 0.18 H new ATOM 0 HB VAL A 149 -12.188 8.491 1.470 1.00 0.28 H new ATOM 0 HG11 VAL A 149 -13.960 7.646 2.925 1.00 0.97 H new ATOM 0 HG12 VAL A 149 -13.602 6.552 1.567 1.00 0.97 H new ATOM 0 HG13 VAL A 149 -13.012 6.166 3.201 1.00 0.97 H new ATOM 0 HG21 VAL A 149 -12.240 9.047 3.891 1.00 1.12 H new ATOM 0 HG22 VAL A 149 -11.150 7.677 4.211 1.00 1.12 H new ATOM 0 HG23 VAL A 149 -10.587 9.053 3.233 1.00 1.12 H new ATOM 2197 N PRO A 150 -8.922 5.990 2.837 1.00 0.21 N ATOM 2198 CA PRO A 150 -8.177 5.243 3.855 1.00 0.20 C ATOM 2199 C PRO A 150 -8.825 5.348 5.234 1.00 0.23 C ATOM 2200 O PRO A 150 -9.031 6.450 5.751 1.00 0.34 O ATOM 2201 CB PRO A 150 -6.802 5.928 3.893 1.00 0.26 C ATOM 2202 CG PRO A 150 -6.857 7.060 2.916 1.00 0.29 C ATOM 2203 CD PRO A 150 -8.048 6.846 2.044 1.00 0.41 C ATOM 0 HA PRO A 150 -8.138 4.181 3.613 1.00 0.20 H new ATOM 0 HB2 PRO A 150 -6.579 6.293 4.896 1.00 0.26 H new ATOM 0 HB3 PRO A 150 -6.012 5.225 3.627 1.00 0.26 H new ATOM 0 HG2 PRO A 150 -6.932 8.014 3.439 1.00 0.29 H new ATOM 0 HG3 PRO A 150 -5.946 7.095 2.318 1.00 0.29 H new ATOM 0 HD2 PRO A 150 -8.534 7.789 1.795 1.00 0.41 H new ATOM 0 HD3 PRO A 150 -7.772 6.371 1.103 1.00 0.41 H new ATOM 2211 N VAL A 151 -9.131 4.209 5.832 1.00 0.22 N ATOM 2212 CA VAL A 151 -9.752 4.182 7.146 1.00 0.29 C ATOM 2213 C VAL A 151 -8.930 3.333 8.103 1.00 0.32 C ATOM 2214 O VAL A 151 -9.099 3.408 9.320 1.00 0.61 O ATOM 2215 CB VAL A 151 -11.202 3.649 7.088 1.00 0.42 C ATOM 2216 CG1 VAL A 151 -12.114 4.652 6.394 1.00 1.45 C ATOM 2217 CG2 VAL A 151 -11.256 2.301 6.382 1.00 1.13 C ATOM 0 H VAL A 151 -8.959 3.289 5.427 1.00 0.22 H new ATOM 0 HA VAL A 151 -9.787 5.209 7.509 1.00 0.29 H new ATOM 0 HB VAL A 151 -11.554 3.512 8.110 1.00 0.42 H new ATOM 0 HG11 VAL A 151 -13.130 4.259 6.363 1.00 1.45 H new ATOM 0 HG12 VAL A 151 -12.106 5.593 6.944 1.00 1.45 H new ATOM 0 HG13 VAL A 151 -11.760 4.823 5.377 1.00 1.45 H new ATOM 0 HG21 VAL A 151 -12.286 1.946 6.353 1.00 1.13 H new ATOM 0 HG22 VAL A 151 -10.881 2.408 5.364 1.00 1.13 H new ATOM 0 HG23 VAL A 151 -10.640 1.582 6.922 1.00 1.13 H new ATOM 2227 N GLU A 152 -8.021 2.539 7.547 1.00 0.19 N ATOM 2228 CA GLU A 152 -7.164 1.671 8.354 1.00 0.20 C ATOM 2229 C GLU A 152 -5.757 1.637 7.790 1.00 0.20 C ATOM 2230 O GLU A 152 -5.506 2.118 6.693 1.00 0.19 O ATOM 2231 CB GLU A 152 -7.671 0.227 8.382 1.00 0.21 C ATOM 2232 CG GLU A 152 -9.170 0.082 8.468 1.00 0.57 C ATOM 2233 CD GLU A 152 -9.732 0.388 9.837 1.00 0.63 C ATOM 2234 OE1 GLU A 152 -9.096 0.015 10.844 1.00 1.17 O ATOM 2235 OE2 GLU A 152 -10.834 0.960 9.915 1.00 1.17 O ATOM 0 H GLU A 152 -7.857 2.477 6.542 1.00 0.19 H new ATOM 0 HA GLU A 152 -7.176 2.086 9.362 1.00 0.20 H new ATOM 0 HB2 GLU A 152 -7.322 -0.283 7.484 1.00 0.21 H new ATOM 0 HB3 GLU A 152 -7.222 -0.284 9.233 1.00 0.21 H new ATOM 0 HG2 GLU A 152 -9.633 0.746 7.738 1.00 0.57 H new ATOM 0 HG3 GLU A 152 -9.444 -0.936 8.192 1.00 0.57 H new ATOM 2242 N ARG A 153 -4.848 1.110 8.581 1.00 0.23 N ATOM 2243 CA ARG A 153 -3.557 0.653 8.092 1.00 0.24 C ATOM 2244 C ARG A 153 -3.083 -0.533 8.924 1.00 0.25 C ATOM 2245 O ARG A 153 -3.309 -0.583 10.133 1.00 0.39 O ATOM 2246 CB ARG A 153 -2.513 1.774 8.063 1.00 0.36 C ATOM 2247 CG ARG A 153 -1.160 1.397 8.667 1.00 0.40 C ATOM 2248 CD ARG A 153 -0.269 2.618 8.848 1.00 0.47 C ATOM 2249 NE ARG A 153 -1.015 3.848 9.157 1.00 0.65 N ATOM 2250 CZ ARG A 153 -1.839 4.005 10.201 1.00 1.51 C ATOM 2251 NH1 ARG A 153 -2.003 3.031 11.094 1.00 2.16 N ATOM 2252 NH2 ARG A 153 -2.485 5.150 10.357 1.00 1.85 N ATOM 0 H ARG A 153 -4.980 0.984 9.585 1.00 0.23 H new ATOM 0 HA ARG A 153 -3.682 0.332 7.058 1.00 0.24 H new ATOM 0 HB2 ARG A 153 -2.361 2.085 7.029 1.00 0.36 H new ATOM 0 HB3 ARG A 153 -2.909 2.636 8.600 1.00 0.36 H new ATOM 0 HG2 ARG A 153 -1.313 0.911 9.631 1.00 0.40 H new ATOM 0 HG3 ARG A 153 -0.661 0.674 8.022 1.00 0.40 H new ATOM 0 HD2 ARG A 153 0.443 2.423 9.650 1.00 0.47 H new ATOM 0 HD3 ARG A 153 0.311 2.773 7.938 1.00 0.47 H new ATOM 0 HE ARG A 153 -0.895 4.642 8.528 1.00 0.65 H new ATOM 0 HH11 ARG A 153 -1.498 2.151 10.988 1.00 2.16 H new ATOM 0 HH12 ARG A 153 -2.634 3.165 11.884 1.00 2.16 H new ATOM 0 HH21 ARG A 153 -2.354 5.905 9.684 1.00 1.85 H new ATOM 0 HH22 ARG A 153 -3.114 5.277 11.150 1.00 1.85 H new ATOM 2266 N PHE A 154 -2.427 -1.471 8.263 1.00 0.24 N ATOM 2267 CA PHE A 154 -2.063 -2.740 8.869 1.00 0.22 C ATOM 2268 C PHE A 154 -0.553 -2.926 8.846 1.00 0.24 C ATOM 2269 O PHE A 154 0.092 -2.633 7.844 1.00 0.32 O ATOM 2270 CB PHE A 154 -2.728 -3.888 8.102 1.00 0.22 C ATOM 2271 CG PHE A 154 -4.234 -3.894 8.163 1.00 0.20 C ATOM 2272 CD1 PHE A 154 -4.978 -3.127 7.279 1.00 0.22 C ATOM 2273 CD2 PHE A 154 -4.906 -4.689 9.083 1.00 0.21 C ATOM 2274 CE1 PHE A 154 -6.359 -3.144 7.315 1.00 0.24 C ATOM 2275 CE2 PHE A 154 -6.292 -4.712 9.118 1.00 0.22 C ATOM 2276 CZ PHE A 154 -7.015 -3.938 8.232 1.00 0.22 C ATOM 0 H PHE A 154 -2.132 -1.374 7.291 1.00 0.24 H new ATOM 0 HA PHE A 154 -2.405 -2.742 9.904 1.00 0.22 H new ATOM 0 HB2 PHE A 154 -2.420 -3.836 7.058 1.00 0.22 H new ATOM 0 HB3 PHE A 154 -2.358 -4.834 8.497 1.00 0.22 H new ATOM 0 HD1 PHE A 154 -4.471 -2.508 6.553 1.00 0.22 H new ATOM 0 HD2 PHE A 154 -4.343 -5.295 9.778 1.00 0.21 H new ATOM 0 HE1 PHE A 154 -6.925 -2.535 6.625 1.00 0.24 H new ATOM 0 HE2 PHE A 154 -6.805 -5.334 9.837 1.00 0.22 H new ATOM 0 HZ PHE A 154 -8.095 -3.954 8.257 1.00 0.22 H new ATOM 2286 N SER A 155 -0.008 -3.427 9.946 1.00 0.22 N ATOM 2287 CA SER A 155 1.427 -3.707 10.055 1.00 0.25 C ATOM 2288 C SER A 155 1.764 -4.830 9.064 1.00 0.22 C ATOM 2289 O SER A 155 0.907 -5.643 8.743 1.00 0.26 O ATOM 2290 CB SER A 155 1.739 -4.140 11.495 1.00 0.35 C ATOM 2291 OG SER A 155 3.130 -4.101 11.771 1.00 1.11 O ATOM 0 H SER A 155 -0.540 -3.652 10.787 1.00 0.22 H new ATOM 0 HA SER A 155 2.023 -2.825 9.821 1.00 0.25 H new ATOM 0 HB2 SER A 155 1.212 -3.488 12.192 1.00 0.35 H new ATOM 0 HB3 SER A 155 1.365 -5.151 11.659 1.00 0.35 H new ATOM 0 HG SER A 155 3.288 -4.381 12.697 1.00 1.11 H new ATOM 2297 N PRO A 156 3.005 -4.879 8.554 1.00 0.25 N ATOM 2298 CA PRO A 156 3.419 -5.865 7.539 1.00 0.29 C ATOM 2299 C PRO A 156 3.259 -7.309 8.003 1.00 0.39 C ATOM 2300 O PRO A 156 3.158 -8.221 7.189 1.00 0.78 O ATOM 2301 CB PRO A 156 4.899 -5.542 7.315 1.00 0.34 C ATOM 2302 CG PRO A 156 5.310 -4.786 8.523 1.00 0.36 C ATOM 2303 CD PRO A 156 4.108 -3.986 8.918 1.00 0.33 C ATOM 0 HA PRO A 156 2.804 -5.794 6.642 1.00 0.29 H new ATOM 0 HB2 PRO A 156 5.489 -6.451 7.198 1.00 0.34 H new ATOM 0 HB3 PRO A 156 5.042 -4.951 6.411 1.00 0.34 H new ATOM 0 HG2 PRO A 156 5.614 -5.460 9.324 1.00 0.36 H new ATOM 0 HG3 PRO A 156 6.161 -4.138 8.311 1.00 0.36 H new ATOM 0 HD2 PRO A 156 4.107 -3.752 9.983 1.00 0.33 H new ATOM 0 HD3 PRO A 156 4.057 -3.038 8.383 1.00 0.33 H new ATOM 2311 N GLY A 157 3.292 -7.504 9.311 1.00 0.36 N ATOM 2312 CA GLY A 157 3.029 -8.807 9.892 1.00 0.46 C ATOM 2313 C GLY A 157 1.560 -9.187 9.907 1.00 0.41 C ATOM 2314 O GLY A 157 1.214 -10.296 10.323 1.00 0.50 O ATOM 0 H GLY A 157 3.499 -6.773 9.991 1.00 0.36 H new ATOM 0 HA2 GLY A 157 3.584 -9.562 9.334 1.00 0.46 H new ATOM 0 HA3 GLY A 157 3.409 -8.822 10.914 1.00 0.46 H new ATOM 2318 N ALA A 158 0.686 -8.291 9.458 1.00 0.34 N ATOM 2319 CA ALA A 158 -0.727 -8.615 9.358 1.00 0.31 C ATOM 2320 C ALA A 158 -0.940 -9.612 8.233 1.00 0.34 C ATOM 2321 O ALA A 158 -0.222 -9.595 7.235 1.00 0.50 O ATOM 2322 CB ALA A 158 -1.560 -7.362 9.129 1.00 0.37 C ATOM 0 H ALA A 158 0.931 -7.346 9.161 1.00 0.34 H new ATOM 0 HA ALA A 158 -1.052 -9.060 10.298 1.00 0.31 H new ATOM 0 HB1 ALA A 158 -2.613 -7.633 9.058 1.00 0.37 H new ATOM 0 HB2 ALA A 158 -1.418 -6.673 9.962 1.00 0.37 H new ATOM 0 HB3 ALA A 158 -1.246 -6.881 8.203 1.00 0.37 H new ATOM 2328 N SER A 159 -1.909 -10.489 8.401 1.00 0.26 N ATOM 2329 CA SER A 159 -2.182 -11.492 7.413 1.00 0.30 C ATOM 2330 C SER A 159 -3.432 -11.118 6.642 1.00 0.23 C ATOM 2331 O SER A 159 -4.137 -10.173 7.010 1.00 0.22 O ATOM 2332 CB SER A 159 -2.357 -12.860 8.074 1.00 0.41 C ATOM 2333 OG SER A 159 -1.254 -13.169 8.914 1.00 1.42 O ATOM 0 H SER A 159 -2.518 -10.521 9.219 1.00 0.26 H new ATOM 0 HA SER A 159 -1.339 -11.550 6.724 1.00 0.30 H new ATOM 0 HB2 SER A 159 -3.277 -12.869 8.659 1.00 0.41 H new ATOM 0 HB3 SER A 159 -2.459 -13.627 7.307 1.00 0.41 H new ATOM 0 HG SER A 159 -1.392 -14.048 9.325 1.00 1.42 H new ATOM 2339 N VAL A 160 -3.673 -11.853 5.573 1.00 0.22 N ATOM 2340 CA VAL A 160 -4.852 -11.692 4.737 1.00 0.20 C ATOM 2341 C VAL A 160 -6.103 -11.440 5.579 1.00 0.21 C ATOM 2342 O VAL A 160 -6.764 -10.420 5.426 1.00 0.20 O ATOM 2343 CB VAL A 160 -5.055 -12.978 3.923 1.00 0.24 C ATOM 2344 CG1 VAL A 160 -6.309 -12.918 3.068 1.00 0.28 C ATOM 2345 CG2 VAL A 160 -3.838 -13.269 3.061 1.00 0.26 C ATOM 0 H VAL A 160 -3.046 -12.592 5.254 1.00 0.22 H new ATOM 0 HA VAL A 160 -4.699 -10.833 4.084 1.00 0.20 H new ATOM 0 HB VAL A 160 -5.183 -13.793 4.636 1.00 0.24 H new ATOM 0 HG11 VAL A 160 -6.413 -13.848 2.509 1.00 0.28 H new ATOM 0 HG12 VAL A 160 -7.180 -12.780 3.709 1.00 0.28 H new ATOM 0 HG13 VAL A 160 -6.235 -12.083 2.372 1.00 0.28 H new ATOM 0 HG21 VAL A 160 -4.005 -14.185 2.493 1.00 0.26 H new ATOM 0 HG22 VAL A 160 -3.673 -12.440 2.373 1.00 0.26 H new ATOM 0 HG23 VAL A 160 -2.962 -13.391 3.698 1.00 0.26 H new ATOM 2355 N LYS A 161 -6.377 -12.349 6.512 1.00 0.26 N ATOM 2356 CA LYS A 161 -7.614 -12.318 7.287 1.00 0.31 C ATOM 2357 C LYS A 161 -7.626 -11.149 8.269 1.00 0.26 C ATOM 2358 O LYS A 161 -8.688 -10.611 8.588 1.00 0.27 O ATOM 2359 CB LYS A 161 -7.805 -13.648 8.029 1.00 0.45 C ATOM 2360 CG LYS A 161 -9.107 -13.740 8.812 1.00 1.12 C ATOM 2361 CD LYS A 161 -10.334 -13.559 7.922 1.00 1.80 C ATOM 2362 CE LYS A 161 -10.684 -14.818 7.134 1.00 2.67 C ATOM 2363 NZ LYS A 161 -9.665 -15.165 6.107 1.00 3.46 N ATOM 0 H LYS A 161 -5.754 -13.121 6.750 1.00 0.26 H new ATOM 0 HA LYS A 161 -8.444 -12.176 6.595 1.00 0.31 H new ATOM 0 HB2 LYS A 161 -7.769 -14.463 7.307 1.00 0.45 H new ATOM 0 HB3 LYS A 161 -6.970 -13.793 8.714 1.00 0.45 H new ATOM 0 HG2 LYS A 161 -9.161 -14.709 9.309 1.00 1.12 H new ATOM 0 HG3 LYS A 161 -9.113 -12.980 9.593 1.00 1.12 H new ATOM 0 HD2 LYS A 161 -11.186 -13.274 8.539 1.00 1.80 H new ATOM 0 HD3 LYS A 161 -10.155 -12.739 7.227 1.00 1.80 H new ATOM 0 HE2 LYS A 161 -10.794 -15.654 7.825 1.00 2.67 H new ATOM 0 HE3 LYS A 161 -11.649 -14.678 6.647 1.00 2.67 H new ATOM 0 HZ1 LYS A 161 -10.133 -15.604 5.289 1.00 3.46 H new ATOM 0 HZ2 LYS A 161 -9.172 -14.302 5.802 1.00 3.46 H new ATOM 0 HZ3 LYS A 161 -8.977 -15.832 6.512 1.00 3.46 H new ATOM 2377 N ASP A 162 -6.442 -10.736 8.713 1.00 0.26 N ATOM 2378 CA ASP A 162 -6.322 -9.624 9.648 1.00 0.27 C ATOM 2379 C ASP A 162 -6.780 -8.351 8.971 1.00 0.22 C ATOM 2380 O ASP A 162 -7.376 -7.472 9.589 1.00 0.26 O ATOM 2381 CB ASP A 162 -4.873 -9.456 10.112 1.00 0.33 C ATOM 2382 CG ASP A 162 -4.419 -10.552 11.051 1.00 0.78 C ATOM 2383 OD1 ASP A 162 -4.018 -11.632 10.565 1.00 1.40 O ATOM 2384 OD2 ASP A 162 -4.484 -10.353 12.280 1.00 0.86 O ATOM 0 H ASP A 162 -5.553 -11.155 8.440 1.00 0.26 H new ATOM 0 HA ASP A 162 -6.944 -9.833 10.518 1.00 0.27 H new ATOM 0 HB2 ASP A 162 -4.219 -9.438 9.241 1.00 0.33 H new ATOM 0 HB3 ASP A 162 -4.767 -8.492 10.610 1.00 0.33 H new ATOM 2389 N ILE A 163 -6.483 -8.278 7.691 1.00 0.18 N ATOM 2390 CA ILE A 163 -6.863 -7.155 6.864 1.00 0.15 C ATOM 2391 C ILE A 163 -8.297 -7.306 6.364 1.00 0.14 C ATOM 2392 O ILE A 163 -9.066 -6.345 6.392 1.00 0.15 O ATOM 2393 CB ILE A 163 -5.888 -7.031 5.675 1.00 0.14 C ATOM 2394 CG1 ILE A 163 -4.520 -6.525 6.159 1.00 0.15 C ATOM 2395 CG2 ILE A 163 -6.453 -6.118 4.596 1.00 0.15 C ATOM 2396 CD1 ILE A 163 -3.427 -6.659 5.126 1.00 0.21 C ATOM 0 H ILE A 163 -5.967 -9.003 7.192 1.00 0.18 H new ATOM 0 HA ILE A 163 -6.812 -6.247 7.465 1.00 0.15 H new ATOM 0 HB ILE A 163 -5.756 -8.020 5.236 1.00 0.14 H new ATOM 0 HG12 ILE A 163 -4.610 -5.478 6.447 1.00 0.15 H new ATOM 0 HG13 ILE A 163 -4.233 -7.078 7.054 1.00 0.15 H new ATOM 0 HG21 ILE A 163 -5.745 -6.049 3.770 1.00 0.15 H new ATOM 0 HG22 ILE A 163 -7.396 -6.525 4.232 1.00 0.15 H new ATOM 0 HG23 ILE A 163 -6.623 -5.125 5.012 1.00 0.15 H new ATOM 0 HD11 ILE A 163 -2.490 -6.282 5.537 1.00 0.21 H new ATOM 0 HD12 ILE A 163 -3.309 -7.708 4.855 1.00 0.21 H new ATOM 0 HD13 ILE A 163 -3.692 -6.083 4.239 1.00 0.21 H new ATOM 2408 N GLU A 164 -8.655 -8.517 5.935 1.00 0.13 N ATOM 2409 CA GLU A 164 -9.992 -8.789 5.414 1.00 0.13 C ATOM 2410 C GLU A 164 -11.063 -8.321 6.381 1.00 0.15 C ATOM 2411 O GLU A 164 -12.051 -7.731 5.981 1.00 0.15 O ATOM 2412 CB GLU A 164 -10.224 -10.281 5.185 1.00 0.14 C ATOM 2413 CG GLU A 164 -9.428 -10.902 4.064 1.00 0.20 C ATOM 2414 CD GLU A 164 -9.699 -12.387 3.953 1.00 0.30 C ATOM 2415 OE1 GLU A 164 -10.626 -12.771 3.214 1.00 0.60 O ATOM 2416 OE2 GLU A 164 -8.971 -13.179 4.581 1.00 0.67 O ATOM 0 H GLU A 164 -8.034 -9.326 5.939 1.00 0.13 H new ATOM 0 HA GLU A 164 -10.056 -8.249 4.469 1.00 0.13 H new ATOM 0 HB2 GLU A 164 -9.992 -10.812 6.108 1.00 0.14 H new ATOM 0 HB3 GLU A 164 -11.284 -10.439 4.984 1.00 0.14 H new ATOM 0 HG2 GLU A 164 -9.679 -10.413 3.123 1.00 0.20 H new ATOM 0 HG3 GLU A 164 -8.364 -10.736 4.235 1.00 0.20 H new ATOM 2423 N GLU A 165 -10.861 -8.593 7.654 1.00 0.18 N ATOM 2424 CA GLU A 165 -11.868 -8.301 8.665 1.00 0.21 C ATOM 2425 C GLU A 165 -12.198 -6.810 8.736 1.00 0.21 C ATOM 2426 O GLU A 165 -13.222 -6.424 9.298 1.00 0.27 O ATOM 2427 CB GLU A 165 -11.415 -8.817 10.030 1.00 0.27 C ATOM 2428 CG GLU A 165 -10.221 -8.084 10.614 1.00 0.47 C ATOM 2429 CD GLU A 165 -9.795 -8.662 11.944 1.00 0.66 C ATOM 2430 OE1 GLU A 165 -9.245 -9.783 11.960 1.00 0.83 O ATOM 2431 OE2 GLU A 165 -9.998 -7.998 12.982 1.00 0.87 O ATOM 0 H GLU A 165 -10.008 -9.017 8.018 1.00 0.18 H new ATOM 0 HA GLU A 165 -12.782 -8.819 8.374 1.00 0.21 H new ATOM 0 HB2 GLU A 165 -12.249 -8.742 10.728 1.00 0.27 H new ATOM 0 HB3 GLU A 165 -11.168 -9.875 9.941 1.00 0.27 H new ATOM 0 HG2 GLU A 165 -9.387 -8.134 9.914 1.00 0.47 H new ATOM 0 HG3 GLU A 165 -10.469 -7.030 10.740 1.00 0.47 H new ATOM 2438 N LYS A 166 -11.335 -5.974 8.175 1.00 0.19 N ATOM 2439 CA LYS A 166 -11.643 -4.561 8.059 1.00 0.20 C ATOM 2440 C LYS A 166 -11.984 -4.220 6.612 1.00 0.19 C ATOM 2441 O LYS A 166 -12.728 -3.280 6.336 1.00 0.25 O ATOM 2442 CB LYS A 166 -10.484 -3.697 8.571 1.00 0.25 C ATOM 2443 CG LYS A 166 -10.133 -3.945 10.035 1.00 0.38 C ATOM 2444 CD LYS A 166 -11.356 -3.856 10.941 1.00 0.58 C ATOM 2445 CE LYS A 166 -11.908 -2.439 11.038 1.00 1.09 C ATOM 2446 NZ LYS A 166 -11.032 -1.545 11.843 1.00 1.71 N ATOM 0 H LYS A 166 -10.428 -6.248 7.798 1.00 0.19 H new ATOM 0 HA LYS A 166 -12.510 -4.343 8.682 1.00 0.20 H new ATOM 0 HB2 LYS A 166 -9.603 -3.887 7.958 1.00 0.25 H new ATOM 0 HB3 LYS A 166 -10.742 -2.646 8.442 1.00 0.25 H new ATOM 0 HG2 LYS A 166 -9.678 -4.930 10.136 1.00 0.38 H new ATOM 0 HG3 LYS A 166 -9.390 -3.216 10.358 1.00 0.38 H new ATOM 0 HD2 LYS A 166 -12.133 -4.520 10.563 1.00 0.58 H new ATOM 0 HD3 LYS A 166 -11.092 -4.209 11.938 1.00 0.58 H new ATOM 0 HE2 LYS A 166 -12.021 -2.026 10.036 1.00 1.09 H new ATOM 0 HE3 LYS A 166 -12.902 -2.468 11.485 1.00 1.09 H new ATOM 0 HZ1 LYS A 166 -11.504 -0.629 11.981 1.00 1.71 H new ATOM 0 HZ2 LYS A 166 -10.847 -1.982 12.769 1.00 1.71 H new ATOM 0 HZ3 LYS A 166 -10.132 -1.399 11.343 1.00 1.71 H new ATOM 2460 N LEU A 167 -11.459 -5.030 5.704 1.00 0.15 N ATOM 2461 CA LEU A 167 -11.630 -4.845 4.270 1.00 0.15 C ATOM 2462 C LEU A 167 -13.013 -5.286 3.798 1.00 0.15 C ATOM 2463 O LEU A 167 -13.695 -4.563 3.071 1.00 0.16 O ATOM 2464 CB LEU A 167 -10.572 -5.664 3.536 1.00 0.13 C ATOM 2465 CG LEU A 167 -10.892 -5.960 2.079 1.00 0.14 C ATOM 2466 CD1 LEU A 167 -10.754 -4.703 1.241 1.00 0.16 C ATOM 2467 CD2 LEU A 167 -10.006 -7.072 1.552 1.00 0.16 C ATOM 0 H LEU A 167 -10.895 -5.845 5.946 1.00 0.15 H new ATOM 0 HA LEU A 167 -11.524 -3.782 4.053 1.00 0.15 H new ATOM 0 HB2 LEU A 167 -9.622 -5.131 3.584 1.00 0.13 H new ATOM 0 HB3 LEU A 167 -10.434 -6.609 4.062 1.00 0.13 H new ATOM 0 HG LEU A 167 -11.926 -6.298 2.011 1.00 0.14 H new ATOM 0 HD11 LEU A 167 -10.986 -4.932 0.201 1.00 0.16 H new ATOM 0 HD12 LEU A 167 -11.444 -3.943 1.608 1.00 0.16 H new ATOM 0 HD13 LEU A 167 -9.732 -4.330 1.311 1.00 0.16 H new ATOM 0 HD21 LEU A 167 -10.251 -7.269 0.508 1.00 0.16 H new ATOM 0 HD22 LEU A 167 -8.961 -6.772 1.629 1.00 0.16 H new ATOM 0 HD23 LEU A 167 -10.169 -7.976 2.139 1.00 0.16 H new ATOM 2479 N ILE A 168 -13.404 -6.487 4.204 1.00 0.16 N ATOM 2480 CA ILE A 168 -14.655 -7.096 3.777 1.00 0.19 C ATOM 2481 C ILE A 168 -15.861 -6.194 4.072 1.00 0.22 C ATOM 2482 O ILE A 168 -16.732 -6.050 3.222 1.00 0.25 O ATOM 2483 CB ILE A 168 -14.860 -8.488 4.414 1.00 0.20 C ATOM 2484 CG1 ILE A 168 -13.682 -9.413 4.069 1.00 0.19 C ATOM 2485 CG2 ILE A 168 -16.176 -9.101 3.945 1.00 0.26 C ATOM 2486 CD1 ILE A 168 -13.766 -10.779 4.719 1.00 0.24 C ATOM 0 H ILE A 168 -12.859 -7.068 4.841 1.00 0.16 H new ATOM 0 HA ILE A 168 -14.584 -7.222 2.697 1.00 0.19 H new ATOM 0 HB ILE A 168 -14.902 -8.371 5.497 1.00 0.20 H new ATOM 0 HG12 ILE A 168 -13.635 -9.538 2.987 1.00 0.19 H new ATOM 0 HG13 ILE A 168 -12.753 -8.932 4.375 1.00 0.19 H new ATOM 0 HG21 ILE A 168 -16.304 -10.082 4.403 1.00 0.26 H new ATOM 0 HG22 ILE A 168 -17.003 -8.453 4.236 1.00 0.26 H new ATOM 0 HG23 ILE A 168 -16.162 -9.207 2.860 1.00 0.26 H new ATOM 0 HD11 ILE A 168 -12.900 -11.374 4.428 1.00 0.24 H new ATOM 0 HD12 ILE A 168 -13.781 -10.666 5.803 1.00 0.24 H new ATOM 0 HD13 ILE A 168 -14.677 -11.281 4.394 1.00 0.24 H new ATOM 2498 N PRO A 169 -15.941 -5.575 5.273 1.00 0.24 N ATOM 2499 CA PRO A 169 -16.971 -4.570 5.577 1.00 0.29 C ATOM 2500 C PRO A 169 -17.083 -3.466 4.518 1.00 0.29 C ATOM 2501 O PRO A 169 -18.128 -2.831 4.394 1.00 0.41 O ATOM 2502 CB PRO A 169 -16.494 -3.975 6.896 1.00 0.34 C ATOM 2503 CG PRO A 169 -15.765 -5.085 7.561 1.00 0.40 C ATOM 2504 CD PRO A 169 -15.093 -5.849 6.455 1.00 0.24 C ATOM 0 HA PRO A 169 -17.963 -5.020 5.610 1.00 0.29 H new ATOM 0 HB2 PRO A 169 -15.844 -3.115 6.732 1.00 0.34 H new ATOM 0 HB3 PRO A 169 -17.332 -3.630 7.502 1.00 0.34 H new ATOM 0 HG2 PRO A 169 -15.034 -4.702 8.273 1.00 0.40 H new ATOM 0 HG3 PRO A 169 -16.449 -5.724 8.119 1.00 0.40 H new ATOM 0 HD2 PRO A 169 -14.069 -5.511 6.300 1.00 0.24 H new ATOM 0 HD3 PRO A 169 -15.047 -6.915 6.676 1.00 0.24 H new ATOM 2512 N LEU A 170 -16.013 -3.225 3.761 1.00 0.22 N ATOM 2513 CA LEU A 170 -16.066 -2.234 2.695 1.00 0.22 C ATOM 2514 C LEU A 170 -16.319 -2.895 1.341 1.00 0.20 C ATOM 2515 O LEU A 170 -17.079 -2.364 0.535 1.00 0.23 O ATOM 2516 CB LEU A 170 -14.800 -1.363 2.651 1.00 0.24 C ATOM 2517 CG LEU A 170 -14.552 -0.499 3.878 1.00 0.33 C ATOM 2518 CD1 LEU A 170 -13.168 0.121 3.798 1.00 0.71 C ATOM 2519 CD2 LEU A 170 -15.619 0.578 3.978 1.00 0.69 C ATOM 0 H LEU A 170 -15.114 -3.696 3.865 1.00 0.22 H new ATOM 0 HA LEU A 170 -16.905 -1.574 2.916 1.00 0.22 H new ATOM 0 HB2 LEU A 170 -13.938 -2.014 2.507 1.00 0.24 H new ATOM 0 HB3 LEU A 170 -14.858 -0.714 1.777 1.00 0.24 H new ATOM 0 HG LEU A 170 -14.604 -1.119 4.773 1.00 0.33 H new ATOM 0 HD11 LEU A 170 -12.995 0.739 4.679 1.00 0.71 H new ATOM 0 HD12 LEU A 170 -12.418 -0.668 3.755 1.00 0.71 H new ATOM 0 HD13 LEU A 170 -13.097 0.738 2.902 1.00 0.71 H new ATOM 0 HD21 LEU A 170 -15.434 1.192 4.859 1.00 0.69 H new ATOM 0 HD22 LEU A 170 -15.589 1.204 3.086 1.00 0.69 H new ATOM 0 HD23 LEU A 170 -16.601 0.111 4.060 1.00 0.69 H new ATOM 2531 N LEU A 171 -15.688 -4.048 1.085 1.00 0.18 N ATOM 2532 CA LEU A 171 -15.962 -4.798 -0.151 1.00 0.20 C ATOM 2533 C LEU A 171 -17.420 -5.169 -0.189 1.00 0.27 C ATOM 2534 O LEU A 171 -18.169 -4.786 -1.085 1.00 0.34 O ATOM 2535 CB LEU A 171 -15.154 -6.095 -0.235 1.00 0.26 C ATOM 2536 CG LEU A 171 -13.652 -5.924 -0.292 1.00 0.17 C ATOM 2537 CD1 LEU A 171 -12.969 -7.274 -0.224 1.00 0.26 C ATOM 2538 CD2 LEU A 171 -13.254 -5.198 -1.566 1.00 0.31 C ATOM 0 H LEU A 171 -14.998 -4.476 1.702 1.00 0.18 H new ATOM 0 HA LEU A 171 -15.682 -4.156 -0.986 1.00 0.20 H new ATOM 0 HB2 LEU A 171 -15.399 -6.712 0.629 1.00 0.26 H new ATOM 0 HB3 LEU A 171 -15.473 -6.645 -1.120 1.00 0.26 H new ATOM 0 HG LEU A 171 -13.335 -5.328 0.564 1.00 0.17 H new ATOM 0 HD11 LEU A 171 -11.888 -7.138 -0.266 1.00 0.26 H new ATOM 0 HD12 LEU A 171 -13.236 -7.770 0.709 1.00 0.26 H new ATOM 0 HD13 LEU A 171 -13.290 -7.887 -1.066 1.00 0.26 H new ATOM 0 HD21 LEU A 171 -12.171 -5.081 -1.595 1.00 0.31 H new ATOM 0 HD22 LEU A 171 -13.580 -5.776 -2.431 1.00 0.31 H new ATOM 0 HD23 LEU A 171 -13.726 -4.215 -1.587 1.00 0.31 H new ATOM 2550 N GLY A 172 -17.797 -5.906 0.832 1.00 0.29 N ATOM 2551 CA GLY A 172 -19.143 -6.380 0.964 1.00 0.39 C ATOM 2552 C GLY A 172 -20.095 -5.265 1.327 1.00 0.66 C ATOM 2553 O GLY A 172 -21.281 -5.318 1.004 1.00 1.12 O ATOM 0 H GLY A 172 -17.175 -6.189 1.589 1.00 0.29 H new ATOM 0 HA2 GLY A 172 -19.461 -6.839 0.028 1.00 0.39 H new ATOM 0 HA3 GLY A 172 -19.182 -7.156 1.729 1.00 0.39 H new ATOM 2557 N SER A 173 -19.548 -4.251 1.998 1.00 0.85 N ATOM 2558 CA SER A 173 -20.299 -3.069 2.410 1.00 1.33 C ATOM 2559 C SER A 173 -21.284 -3.377 3.538 1.00 1.84 C ATOM 2560 O SER A 173 -22.199 -4.191 3.398 1.00 2.43 O ATOM 2561 CB SER A 173 -21.012 -2.430 1.217 1.00 2.03 C ATOM 2562 OG SER A 173 -20.076 -1.908 0.289 1.00 2.64 O ATOM 0 H SER A 173 -18.566 -4.228 2.272 1.00 0.85 H new ATOM 0 HA SER A 173 -19.578 -2.351 2.802 1.00 1.33 H new ATOM 0 HB2 SER A 173 -21.643 -3.171 0.726 1.00 2.03 H new ATOM 0 HB3 SER A 173 -21.669 -1.633 1.565 1.00 2.03 H new ATOM 0 HG SER A 173 -19.175 -2.210 0.528 1.00 2.64 H new ATOM 2568 N ALA A 174 -21.080 -2.697 4.660 1.00 2.40 N ATOM 2569 CA ALA A 174 -21.938 -2.826 5.832 1.00 3.35 C ATOM 2570 C ALA A 174 -23.295 -2.159 5.601 1.00 3.69 C ATOM 2571 O ALA A 174 -24.149 -2.161 6.488 1.00 4.35 O ATOM 2572 CB ALA A 174 -21.254 -2.227 7.050 1.00 4.30 C ATOM 0 H ALA A 174 -20.311 -2.038 4.783 1.00 2.40 H new ATOM 0 HA ALA A 174 -22.113 -3.887 6.009 1.00 3.35 H new ATOM 0 HB1 ALA A 174 -21.904 -2.329 7.919 1.00 4.30 H new ATOM 0 HB2 ALA A 174 -20.316 -2.751 7.235 1.00 4.30 H new ATOM 0 HB3 ALA A 174 -21.051 -1.171 6.871 1.00 4.30 H new ATOM 2578 N ARG A 175 -23.447 -1.557 4.419 1.00 3.66 N ATOM 2579 CA ARG A 175 -24.674 -0.867 4.000 1.00 4.44 C ATOM 2580 C ARG A 175 -25.951 -1.626 4.375 1.00 4.81 C ATOM 2581 O ARG A 175 -26.959 -1.012 4.719 1.00 5.15 O ATOM 2582 CB ARG A 175 -24.645 -0.632 2.483 1.00 5.16 C ATOM 2583 CG ARG A 175 -24.481 -1.904 1.663 1.00 5.82 C ATOM 2584 CD ARG A 175 -24.376 -1.614 0.171 1.00 6.62 C ATOM 2585 NE ARG A 175 -24.081 -2.825 -0.600 1.00 7.03 N ATOM 2586 CZ ARG A 175 -23.482 -2.831 -1.795 1.00 7.84 C ATOM 2587 NH1 ARG A 175 -23.156 -1.693 -2.397 1.00 8.30 N ATOM 2588 NH2 ARG A 175 -23.230 -3.986 -2.398 1.00 8.45 N ATOM 0 H ARG A 175 -22.711 -1.534 3.714 1.00 3.66 H new ATOM 0 HA ARG A 175 -24.698 0.082 4.535 1.00 4.44 H new ATOM 0 HB2 ARG A 175 -25.569 -0.136 2.185 1.00 5.16 H new ATOM 0 HB3 ARG A 175 -23.827 0.049 2.247 1.00 5.16 H new ATOM 0 HG2 ARG A 175 -23.588 -2.435 1.993 1.00 5.82 H new ATOM 0 HG3 ARG A 175 -25.329 -2.564 1.845 1.00 5.82 H new ATOM 0 HD2 ARG A 175 -25.311 -1.178 -0.181 1.00 6.62 H new ATOM 0 HD3 ARG A 175 -23.594 -0.874 -0.001 1.00 6.62 H new ATOM 0 HE ARG A 175 -24.351 -3.723 -0.198 1.00 7.03 H new ATOM 0 HH11 ARG A 175 -23.362 -0.801 -1.948 1.00 8.30 H new ATOM 0 HH12 ARG A 175 -22.699 -1.711 -3.309 1.00 8.30 H new ATOM 0 HH21 ARG A 175 -23.493 -4.864 -1.950 1.00 8.45 H new ATOM 0 HH22 ARG A 175 -22.773 -3.996 -3.310 1.00 8.45 H new ATOM 2602 N LEU A 176 -25.908 -2.950 4.311 1.00 5.22 N ATOM 2603 CA LEU A 176 -27.071 -3.763 4.637 1.00 6.05 C ATOM 2604 C LEU A 176 -27.128 -4.034 6.134 1.00 6.72 C ATOM 2605 O LEU A 176 -27.685 -3.195 6.872 1.00 7.14 O ATOM 2606 CB LEU A 176 -27.028 -5.085 3.866 1.00 6.60 C ATOM 2607 CG LEU A 176 -27.083 -4.956 2.344 1.00 7.19 C ATOM 2608 CD1 LEU A 176 -26.962 -6.324 1.695 1.00 7.69 C ATOM 2609 CD2 LEU A 176 -28.372 -4.274 1.914 1.00 7.60 C ATOM 2610 OXT LEU A 176 -26.599 -5.073 6.569 1.00 7.13 O ATOM 0 H LEU A 176 -25.082 -3.483 4.037 1.00 5.22 H new ATOM 0 HA LEU A 176 -27.967 -3.215 4.347 1.00 6.05 H new ATOM 0 HB2 LEU A 176 -26.115 -5.615 4.136 1.00 6.60 H new ATOM 0 HB3 LEU A 176 -27.864 -5.704 4.192 1.00 6.60 H new ATOM 0 HG LEU A 176 -26.244 -4.342 2.017 1.00 7.19 H new ATOM 0 HD11 LEU A 176 -27.003 -6.217 0.611 1.00 7.69 H new ATOM 0 HD12 LEU A 176 -26.013 -6.779 1.979 1.00 7.69 H new ATOM 0 HD13 LEU A 176 -27.783 -6.959 2.028 1.00 7.69 H new ATOM 0 HD21 LEU A 176 -28.394 -4.190 0.827 1.00 7.60 H new ATOM 0 HD22 LEU A 176 -29.225 -4.863 2.250 1.00 7.60 H new ATOM 0 HD23 LEU A 176 -28.422 -3.279 2.356 1.00 7.60 H new TER 2622 LEU A 176