USER MOD reduce.3.24.130724 H: found=0, std=0, add=1025, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1020 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 14 MET CE :methyl 142:sc= -1.41 (180deg=-2.94!) USER MOD Set 1.2: A 112 SER OG : rot -150:sc= 0.848 USER MOD Set 2.1: A 62 THR OG1 : rot 38:sc= 0.743 USER MOD Set 2.2: A 64 LYS NZ :NH3+ -161:sc= 1.36 (180deg=0.837) USER MOD Set 3.1: A 46 LYS NZ :NH3+ -132:sc= 1.21 (180deg=-1.31!) USER MOD Set 3.2: A 48 GLN : amide:sc= 1.01 K(o=2.2,f=-8.3!) USER MOD Set 4.1: A 17 HIS : no HD1:sc= -0.593 X(o=-0.72,f=-1.2) USER MOD Set 4.2: A 23 LYS NZ :NH3+ 146:sc= -0.129 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ -124:sc= 0.118 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0.00125 USER MOD Single : A 3 HIS : no HE2:sc= 0.76 K(o=0.76,f=-2.7!) USER MOD Single : A 4 MET CE :methyl 171:sc= 0 (180deg=-0.08) USER MOD Single : A 6 THR OG1 : rot -148:sc= 0.583 USER MOD Single : A 8 SER OG : rot 51:sc= 0.00866 USER MOD Single : A 10 ASN : amide:sc= -2.5 K(o=-2.5,f=-3.1!) USER MOD Single : A 21 THR OG1 : rot -95:sc= 1.19 USER MOD Single : A 25 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 28 CYS SG : rot 150:sc= -0.294 USER MOD Single : A 29 MET CE :methyl -161:sc= -0.175 (180deg=-0.725) USER MOD Single : A 35 MET CE :methyl -159:sc= -0.0641 (180deg=-0.473) USER MOD Single : A 37 THR OG1 : rot -140:sc= -0.0518 USER MOD Single : A 39 GLN : amide:sc= -1.43 K(o=-1.4,f=-0.77) USER MOD Single : A 41 LYS NZ :NH3+ -166:sc= 0.849 (180deg=0.52) USER MOD Single : A 42 TYR OH : rot 180:sc= -0.161 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 TYR OH : rot 30:sc= 0.0904 USER MOD Single : A 61 TYR OH : rot 32:sc= 0.226 USER MOD Single : A 63 SER OG : rot 180:sc= 0.0579 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 72 THR OG1 : rot 86:sc= 1.12 USER MOD Single : A 73 LYS NZ :NH3+ 137:sc= 1.02 (180deg=-0.892) USER MOD Single : A 75 ASN : amide:sc= -0.384 X(o=-0.38,f=-0.65) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 78 ASN : amide:sc= -0.0701 K(o=-0.07,f=-1.2) USER MOD Single : A 83 THR OG1 : rot 95:sc= 1.1 USER MOD Single : A 84 MET CE :methyl -173:sc= 0 (180deg=-0.0321) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 THR OG1 : rot -24:sc= 0.477 USER MOD Single : A 91 HIS : no HE2:sc= -0.592 K(o=-0.59,f=-3.6) USER MOD Single : A 94 ASN : amide:sc= -0.106 X(o=-0.11,f=0) USER MOD Single : A 101 CYS SG : rot 173:sc= 0.4 USER MOD Single : A 102 MET CE :methyl 176:sc=-0.00221 (180deg=-0.0175) USER MOD Single : A 104 SER OG : rot 83:sc= 0.322 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0.0156 USER MOD Single : A 122 TYR OH : rot 126:sc= 0.473 USER MOD Single : A 123 ASN : amide:sc= -0.0604 K(o=-0.06,f=-1.5) USER MOD Single : A 125 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 THR OG1 : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc= 0.158 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 10.013 -19.588 2.374 1.00 13.34 N ATOM 2 CA GLY A 1 10.039 -18.119 2.469 1.00 62.03 C ATOM 3 C GLY A 1 9.591 -17.645 3.835 1.00 65.42 C ATOM 4 O GLY A 1 9.207 -18.453 4.680 1.00 12.13 O ATOM 0 H1 GLY A 1 10.954 -19.935 2.097 1.00 13.34 H new ATOM 0 H2 GLY A 1 9.754 -19.991 3.297 1.00 13.34 H new ATOM 0 H3 GLY A 1 9.313 -19.877 1.661 1.00 13.34 H new ATOM 0 HA2 GLY A 1 11.048 -17.758 2.270 1.00 62.03 H new ATOM 0 HA3 GLY A 1 9.391 -17.692 1.704 1.00 62.03 H new ATOM 8 N SER A 2 9.697 -16.343 4.072 1.00 4.21 N ATOM 9 CA SER A 2 9.364 -15.706 5.336 1.00 55.05 C ATOM 10 C SER A 2 7.874 -15.336 5.353 1.00 13.53 C ATOM 11 O SER A 2 7.098 -15.749 4.480 1.00 1.32 O ATOM 12 CB SER A 2 10.303 -14.499 5.510 1.00 70.55 C ATOM 13 OG SER A 2 10.297 -14.007 6.833 1.00 24.12 O ATOM 0 H SER A 2 10.027 -15.683 3.367 1.00 4.21 H new ATOM 0 HA SER A 2 9.514 -16.374 6.184 1.00 55.05 H new ATOM 0 HB2 SER A 2 11.318 -14.787 5.236 1.00 70.55 H new ATOM 0 HB3 SER A 2 10.002 -13.705 4.827 1.00 70.55 H new ATOM 0 HG SER A 2 10.907 -13.243 6.901 1.00 24.12 H new ATOM 19 N HIS A 3 7.474 -14.547 6.347 1.00 51.04 N ATOM 20 CA HIS A 3 6.251 -13.763 6.360 1.00 14.14 C ATOM 21 C HIS A 3 6.614 -12.305 6.634 1.00 0.11 C ATOM 22 O HIS A 3 7.700 -12.009 7.147 1.00 74.44 O ATOM 23 CB HIS A 3 5.253 -14.324 7.377 1.00 65.42 C ATOM 24 CG HIS A 3 4.353 -15.396 6.819 1.00 64.00 C ATOM 25 ND1 HIS A 3 4.487 -16.052 5.612 1.00 54.44 N ATOM 26 CD2 HIS A 3 3.173 -15.796 7.377 1.00 21.21 C ATOM 27 CE1 HIS A 3 3.390 -16.800 5.425 1.00 60.33 C ATOM 28 NE2 HIS A 3 2.573 -16.692 6.486 1.00 71.30 N ATOM 0 H HIS A 3 8.020 -14.435 7.201 1.00 51.04 H new ATOM 0 HA HIS A 3 5.754 -13.819 5.391 1.00 14.14 H new ATOM 0 HB2 HIS A 3 5.803 -14.730 8.226 1.00 65.42 H new ATOM 0 HB3 HIS A 3 4.638 -13.508 7.757 1.00 65.42 H new ATOM 0 HD1 HIS A 3 5.280 -15.980 4.975 1.00 54.44 H new ATOM 0 HD2 HIS A 3 2.776 -15.479 8.330 1.00 21.21 H new ATOM 0 HE1 HIS A 3 3.192 -17.401 4.550 1.00 60.33 H new ATOM 36 N MET A 4 5.700 -11.412 6.265 1.00 72.41 N ATOM 37 CA MET A 4 5.859 -9.970 6.109 1.00 52.22 C ATOM 38 C MET A 4 7.132 -9.552 5.357 1.00 42.22 C ATOM 39 O MET A 4 7.814 -10.387 4.748 1.00 31.02 O ATOM 40 CB MET A 4 5.593 -9.216 7.425 1.00 0.41 C ATOM 41 CG MET A 4 6.717 -9.369 8.453 1.00 51.25 C ATOM 42 SD MET A 4 6.776 -8.085 9.733 1.00 43.24 S ATOM 43 CE MET A 4 5.085 -8.170 10.369 1.00 30.13 C ATOM 0 H MET A 4 4.747 -11.705 6.049 1.00 72.41 H new ATOM 0 HA MET A 4 5.072 -9.644 5.429 1.00 52.22 H new ATOM 0 HB2 MET A 4 5.453 -8.157 7.206 1.00 0.41 H new ATOM 0 HB3 MET A 4 4.661 -9.578 7.860 1.00 0.41 H new ATOM 0 HG2 MET A 4 6.613 -10.339 8.939 1.00 51.25 H new ATOM 0 HG3 MET A 4 7.671 -9.377 7.926 1.00 51.25 H new ATOM 0 HE1 MET A 4 5.003 -7.557 11.267 1.00 30.13 H new ATOM 0 HE2 MET A 4 4.393 -7.801 9.612 1.00 30.13 H new ATOM 0 HE3 MET A 4 4.839 -9.204 10.612 1.00 30.13 H new ATOM 53 N GLY A 5 7.411 -8.248 5.354 1.00 21.13 N ATOM 54 CA GLY A 5 8.481 -7.653 4.576 1.00 60.33 C ATOM 55 C GLY A 5 8.070 -7.505 3.119 1.00 54.05 C ATOM 56 O GLY A 5 6.899 -7.669 2.767 1.00 60.30 O ATOM 0 H GLY A 5 6.886 -7.569 5.905 1.00 21.13 H new ATOM 0 HA2 GLY A 5 8.737 -6.677 4.988 1.00 60.33 H new ATOM 0 HA3 GLY A 5 9.375 -8.272 4.645 1.00 60.33 H new ATOM 60 N THR A 6 9.032 -7.136 2.273 1.00 12.32 N ATOM 61 CA THR A 6 8.806 -7.116 0.841 1.00 75.50 C ATOM 62 C THR A 6 8.654 -8.558 0.334 1.00 1.50 C ATOM 63 O THR A 6 9.371 -9.450 0.794 1.00 72.10 O ATOM 64 CB THR A 6 9.912 -6.320 0.135 1.00 13.25 C ATOM 65 OG1 THR A 6 10.013 -5.045 0.753 1.00 15.01 O ATOM 66 CG2 THR A 6 9.589 -6.100 -1.345 1.00 60.04 C ATOM 0 H THR A 6 9.968 -6.850 2.559 1.00 12.32 H new ATOM 0 HA THR A 6 7.877 -6.597 0.605 1.00 75.50 H new ATOM 0 HB THR A 6 10.841 -6.884 0.212 1.00 13.25 H new ATOM 0 HG1 THR A 6 10.289 -4.380 0.088 1.00 15.01 H new ATOM 0 HG21 THR A 6 10.394 -5.533 -1.813 1.00 60.04 H new ATOM 0 HG22 THR A 6 9.488 -7.064 -1.843 1.00 60.04 H new ATOM 0 HG23 THR A 6 8.655 -5.546 -1.435 1.00 60.04 H new ATOM 74 N VAL A 7 7.738 -8.775 -0.614 1.00 3.42 N ATOM 75 CA VAL A 7 7.392 -10.055 -1.232 1.00 4.22 C ATOM 76 C VAL A 7 6.907 -9.820 -2.673 1.00 4.51 C ATOM 77 O VAL A 7 6.645 -8.675 -3.047 1.00 5.12 O ATOM 78 CB VAL A 7 6.292 -10.747 -0.413 1.00 3.21 C ATOM 79 CG1 VAL A 7 6.768 -11.217 0.963 1.00 64.30 C ATOM 80 CG2 VAL A 7 5.049 -9.858 -0.216 1.00 22.43 C ATOM 0 H VAL A 7 7.182 -8.009 -0.994 1.00 3.42 H new ATOM 0 HA VAL A 7 8.274 -10.695 -1.253 1.00 4.22 H new ATOM 0 HB VAL A 7 6.025 -11.619 -1.011 1.00 3.21 H new ATOM 0 HG11 VAL A 7 5.943 -11.697 1.489 1.00 64.30 H new ATOM 0 HG12 VAL A 7 7.584 -11.929 0.842 1.00 64.30 H new ATOM 0 HG13 VAL A 7 7.117 -10.360 1.540 1.00 64.30 H new ATOM 0 HG21 VAL A 7 4.305 -10.398 0.369 1.00 22.43 H new ATOM 0 HG22 VAL A 7 5.333 -8.947 0.310 1.00 22.43 H new ATOM 0 HG23 VAL A 7 4.629 -9.600 -1.188 1.00 22.43 H new ATOM 90 N SER A 8 6.723 -10.864 -3.488 1.00 64.51 N ATOM 91 CA SER A 8 6.123 -10.729 -4.816 1.00 74.11 C ATOM 92 C SER A 8 4.658 -11.141 -4.711 1.00 32.50 C ATOM 93 O SER A 8 4.271 -12.275 -5.019 1.00 73.45 O ATOM 94 CB SER A 8 6.923 -11.489 -5.879 1.00 11.21 C ATOM 95 OG SER A 8 7.221 -12.811 -5.478 1.00 30.44 O ATOM 0 H SER A 8 6.984 -11.820 -3.246 1.00 64.51 H new ATOM 0 HA SER A 8 6.157 -9.694 -5.157 1.00 74.11 H new ATOM 0 HB2 SER A 8 6.357 -11.512 -6.810 1.00 11.21 H new ATOM 0 HB3 SER A 8 7.851 -10.955 -6.084 1.00 11.21 H new ATOM 0 HG SER A 8 6.401 -13.254 -5.175 1.00 30.44 H new ATOM 101 N TRP A 9 3.832 -10.231 -4.199 1.00 62.52 N ATOM 102 CA TRP A 9 2.394 -10.415 -4.091 1.00 34.43 C ATOM 103 C TRP A 9 1.756 -9.612 -5.204 1.00 53.32 C ATOM 104 O TRP A 9 1.956 -8.401 -5.278 1.00 23.34 O ATOM 105 CB TRP A 9 1.902 -10.002 -2.700 1.00 54.24 C ATOM 106 CG TRP A 9 2.159 -11.001 -1.615 1.00 64.44 C ATOM 107 CD1 TRP A 9 2.949 -12.092 -1.719 1.00 43.11 C ATOM 108 CD2 TRP A 9 1.606 -11.052 -0.268 1.00 12.10 C ATOM 109 NE1 TRP A 9 2.946 -12.797 -0.541 1.00 0.45 N ATOM 110 CE2 TRP A 9 2.104 -12.220 0.386 1.00 50.12 C ATOM 111 CE3 TRP A 9 0.738 -10.222 0.468 1.00 13.24 C ATOM 112 CZ2 TRP A 9 1.741 -12.553 1.699 1.00 21.51 C ATOM 113 CZ3 TRP A 9 0.368 -10.548 1.784 1.00 35.41 C ATOM 114 CH2 TRP A 9 0.856 -11.715 2.398 1.00 20.55 C ATOM 0 H TRP A 9 4.153 -9.331 -3.843 1.00 62.52 H new ATOM 0 HA TRP A 9 2.115 -11.463 -4.202 1.00 34.43 H new ATOM 0 HB2 TRP A 9 2.379 -9.061 -2.427 1.00 54.24 H new ATOM 0 HB3 TRP A 9 0.830 -9.812 -2.752 1.00 54.24 H new ATOM 0 HD1 TRP A 9 3.504 -12.370 -2.603 1.00 43.11 H new ATOM 0 HE1 TRP A 9 3.496 -13.639 -0.373 1.00 0.45 H new ATOM 0 HE3 TRP A 9 0.351 -9.322 0.014 1.00 13.24 H new ATOM 0 HZ2 TRP A 9 2.137 -13.442 2.167 1.00 21.51 H new ATOM 0 HZ3 TRP A 9 -0.298 -9.896 2.329 1.00 35.41 H new ATOM 0 HH2 TRP A 9 0.552 -11.966 3.403 1.00 20.55 H new ATOM 125 N ASN A 10 1.023 -10.295 -6.085 1.00 62.22 N ATOM 126 CA ASN A 10 0.270 -9.609 -7.125 1.00 65.45 C ATOM 127 C ASN A 10 -0.917 -8.898 -6.480 1.00 31.45 C ATOM 128 O ASN A 10 -1.217 -9.113 -5.303 1.00 74.33 O ATOM 129 CB ASN A 10 -0.198 -10.583 -8.224 1.00 1.33 C ATOM 130 CG ASN A 10 -1.454 -11.364 -7.840 1.00 13.00 C ATOM 131 OD1 ASN A 10 -1.460 -12.142 -6.897 1.00 71.34 O ATOM 132 ND2 ASN A 10 -2.567 -11.165 -8.518 1.00 75.51 N ATOM 0 H ASN A 10 0.938 -11.311 -6.096 1.00 62.22 H new ATOM 0 HA ASN A 10 0.916 -8.878 -7.611 1.00 65.45 H new ATOM 0 HB2 ASN A 10 -0.392 -10.023 -9.139 1.00 1.33 H new ATOM 0 HB3 ASN A 10 0.606 -11.285 -8.444 1.00 1.33 H new ATOM 0 HD21 ASN A 10 -3.420 -11.658 -8.254 1.00 75.51 H new ATOM 0 HD22 ASN A 10 -2.575 -10.518 -9.307 1.00 75.51 H new ATOM 139 N LEU A 11 -1.648 -8.133 -7.288 1.00 13.12 N ATOM 140 CA LEU A 11 -2.838 -7.395 -6.883 1.00 32.32 C ATOM 141 C LEU A 11 -3.757 -8.257 -6.014 1.00 61.22 C ATOM 142 O LEU A 11 -4.115 -7.829 -4.915 1.00 54.52 O ATOM 143 CB LEU A 11 -3.513 -6.864 -8.157 1.00 31.42 C ATOM 144 CG LEU A 11 -4.938 -6.295 -8.019 1.00 31.10 C ATOM 145 CD1 LEU A 11 -5.118 -5.263 -6.902 1.00 41.51 C ATOM 146 CD2 LEU A 11 -5.285 -5.634 -9.355 1.00 70.44 C ATOM 0 H LEU A 11 -1.419 -8.007 -8.274 1.00 13.12 H new ATOM 0 HA LEU A 11 -2.576 -6.547 -6.251 1.00 32.32 H new ATOM 0 HB2 LEU A 11 -2.877 -6.083 -8.575 1.00 31.42 H new ATOM 0 HB3 LEU A 11 -3.543 -7.674 -8.885 1.00 31.42 H new ATOM 0 HG LEU A 11 -5.593 -7.126 -7.756 1.00 31.10 H new ATOM 0 HD11 LEU A 11 -6.153 -4.922 -6.885 1.00 41.51 H new ATOM 0 HD12 LEU A 11 -4.870 -5.718 -5.943 1.00 41.51 H new ATOM 0 HD13 LEU A 11 -4.459 -4.413 -7.082 1.00 41.51 H new ATOM 0 HD21 LEU A 11 -6.290 -5.215 -9.304 1.00 70.44 H new ATOM 0 HD22 LEU A 11 -4.570 -4.838 -9.563 1.00 70.44 H new ATOM 0 HD23 LEU A 11 -5.242 -6.378 -10.151 1.00 70.44 H new ATOM 158 N ARG A 12 -4.109 -9.467 -6.461 1.00 61.31 N ATOM 159 CA ARG A 12 -4.990 -10.340 -5.694 1.00 4.15 C ATOM 160 C ARG A 12 -4.331 -10.971 -4.479 1.00 64.30 C ATOM 161 O ARG A 12 -5.048 -11.144 -3.506 1.00 70.21 O ATOM 162 CB ARG A 12 -5.612 -11.446 -6.546 1.00 35.14 C ATOM 163 CG ARG A 12 -6.835 -10.948 -7.310 1.00 13.24 C ATOM 164 CD ARG A 12 -7.433 -12.128 -8.079 1.00 71.22 C ATOM 165 NE ARG A 12 -8.549 -11.744 -8.958 1.00 23.03 N ATOM 166 CZ ARG A 12 -9.289 -12.619 -9.648 1.00 4.41 C ATOM 167 NH1 ARG A 12 -9.048 -13.923 -9.562 1.00 53.45 N ATOM 168 NH2 ARG A 12 -10.268 -12.199 -10.436 1.00 15.41 N ATOM 0 H ARG A 12 -3.796 -9.859 -7.349 1.00 61.31 H new ATOM 0 HA ARG A 12 -5.773 -9.669 -5.342 1.00 4.15 H new ATOM 0 HB2 ARG A 12 -4.871 -11.823 -7.251 1.00 35.14 H new ATOM 0 HB3 ARG A 12 -5.897 -12.281 -5.907 1.00 35.14 H new ATOM 0 HG2 ARG A 12 -7.570 -10.532 -6.621 1.00 13.24 H new ATOM 0 HG3 ARG A 12 -6.555 -10.150 -7.997 1.00 13.24 H new ATOM 0 HD2 ARG A 12 -6.652 -12.596 -8.678 1.00 71.22 H new ATOM 0 HD3 ARG A 12 -7.781 -12.877 -7.368 1.00 71.22 H new ATOM 0 HE ARG A 12 -8.771 -10.752 -9.046 1.00 23.03 H new ATOM 0 HH11 ARG A 12 -8.294 -14.264 -8.966 1.00 53.45 H new ATOM 0 HH12 ARG A 12 -9.617 -14.583 -10.092 1.00 53.45 H new ATOM 0 HH21 ARG A 12 -10.462 -11.201 -10.520 1.00 15.41 H new ATOM 0 HH22 ARG A 12 -10.827 -12.873 -10.958 1.00 15.41 H new ATOM 182 N GLU A 13 -3.038 -11.308 -4.494 1.00 44.14 N ATOM 183 CA GLU A 13 -2.390 -11.909 -3.322 1.00 43.44 C ATOM 184 C GLU A 13 -2.624 -11.023 -2.094 1.00 64.40 C ATOM 185 O GLU A 13 -3.053 -11.501 -1.043 1.00 52.52 O ATOM 186 CB GLU A 13 -0.876 -12.130 -3.507 1.00 32.42 C ATOM 187 CG GLU A 13 -0.452 -13.489 -4.074 1.00 30.41 C ATOM 188 CD GLU A 13 -1.065 -14.650 -3.285 1.00 2.12 C ATOM 189 OE1 GLU A 13 -0.788 -14.757 -2.067 1.00 21.51 O ATOM 190 OE2 GLU A 13 -1.842 -15.424 -3.891 1.00 11.41 O ATOM 0 H GLU A 13 -2.423 -11.177 -5.297 1.00 44.14 H new ATOM 0 HA GLU A 13 -2.842 -12.892 -3.186 1.00 43.44 H new ATOM 0 HB2 GLU A 13 -0.495 -11.350 -4.166 1.00 32.42 H new ATOM 0 HB3 GLU A 13 -0.390 -11.996 -2.541 1.00 32.42 H new ATOM 0 HG2 GLU A 13 -0.756 -13.558 -5.118 1.00 30.41 H new ATOM 0 HG3 GLU A 13 0.635 -13.569 -4.053 1.00 30.41 H new ATOM 197 N MET A 14 -2.366 -9.725 -2.256 1.00 32.02 N ATOM 198 CA MET A 14 -2.523 -8.719 -1.214 1.00 75.10 C ATOM 199 C MET A 14 -3.997 -8.574 -0.842 1.00 2.21 C ATOM 200 O MET A 14 -4.354 -8.588 0.338 1.00 65.45 O ATOM 201 CB MET A 14 -2.004 -7.364 -1.716 1.00 72.44 C ATOM 202 CG MET A 14 -0.629 -7.427 -2.381 1.00 63.43 C ATOM 203 SD MET A 14 -0.121 -5.872 -3.129 1.00 41.42 S ATOM 204 CE MET A 14 0.568 -5.104 -1.653 1.00 34.44 C ATOM 0 H MET A 14 -2.034 -9.338 -3.139 1.00 32.02 H new ATOM 0 HA MET A 14 -1.954 -9.033 -0.339 1.00 75.10 H new ATOM 0 HB2 MET A 14 -2.721 -6.954 -2.427 1.00 72.44 H new ATOM 0 HB3 MET A 14 -1.957 -6.671 -0.876 1.00 72.44 H new ATOM 0 HG2 MET A 14 0.112 -7.723 -1.638 1.00 63.43 H new ATOM 0 HG3 MET A 14 -0.640 -8.203 -3.147 1.00 63.43 H new ATOM 0 HE1 MET A 14 1.461 -4.539 -1.920 1.00 34.44 H new ATOM 0 HE2 MET A 14 -0.169 -4.431 -1.215 1.00 34.44 H new ATOM 0 HE3 MET A 14 0.830 -5.876 -0.930 1.00 34.44 H new ATOM 214 N LEU A 15 -4.839 -8.410 -1.867 1.00 14.43 N ATOM 215 CA LEU A 15 -6.254 -8.117 -1.725 1.00 31.42 C ATOM 216 C LEU A 15 -6.960 -9.240 -0.967 1.00 12.03 C ATOM 217 O LEU A 15 -7.797 -8.955 -0.113 1.00 64.14 O ATOM 218 CB LEU A 15 -6.863 -7.916 -3.121 1.00 0.41 C ATOM 219 CG LEU A 15 -8.282 -7.344 -3.039 1.00 63.31 C ATOM 220 CD1 LEU A 15 -8.296 -5.815 -2.917 1.00 33.21 C ATOM 221 CD2 LEU A 15 -9.106 -7.687 -4.263 1.00 43.41 C ATOM 0 H LEU A 15 -4.540 -8.481 -2.840 1.00 14.43 H new ATOM 0 HA LEU A 15 -6.386 -7.203 -1.146 1.00 31.42 H new ATOM 0 HB2 LEU A 15 -6.231 -7.243 -3.701 1.00 0.41 H new ATOM 0 HB3 LEU A 15 -6.884 -8.869 -3.650 1.00 0.41 H new ATOM 0 HG LEU A 15 -8.709 -7.798 -2.145 1.00 63.31 H new ATOM 0 HD11 LEU A 15 -9.326 -5.464 -2.863 1.00 33.21 H new ATOM 0 HD12 LEU A 15 -7.763 -5.517 -2.014 1.00 33.21 H new ATOM 0 HD13 LEU A 15 -7.809 -5.376 -3.788 1.00 33.21 H new ATOM 0 HD21 LEU A 15 -10.104 -7.261 -4.161 1.00 43.41 H new ATOM 0 HD22 LEU A 15 -8.626 -7.277 -5.151 1.00 43.41 H new ATOM 0 HD23 LEU A 15 -9.182 -8.770 -4.359 1.00 43.41 H new ATOM 233 N ALA A 16 -6.627 -10.489 -1.287 1.00 24.42 N ATOM 234 CA ALA A 16 -7.166 -11.696 -0.692 1.00 24.13 C ATOM 235 C ALA A 16 -6.693 -11.831 0.753 1.00 2.23 C ATOM 236 O ALA A 16 -7.518 -12.069 1.631 1.00 4.22 O ATOM 237 CB ALA A 16 -6.727 -12.892 -1.539 1.00 11.34 C ATOM 0 H ALA A 16 -5.935 -10.690 -2.009 1.00 24.42 H new ATOM 0 HA ALA A 16 -8.255 -11.654 -0.672 1.00 24.13 H new ATOM 0 HB1 ALA A 16 -7.124 -13.810 -1.106 1.00 11.34 H new ATOM 0 HB2 ALA A 16 -7.105 -12.777 -2.555 1.00 11.34 H new ATOM 0 HB3 ALA A 16 -5.638 -12.942 -1.561 1.00 11.34 H new ATOM 243 N HIS A 17 -5.400 -11.612 1.029 1.00 55.12 N ATOM 244 CA HIS A 17 -4.881 -11.622 2.396 1.00 33.05 C ATOM 245 C HIS A 17 -5.662 -10.611 3.246 1.00 13.21 C ATOM 246 O HIS A 17 -6.104 -10.924 4.348 1.00 62.11 O ATOM 247 CB HIS A 17 -3.365 -11.349 2.391 1.00 4.22 C ATOM 248 CG HIS A 17 -2.686 -11.413 3.743 1.00 1.13 C ATOM 249 ND1 HIS A 17 -2.598 -12.509 4.572 1.00 31.50 N ATOM 250 CD2 HIS A 17 -1.972 -10.406 4.339 1.00 75.22 C ATOM 251 CE1 HIS A 17 -1.861 -12.169 5.639 1.00 62.05 C ATOM 252 NE2 HIS A 17 -1.477 -10.881 5.562 1.00 2.32 N ATOM 0 H HIS A 17 -4.694 -11.425 0.317 1.00 55.12 H new ATOM 0 HA HIS A 17 -5.021 -12.606 2.844 1.00 33.05 H new ATOM 0 HB2 HIS A 17 -2.886 -12.070 1.729 1.00 4.22 H new ATOM 0 HB3 HIS A 17 -3.193 -10.361 1.964 1.00 4.22 H new ATOM 0 HD2 HIS A 17 -1.817 -9.416 3.936 1.00 75.22 H new ATOM 0 HE1 HIS A 17 -1.610 -12.837 6.450 1.00 62.05 H new ATOM 0 HE2 HIS A 17 -0.937 -10.358 6.252 1.00 2.32 H new ATOM 260 N ALA A 18 -5.879 -9.386 2.754 1.00 23.53 N ATOM 261 CA ALA A 18 -6.643 -8.352 3.442 1.00 1.03 C ATOM 262 C ALA A 18 -8.152 -8.637 3.458 1.00 12.21 C ATOM 263 O ALA A 18 -8.823 -8.119 4.351 1.00 64.24 O ATOM 264 CB ALA A 18 -6.328 -7.010 2.776 1.00 23.41 C ATOM 0 H ALA A 18 -5.519 -9.085 1.848 1.00 23.53 H new ATOM 0 HA ALA A 18 -6.347 -8.331 4.491 1.00 1.03 H new ATOM 0 HB1 ALA A 18 -6.888 -6.217 3.272 1.00 23.41 H new ATOM 0 HB2 ALA A 18 -5.260 -6.806 2.856 1.00 23.41 H new ATOM 0 HB3 ALA A 18 -6.611 -7.050 1.724 1.00 23.41 H new ATOM 270 N GLU A 19 -8.705 -9.448 2.547 1.00 2.43 N ATOM 271 CA GLU A 19 -10.085 -9.909 2.650 1.00 63.12 C ATOM 272 C GLU A 19 -10.210 -10.861 3.837 1.00 55.14 C ATOM 273 O GLU A 19 -11.147 -10.747 4.633 1.00 73.15 O ATOM 274 CB GLU A 19 -10.599 -10.568 1.351 1.00 10.55 C ATOM 275 CG GLU A 19 -11.270 -9.565 0.406 1.00 63.50 C ATOM 276 CD GLU A 19 -12.265 -10.208 -0.563 1.00 43.40 C ATOM 277 OE1 GLU A 19 -11.858 -10.735 -1.621 1.00 3.20 O ATOM 278 OE2 GLU A 19 -13.494 -10.095 -0.342 1.00 11.53 O ATOM 0 H GLU A 19 -8.209 -9.797 1.727 1.00 2.43 H new ATOM 0 HA GLU A 19 -10.717 -9.036 2.810 1.00 63.12 H new ATOM 0 HB2 GLU A 19 -9.765 -11.045 0.836 1.00 10.55 H new ATOM 0 HB3 GLU A 19 -11.310 -11.355 1.604 1.00 10.55 H new ATOM 0 HG2 GLU A 19 -11.788 -8.811 0.998 1.00 63.50 H new ATOM 0 HG3 GLU A 19 -10.501 -9.047 -0.167 1.00 63.50 H new ATOM 285 N GLU A 20 -9.246 -11.769 3.970 1.00 40.23 N ATOM 286 CA GLU A 20 -9.190 -12.774 5.014 1.00 62.21 C ATOM 287 C GLU A 20 -9.004 -12.144 6.403 1.00 20.33 C ATOM 288 O GLU A 20 -9.512 -12.668 7.396 1.00 21.22 O ATOM 289 CB GLU A 20 -8.032 -13.723 4.659 1.00 30.31 C ATOM 290 CG GLU A 20 -8.062 -15.030 5.450 1.00 72.44 C ATOM 291 CD GLU A 20 -9.298 -15.877 5.149 1.00 13.31 C ATOM 292 OE1 GLU A 20 -9.877 -15.746 4.043 1.00 41.40 O ATOM 293 OE2 GLU A 20 -9.663 -16.689 6.028 1.00 20.33 O ATOM 0 H GLU A 20 -8.456 -11.822 3.327 1.00 40.23 H new ATOM 0 HA GLU A 20 -10.131 -13.322 5.067 1.00 62.21 H new ATOM 0 HB2 GLU A 20 -8.070 -13.950 3.593 1.00 30.31 H new ATOM 0 HB3 GLU A 20 -7.085 -13.216 4.844 1.00 30.31 H new ATOM 0 HG2 GLU A 20 -7.167 -15.608 5.221 1.00 72.44 H new ATOM 0 HG3 GLU A 20 -8.032 -14.805 6.516 1.00 72.44 H new ATOM 300 N THR A 21 -8.304 -11.012 6.491 1.00 30.11 N ATOM 301 CA THR A 21 -7.737 -10.473 7.726 1.00 62.13 C ATOM 302 C THR A 21 -8.290 -9.075 8.043 1.00 61.23 C ATOM 303 O THR A 21 -9.367 -8.704 7.577 1.00 32.25 O ATOM 304 CB THR A 21 -6.202 -10.583 7.698 1.00 44.51 C ATOM 305 OG1 THR A 21 -5.651 -9.841 6.634 1.00 24.23 O ATOM 306 CG2 THR A 21 -5.737 -12.033 7.561 1.00 11.20 C ATOM 0 H THR A 21 -8.110 -10.427 5.678 1.00 30.11 H new ATOM 0 HA THR A 21 -8.059 -11.079 8.573 1.00 62.13 H new ATOM 0 HB THR A 21 -5.854 -10.180 8.649 1.00 44.51 H new ATOM 0 HG1 THR A 21 -5.514 -10.429 5.862 1.00 24.23 H new ATOM 0 HG21 THR A 21 -4.648 -12.066 7.545 1.00 11.20 H new ATOM 0 HG22 THR A 21 -6.105 -12.615 8.406 1.00 11.20 H new ATOM 0 HG23 THR A 21 -6.126 -12.454 6.634 1.00 11.20 H new ATOM 314 N ARG A 22 -7.618 -8.346 8.941 1.00 24.11 N ATOM 315 CA ARG A 22 -8.002 -7.020 9.436 1.00 1.31 C ATOM 316 C ARG A 22 -6.867 -6.004 9.248 1.00 13.32 C ATOM 317 O ARG A 22 -6.853 -4.972 9.920 1.00 13.31 O ATOM 318 CB ARG A 22 -8.435 -7.069 10.915 1.00 3.23 C ATOM 319 CG ARG A 22 -9.628 -7.974 11.247 1.00 52.32 C ATOM 320 CD ARG A 22 -9.272 -9.461 11.320 1.00 14.33 C ATOM 321 NE ARG A 22 -9.875 -10.096 12.503 1.00 71.21 N ATOM 322 CZ ARG A 22 -10.397 -11.325 12.575 1.00 51.51 C ATOM 323 NH1 ARG A 22 -10.458 -12.097 11.496 1.00 42.20 N ATOM 324 NH2 ARG A 22 -10.860 -11.777 13.734 1.00 71.20 N ATOM 0 H ARG A 22 -6.751 -8.680 9.362 1.00 24.11 H new ATOM 0 HA ARG A 22 -8.857 -6.695 8.843 1.00 1.31 H new ATOM 0 HB2 ARG A 22 -7.582 -7.396 11.510 1.00 3.23 H new ATOM 0 HB3 ARG A 22 -8.676 -6.055 11.234 1.00 3.23 H new ATOM 0 HG2 ARG A 22 -10.053 -7.664 12.202 1.00 52.32 H new ATOM 0 HG3 ARG A 22 -10.402 -7.831 10.493 1.00 52.32 H new ATOM 0 HD2 ARG A 22 -9.618 -9.965 10.418 1.00 14.33 H new ATOM 0 HD3 ARG A 22 -8.189 -9.577 11.354 1.00 14.33 H new ATOM 0 HE ARG A 22 -9.897 -9.540 13.358 1.00 71.21 H new ATOM 0 HH11 ARG A 22 -10.105 -11.754 10.603 1.00 42.20 H new ATOM 0 HH12 ARG A 22 -10.858 -13.033 11.561 1.00 42.20 H new ATOM 0 HH21 ARG A 22 -10.817 -11.187 14.565 1.00 71.20 H new ATOM 0 HH22 ARG A 22 -11.259 -12.714 13.793 1.00 71.20 H new ATOM 338 N LYS A 23 -5.845 -6.326 8.451 1.00 34.14 N ATOM 339 CA LYS A 23 -4.737 -5.419 8.173 1.00 40.43 C ATOM 340 C LYS A 23 -5.262 -4.205 7.414 1.00 52.13 C ATOM 341 O LYS A 23 -6.279 -4.280 6.718 1.00 3.10 O ATOM 342 CB LYS A 23 -3.693 -6.128 7.304 1.00 4.11 C ATOM 343 CG LYS A 23 -2.714 -7.005 8.099 1.00 22.11 C ATOM 344 CD LYS A 23 -3.177 -8.458 8.207 1.00 23.24 C ATOM 345 CE LYS A 23 -2.088 -9.365 8.780 1.00 34.53 C ATOM 346 NZ LYS A 23 -2.391 -10.782 8.502 1.00 30.20 N ATOM 0 H LYS A 23 -5.766 -7.227 7.980 1.00 34.14 H new ATOM 0 HA LYS A 23 -4.282 -5.109 9.114 1.00 40.43 H new ATOM 0 HB2 LYS A 23 -4.207 -6.748 6.569 1.00 4.11 H new ATOM 0 HB3 LYS A 23 -3.127 -5.379 6.750 1.00 4.11 H new ATOM 0 HG2 LYS A 23 -1.735 -6.975 7.621 1.00 22.11 H new ATOM 0 HG3 LYS A 23 -2.593 -6.591 9.100 1.00 22.11 H new ATOM 0 HD2 LYS A 23 -4.063 -8.510 8.840 1.00 23.24 H new ATOM 0 HD3 LYS A 23 -3.469 -8.820 7.221 1.00 23.24 H new ATOM 0 HE2 LYS A 23 -1.123 -9.102 8.346 1.00 34.53 H new ATOM 0 HE3 LYS A 23 -2.007 -9.209 9.856 1.00 34.53 H new ATOM 0 HZ1 LYS A 23 -1.504 -11.303 8.348 1.00 30.20 H new ATOM 0 HZ2 LYS A 23 -2.898 -11.194 9.311 1.00 30.20 H new ATOM 0 HZ3 LYS A 23 -2.985 -10.850 7.651 1.00 30.20 H new ATOM 360 N LEU A 24 -4.516 -3.106 7.470 1.00 61.43 N ATOM 361 CA LEU A 24 -4.765 -1.976 6.588 1.00 31.40 C ATOM 362 C LEU A 24 -4.282 -2.337 5.183 1.00 63.13 C ATOM 363 O LEU A 24 -3.258 -3.013 5.038 1.00 61.51 O ATOM 364 CB LEU A 24 -3.981 -0.761 7.091 1.00 53.13 C ATOM 365 CG LEU A 24 -4.559 0.560 6.549 1.00 32.20 C ATOM 366 CD1 LEU A 24 -5.645 1.069 7.486 1.00 11.40 C ATOM 367 CD2 LEU A 24 -3.496 1.644 6.461 1.00 2.43 C ATOM 0 H LEU A 24 -3.737 -2.976 8.115 1.00 61.43 H new ATOM 0 HA LEU A 24 -5.830 -1.742 6.571 1.00 31.40 H new ATOM 0 HB2 LEU A 24 -3.997 -0.744 8.181 1.00 53.13 H new ATOM 0 HB3 LEU A 24 -2.938 -0.852 6.789 1.00 53.13 H new ATOM 0 HG LEU A 24 -4.953 0.353 5.554 1.00 32.20 H new ATOM 0 HD11 LEU A 24 -6.051 2.004 7.099 1.00 11.40 H new ATOM 0 HD12 LEU A 24 -6.442 0.328 7.556 1.00 11.40 H new ATOM 0 HD13 LEU A 24 -5.221 1.240 8.475 1.00 11.40 H new ATOM 0 HD21 LEU A 24 -3.942 2.560 6.075 1.00 2.43 H new ATOM 0 HD22 LEU A 24 -3.084 1.831 7.453 1.00 2.43 H new ATOM 0 HD23 LEU A 24 -2.699 1.319 5.793 1.00 2.43 H new ATOM 379 N MET A 25 -4.923 -1.795 4.150 1.00 61.31 N ATOM 380 CA MET A 25 -4.488 -1.955 2.767 1.00 65.03 C ATOM 381 C MET A 25 -4.609 -0.603 2.048 1.00 12.43 C ATOM 382 O MET A 25 -5.635 -0.323 1.434 1.00 2.33 O ATOM 383 CB MET A 25 -5.267 -3.110 2.117 1.00 23.12 C ATOM 384 CG MET A 25 -4.838 -3.339 0.666 1.00 11.14 C ATOM 385 SD MET A 25 -5.562 -4.811 -0.094 1.00 33.33 S ATOM 386 CE MET A 25 -4.885 -4.608 -1.756 1.00 71.10 C ATOM 0 H MET A 25 -5.765 -1.228 4.251 1.00 61.31 H new ATOM 0 HA MET A 25 -3.438 -2.239 2.699 1.00 65.03 H new ATOM 0 HB2 MET A 25 -5.109 -4.023 2.691 1.00 23.12 H new ATOM 0 HB3 MET A 25 -6.335 -2.893 2.150 1.00 23.12 H new ATOM 0 HG2 MET A 25 -5.113 -2.465 0.075 1.00 11.14 H new ATOM 0 HG3 MET A 25 -3.752 -3.421 0.628 1.00 11.14 H new ATOM 0 HE1 MET A 25 -5.221 -5.430 -2.389 1.00 71.10 H new ATOM 0 HE2 MET A 25 -5.229 -3.663 -2.176 1.00 71.10 H new ATOM 0 HE3 MET A 25 -3.796 -4.609 -1.708 1.00 71.10 H new ATOM 396 N PRO A 26 -3.616 0.295 2.174 1.00 14.43 N ATOM 397 CA PRO A 26 -3.703 1.629 1.588 1.00 22.44 C ATOM 398 C PRO A 26 -3.434 1.650 0.075 1.00 15.11 C ATOM 399 O PRO A 26 -2.626 0.856 -0.416 1.00 63.51 O ATOM 400 CB PRO A 26 -2.677 2.467 2.344 1.00 4.32 C ATOM 401 CG PRO A 26 -1.650 1.462 2.855 1.00 75.44 C ATOM 402 CD PRO A 26 -2.467 0.184 3.054 1.00 41.11 C ATOM 0 HA PRO A 26 -4.716 2.021 1.685 1.00 22.44 H new ATOM 0 HB2 PRO A 26 -2.214 3.208 1.692 1.00 4.32 H new ATOM 0 HB3 PRO A 26 -3.140 3.011 3.167 1.00 4.32 H new ATOM 0 HG2 PRO A 26 -0.842 1.314 2.138 1.00 75.44 H new ATOM 0 HG3 PRO A 26 -1.192 1.795 3.787 1.00 75.44 H new ATOM 0 HD2 PRO A 26 -1.875 -0.698 2.811 1.00 41.11 H new ATOM 0 HD3 PRO A 26 -2.781 0.081 4.093 1.00 41.11 H new ATOM 410 N ILE A 27 -4.035 2.609 -0.649 1.00 74.54 N ATOM 411 CA ILE A 27 -4.121 2.696 -2.120 1.00 63.14 C ATOM 412 C ILE A 27 -3.971 4.175 -2.555 1.00 1.12 C ATOM 413 O ILE A 27 -4.330 5.070 -1.780 1.00 15.24 O ATOM 414 CB ILE A 27 -5.500 2.108 -2.534 1.00 0.42 C ATOM 415 CG1 ILE A 27 -5.631 0.589 -2.242 1.00 23.01 C ATOM 416 CG2 ILE A 27 -5.873 2.352 -4.009 1.00 24.24 C ATOM 417 CD1 ILE A 27 -6.945 0.242 -1.539 1.00 14.14 C ATOM 0 H ILE A 27 -4.503 3.394 -0.196 1.00 74.54 H new ATOM 0 HA ILE A 27 -3.326 2.133 -2.609 1.00 63.14 H new ATOM 0 HB ILE A 27 -6.199 2.660 -1.906 1.00 0.42 H new ATOM 0 HG12 ILE A 27 -5.565 0.035 -3.178 1.00 23.01 H new ATOM 0 HG13 ILE A 27 -4.794 0.267 -1.622 1.00 23.01 H new ATOM 0 HG21 ILE A 27 -6.848 1.911 -4.216 1.00 24.24 H new ATOM 0 HG22 ILE A 27 -5.912 3.424 -4.202 1.00 24.24 H new ATOM 0 HG23 ILE A 27 -5.123 1.894 -4.654 1.00 24.24 H new ATOM 0 HD11 ILE A 27 -6.988 -0.832 -1.357 1.00 14.14 H new ATOM 0 HD12 ILE A 27 -7.001 0.773 -0.589 1.00 14.14 H new ATOM 0 HD13 ILE A 27 -7.784 0.537 -2.169 1.00 14.14 H new ATOM 429 N CYS A 28 -3.519 4.468 -3.781 1.00 51.33 N ATOM 430 CA CYS A 28 -3.410 5.834 -4.322 1.00 14.03 C ATOM 431 C CYS A 28 -4.487 6.119 -5.375 1.00 22.31 C ATOM 432 O CYS A 28 -4.793 5.283 -6.221 1.00 3.12 O ATOM 433 CB CYS A 28 -2.037 6.077 -4.951 1.00 50.11 C ATOM 434 SG CYS A 28 -0.782 6.281 -3.667 1.00 74.24 S ATOM 0 H CYS A 28 -3.213 3.751 -4.439 1.00 51.33 H new ATOM 0 HA CYS A 28 -3.550 6.508 -3.477 1.00 14.03 H new ATOM 0 HB2 CYS A 28 -1.773 5.240 -5.597 1.00 50.11 H new ATOM 0 HB3 CYS A 28 -2.071 6.967 -5.580 1.00 50.11 H new ATOM 0 HG CYS A 28 0.365 5.860 -4.110 1.00 74.24 H new ATOM 440 N MET A 29 -4.995 7.352 -5.379 1.00 41.25 N ATOM 441 CA MET A 29 -6.167 7.780 -6.141 1.00 55.44 C ATOM 442 C MET A 29 -5.791 8.189 -7.568 1.00 40.14 C ATOM 443 O MET A 29 -6.655 8.575 -8.357 1.00 13.13 O ATOM 444 CB MET A 29 -6.843 8.934 -5.376 1.00 73.23 C ATOM 445 CG MET A 29 -8.332 9.097 -5.689 1.00 24.33 C ATOM 446 SD MET A 29 -9.181 10.327 -4.656 1.00 2.35 S ATOM 447 CE MET A 29 -8.937 9.631 -2.994 1.00 11.41 C ATOM 0 H MET A 29 -4.585 8.108 -4.830 1.00 41.25 H new ATOM 0 HA MET A 29 -6.866 6.949 -6.240 1.00 55.44 H new ATOM 0 HB2 MET A 29 -6.723 8.767 -4.306 1.00 73.23 H new ATOM 0 HB3 MET A 29 -6.328 9.865 -5.613 1.00 73.23 H new ATOM 0 HG2 MET A 29 -8.443 9.380 -6.736 1.00 24.33 H new ATOM 0 HG3 MET A 29 -8.825 8.133 -5.565 1.00 24.33 H new ATOM 0 HE1 MET A 29 -9.663 10.066 -2.307 1.00 11.41 H new ATOM 0 HE2 MET A 29 -9.073 8.550 -3.029 1.00 11.41 H new ATOM 0 HE3 MET A 29 -7.929 9.859 -2.648 1.00 11.41 H new ATOM 457 N ASP A 30 -4.498 8.148 -7.893 1.00 74.21 N ATOM 458 CA ASP A 30 -3.978 8.281 -9.252 1.00 64.13 C ATOM 459 C ASP A 30 -3.783 6.914 -9.900 1.00 13.21 C ATOM 460 O ASP A 30 -3.574 6.820 -11.112 1.00 21.22 O ATOM 461 CB ASP A 30 -2.655 9.057 -9.233 1.00 63.04 C ATOM 462 CG ASP A 30 -2.332 9.603 -10.626 1.00 24.33 C ATOM 463 OD1 ASP A 30 -2.953 10.629 -10.988 1.00 72.15 O ATOM 464 OD2 ASP A 30 -1.485 9.025 -11.336 1.00 55.12 O ATOM 0 H ASP A 30 -3.764 8.018 -7.197 1.00 74.21 H new ATOM 0 HA ASP A 30 -4.706 8.833 -9.846 1.00 64.13 H new ATOM 0 HB2 ASP A 30 -2.719 9.879 -8.520 1.00 63.04 H new ATOM 0 HB3 ASP A 30 -1.849 8.405 -8.896 1.00 63.04 H new ATOM 469 N VAL A 31 -3.887 5.838 -9.119 1.00 33.22 N ATOM 470 CA VAL A 31 -3.470 4.527 -9.556 1.00 3.22 C ATOM 471 C VAL A 31 -4.707 3.716 -9.913 1.00 51.34 C ATOM 472 O VAL A 31 -5.171 2.870 -9.146 1.00 72.43 O ATOM 473 CB VAL A 31 -2.535 3.888 -8.507 1.00 70.25 C ATOM 474 CG1 VAL A 31 -2.032 2.527 -8.993 1.00 2.21 C ATOM 475 CG2 VAL A 31 -1.302 4.767 -8.221 1.00 1.23 C ATOM 0 H VAL A 31 -4.263 5.862 -8.171 1.00 33.22 H new ATOM 0 HA VAL A 31 -2.868 4.574 -10.463 1.00 3.22 H new ATOM 0 HB VAL A 31 -3.123 3.781 -7.595 1.00 70.25 H new ATOM 0 HG11 VAL A 31 -1.374 2.092 -8.240 1.00 2.21 H new ATOM 0 HG12 VAL A 31 -2.881 1.864 -9.160 1.00 2.21 H new ATOM 0 HG13 VAL A 31 -1.482 2.654 -9.925 1.00 2.21 H new ATOM 0 HG21 VAL A 31 -0.672 4.279 -7.477 1.00 1.23 H new ATOM 0 HG22 VAL A 31 -0.735 4.908 -9.141 1.00 1.23 H new ATOM 0 HG23 VAL A 31 -1.626 5.736 -7.842 1.00 1.23 H new ATOM 485 N ARG A 32 -5.241 3.946 -11.118 1.00 13.42 N ATOM 486 CA ARG A 32 -6.312 3.118 -11.658 1.00 4.12 C ATOM 487 C ARG A 32 -5.907 1.645 -11.714 1.00 22.44 C ATOM 488 O ARG A 32 -6.787 0.796 -11.595 1.00 60.02 O ATOM 489 CB ARG A 32 -6.724 3.614 -13.058 1.00 10.24 C ATOM 490 CG ARG A 32 -8.018 4.445 -13.091 1.00 45.22 C ATOM 491 CD ARG A 32 -7.801 5.942 -12.846 1.00 41.44 C ATOM 492 NE ARG A 32 -8.989 6.714 -13.243 1.00 33.42 N ATOM 493 CZ ARG A 32 -9.128 8.044 -13.257 1.00 21.53 C ATOM 494 NH1 ARG A 32 -8.183 8.871 -12.838 1.00 3.32 N ATOM 495 NH2 ARG A 32 -10.262 8.551 -13.704 1.00 3.23 N ATOM 0 H ARG A 32 -4.944 4.702 -11.735 1.00 13.42 H new ATOM 0 HA ARG A 32 -7.167 3.204 -10.987 1.00 4.12 H new ATOM 0 HB2 ARG A 32 -5.912 4.214 -13.469 1.00 10.24 H new ATOM 0 HB3 ARG A 32 -6.846 2.751 -13.713 1.00 10.24 H new ATOM 0 HG2 ARG A 32 -8.499 4.311 -14.060 1.00 45.22 H new ATOM 0 HG3 ARG A 32 -8.705 4.059 -12.338 1.00 45.22 H new ATOM 0 HD2 ARG A 32 -7.585 6.115 -11.792 1.00 41.44 H new ATOM 0 HD3 ARG A 32 -6.934 6.285 -13.410 1.00 41.44 H new ATOM 0 HE ARG A 32 -9.800 6.172 -13.542 1.00 33.42 H new ATOM 0 HH11 ARG A 32 -7.301 8.500 -12.484 1.00 3.32 H new ATOM 0 HH12 ARG A 32 -8.337 9.879 -12.869 1.00 3.32 H new ATOM 0 HH21 ARG A 32 -11.005 7.932 -14.028 1.00 3.23 H new ATOM 0 HH22 ARG A 32 -10.395 9.562 -13.726 1.00 3.23 H new ATOM 509 N ALA A 33 -4.610 1.325 -11.824 1.00 30.20 N ATOM 510 CA ALA A 33 -4.133 -0.053 -11.847 1.00 61.44 C ATOM 511 C ALA A 33 -4.599 -0.862 -10.639 1.00 4.21 C ATOM 512 O ALA A 33 -4.791 -2.076 -10.746 1.00 34.13 O ATOM 513 CB ALA A 33 -2.605 -0.091 -11.918 1.00 2.34 C ATOM 0 H ALA A 33 -3.867 2.019 -11.899 1.00 30.20 H new ATOM 0 HA ALA A 33 -4.562 -0.510 -12.738 1.00 61.44 H new ATOM 0 HB1 ALA A 33 -2.267 -1.127 -11.934 1.00 2.34 H new ATOM 0 HB2 ALA A 33 -2.270 0.414 -12.824 1.00 2.34 H new ATOM 0 HB3 ALA A 33 -2.188 0.413 -11.046 1.00 2.34 H new ATOM 519 N ILE A 34 -4.780 -0.200 -9.501 1.00 4.52 N ATOM 520 CA ILE A 34 -5.223 -0.801 -8.260 1.00 4.02 C ATOM 521 C ILE A 34 -6.685 -0.383 -8.078 1.00 53.05 C ATOM 522 O ILE A 34 -7.571 -1.240 -8.035 1.00 64.32 O ATOM 523 CB ILE A 34 -4.248 -0.371 -7.135 1.00 30.24 C ATOM 524 CG1 ILE A 34 -2.773 -0.758 -7.426 1.00 23.10 C ATOM 525 CG2 ILE A 34 -4.657 -0.939 -5.774 1.00 14.41 C ATOM 526 CD1 ILE A 34 -2.486 -2.246 -7.673 1.00 24.43 C ATOM 0 H ILE A 34 -4.615 0.803 -9.421 1.00 4.52 H new ATOM 0 HA ILE A 34 -5.201 -1.891 -8.246 1.00 4.02 H new ATOM 0 HB ILE A 34 -4.313 0.717 -7.106 1.00 30.24 H new ATOM 0 HG12 ILE A 34 -2.440 -0.198 -8.300 1.00 23.10 H new ATOM 0 HG13 ILE A 34 -2.163 -0.429 -6.585 1.00 23.10 H new ATOM 0 HG21 ILE A 34 -3.946 -0.613 -5.015 1.00 14.41 H new ATOM 0 HG22 ILE A 34 -5.654 -0.582 -5.515 1.00 14.41 H new ATOM 0 HG23 ILE A 34 -4.663 -2.028 -5.821 1.00 14.41 H new ATOM 0 HD11 ILE A 34 -1.422 -2.384 -7.864 1.00 24.43 H new ATOM 0 HD12 ILE A 34 -2.775 -2.823 -6.795 1.00 24.43 H new ATOM 0 HD13 ILE A 34 -3.057 -2.588 -8.536 1.00 24.43 H new ATOM 538 N MET A 35 -6.955 0.927 -8.066 1.00 22.04 N ATOM 539 CA MET A 35 -8.249 1.535 -7.778 1.00 20.45 C ATOM 540 C MET A 35 -9.403 0.939 -8.599 1.00 63.42 C ATOM 541 O MET A 35 -10.468 0.679 -8.030 1.00 5.33 O ATOM 542 CB MET A 35 -8.124 3.061 -7.936 1.00 44.43 C ATOM 543 CG MET A 35 -9.437 3.776 -7.613 1.00 12.14 C ATOM 544 SD MET A 35 -9.344 5.367 -6.742 1.00 33.25 S ATOM 545 CE MET A 35 -8.524 4.860 -5.204 1.00 42.24 C ATOM 0 H MET A 35 -6.237 1.623 -8.268 1.00 22.04 H new ATOM 0 HA MET A 35 -8.518 1.304 -6.747 1.00 20.45 H new ATOM 0 HB2 MET A 35 -7.337 3.431 -7.278 1.00 44.43 H new ATOM 0 HB3 MET A 35 -7.823 3.297 -8.957 1.00 44.43 H new ATOM 0 HG2 MET A 35 -9.969 3.938 -8.550 1.00 12.14 H new ATOM 0 HG3 MET A 35 -10.047 3.101 -7.013 1.00 12.14 H new ATOM 0 HE1 MET A 35 -8.720 5.599 -4.427 1.00 42.24 H new ATOM 0 HE2 MET A 35 -8.910 3.891 -4.888 1.00 42.24 H new ATOM 0 HE3 MET A 35 -7.450 4.786 -5.372 1.00 42.24 H new ATOM 555 N ALA A 36 -9.207 0.647 -9.891 1.00 31.51 N ATOM 556 CA ALA A 36 -10.280 0.110 -10.723 1.00 20.40 C ATOM 557 C ALA A 36 -10.739 -1.268 -10.241 1.00 13.23 C ATOM 558 O ALA A 36 -11.910 -1.612 -10.393 1.00 54.34 O ATOM 559 CB ALA A 36 -9.832 0.022 -12.183 1.00 30.22 C ATOM 0 H ALA A 36 -8.319 0.774 -10.377 1.00 31.51 H new ATOM 0 HA ALA A 36 -11.124 0.795 -10.642 1.00 20.40 H new ATOM 0 HB1 ALA A 36 -10.644 -0.380 -12.789 1.00 30.22 H new ATOM 0 HB2 ALA A 36 -9.569 1.016 -12.543 1.00 30.22 H new ATOM 0 HB3 ALA A 36 -8.964 -0.633 -12.258 1.00 30.22 H new ATOM 565 N THR A 37 -9.853 -2.077 -9.654 1.00 73.44 N ATOM 566 CA THR A 37 -10.246 -3.360 -9.088 1.00 55.40 C ATOM 567 C THR A 37 -11.090 -3.165 -7.841 1.00 21.24 C ATOM 568 O THR A 37 -12.095 -3.871 -7.708 1.00 11.33 O ATOM 569 CB THR A 37 -9.009 -4.239 -8.858 1.00 60.11 C ATOM 570 OG1 THR A 37 -8.579 -4.677 -10.136 1.00 45.34 O ATOM 571 CG2 THR A 37 -9.228 -5.437 -7.921 1.00 55.33 C ATOM 0 H THR A 37 -8.860 -1.862 -9.561 1.00 73.44 H new ATOM 0 HA THR A 37 -10.879 -3.892 -9.798 1.00 55.40 H new ATOM 0 HB THR A 37 -8.258 -3.639 -8.344 1.00 60.11 H new ATOM 0 HG1 THR A 37 -8.296 -5.614 -10.083 1.00 45.34 H new ATOM 0 HG21 THR A 37 -8.298 -5.996 -7.822 1.00 55.33 H new ATOM 0 HG22 THR A 37 -9.543 -5.079 -6.941 1.00 55.33 H new ATOM 0 HG23 THR A 37 -9.999 -6.087 -8.335 1.00 55.33 H new ATOM 579 N ILE A 38 -10.734 -2.203 -6.983 1.00 20.23 N ATOM 580 CA ILE A 38 -11.542 -1.881 -5.824 1.00 2.43 C ATOM 581 C ILE A 38 -12.929 -1.495 -6.309 1.00 52.04 C ATOM 582 O ILE A 38 -13.864 -2.211 -5.981 1.00 50.03 O ATOM 583 CB ILE A 38 -10.851 -0.822 -4.945 1.00 54.41 C ATOM 584 CG1 ILE A 38 -9.629 -1.463 -4.245 1.00 12.32 C ATOM 585 CG2 ILE A 38 -11.815 -0.216 -3.915 1.00 14.43 C ATOM 586 CD1 ILE A 38 -8.348 -0.719 -4.593 1.00 24.02 C ATOM 0 H ILE A 38 -9.889 -1.639 -7.078 1.00 20.23 H new ATOM 0 HA ILE A 38 -11.654 -2.743 -5.167 1.00 2.43 H new ATOM 0 HB ILE A 38 -10.519 -0.004 -5.584 1.00 54.41 H new ATOM 0 HG12 ILE A 38 -9.778 -1.453 -3.165 1.00 12.32 H new ATOM 0 HG13 ILE A 38 -9.540 -2.507 -4.545 1.00 12.32 H new ATOM 0 HG21 ILE A 38 -11.288 0.526 -3.316 1.00 14.43 H new ATOM 0 HG22 ILE A 38 -12.648 0.261 -4.432 1.00 14.43 H new ATOM 0 HG23 ILE A 38 -12.195 -1.004 -3.265 1.00 14.43 H new ATOM 0 HD11 ILE A 38 -7.505 -1.190 -4.088 1.00 24.02 H new ATOM 0 HD12 ILE A 38 -8.190 -0.752 -5.671 1.00 24.02 H new ATOM 0 HD13 ILE A 38 -8.431 0.319 -4.270 1.00 24.02 H new ATOM 598 N GLN A 39 -13.071 -0.444 -7.118 1.00 3.24 N ATOM 599 CA GLN A 39 -14.391 0.044 -7.509 1.00 51.32 C ATOM 600 C GLN A 39 -15.191 -0.980 -8.326 1.00 20.03 C ATOM 601 O GLN A 39 -16.421 -0.935 -8.313 1.00 2.54 O ATOM 602 CB GLN A 39 -14.264 1.382 -8.250 1.00 3.53 C ATOM 603 CG GLN A 39 -13.763 2.482 -7.298 1.00 74.12 C ATOM 604 CD GLN A 39 -13.802 3.868 -7.939 1.00 25.31 C ATOM 605 OE1 GLN A 39 -14.829 4.324 -8.428 1.00 30.35 O ATOM 606 NE2 GLN A 39 -12.695 4.590 -7.953 1.00 55.20 N ATOM 0 H GLN A 39 -12.291 0.082 -7.513 1.00 3.24 H new ATOM 0 HA GLN A 39 -14.961 0.203 -6.594 1.00 51.32 H new ATOM 0 HB2 GLN A 39 -13.574 1.276 -9.087 1.00 3.53 H new ATOM 0 HB3 GLN A 39 -15.230 1.666 -8.667 1.00 3.53 H new ATOM 0 HG2 GLN A 39 -14.375 2.484 -6.396 1.00 74.12 H new ATOM 0 HG3 GLN A 39 -12.742 2.255 -6.990 1.00 74.12 H new ATOM 0 HE21 GLN A 39 -11.837 4.216 -7.548 1.00 55.20 H new ATOM 0 HE22 GLN A 39 -12.699 5.521 -8.369 1.00 55.20 H new ATOM 615 N ARG A 40 -14.538 -1.926 -9.009 1.00 31.24 N ATOM 616 CA ARG A 40 -15.235 -3.052 -9.629 1.00 22.14 C ATOM 617 C ARG A 40 -15.823 -3.978 -8.572 1.00 71.41 C ATOM 618 O ARG A 40 -17.010 -4.292 -8.622 1.00 24.15 O ATOM 619 CB ARG A 40 -14.301 -3.829 -10.574 1.00 73.21 C ATOM 620 CG ARG A 40 -14.349 -3.227 -11.983 1.00 64.34 C ATOM 621 CD ARG A 40 -13.696 -4.135 -13.032 1.00 13.32 C ATOM 622 NE ARG A 40 -12.600 -3.471 -13.759 1.00 34.13 N ATOM 623 CZ ARG A 40 -11.983 -3.994 -14.826 1.00 12.21 C ATOM 624 NH1 ARG A 40 -12.398 -5.144 -15.346 1.00 24.43 N ATOM 625 NH2 ARG A 40 -10.940 -3.385 -15.370 1.00 52.05 N ATOM 0 H ARG A 40 -13.527 -1.932 -9.145 1.00 31.24 H new ATOM 0 HA ARG A 40 -16.056 -2.649 -10.222 1.00 22.14 H new ATOM 0 HB2 ARG A 40 -13.280 -3.799 -10.193 1.00 73.21 H new ATOM 0 HB3 ARG A 40 -14.598 -4.877 -10.609 1.00 73.21 H new ATOM 0 HG2 ARG A 40 -15.387 -3.044 -12.261 1.00 64.34 H new ATOM 0 HG3 ARG A 40 -13.845 -2.261 -11.979 1.00 64.34 H new ATOM 0 HD2 ARG A 40 -13.312 -5.030 -12.543 1.00 13.32 H new ATOM 0 HD3 ARG A 40 -14.453 -4.462 -13.745 1.00 13.32 H new ATOM 0 HE ARG A 40 -12.292 -2.556 -13.429 1.00 34.13 H new ATOM 0 HH11 ARG A 40 -13.191 -5.634 -14.932 1.00 24.43 H new ATOM 0 HH12 ARG A 40 -11.923 -5.537 -16.159 1.00 24.43 H new ATOM 0 HH21 ARG A 40 -10.599 -2.508 -14.976 1.00 52.05 H new ATOM 0 HH22 ARG A 40 -10.478 -3.793 -16.183 1.00 52.05 H new ATOM 639 N LYS A 41 -14.990 -4.477 -7.660 1.00 62.03 N ATOM 640 CA LYS A 41 -15.380 -5.455 -6.650 1.00 34.43 C ATOM 641 C LYS A 41 -16.297 -4.758 -5.650 1.00 41.14 C ATOM 642 O LYS A 41 -17.487 -5.037 -5.542 1.00 1.23 O ATOM 643 CB LYS A 41 -14.088 -6.022 -6.028 1.00 33.24 C ATOM 644 CG LYS A 41 -14.228 -7.293 -5.183 1.00 21.23 C ATOM 645 CD LYS A 41 -14.823 -7.057 -3.789 1.00 53.41 C ATOM 646 CE LYS A 41 -14.196 -8.005 -2.764 1.00 32.01 C ATOM 647 NZ LYS A 41 -14.653 -9.402 -2.857 1.00 23.02 N ATOM 0 H LYS A 41 -14.008 -4.207 -7.603 1.00 62.03 H new ATOM 0 HA LYS A 41 -15.939 -6.298 -7.057 1.00 34.43 H new ATOM 0 HB2 LYS A 41 -13.384 -6.226 -6.835 1.00 33.24 H new ATOM 0 HB3 LYS A 41 -13.643 -5.247 -5.404 1.00 33.24 H new ATOM 0 HG2 LYS A 41 -14.856 -8.005 -5.718 1.00 21.23 H new ATOM 0 HG3 LYS A 41 -13.246 -7.754 -5.074 1.00 21.23 H new ATOM 0 HD2 LYS A 41 -14.654 -6.024 -3.487 1.00 53.41 H new ATOM 0 HD3 LYS A 41 -15.902 -7.208 -3.819 1.00 53.41 H new ATOM 0 HE2 LYS A 41 -13.113 -7.983 -2.884 1.00 32.01 H new ATOM 0 HE3 LYS A 41 -14.414 -7.632 -1.763 1.00 32.01 H new ATOM 0 HZ1 LYS A 41 -14.372 -9.917 -1.998 1.00 23.02 H new ATOM 0 HZ2 LYS A 41 -15.689 -9.423 -2.950 1.00 23.02 H new ATOM 0 HZ3 LYS A 41 -14.221 -9.854 -3.688 1.00 23.02 H new ATOM 661 N TYR A 42 -15.733 -3.833 -4.893 1.00 45.42 N ATOM 662 CA TYR A 42 -16.424 -2.994 -3.938 1.00 45.13 C ATOM 663 C TYR A 42 -17.273 -1.945 -4.652 1.00 11.33 C ATOM 664 O TYR A 42 -16.761 -0.933 -5.125 1.00 71.20 O ATOM 665 CB TYR A 42 -15.387 -2.359 -3.013 1.00 41.42 C ATOM 666 CG TYR A 42 -14.650 -3.408 -2.213 1.00 54.51 C ATOM 667 CD1 TYR A 42 -15.304 -4.074 -1.160 1.00 44.22 C ATOM 668 CD2 TYR A 42 -13.362 -3.808 -2.608 1.00 1.55 C ATOM 669 CE1 TYR A 42 -14.683 -5.144 -0.508 1.00 4.31 C ATOM 670 CE2 TYR A 42 -12.730 -4.880 -1.961 1.00 43.11 C ATOM 671 CZ TYR A 42 -13.392 -5.543 -0.902 1.00 12.23 C ATOM 672 OH TYR A 42 -12.835 -6.630 -0.316 1.00 14.50 O ATOM 0 H TYR A 42 -14.732 -3.640 -4.932 1.00 45.42 H new ATOM 0 HA TYR A 42 -17.111 -3.593 -3.340 1.00 45.13 H new ATOM 0 HB2 TYR A 42 -14.675 -1.782 -3.603 1.00 41.42 H new ATOM 0 HB3 TYR A 42 -15.879 -1.661 -2.336 1.00 41.42 H new ATOM 0 HD1 TYR A 42 -16.290 -3.757 -0.854 1.00 44.22 H new ATOM 0 HD2 TYR A 42 -12.858 -3.289 -3.410 1.00 1.55 H new ATOM 0 HE1 TYR A 42 -15.191 -5.661 0.293 1.00 4.31 H new ATOM 0 HE2 TYR A 42 -11.745 -5.197 -2.269 1.00 43.11 H new ATOM 0 HH TYR A 42 -11.943 -6.783 -0.691 1.00 14.50 H new ATOM 682 N LYS A 43 -18.588 -2.164 -4.705 1.00 22.10 N ATOM 683 CA LYS A 43 -19.524 -1.161 -5.200 1.00 72.30 C ATOM 684 C LYS A 43 -19.605 0.020 -4.232 1.00 62.34 C ATOM 685 O LYS A 43 -19.336 1.154 -4.621 1.00 54.12 O ATOM 686 CB LYS A 43 -20.903 -1.794 -5.433 1.00 42.23 C ATOM 687 CG LYS A 43 -20.935 -2.786 -6.612 1.00 72.24 C ATOM 688 CD LYS A 43 -20.784 -2.159 -8.006 1.00 4.44 C ATOM 689 CE LYS A 43 -21.840 -1.087 -8.300 1.00 4.51 C ATOM 690 NZ LYS A 43 -23.221 -1.614 -8.339 1.00 23.05 N ATOM 0 H LYS A 43 -19.028 -3.035 -4.408 1.00 22.10 H new ATOM 0 HA LYS A 43 -19.164 -0.779 -6.155 1.00 72.30 H new ATOM 0 HB2 LYS A 43 -21.214 -2.311 -4.525 1.00 42.23 H new ATOM 0 HB3 LYS A 43 -21.631 -1.003 -5.615 1.00 42.23 H new ATOM 0 HG2 LYS A 43 -20.137 -3.516 -6.472 1.00 72.24 H new ATOM 0 HG3 LYS A 43 -21.877 -3.333 -6.579 1.00 72.24 H new ATOM 0 HD2 LYS A 43 -19.792 -1.717 -8.094 1.00 4.44 H new ATOM 0 HD3 LYS A 43 -20.851 -2.943 -8.760 1.00 4.44 H new ATOM 0 HE2 LYS A 43 -21.778 -0.309 -7.539 1.00 4.51 H new ATOM 0 HE3 LYS A 43 -21.612 -0.616 -9.256 1.00 4.51 H new ATOM 0 HZ1 LYS A 43 -23.883 -0.838 -8.542 1.00 23.05 H new ATOM 0 HZ2 LYS A 43 -23.296 -2.337 -9.083 1.00 23.05 H new ATOM 0 HZ3 LYS A 43 -23.457 -2.039 -7.419 1.00 23.05 H new ATOM 704 N GLY A 44 -19.988 -0.233 -2.981 1.00 32.42 N ATOM 705 CA GLY A 44 -20.507 0.782 -2.069 1.00 21.53 C ATOM 706 C GLY A 44 -19.485 1.708 -1.407 1.00 23.02 C ATOM 707 O GLY A 44 -19.882 2.524 -0.572 1.00 2.24 O ATOM 0 H GLY A 44 -19.945 -1.164 -2.567 1.00 32.42 H new ATOM 0 HA2 GLY A 44 -21.218 1.399 -2.618 1.00 21.53 H new ATOM 0 HA3 GLY A 44 -21.066 0.276 -1.282 1.00 21.53 H new ATOM 711 N ILE A 45 -18.196 1.582 -1.720 1.00 44.30 N ATOM 712 CA ILE A 45 -17.135 2.414 -1.157 1.00 62.20 C ATOM 713 C ILE A 45 -17.261 3.852 -1.676 1.00 53.14 C ATOM 714 O ILE A 45 -17.299 4.080 -2.890 1.00 14.44 O ATOM 715 CB ILE A 45 -15.762 1.748 -1.421 1.00 23.20 C ATOM 716 CG1 ILE A 45 -14.562 2.577 -0.916 1.00 21.13 C ATOM 717 CG2 ILE A 45 -15.569 1.268 -2.872 1.00 14.33 C ATOM 718 CD1 ILE A 45 -13.921 3.495 -1.962 1.00 34.24 C ATOM 0 H ILE A 45 -17.855 0.887 -2.384 1.00 44.30 H new ATOM 0 HA ILE A 45 -17.230 2.489 -0.074 1.00 62.20 H new ATOM 0 HB ILE A 45 -15.784 0.846 -0.810 1.00 23.20 H new ATOM 0 HG12 ILE A 45 -14.889 3.185 -0.073 1.00 21.13 H new ATOM 0 HG13 ILE A 45 -13.801 1.894 -0.539 1.00 21.13 H new ATOM 0 HG21 ILE A 45 -14.584 0.813 -2.977 1.00 14.33 H new ATOM 0 HG22 ILE A 45 -16.336 0.533 -3.117 1.00 14.33 H new ATOM 0 HG23 ILE A 45 -15.651 2.117 -3.550 1.00 14.33 H new ATOM 0 HD11 ILE A 45 -13.088 4.034 -1.511 1.00 34.24 H new ATOM 0 HD12 ILE A 45 -13.556 2.896 -2.797 1.00 34.24 H new ATOM 0 HD13 ILE A 45 -14.662 4.208 -2.323 1.00 34.24 H new ATOM 730 N LYS A 46 -17.321 4.814 -0.754 1.00 14.43 N ATOM 731 CA LYS A 46 -17.170 6.240 -1.035 1.00 73.22 C ATOM 732 C LYS A 46 -15.683 6.523 -1.154 1.00 5.00 C ATOM 733 O LYS A 46 -14.921 6.143 -0.270 1.00 1.23 O ATOM 734 CB LYS A 46 -17.798 7.033 0.123 1.00 41.12 C ATOM 735 CG LYS A 46 -17.845 8.563 -0.060 1.00 63.00 C ATOM 736 CD LYS A 46 -16.810 9.319 0.798 1.00 53.25 C ATOM 737 CE LYS A 46 -17.179 10.811 0.876 1.00 75.54 C ATOM 738 NZ LYS A 46 -16.434 11.557 1.916 1.00 21.20 N ATOM 0 H LYS A 46 -17.480 4.616 0.234 1.00 14.43 H new ATOM 0 HA LYS A 46 -17.668 6.532 -1.959 1.00 73.22 H new ATOM 0 HB2 LYS A 46 -18.815 6.673 0.276 1.00 41.12 H new ATOM 0 HB3 LYS A 46 -17.242 6.812 1.034 1.00 41.12 H new ATOM 0 HG2 LYS A 46 -17.677 8.800 -1.110 1.00 63.00 H new ATOM 0 HG3 LYS A 46 -18.844 8.920 0.191 1.00 63.00 H new ATOM 0 HD2 LYS A 46 -16.775 8.892 1.800 1.00 53.25 H new ATOM 0 HD3 LYS A 46 -15.815 9.204 0.368 1.00 53.25 H new ATOM 0 HE2 LYS A 46 -16.992 11.273 -0.093 1.00 75.54 H new ATOM 0 HE3 LYS A 46 -18.247 10.902 1.072 1.00 75.54 H new ATOM 0 HZ1 LYS A 46 -17.098 12.127 2.478 1.00 21.20 H new ATOM 0 HZ2 LYS A 46 -15.941 10.886 2.539 1.00 21.20 H new ATOM 0 HZ3 LYS A 46 -15.738 12.183 1.463 1.00 21.20 H new ATOM 752 N ILE A 47 -15.255 7.189 -2.223 1.00 24.32 N ATOM 753 CA ILE A 47 -13.861 7.579 -2.356 1.00 41.01 C ATOM 754 C ILE A 47 -13.676 8.802 -1.457 1.00 32.13 C ATOM 755 O ILE A 47 -14.307 9.838 -1.685 1.00 73.22 O ATOM 756 CB ILE A 47 -13.485 7.895 -3.822 1.00 61.13 C ATOM 757 CG1 ILE A 47 -13.969 6.855 -4.862 1.00 3.34 C ATOM 758 CG2 ILE A 47 -11.958 8.076 -3.908 1.00 34.10 C ATOM 759 CD1 ILE A 47 -13.260 5.501 -4.778 1.00 4.50 C ATOM 0 H ILE A 47 -15.851 7.467 -3.003 1.00 24.32 H new ATOM 0 HA ILE A 47 -13.202 6.764 -2.058 1.00 41.01 H new ATOM 0 HB ILE A 47 -14.011 8.811 -4.089 1.00 61.13 H new ATOM 0 HG12 ILE A 47 -15.040 6.700 -4.731 1.00 3.34 H new ATOM 0 HG13 ILE A 47 -13.826 7.265 -5.862 1.00 3.34 H new ATOM 0 HG21 ILE A 47 -11.675 8.300 -4.937 1.00 34.10 H new ATOM 0 HG22 ILE A 47 -11.652 8.898 -3.261 1.00 34.10 H new ATOM 0 HG23 ILE A 47 -11.464 7.159 -3.588 1.00 34.10 H new ATOM 0 HD11 ILE A 47 -13.660 4.833 -5.541 1.00 4.50 H new ATOM 0 HD12 ILE A 47 -12.191 5.639 -4.940 1.00 4.50 H new ATOM 0 HD13 ILE A 47 -13.424 5.065 -3.793 1.00 4.50 H new ATOM 771 N GLN A 48 -12.802 8.720 -0.462 1.00 63.34 N ATOM 772 CA GLN A 48 -12.221 9.887 0.179 1.00 11.44 C ATOM 773 C GLN A 48 -10.792 9.563 0.559 1.00 51.31 C ATOM 774 O GLN A 48 -10.503 8.402 0.806 1.00 53.34 O ATOM 775 CB GLN A 48 -13.025 10.322 1.412 1.00 40.35 C ATOM 776 CG GLN A 48 -13.232 9.220 2.464 1.00 63.41 C ATOM 777 CD GLN A 48 -13.832 9.809 3.734 1.00 71.25 C ATOM 778 OE1 GLN A 48 -15.016 10.130 3.771 1.00 14.31 O ATOM 779 NE2 GLN A 48 -13.014 10.037 4.746 1.00 2.14 N ATOM 0 H GLN A 48 -12.476 7.834 -0.076 1.00 63.34 H new ATOM 0 HA GLN A 48 -12.244 10.723 -0.520 1.00 11.44 H new ATOM 0 HB2 GLN A 48 -12.517 11.164 1.882 1.00 40.35 H new ATOM 0 HB3 GLN A 48 -14.001 10.681 1.085 1.00 40.35 H new ATOM 0 HG2 GLN A 48 -13.890 8.447 2.067 1.00 63.41 H new ATOM 0 HG3 GLN A 48 -12.280 8.741 2.692 1.00 63.41 H new ATOM 0 HE21 GLN A 48 -12.035 9.758 4.683 1.00 2.14 H new ATOM 0 HE22 GLN A 48 -13.361 10.492 5.590 1.00 2.14 H new ATOM 788 N GLU A 49 -9.909 10.558 0.639 1.00 30.04 N ATOM 789 CA GLU A 49 -8.497 10.382 1.008 1.00 3.21 C ATOM 790 C GLU A 49 -8.312 10.316 2.528 1.00 74.41 C ATOM 791 O GLU A 49 -7.424 10.934 3.113 1.00 71.02 O ATOM 792 CB GLU A 49 -7.591 11.403 0.300 1.00 11.05 C ATOM 793 CG GLU A 49 -8.050 12.864 0.368 1.00 23.35 C ATOM 794 CD GLU A 49 -7.687 13.618 1.649 1.00 12.53 C ATOM 795 OE1 GLU A 49 -6.612 14.254 1.673 1.00 44.44 O ATOM 796 OE2 GLU A 49 -8.569 13.743 2.537 1.00 44.32 O ATOM 0 H GLU A 49 -10.156 11.529 0.446 1.00 30.04 H new ATOM 0 HA GLU A 49 -8.168 9.410 0.640 1.00 3.21 H new ATOM 0 HB2 GLU A 49 -6.593 11.335 0.732 1.00 11.05 H new ATOM 0 HB3 GLU A 49 -7.504 11.118 -0.748 1.00 11.05 H new ATOM 0 HG2 GLU A 49 -7.622 13.399 -0.480 1.00 23.35 H new ATOM 0 HG3 GLU A 49 -9.133 12.891 0.248 1.00 23.35 H new ATOM 803 N GLY A 50 -9.190 9.551 3.161 1.00 23.15 N ATOM 804 CA GLY A 50 -9.183 9.212 4.571 1.00 54.13 C ATOM 805 C GLY A 50 -9.287 7.700 4.718 1.00 44.55 C ATOM 806 O GLY A 50 -9.039 6.950 3.768 1.00 51.13 O ATOM 0 H GLY A 50 -9.975 9.125 2.669 1.00 23.15 H new ATOM 0 HA2 GLY A 50 -8.268 9.574 5.041 1.00 54.13 H new ATOM 0 HA3 GLY A 50 -10.016 9.698 5.079 1.00 54.13 H new ATOM 810 N ILE A 51 -9.636 7.251 5.922 1.00 13.13 N ATOM 811 CA ILE A 51 -10.122 5.894 6.141 1.00 72.25 C ATOM 812 C ILE A 51 -11.469 5.781 5.424 1.00 0.52 C ATOM 813 O ILE A 51 -12.221 6.759 5.325 1.00 1.10 O ATOM 814 CB ILE A 51 -10.265 5.634 7.662 1.00 61.54 C ATOM 815 CG1 ILE A 51 -8.901 5.670 8.389 1.00 22.43 C ATOM 816 CG2 ILE A 51 -11.024 4.341 8.010 1.00 72.42 C ATOM 817 CD1 ILE A 51 -7.998 4.459 8.121 1.00 61.25 C ATOM 0 H ILE A 51 -9.589 7.817 6.769 1.00 13.13 H new ATOM 0 HA ILE A 51 -9.430 5.148 5.749 1.00 72.25 H new ATOM 0 HB ILE A 51 -10.877 6.460 8.025 1.00 61.54 H new ATOM 0 HG12 ILE A 51 -8.370 6.574 8.092 1.00 22.43 H new ATOM 0 HG13 ILE A 51 -9.079 5.743 9.462 1.00 22.43 H new ATOM 0 HG21 ILE A 51 -11.081 4.233 9.093 1.00 72.42 H new ATOM 0 HG22 ILE A 51 -12.032 4.388 7.597 1.00 72.42 H new ATOM 0 HG23 ILE A 51 -10.498 3.485 7.587 1.00 72.42 H new ATOM 0 HD11 ILE A 51 -7.064 4.572 8.672 1.00 61.25 H new ATOM 0 HD12 ILE A 51 -8.503 3.549 8.446 1.00 61.25 H new ATOM 0 HD13 ILE A 51 -7.784 4.394 7.054 1.00 61.25 H new ATOM 829 N VAL A 52 -11.811 4.561 5.026 1.00 41.02 N ATOM 830 CA VAL A 52 -13.182 4.152 4.782 1.00 12.41 C ATOM 831 C VAL A 52 -13.374 2.831 5.539 1.00 62.40 C ATOM 832 O VAL A 52 -12.406 2.201 5.991 1.00 52.12 O ATOM 833 CB VAL A 52 -13.463 4.083 3.259 1.00 30.22 C ATOM 834 CG1 VAL A 52 -12.987 5.335 2.504 1.00 42.22 C ATOM 835 CG2 VAL A 52 -12.860 2.840 2.618 1.00 73.32 C ATOM 0 H VAL A 52 -11.130 3.819 4.862 1.00 41.02 H new ATOM 0 HA VAL A 52 -13.916 4.869 5.151 1.00 12.41 H new ATOM 0 HB VAL A 52 -14.548 4.031 3.173 1.00 30.22 H new ATOM 0 HG11 VAL A 52 -13.211 5.227 1.443 1.00 42.22 H new ATOM 0 HG12 VAL A 52 -13.500 6.213 2.896 1.00 42.22 H new ATOM 0 HG13 VAL A 52 -11.912 5.453 2.637 1.00 42.22 H new ATOM 0 HG21 VAL A 52 -13.083 2.836 1.551 1.00 73.32 H new ATOM 0 HG22 VAL A 52 -11.780 2.844 2.763 1.00 73.32 H new ATOM 0 HG23 VAL A 52 -13.285 1.949 3.081 1.00 73.32 H new ATOM 845 N ASP A 53 -14.605 2.349 5.661 1.00 70.34 N ATOM 846 CA ASP A 53 -14.961 1.043 6.220 1.00 13.03 C ATOM 847 C ASP A 53 -15.896 0.302 5.259 1.00 41.04 C ATOM 848 O ASP A 53 -17.120 0.319 5.412 1.00 75.21 O ATOM 849 CB ASP A 53 -15.573 1.187 7.628 1.00 24.14 C ATOM 850 CG ASP A 53 -16.839 2.044 7.730 1.00 12.41 C ATOM 851 OD1 ASP A 53 -16.790 3.250 7.398 1.00 54.51 O ATOM 852 OD2 ASP A 53 -17.877 1.537 8.222 1.00 45.35 O ATOM 0 H ASP A 53 -15.422 2.880 5.360 1.00 70.34 H new ATOM 0 HA ASP A 53 -14.055 0.448 6.334 1.00 13.03 H new ATOM 0 HB2 ASP A 53 -15.802 0.191 8.006 1.00 24.14 H new ATOM 0 HB3 ASP A 53 -14.817 1.612 8.288 1.00 24.14 H new ATOM 857 N TYR A 54 -15.329 -0.370 4.248 1.00 11.52 N ATOM 858 CA TYR A 54 -16.150 -1.064 3.255 1.00 34.43 C ATOM 859 C TYR A 54 -15.507 -2.371 2.821 1.00 45.23 C ATOM 860 O TYR A 54 -14.851 -2.488 1.784 1.00 4.30 O ATOM 861 CB TYR A 54 -16.582 -0.157 2.100 1.00 63.14 C ATOM 862 CG TYR A 54 -17.682 -0.788 1.261 1.00 70.40 C ATOM 863 CD1 TYR A 54 -19.005 -0.893 1.739 1.00 0.41 C ATOM 864 CD2 TYR A 54 -17.368 -1.328 0.007 1.00 75.43 C ATOM 865 CE1 TYR A 54 -19.999 -1.523 0.962 1.00 62.51 C ATOM 866 CE2 TYR A 54 -18.352 -1.940 -0.783 1.00 30.43 C ATOM 867 CZ TYR A 54 -19.672 -2.050 -0.308 1.00 30.00 C ATOM 868 OH TYR A 54 -20.590 -2.664 -1.102 1.00 61.42 O ATOM 0 H TYR A 54 -14.323 -0.446 4.100 1.00 11.52 H new ATOM 0 HA TYR A 54 -17.087 -1.340 3.738 1.00 34.43 H new ATOM 0 HB2 TYR A 54 -16.931 0.796 2.498 1.00 63.14 H new ATOM 0 HB3 TYR A 54 -15.721 0.058 1.467 1.00 63.14 H new ATOM 0 HD1 TYR A 54 -19.259 -0.488 2.707 1.00 0.41 H new ATOM 0 HD2 TYR A 54 -16.353 -1.272 -0.357 1.00 75.43 H new ATOM 0 HE1 TYR A 54 -21.009 -1.603 1.337 1.00 62.51 H new ATOM 0 HE2 TYR A 54 -18.096 -2.328 -1.758 1.00 30.43 H new ATOM 0 HH TYR A 54 -21.477 -2.283 -0.932 1.00 61.42 H new ATOM 878 N GLY A 55 -15.726 -3.396 3.633 1.00 72.30 N ATOM 879 CA GLY A 55 -15.205 -4.718 3.402 1.00 40.03 C ATOM 880 C GLY A 55 -13.823 -4.763 4.010 1.00 61.23 C ATOM 881 O GLY A 55 -13.689 -4.995 5.212 1.00 43.35 O ATOM 0 H GLY A 55 -16.283 -3.321 4.484 1.00 72.30 H new ATOM 0 HA2 GLY A 55 -15.850 -5.471 3.855 1.00 40.03 H new ATOM 0 HA3 GLY A 55 -15.163 -4.935 2.335 1.00 40.03 H new ATOM 885 N VAL A 56 -12.815 -4.450 3.210 1.00 34.21 N ATOM 886 CA VAL A 56 -11.424 -4.457 3.634 1.00 11.52 C ATOM 887 C VAL A 56 -11.067 -3.034 3.981 1.00 3.23 C ATOM 888 O VAL A 56 -11.336 -2.147 3.178 1.00 64.14 O ATOM 889 CB VAL A 56 -10.513 -4.992 2.519 1.00 55.33 C ATOM 890 CG1 VAL A 56 -9.023 -4.818 2.842 1.00 53.30 C ATOM 891 CG2 VAL A 56 -10.786 -6.482 2.340 1.00 2.15 C ATOM 0 H VAL A 56 -12.942 -4.180 2.235 1.00 34.21 H new ATOM 0 HA VAL A 56 -11.286 -5.113 4.494 1.00 11.52 H new ATOM 0 HB VAL A 56 -10.733 -4.424 1.615 1.00 55.33 H new ATOM 0 HG11 VAL A 56 -8.424 -5.213 2.021 1.00 53.30 H new ATOM 0 HG12 VAL A 56 -8.801 -3.759 2.977 1.00 53.30 H new ATOM 0 HG13 VAL A 56 -8.784 -5.358 3.758 1.00 53.30 H new ATOM 0 HG21 VAL A 56 -10.146 -6.877 1.551 1.00 2.15 H new ATOM 0 HG22 VAL A 56 -10.576 -7.005 3.273 1.00 2.15 H new ATOM 0 HG23 VAL A 56 -11.831 -6.630 2.068 1.00 2.15 H new ATOM 901 N ARG A 57 -10.455 -2.835 5.150 1.00 63.13 N ATOM 902 CA ARG A 57 -10.018 -1.551 5.676 1.00 51.32 C ATOM 903 C ARG A 57 -9.099 -0.846 4.670 1.00 11.12 C ATOM 904 O ARG A 57 -7.883 -1.086 4.664 1.00 54.32 O ATOM 905 CB ARG A 57 -9.267 -1.762 7.008 1.00 21.43 C ATOM 906 CG ARG A 57 -10.147 -2.196 8.184 1.00 34.35 C ATOM 907 CD ARG A 57 -9.275 -2.507 9.408 1.00 23.20 C ATOM 908 NE ARG A 57 -10.063 -2.545 10.648 1.00 13.43 N ATOM 909 CZ ARG A 57 -9.600 -2.858 11.865 1.00 42.25 C ATOM 910 NH1 ARG A 57 -8.355 -3.277 12.052 1.00 4.20 N ATOM 911 NH2 ARG A 57 -10.377 -2.746 12.933 1.00 30.45 N ATOM 0 H ARG A 57 -10.243 -3.606 5.783 1.00 63.13 H new ATOM 0 HA ARG A 57 -10.894 -0.926 5.848 1.00 51.32 H new ATOM 0 HB2 ARG A 57 -8.492 -2.514 6.856 1.00 21.43 H new ATOM 0 HB3 ARG A 57 -8.762 -0.833 7.274 1.00 21.43 H new ATOM 0 HG2 ARG A 57 -10.859 -1.407 8.426 1.00 34.35 H new ATOM 0 HG3 ARG A 57 -10.728 -3.076 7.908 1.00 34.35 H new ATOM 0 HD2 ARG A 57 -8.777 -3.466 9.265 1.00 23.20 H new ATOM 0 HD3 ARG A 57 -8.493 -1.753 9.498 1.00 23.20 H new ATOM 0 HE ARG A 57 -11.053 -2.312 10.575 1.00 13.43 H new ATOM 0 HH11 ARG A 57 -7.723 -3.368 11.257 1.00 4.20 H new ATOM 0 HH12 ARG A 57 -8.030 -3.508 12.991 1.00 4.20 H new ATOM 0 HH21 ARG A 57 -11.338 -2.419 12.833 1.00 30.45 H new ATOM 0 HH22 ARG A 57 -10.014 -2.987 13.855 1.00 30.45 H new ATOM 925 N PHE A 58 -9.661 0.022 3.833 1.00 41.23 N ATOM 926 CA PHE A 58 -8.882 0.804 2.884 1.00 51.24 C ATOM 927 C PHE A 58 -8.641 2.191 3.458 1.00 13.53 C ATOM 928 O PHE A 58 -9.356 2.672 4.342 1.00 52.53 O ATOM 929 CB PHE A 58 -9.537 0.852 1.494 1.00 72.04 C ATOM 930 CG PHE A 58 -9.630 -0.468 0.736 1.00 41.12 C ATOM 931 CD1 PHE A 58 -8.670 -1.489 0.888 1.00 32.12 C ATOM 932 CD2 PHE A 58 -10.693 -0.675 -0.159 1.00 22.12 C ATOM 933 CE1 PHE A 58 -8.786 -2.699 0.184 1.00 75.50 C ATOM 934 CE2 PHE A 58 -10.845 -1.904 -0.818 1.00 24.45 C ATOM 935 CZ PHE A 58 -9.887 -2.916 -0.657 1.00 34.10 C ATOM 0 H PHE A 58 -10.664 0.201 3.795 1.00 41.23 H new ATOM 0 HA PHE A 58 -7.919 0.316 2.734 1.00 51.24 H new ATOM 0 HB2 PHE A 58 -10.545 1.252 1.606 1.00 72.04 H new ATOM 0 HB3 PHE A 58 -8.980 1.559 0.879 1.00 72.04 H new ATOM 0 HD1 PHE A 58 -7.834 -1.339 1.555 1.00 32.12 H new ATOM 0 HD2 PHE A 58 -11.400 0.120 -0.342 1.00 22.12 H new ATOM 0 HE1 PHE A 58 -8.028 -3.461 0.290 1.00 75.50 H new ATOM 0 HE2 PHE A 58 -11.703 -2.072 -1.452 1.00 24.45 H new ATOM 0 HZ PHE A 58 -9.997 -3.856 -1.177 1.00 34.10 H new ATOM 945 N PHE A 59 -7.586 2.818 2.951 1.00 72.43 N ATOM 946 CA PHE A 59 -7.071 4.095 3.387 1.00 42.22 C ATOM 947 C PHE A 59 -6.449 4.712 2.142 1.00 51.44 C ATOM 948 O PHE A 59 -5.655 4.053 1.464 1.00 12.01 O ATOM 949 CB PHE A 59 -6.054 3.840 4.508 1.00 51.04 C ATOM 950 CG PHE A 59 -5.430 5.075 5.121 1.00 1.13 C ATOM 951 CD1 PHE A 59 -6.246 6.124 5.584 1.00 23.43 C ATOM 952 CD2 PHE A 59 -4.033 5.165 5.265 1.00 52.04 C ATOM 953 CE1 PHE A 59 -5.672 7.274 6.150 1.00 21.45 C ATOM 954 CE2 PHE A 59 -3.462 6.301 5.858 1.00 13.03 C ATOM 955 CZ PHE A 59 -4.277 7.370 6.271 1.00 4.11 C ATOM 0 H PHE A 59 -7.043 2.421 2.184 1.00 72.43 H new ATOM 0 HA PHE A 59 -7.821 4.772 3.796 1.00 42.22 H new ATOM 0 HB2 PHE A 59 -6.547 3.274 5.298 1.00 51.04 H new ATOM 0 HB3 PHE A 59 -5.257 3.210 4.114 1.00 51.04 H new ATOM 0 HD1 PHE A 59 -7.320 6.044 5.504 1.00 23.43 H new ATOM 0 HD2 PHE A 59 -3.401 4.360 4.919 1.00 52.04 H new ATOM 0 HE1 PHE A 59 -6.302 8.082 6.491 1.00 21.45 H new ATOM 0 HE2 PHE A 59 -2.392 6.355 5.998 1.00 13.03 H new ATOM 0 HZ PHE A 59 -3.830 8.264 6.681 1.00 4.11 H new ATOM 965 N PHE A 60 -6.871 5.914 1.772 1.00 31.13 N ATOM 966 CA PHE A 60 -6.638 6.423 0.431 1.00 5.32 C ATOM 967 C PHE A 60 -5.828 7.715 0.482 1.00 0.14 C ATOM 968 O PHE A 60 -5.997 8.534 1.388 1.00 34.22 O ATOM 969 CB PHE A 60 -7.997 6.637 -0.238 1.00 75.34 C ATOM 970 CG PHE A 60 -8.807 5.387 -0.560 1.00 75.44 C ATOM 971 CD1 PHE A 60 -8.376 4.474 -1.544 1.00 11.22 C ATOM 972 CD2 PHE A 60 -10.031 5.153 0.095 1.00 62.11 C ATOM 973 CE1 PHE A 60 -9.138 3.331 -1.848 1.00 1.21 C ATOM 974 CE2 PHE A 60 -10.790 4.011 -0.205 1.00 70.03 C ATOM 975 CZ PHE A 60 -10.346 3.094 -1.172 1.00 50.41 C ATOM 0 H PHE A 60 -7.377 6.554 2.384 1.00 31.13 H new ATOM 0 HA PHE A 60 -6.057 5.708 -0.152 1.00 5.32 H new ATOM 0 HB2 PHE A 60 -8.598 7.274 0.410 1.00 75.34 H new ATOM 0 HB3 PHE A 60 -7.837 7.187 -1.166 1.00 75.34 H new ATOM 0 HD1 PHE A 60 -7.450 4.654 -2.070 1.00 11.22 H new ATOM 0 HD2 PHE A 60 -10.388 5.856 0.833 1.00 62.11 H new ATOM 0 HE1 PHE A 60 -8.794 2.637 -2.600 1.00 1.21 H new ATOM 0 HE2 PHE A 60 -11.722 3.836 0.311 1.00 70.03 H new ATOM 0 HZ PHE A 60 -10.930 2.213 -1.394 1.00 50.41 H new ATOM 985 N TYR A 61 -5.006 7.922 -0.547 1.00 62.10 N ATOM 986 CA TYR A 61 -4.214 9.123 -0.772 1.00 41.11 C ATOM 987 C TYR A 61 -4.577 9.702 -2.121 1.00 65.54 C ATOM 988 O TYR A 61 -4.603 8.976 -3.116 1.00 64.35 O ATOM 989 CB TYR A 61 -2.714 8.785 -0.768 1.00 65.24 C ATOM 990 CG TYR A 61 -2.315 7.805 0.306 1.00 23.22 C ATOM 991 CD1 TYR A 61 -2.682 8.077 1.628 1.00 55.12 C ATOM 992 CD2 TYR A 61 -1.666 6.597 -0.010 1.00 4.22 C ATOM 993 CE1 TYR A 61 -2.429 7.146 2.636 1.00 43.41 C ATOM 994 CE2 TYR A 61 -1.369 5.673 1.005 1.00 2.21 C ATOM 995 CZ TYR A 61 -1.734 5.957 2.339 1.00 3.23 C ATOM 996 OH TYR A 61 -1.361 5.126 3.346 1.00 32.11 O ATOM 0 H TYR A 61 -4.871 7.223 -1.277 1.00 62.10 H new ATOM 0 HA TYR A 61 -4.421 9.839 0.023 1.00 41.11 H new ATOM 0 HB2 TYR A 61 -2.441 8.376 -1.740 1.00 65.24 H new ATOM 0 HB3 TYR A 61 -2.144 9.705 -0.638 1.00 65.24 H new ATOM 0 HD1 TYR A 61 -3.164 9.013 1.870 1.00 55.12 H new ATOM 0 HD2 TYR A 61 -1.396 6.380 -1.033 1.00 4.22 H new ATOM 0 HE1 TYR A 61 -2.766 7.337 3.644 1.00 43.41 H new ATOM 0 HE2 TYR A 61 -0.863 4.749 0.766 1.00 2.21 H new ATOM 0 HH TYR A 61 -2.018 5.175 4.071 1.00 32.11 H new ATOM 1006 N THR A 62 -4.834 10.999 -2.152 1.00 63.12 N ATOM 1007 CA THR A 62 -4.716 11.831 -3.341 1.00 31.13 C ATOM 1008 C THR A 62 -3.236 11.995 -3.670 1.00 45.21 C ATOM 1009 O THR A 62 -2.436 12.125 -2.739 1.00 43.25 O ATOM 1010 CB THR A 62 -5.322 13.205 -3.026 1.00 52.40 C ATOM 1011 OG1 THR A 62 -5.050 13.582 -1.682 1.00 1.13 O ATOM 1012 CG2 THR A 62 -6.827 13.167 -3.227 1.00 1.41 C ATOM 0 H THR A 62 -5.139 11.518 -1.329 1.00 63.12 H new ATOM 0 HA THR A 62 -5.234 11.378 -4.186 1.00 31.13 H new ATOM 0 HB THR A 62 -4.872 13.933 -3.701 1.00 52.40 H new ATOM 0 HG1 THR A 62 -4.144 13.297 -1.439 1.00 1.13 H new ATOM 0 HG21 THR A 62 -7.249 14.146 -3.001 1.00 1.41 H new ATOM 0 HG22 THR A 62 -7.049 12.906 -4.262 1.00 1.41 H new ATOM 0 HG23 THR A 62 -7.264 12.422 -2.563 1.00 1.41 H new ATOM 1020 N SER A 63 -2.891 12.092 -4.955 1.00 25.04 N ATOM 1021 CA SER A 63 -1.529 12.335 -5.419 1.00 34.34 C ATOM 1022 C SER A 63 -0.915 13.597 -4.800 1.00 3.40 C ATOM 1023 O SER A 63 0.297 13.623 -4.602 1.00 42.32 O ATOM 1024 CB SER A 63 -1.502 12.358 -6.958 1.00 74.31 C ATOM 1025 OG SER A 63 -2.728 12.816 -7.518 1.00 71.32 O ATOM 0 H SER A 63 -3.565 12.002 -5.715 1.00 25.04 H new ATOM 0 HA SER A 63 -0.898 11.514 -5.079 1.00 34.34 H new ATOM 0 HB2 SER A 63 -0.690 13.002 -7.294 1.00 74.31 H new ATOM 0 HB3 SER A 63 -1.289 11.356 -7.329 1.00 74.31 H new ATOM 0 HG SER A 63 -2.662 12.815 -8.496 1.00 71.32 H new ATOM 1031 N LYS A 64 -1.736 14.595 -4.435 1.00 25.51 N ATOM 1032 CA LYS A 64 -1.290 15.834 -3.808 1.00 24.00 C ATOM 1033 C LYS A 64 -0.438 15.625 -2.563 1.00 53.03 C ATOM 1034 O LYS A 64 0.429 16.462 -2.317 1.00 70.13 O ATOM 1035 CB LYS A 64 -2.478 16.783 -3.550 1.00 34.43 C ATOM 1036 CG LYS A 64 -3.418 16.327 -2.422 1.00 5.12 C ATOM 1037 CD LYS A 64 -3.126 16.986 -1.065 1.00 1.13 C ATOM 1038 CE LYS A 64 -3.492 16.043 0.088 1.00 41.23 C ATOM 1039 NZ LYS A 64 -4.942 15.762 0.193 1.00 51.42 N ATOM 0 H LYS A 64 -2.746 14.555 -4.573 1.00 25.51 H new ATOM 0 HA LYS A 64 -0.623 16.314 -4.524 1.00 24.00 H new ATOM 0 HB2 LYS A 64 -2.091 17.773 -3.307 1.00 34.43 H new ATOM 0 HB3 LYS A 64 -3.055 16.883 -4.470 1.00 34.43 H new ATOM 0 HG2 LYS A 64 -4.447 16.547 -2.708 1.00 5.12 H new ATOM 0 HG3 LYS A 64 -3.342 15.245 -2.314 1.00 5.12 H new ATOM 0 HD2 LYS A 64 -2.070 17.250 -1.004 1.00 1.13 H new ATOM 0 HD3 LYS A 64 -3.692 17.913 -0.976 1.00 1.13 H new ATOM 0 HE2 LYS A 64 -2.957 15.102 -0.041 1.00 41.23 H new ATOM 0 HE3 LYS A 64 -3.147 16.479 1.025 1.00 41.23 H new ATOM 0 HZ1 LYS A 64 -5.158 15.402 1.144 1.00 51.42 H new ATOM 0 HZ2 LYS A 64 -5.478 16.637 0.024 1.00 51.42 H new ATOM 0 HZ3 LYS A 64 -5.210 15.050 -0.516 1.00 51.42 H new ATOM 1053 N GLU A 65 -0.720 14.622 -1.722 1.00 42.05 N ATOM 1054 CA GLU A 65 -0.036 14.619 -0.427 1.00 14.25 C ATOM 1055 C GLU A 65 1.416 14.136 -0.586 1.00 75.14 C ATOM 1056 O GLU A 65 1.649 13.207 -1.362 1.00 13.42 O ATOM 1057 CB GLU A 65 -0.820 13.775 0.597 1.00 44.42 C ATOM 1058 CG GLU A 65 -0.810 14.469 1.969 1.00 41.52 C ATOM 1059 CD GLU A 65 -1.988 14.067 2.849 1.00 53.31 C ATOM 1060 OE1 GLU A 65 -2.165 12.864 3.123 1.00 61.32 O ATOM 1061 OE2 GLU A 65 -2.740 14.975 3.287 1.00 51.31 O ATOM 0 H GLU A 65 -1.369 13.854 -1.896 1.00 42.05 H new ATOM 0 HA GLU A 65 0.002 15.639 -0.044 1.00 14.25 H new ATOM 0 HB2 GLU A 65 -1.847 13.638 0.257 1.00 44.42 H new ATOM 0 HB3 GLU A 65 -0.376 12.783 0.679 1.00 44.42 H new ATOM 0 HG2 GLU A 65 0.120 14.229 2.485 1.00 41.52 H new ATOM 0 HG3 GLU A 65 -0.824 15.549 1.824 1.00 41.52 H new ATOM 1068 N PRO A 66 2.392 14.687 0.163 1.00 74.25 N ATOM 1069 CA PRO A 66 3.772 14.215 0.118 1.00 71.11 C ATOM 1070 C PRO A 66 3.916 12.873 0.835 1.00 43.30 C ATOM 1071 O PRO A 66 3.297 12.640 1.877 1.00 64.35 O ATOM 1072 CB PRO A 66 4.612 15.298 0.806 1.00 55.52 C ATOM 1073 CG PRO A 66 3.623 16.057 1.680 1.00 33.45 C ATOM 1074 CD PRO A 66 2.297 15.915 0.939 1.00 3.12 C ATOM 0 HA PRO A 66 4.101 14.051 -0.908 1.00 71.11 H new ATOM 0 HB2 PRO A 66 5.412 14.859 1.402 1.00 55.52 H new ATOM 0 HB3 PRO A 66 5.083 15.957 0.077 1.00 55.52 H new ATOM 0 HG2 PRO A 66 3.568 15.633 2.683 1.00 33.45 H new ATOM 0 HG3 PRO A 66 3.909 17.103 1.791 1.00 33.45 H new ATOM 0 HD2 PRO A 66 1.463 15.869 1.640 1.00 3.12 H new ATOM 0 HD3 PRO A 66 2.121 16.773 0.290 1.00 3.12 H new ATOM 1082 N VAL A 67 4.822 12.036 0.332 1.00 54.02 N ATOM 1083 CA VAL A 67 5.150 10.715 0.861 1.00 53.40 C ATOM 1084 C VAL A 67 5.504 10.804 2.352 1.00 71.41 C ATOM 1085 O VAL A 67 5.065 9.956 3.129 1.00 41.20 O ATOM 1086 CB VAL A 67 6.280 10.068 0.021 1.00 11.33 C ATOM 1087 CG1 VAL A 67 6.293 8.544 0.173 1.00 53.14 C ATOM 1088 CG2 VAL A 67 6.137 10.342 -1.480 1.00 51.42 C ATOM 0 H VAL A 67 5.372 12.272 -0.494 1.00 54.02 H new ATOM 0 HA VAL A 67 4.277 10.068 0.781 1.00 53.40 H new ATOM 0 HB VAL A 67 7.197 10.517 0.402 1.00 11.33 H new ATOM 0 HG11 VAL A 67 7.098 8.125 -0.430 1.00 53.14 H new ATOM 0 HG12 VAL A 67 6.451 8.284 1.220 1.00 53.14 H new ATOM 0 HG13 VAL A 67 5.339 8.137 -0.162 1.00 53.14 H new ATOM 0 HG21 VAL A 67 6.957 9.864 -2.017 1.00 51.42 H new ATOM 0 HG22 VAL A 67 5.188 9.940 -1.834 1.00 51.42 H new ATOM 0 HG23 VAL A 67 6.165 11.417 -1.658 1.00 51.42 H new ATOM 1098 N ALA A 68 6.219 11.853 2.774 1.00 62.01 N ATOM 1099 CA ALA A 68 6.547 12.088 4.178 1.00 32.51 C ATOM 1100 C ALA A 68 5.295 12.210 5.058 1.00 62.34 C ATOM 1101 O ALA A 68 5.222 11.600 6.130 1.00 54.10 O ATOM 1102 CB ALA A 68 7.379 13.364 4.293 1.00 13.03 C ATOM 0 H ALA A 68 6.587 12.566 2.144 1.00 62.01 H new ATOM 0 HA ALA A 68 7.113 11.227 4.535 1.00 32.51 H new ATOM 0 HB1 ALA A 68 7.626 13.544 5.339 1.00 13.03 H new ATOM 0 HB2 ALA A 68 8.298 13.253 3.717 1.00 13.03 H new ATOM 0 HB3 ALA A 68 6.807 14.207 3.905 1.00 13.03 H new ATOM 1108 N SER A 69 4.317 13.012 4.624 1.00 43.01 N ATOM 1109 CA SER A 69 3.062 13.170 5.351 1.00 11.12 C ATOM 1110 C SER A 69 2.348 11.819 5.405 1.00 72.12 C ATOM 1111 O SER A 69 1.911 11.393 6.476 1.00 74.34 O ATOM 1112 CB SER A 69 2.221 14.250 4.666 1.00 14.31 C ATOM 1113 OG SER A 69 1.052 14.563 5.384 1.00 62.04 O ATOM 0 H SER A 69 4.375 13.563 3.767 1.00 43.01 H new ATOM 0 HA SER A 69 3.238 13.493 6.377 1.00 11.12 H new ATOM 0 HB2 SER A 69 2.822 15.152 4.547 1.00 14.31 H new ATOM 0 HB3 SER A 69 1.949 13.913 3.666 1.00 14.31 H new ATOM 0 HG SER A 69 0.551 15.258 4.907 1.00 62.04 H new ATOM 1119 N ILE A 70 2.310 11.107 4.272 1.00 12.14 N ATOM 1120 CA ILE A 70 1.683 9.803 4.170 1.00 62.51 C ATOM 1121 C ILE A 70 2.275 8.860 5.229 1.00 72.23 C ATOM 1122 O ILE A 70 1.498 8.351 6.038 1.00 1.03 O ATOM 1123 CB ILE A 70 1.714 9.277 2.714 1.00 32.34 C ATOM 1124 CG1 ILE A 70 0.816 10.156 1.806 1.00 5.13 C ATOM 1125 CG2 ILE A 70 1.259 7.810 2.645 1.00 3.22 C ATOM 1126 CD1 ILE A 70 0.999 9.931 0.299 1.00 62.25 C ATOM 0 H ILE A 70 2.721 11.432 3.397 1.00 12.14 H new ATOM 0 HA ILE A 70 0.620 9.872 4.400 1.00 62.51 H new ATOM 0 HB ILE A 70 2.743 9.332 2.358 1.00 32.34 H new ATOM 0 HG12 ILE A 70 -0.227 9.969 2.062 1.00 5.13 H new ATOM 0 HG13 ILE A 70 1.016 11.204 2.028 1.00 5.13 H new ATOM 0 HG21 ILE A 70 1.291 7.467 1.611 1.00 3.22 H new ATOM 0 HG22 ILE A 70 1.923 7.194 3.252 1.00 3.22 H new ATOM 0 HG23 ILE A 70 0.240 7.727 3.024 1.00 3.22 H new ATOM 0 HD11 ILE A 70 0.328 10.591 -0.251 1.00 62.25 H new ATOM 0 HD12 ILE A 70 2.030 10.148 0.021 1.00 62.25 H new ATOM 0 HD13 ILE A 70 0.768 8.894 0.055 1.00 62.25 H new ATOM 1138 N ILE A 71 3.606 8.677 5.296 1.00 61.25 N ATOM 1139 CA ILE A 71 4.285 7.836 6.304 1.00 31.50 C ATOM 1140 C ILE A 71 3.728 8.173 7.694 1.00 71.12 C ATOM 1141 O ILE A 71 3.335 7.290 8.461 1.00 31.41 O ATOM 1142 CB ILE A 71 5.829 8.060 6.273 1.00 25.33 C ATOM 1143 CG1 ILE A 71 6.506 7.605 4.959 1.00 43.13 C ATOM 1144 CG2 ILE A 71 6.549 7.448 7.499 1.00 11.22 C ATOM 1145 CD1 ILE A 71 6.907 6.133 4.885 1.00 25.10 C ATOM 0 H ILE A 71 4.253 9.116 4.641 1.00 61.25 H new ATOM 0 HA ILE A 71 4.097 6.787 6.075 1.00 31.50 H new ATOM 0 HB ILE A 71 5.942 9.143 6.322 1.00 25.33 H new ATOM 0 HG12 ILE A 71 5.828 7.818 4.132 1.00 43.13 H new ATOM 0 HG13 ILE A 71 7.398 8.212 4.805 1.00 43.13 H new ATOM 0 HG21 ILE A 71 7.620 7.635 7.423 1.00 11.22 H new ATOM 0 HG22 ILE A 71 6.165 7.904 8.412 1.00 11.22 H new ATOM 0 HG23 ILE A 71 6.369 6.373 7.527 1.00 11.22 H new ATOM 0 HD11 ILE A 71 7.371 5.930 3.920 1.00 25.10 H new ATOM 0 HD12 ILE A 71 7.615 5.908 5.683 1.00 25.10 H new ATOM 0 HD13 ILE A 71 6.021 5.508 5.000 1.00 25.10 H new ATOM 1157 N THR A 72 3.723 9.463 8.023 1.00 72.44 N ATOM 1158 CA THR A 72 3.376 9.960 9.342 1.00 44.21 C ATOM 1159 C THR A 72 1.940 9.562 9.712 1.00 1.20 C ATOM 1160 O THR A 72 1.690 9.167 10.854 1.00 72.01 O ATOM 1161 CB THR A 72 3.626 11.480 9.361 1.00 15.43 C ATOM 1162 OG1 THR A 72 4.921 11.762 8.845 1.00 13.13 O ATOM 1163 CG2 THR A 72 3.572 12.057 10.774 1.00 71.22 C ATOM 0 H THR A 72 3.966 10.202 7.363 1.00 72.44 H new ATOM 0 HA THR A 72 4.003 9.508 10.111 1.00 44.21 H new ATOM 0 HB THR A 72 2.841 11.932 8.755 1.00 15.43 H new ATOM 0 HG1 THR A 72 4.876 11.829 7.868 1.00 13.13 H new ATOM 0 HG21 THR A 72 3.754 13.131 10.736 1.00 71.22 H new ATOM 0 HG22 THR A 72 2.589 11.871 11.206 1.00 71.22 H new ATOM 0 HG23 THR A 72 4.335 11.581 11.391 1.00 71.22 H new ATOM 1171 N LYS A 73 0.994 9.608 8.769 1.00 51.00 N ATOM 1172 CA LYS A 73 -0.388 9.226 9.040 1.00 0.52 C ATOM 1173 C LYS A 73 -0.517 7.733 9.359 1.00 72.12 C ATOM 1174 O LYS A 73 -1.322 7.389 10.228 1.00 30.30 O ATOM 1175 CB LYS A 73 -1.292 9.653 7.871 1.00 1.23 C ATOM 1176 CG LYS A 73 -2.402 10.612 8.311 1.00 62.13 C ATOM 1177 CD LYS A 73 -3.227 11.172 7.144 1.00 71.33 C ATOM 1178 CE LYS A 73 -2.493 12.300 6.415 1.00 54.45 C ATOM 1179 NZ LYS A 73 -3.411 13.069 5.549 1.00 34.52 N ATOM 0 H LYS A 73 1.165 9.908 7.809 1.00 51.00 H new ATOM 0 HA LYS A 73 -0.722 9.753 9.934 1.00 0.52 H new ATOM 0 HB2 LYS A 73 -0.685 10.132 7.102 1.00 1.23 H new ATOM 0 HB3 LYS A 73 -1.739 8.768 7.419 1.00 1.23 H new ATOM 0 HG2 LYS A 73 -3.068 10.092 9.000 1.00 62.13 H new ATOM 0 HG3 LYS A 73 -1.958 11.441 8.862 1.00 62.13 H new ATOM 0 HD2 LYS A 73 -3.451 10.370 6.440 1.00 71.33 H new ATOM 0 HD3 LYS A 73 -4.181 11.543 7.519 1.00 71.33 H new ATOM 0 HE2 LYS A 73 -2.033 12.967 7.144 1.00 54.45 H new ATOM 0 HE3 LYS A 73 -1.687 11.882 5.812 1.00 54.45 H new ATOM 0 HZ1 LYS A 73 -3.215 14.085 5.651 1.00 34.52 H new ATOM 0 HZ2 LYS A 73 -3.271 12.787 4.558 1.00 34.52 H new ATOM 0 HZ3 LYS A 73 -4.394 12.876 5.828 1.00 34.52 H new ATOM 1193 N LEU A 74 0.229 6.826 8.710 1.00 12.42 N ATOM 1194 CA LEU A 74 0.197 5.398 9.063 1.00 23.22 C ATOM 1195 C LEU A 74 0.718 5.177 10.475 1.00 21.52 C ATOM 1196 O LEU A 74 0.259 4.282 11.185 1.00 23.43 O ATOM 1197 CB LEU A 74 1.114 4.554 8.164 1.00 64.12 C ATOM 1198 CG LEU A 74 0.648 4.223 6.747 1.00 25.33 C ATOM 1199 CD1 LEU A 74 -0.792 3.686 6.694 1.00 41.02 C ATOM 1200 CD2 LEU A 74 0.850 5.392 5.797 1.00 54.00 C ATOM 0 H LEU A 74 0.859 7.054 7.941 1.00 12.42 H new ATOM 0 HA LEU A 74 -0.845 5.099 8.951 1.00 23.22 H new ATOM 0 HB2 LEU A 74 2.069 5.073 8.085 1.00 64.12 H new ATOM 0 HB3 LEU A 74 1.305 3.612 8.678 1.00 64.12 H new ATOM 0 HG LEU A 74 1.286 3.408 6.404 1.00 25.33 H new ATOM 0 HD11 LEU A 74 -1.062 3.470 5.660 1.00 41.02 H new ATOM 0 HD12 LEU A 74 -0.862 2.773 7.285 1.00 41.02 H new ATOM 0 HD13 LEU A 74 -1.474 4.434 7.099 1.00 41.02 H new ATOM 0 HD21 LEU A 74 0.506 5.115 4.801 1.00 54.00 H new ATOM 0 HD22 LEU A 74 0.281 6.251 6.151 1.00 54.00 H new ATOM 0 HD23 LEU A 74 1.908 5.649 5.757 1.00 54.00 H new ATOM 1212 N ASN A 75 1.713 5.973 10.854 1.00 73.13 N ATOM 1213 CA ASN A 75 2.488 5.821 12.077 1.00 2.22 C ATOM 1214 C ASN A 75 1.625 5.973 13.330 1.00 1.42 C ATOM 1215 O ASN A 75 2.011 5.551 14.415 1.00 24.32 O ATOM 1216 CB ASN A 75 3.599 6.878 12.079 1.00 13.23 C ATOM 1217 CG ASN A 75 4.903 6.315 12.603 1.00 33.34 C ATOM 1218 OD1 ASN A 75 4.954 5.641 13.625 1.00 43.43 O ATOM 1219 ND2 ASN A 75 5.987 6.533 11.882 1.00 42.23 N ATOM 0 H ASN A 75 2.012 6.772 10.295 1.00 73.13 H new ATOM 0 HA ASN A 75 2.907 4.815 12.099 1.00 2.22 H new ATOM 0 HB2 ASN A 75 3.745 7.255 11.067 1.00 13.23 H new ATOM 0 HB3 ASN A 75 3.295 7.725 12.694 1.00 13.23 H new ATOM 0 HD21 ASN A 75 6.881 6.138 12.174 1.00 42.23 H new ATOM 0 HD22 ASN A 75 5.930 7.096 11.033 1.00 42.23 H new ATOM 1226 N SER A 76 0.461 6.601 13.175 1.00 30.43 N ATOM 1227 CA SER A 76 -0.542 6.756 14.204 1.00 30.34 C ATOM 1228 C SER A 76 -1.299 5.436 14.401 1.00 22.34 C ATOM 1229 O SER A 76 -1.366 4.934 15.521 1.00 12.04 O ATOM 1230 CB SER A 76 -1.424 7.921 13.792 1.00 45.05 C ATOM 1231 OG SER A 76 -2.132 8.470 14.882 1.00 43.40 O ATOM 0 H SER A 76 0.189 7.030 12.290 1.00 30.43 H new ATOM 0 HA SER A 76 -0.109 6.984 15.178 1.00 30.34 H new ATOM 0 HB2 SER A 76 -0.808 8.696 13.335 1.00 45.05 H new ATOM 0 HB3 SER A 76 -2.132 7.587 13.033 1.00 45.05 H new ATOM 0 HG SER A 76 -2.684 9.217 14.570 1.00 43.40 H new ATOM 1237 N LEU A 77 -1.821 4.843 13.317 1.00 3.14 N ATOM 1238 CA LEU A 77 -2.610 3.610 13.362 1.00 32.13 C ATOM 1239 C LEU A 77 -1.821 2.477 14.001 1.00 33.34 C ATOM 1240 O LEU A 77 -2.367 1.721 14.812 1.00 11.54 O ATOM 1241 CB LEU A 77 -3.010 3.163 11.949 1.00 51.02 C ATOM 1242 CG LEU A 77 -4.039 4.070 11.262 1.00 11.34 C ATOM 1243 CD1 LEU A 77 -4.147 3.633 9.801 1.00 12.43 C ATOM 1244 CD2 LEU A 77 -5.407 3.959 11.939 1.00 3.53 C ATOM 0 H LEU A 77 -1.704 5.214 12.374 1.00 3.14 H new ATOM 0 HA LEU A 77 -3.499 3.826 13.955 1.00 32.13 H new ATOM 0 HB2 LEU A 77 -2.115 3.116 11.329 1.00 51.02 H new ATOM 0 HB3 LEU A 77 -3.414 2.152 12.002 1.00 51.02 H new ATOM 0 HG LEU A 77 -3.718 5.109 11.334 1.00 11.34 H new ATOM 0 HD11 LEU A 77 -4.873 4.262 9.286 1.00 12.43 H new ATOM 0 HD12 LEU A 77 -3.175 3.732 9.319 1.00 12.43 H new ATOM 0 HD13 LEU A 77 -4.470 2.593 9.755 1.00 12.43 H new ATOM 0 HD21 LEU A 77 -6.118 4.612 11.432 1.00 3.53 H new ATOM 0 HD22 LEU A 77 -5.758 2.928 11.884 1.00 3.53 H new ATOM 0 HD23 LEU A 77 -5.321 4.257 12.984 1.00 3.53 H new ATOM 1256 N ASN A 78 -0.538 2.381 13.636 1.00 33.30 N ATOM 1257 CA ASN A 78 0.429 1.433 14.181 1.00 50.51 C ATOM 1258 C ASN A 78 -0.116 -0.004 14.192 1.00 14.14 C ATOM 1259 O ASN A 78 -0.078 -0.716 15.201 1.00 11.24 O ATOM 1260 CB ASN A 78 0.913 1.951 15.541 1.00 32.43 C ATOM 1261 CG ASN A 78 2.098 1.163 16.069 1.00 63.10 C ATOM 1262 OD1 ASN A 78 2.808 0.486 15.331 1.00 31.22 O ATOM 1263 ND2 ASN A 78 2.367 1.284 17.353 1.00 41.21 N ATOM 0 H ASN A 78 -0.132 2.988 12.924 1.00 33.30 H new ATOM 0 HA ASN A 78 1.303 1.368 13.533 1.00 50.51 H new ATOM 0 HB2 ASN A 78 1.190 3.001 15.450 1.00 32.43 H new ATOM 0 HB3 ASN A 78 0.095 1.898 16.260 1.00 32.43 H new ATOM 0 HD21 ASN A 78 3.178 0.810 17.751 1.00 41.21 H new ATOM 0 HD22 ASN A 78 1.764 1.851 17.949 1.00 41.21 H new ATOM 1270 N GLU A 79 -0.692 -0.392 13.058 1.00 34.33 N ATOM 1271 CA GLU A 79 -1.217 -1.712 12.725 1.00 33.33 C ATOM 1272 C GLU A 79 -0.419 -2.268 11.543 1.00 75.20 C ATOM 1273 O GLU A 79 0.264 -1.486 10.876 1.00 12.34 O ATOM 1274 CB GLU A 79 -2.695 -1.540 12.339 1.00 42.15 C ATOM 1275 CG GLU A 79 -3.609 -1.641 13.563 1.00 21.33 C ATOM 1276 CD GLU A 79 -3.978 -3.085 13.936 1.00 34.25 C ATOM 1277 OE1 GLU A 79 -4.523 -3.783 13.054 1.00 53.45 O ATOM 1278 OE2 GLU A 79 -3.794 -3.493 15.113 1.00 1.53 O ATOM 0 H GLU A 79 -0.813 0.263 12.285 1.00 34.33 H new ATOM 0 HA GLU A 79 -1.132 -2.402 13.565 1.00 33.33 H new ATOM 0 HB2 GLU A 79 -2.836 -0.573 11.857 1.00 42.15 H new ATOM 0 HB3 GLU A 79 -2.973 -2.302 11.612 1.00 42.15 H new ATOM 0 HG2 GLU A 79 -3.117 -1.169 14.414 1.00 21.33 H new ATOM 0 HG3 GLU A 79 -4.523 -1.079 13.371 1.00 21.33 H new ATOM 1285 N PRO A 80 -0.497 -3.579 11.255 1.00 75.23 N ATOM 1286 CA PRO A 80 0.143 -4.133 10.079 1.00 52.52 C ATOM 1287 C PRO A 80 -0.556 -3.644 8.815 1.00 4.22 C ATOM 1288 O PRO A 80 -1.789 -3.564 8.749 1.00 32.43 O ATOM 1289 CB PRO A 80 0.055 -5.653 10.189 1.00 12.43 C ATOM 1290 CG PRO A 80 -0.842 -5.939 11.395 1.00 63.22 C ATOM 1291 CD PRO A 80 -1.321 -4.582 11.909 1.00 25.40 C ATOM 0 HA PRO A 80 1.184 -3.815 10.019 1.00 52.52 H new ATOM 0 HB2 PRO A 80 -0.363 -6.086 9.280 1.00 12.43 H new ATOM 0 HB3 PRO A 80 1.043 -6.092 10.325 1.00 12.43 H new ATOM 0 HG2 PRO A 80 -1.687 -6.566 11.110 1.00 63.22 H new ATOM 0 HG3 PRO A 80 -0.293 -6.475 12.169 1.00 63.22 H new ATOM 0 HD2 PRO A 80 -2.375 -4.429 11.677 1.00 25.40 H new ATOM 0 HD3 PRO A 80 -1.221 -4.520 12.993 1.00 25.40 H new ATOM 1299 N LEU A 81 0.249 -3.372 7.793 1.00 62.11 N ATOM 1300 CA LEU A 81 -0.202 -2.853 6.514 1.00 4.33 C ATOM 1301 C LEU A 81 0.189 -3.840 5.422 1.00 22.33 C ATOM 1302 O LEU A 81 1.137 -4.608 5.592 1.00 64.51 O ATOM 1303 CB LEU A 81 0.440 -1.482 6.235 1.00 21.44 C ATOM 1304 CG LEU A 81 0.613 -0.533 7.439 1.00 11.24 C ATOM 1305 CD1 LEU A 81 1.325 0.716 6.932 1.00 53.23 C ATOM 1306 CD2 LEU A 81 -0.696 -0.095 8.106 1.00 3.50 C ATOM 0 H LEU A 81 1.259 -3.511 7.836 1.00 62.11 H new ATOM 0 HA LEU A 81 -1.284 -2.727 6.533 1.00 4.33 H new ATOM 0 HB2 LEU A 81 1.422 -1.651 5.793 1.00 21.44 H new ATOM 0 HB3 LEU A 81 -0.164 -0.971 5.485 1.00 21.44 H new ATOM 0 HG LEU A 81 1.171 -1.081 8.198 1.00 11.24 H new ATOM 0 HD11 LEU A 81 1.466 1.414 7.757 1.00 53.23 H new ATOM 0 HD12 LEU A 81 2.296 0.440 6.520 1.00 53.23 H new ATOM 0 HD13 LEU A 81 0.723 1.188 6.156 1.00 53.23 H new ATOM 0 HD21 LEU A 81 -0.474 0.570 8.941 1.00 3.50 H new ATOM 0 HD22 LEU A 81 -1.317 0.430 7.380 1.00 3.50 H new ATOM 0 HD23 LEU A 81 -1.229 -0.972 8.472 1.00 3.50 H new ATOM 1318 N VAL A 82 -0.480 -3.769 4.276 1.00 73.11 N ATOM 1319 CA VAL A 82 -0.147 -4.528 3.077 1.00 63.12 C ATOM 1320 C VAL A 82 -0.319 -3.556 1.911 1.00 50.33 C ATOM 1321 O VAL A 82 -1.444 -3.130 1.642 1.00 31.50 O ATOM 1322 CB VAL A 82 -1.029 -5.800 2.960 1.00 51.55 C ATOM 1323 CG1 VAL A 82 -0.588 -6.690 1.790 1.00 61.24 C ATOM 1324 CG2 VAL A 82 -1.084 -6.657 4.224 1.00 23.53 C ATOM 0 H VAL A 82 -1.292 -3.164 4.153 1.00 73.11 H new ATOM 0 HA VAL A 82 0.875 -4.907 3.095 1.00 63.12 H new ATOM 0 HB VAL A 82 -2.031 -5.407 2.789 1.00 51.55 H new ATOM 0 HG11 VAL A 82 -1.229 -7.570 1.741 1.00 61.24 H new ATOM 0 HG12 VAL A 82 -0.667 -6.131 0.858 1.00 61.24 H new ATOM 0 HG13 VAL A 82 0.446 -7.002 1.940 1.00 61.24 H new ATOM 0 HG21 VAL A 82 -1.723 -7.523 4.049 1.00 23.53 H new ATOM 0 HG22 VAL A 82 -0.079 -6.993 4.480 1.00 23.53 H new ATOM 0 HG23 VAL A 82 -1.490 -6.067 5.046 1.00 23.53 H new ATOM 1334 N THR A 83 0.759 -3.111 1.260 1.00 34.51 N ATOM 1335 CA THR A 83 0.646 -2.125 0.191 1.00 34.02 C ATOM 1336 C THR A 83 1.804 -2.207 -0.806 1.00 74.41 C ATOM 1337 O THR A 83 2.782 -2.926 -0.607 1.00 51.53 O ATOM 1338 CB THR A 83 0.482 -0.729 0.816 1.00 61.55 C ATOM 1339 OG1 THR A 83 0.057 0.210 -0.145 1.00 5.42 O ATOM 1340 CG2 THR A 83 1.738 -0.206 1.522 1.00 41.04 C ATOM 0 H THR A 83 1.712 -3.417 1.455 1.00 34.51 H new ATOM 0 HA THR A 83 -0.241 -2.342 -0.404 1.00 34.02 H new ATOM 0 HB THR A 83 -0.282 -0.851 1.584 1.00 61.55 H new ATOM 0 HG1 THR A 83 -0.918 0.297 -0.108 1.00 5.42 H new ATOM 0 HG21 THR A 83 1.538 0.783 1.935 1.00 41.04 H new ATOM 0 HG22 THR A 83 2.013 -0.887 2.328 1.00 41.04 H new ATOM 0 HG23 THR A 83 2.558 -0.142 0.806 1.00 41.04 H new ATOM 1348 N MET A 84 1.658 -1.527 -1.927 1.00 41.45 N ATOM 1349 CA MET A 84 2.654 -1.375 -2.978 1.00 70.11 C ATOM 1350 C MET A 84 3.597 -0.222 -2.576 1.00 34.44 C ATOM 1351 O MET A 84 3.277 0.513 -1.631 1.00 24.32 O ATOM 1352 CB MET A 84 1.979 -1.135 -4.338 1.00 74.14 C ATOM 1353 CG MET A 84 0.668 -1.890 -4.534 1.00 42.12 C ATOM 1354 SD MET A 84 -0.769 -1.012 -3.844 1.00 25.11 S ATOM 1355 CE MET A 84 -1.936 -2.373 -3.643 1.00 23.40 C ATOM 0 H MET A 84 0.791 -1.036 -2.144 1.00 41.45 H new ATOM 0 HA MET A 84 3.239 -2.288 -3.090 1.00 70.11 H new ATOM 0 HB2 MET A 84 1.790 -0.068 -4.452 1.00 74.14 H new ATOM 0 HB3 MET A 84 2.671 -1.423 -5.129 1.00 74.14 H new ATOM 0 HG2 MET A 84 0.507 -2.057 -5.599 1.00 42.12 H new ATOM 0 HG3 MET A 84 0.747 -2.871 -4.065 1.00 42.12 H new ATOM 0 HE1 MET A 84 -2.908 -1.978 -3.346 1.00 23.40 H new ATOM 0 HE2 MET A 84 -2.035 -2.910 -4.586 1.00 23.40 H new ATOM 0 HE3 MET A 84 -1.571 -3.054 -2.874 1.00 23.40 H new ATOM 1365 N PRO A 85 4.753 -0.031 -3.215 1.00 22.55 N ATOM 1366 CA PRO A 85 5.631 1.090 -2.878 1.00 31.30 C ATOM 1367 C PRO A 85 4.930 2.395 -3.276 1.00 74.31 C ATOM 1368 O PRO A 85 4.707 2.622 -4.467 1.00 23.24 O ATOM 1369 CB PRO A 85 6.914 0.835 -3.661 1.00 61.33 C ATOM 1370 CG PRO A 85 6.440 0.074 -4.899 1.00 62.55 C ATOM 1371 CD PRO A 85 5.209 -0.700 -4.431 1.00 40.00 C ATOM 0 HA PRO A 85 5.859 1.177 -1.816 1.00 31.30 H new ATOM 0 HB2 PRO A 85 7.410 1.767 -3.930 1.00 61.33 H new ATOM 0 HB3 PRO A 85 7.627 0.250 -3.081 1.00 61.33 H new ATOM 0 HG2 PRO A 85 6.193 0.756 -5.713 1.00 62.55 H new ATOM 0 HG3 PRO A 85 7.213 -0.599 -5.270 1.00 62.55 H new ATOM 0 HD2 PRO A 85 4.431 -0.695 -5.195 1.00 40.00 H new ATOM 0 HD3 PRO A 85 5.455 -1.743 -4.234 1.00 40.00 H new ATOM 1379 N ILE A 86 4.512 3.207 -2.302 1.00 15.54 N ATOM 1380 CA ILE A 86 3.696 4.404 -2.533 1.00 1.23 C ATOM 1381 C ILE A 86 4.471 5.337 -3.465 1.00 0.23 C ATOM 1382 O ILE A 86 4.032 5.627 -4.580 1.00 12.30 O ATOM 1383 CB ILE A 86 3.287 5.067 -1.191 1.00 32.51 C ATOM 1384 CG1 ILE A 86 2.500 4.057 -0.325 1.00 62.41 C ATOM 1385 CG2 ILE A 86 2.465 6.346 -1.441 1.00 61.30 C ATOM 1386 CD1 ILE A 86 1.977 4.579 1.011 1.00 34.52 C ATOM 0 H ILE A 86 4.733 3.051 -1.318 1.00 15.54 H new ATOM 0 HA ILE A 86 2.756 4.144 -3.019 1.00 1.23 H new ATOM 0 HB ILE A 86 4.188 5.357 -0.651 1.00 32.51 H new ATOM 0 HG12 ILE A 86 1.653 3.694 -0.907 1.00 62.41 H new ATOM 0 HG13 ILE A 86 3.143 3.199 -0.130 1.00 62.41 H new ATOM 0 HG21 ILE A 86 2.189 6.794 -0.486 1.00 61.30 H new ATOM 0 HG22 ILE A 86 3.061 7.055 -2.016 1.00 61.30 H new ATOM 0 HG23 ILE A 86 1.562 6.095 -1.998 1.00 61.30 H new ATOM 0 HD11 ILE A 86 1.442 3.783 1.529 1.00 34.52 H new ATOM 0 HD12 ILE A 86 2.814 4.912 1.624 1.00 34.52 H new ATOM 0 HD13 ILE A 86 1.300 5.415 0.835 1.00 34.52 H new ATOM 1398 N GLY A 87 5.650 5.772 -3.034 1.00 25.03 N ATOM 1399 CA GLY A 87 6.539 6.563 -3.853 1.00 53.44 C ATOM 1400 C GLY A 87 7.257 5.647 -4.834 1.00 40.44 C ATOM 1401 O GLY A 87 8.366 5.215 -4.556 1.00 64.32 O ATOM 0 H GLY A 87 6.011 5.580 -2.099 1.00 25.03 H new ATOM 0 HA2 GLY A 87 5.976 7.325 -4.392 1.00 53.44 H new ATOM 0 HA3 GLY A 87 7.263 7.085 -3.227 1.00 53.44 H new ATOM 1405 N TYR A 88 6.639 5.339 -5.973 1.00 2.12 N ATOM 1406 CA TYR A 88 7.311 4.757 -7.141 1.00 62.14 C ATOM 1407 C TYR A 88 6.709 5.274 -8.451 1.00 40.24 C ATOM 1408 O TYR A 88 7.377 5.293 -9.478 1.00 65.43 O ATOM 1409 CB TYR A 88 7.268 3.225 -7.067 1.00 62.24 C ATOM 1410 CG TYR A 88 8.124 2.509 -8.102 1.00 24.14 C ATOM 1411 CD1 TYR A 88 9.525 2.447 -7.958 1.00 45.44 C ATOM 1412 CD2 TYR A 88 7.525 1.888 -9.214 1.00 0.33 C ATOM 1413 CE1 TYR A 88 10.303 1.733 -8.882 1.00 62.31 C ATOM 1414 CE2 TYR A 88 8.304 1.206 -10.163 1.00 75.45 C ATOM 1415 CZ TYR A 88 9.699 1.106 -9.990 1.00 62.10 C ATOM 1416 OH TYR A 88 10.457 0.389 -10.865 1.00 42.31 O ATOM 0 H TYR A 88 5.640 5.488 -6.116 1.00 2.12 H new ATOM 0 HA TYR A 88 8.355 5.071 -7.128 1.00 62.14 H new ATOM 0 HB2 TYR A 88 7.590 2.915 -6.073 1.00 62.24 H new ATOM 0 HB3 TYR A 88 6.234 2.899 -7.183 1.00 62.24 H new ATOM 0 HD1 TYR A 88 10.002 2.952 -7.131 1.00 45.44 H new ATOM 0 HD2 TYR A 88 6.453 1.937 -9.339 1.00 0.33 H new ATOM 0 HE1 TYR A 88 11.372 1.664 -8.743 1.00 62.31 H new ATOM 0 HE2 TYR A 88 7.834 0.758 -11.026 1.00 75.45 H new ATOM 0 HH TYR A 88 9.884 0.022 -11.570 1.00 42.31 H new ATOM 1426 N VAL A 89 5.468 5.759 -8.423 1.00 22.33 N ATOM 1427 CA VAL A 89 4.709 6.125 -9.611 1.00 2.00 C ATOM 1428 C VAL A 89 4.066 7.492 -9.395 1.00 51.30 C ATOM 1429 O VAL A 89 4.447 8.422 -10.099 1.00 1.21 O ATOM 1430 CB VAL A 89 3.729 5.004 -10.024 1.00 2.21 C ATOM 1431 CG1 VAL A 89 3.181 5.321 -11.409 1.00 12.22 C ATOM 1432 CG2 VAL A 89 4.386 3.613 -10.076 1.00 42.30 C ATOM 0 H VAL A 89 4.955 5.910 -7.555 1.00 22.33 H new ATOM 0 HA VAL A 89 5.374 6.226 -10.469 1.00 2.00 H new ATOM 0 HB VAL A 89 2.945 4.971 -9.268 1.00 2.21 H new ATOM 0 HG11 VAL A 89 2.487 4.538 -11.714 1.00 12.22 H new ATOM 0 HG12 VAL A 89 2.660 6.278 -11.384 1.00 12.22 H new ATOM 0 HG13 VAL A 89 4.004 5.375 -12.122 1.00 12.22 H new ATOM 0 HG21 VAL A 89 3.644 2.871 -10.372 1.00 42.30 H new ATOM 0 HG22 VAL A 89 5.200 3.622 -10.801 1.00 42.30 H new ATOM 0 HG23 VAL A 89 4.780 3.360 -9.092 1.00 42.30 H new ATOM 1442 N THR A 90 3.216 7.673 -8.379 1.00 32.14 N ATOM 1443 CA THR A 90 2.605 8.971 -8.056 1.00 12.51 C ATOM 1444 C THR A 90 3.631 10.062 -7.662 1.00 33.45 C ATOM 1445 O THR A 90 3.222 11.208 -7.459 1.00 23.54 O ATOM 1446 CB THR A 90 1.487 8.781 -7.000 1.00 62.23 C ATOM 1447 OG1 THR A 90 0.952 10.015 -6.553 1.00 62.25 O ATOM 1448 CG2 THR A 90 1.948 7.977 -5.778 1.00 41.10 C ATOM 0 H THR A 90 2.930 6.920 -7.753 1.00 32.14 H new ATOM 0 HA THR A 90 2.150 9.355 -8.969 1.00 12.51 H new ATOM 0 HB THR A 90 0.712 8.217 -7.518 1.00 62.23 H new ATOM 0 HG1 THR A 90 1.613 10.726 -6.687 1.00 62.25 H new ATOM 0 HG21 THR A 90 1.121 7.878 -5.075 1.00 41.10 H new ATOM 0 HG22 THR A 90 2.275 6.987 -6.096 1.00 41.10 H new ATOM 0 HG23 THR A 90 2.776 8.494 -5.294 1.00 41.10 H new ATOM 1456 N HIS A 91 4.925 9.733 -7.540 1.00 52.31 N ATOM 1457 CA HIS A 91 6.004 10.703 -7.359 1.00 11.41 C ATOM 1458 C HIS A 91 7.090 10.568 -8.439 1.00 43.01 C ATOM 1459 O HIS A 91 7.952 11.439 -8.539 1.00 62.30 O ATOM 1460 CB HIS A 91 6.613 10.553 -5.953 1.00 24.21 C ATOM 1461 CG HIS A 91 7.163 11.849 -5.413 1.00 13.03 C ATOM 1462 ND1 HIS A 91 8.179 12.593 -5.968 1.00 52.15 N ATOM 1463 CD2 HIS A 91 6.777 12.467 -4.257 1.00 33.34 C ATOM 1464 CE1 HIS A 91 8.422 13.628 -5.151 1.00 20.12 C ATOM 1465 NE2 HIS A 91 7.595 13.590 -4.091 1.00 55.42 N ATOM 0 H HIS A 91 5.252 8.767 -7.565 1.00 52.31 H new ATOM 0 HA HIS A 91 5.576 11.700 -7.461 1.00 11.41 H new ATOM 0 HB2 HIS A 91 5.852 10.174 -5.271 1.00 24.21 H new ATOM 0 HB3 HIS A 91 7.410 9.810 -5.985 1.00 24.21 H new ATOM 0 HD1 HIS A 91 8.661 12.393 -6.844 1.00 52.15 H new ATOM 0 HD2 HIS A 91 5.987 12.148 -3.594 1.00 33.34 H new ATOM 0 HE1 HIS A 91 9.174 14.384 -5.320 1.00 20.12 H new ATOM 1473 N GLY A 92 7.085 9.493 -9.232 1.00 72.53 N ATOM 1474 CA GLY A 92 8.162 9.161 -10.155 1.00 52.32 C ATOM 1475 C GLY A 92 9.470 8.856 -9.425 1.00 33.51 C ATOM 1476 O GLY A 92 10.475 9.527 -9.667 1.00 34.23 O ATOM 0 H GLY A 92 6.318 8.821 -9.247 1.00 72.53 H new ATOM 0 HA2 GLY A 92 7.872 8.298 -10.755 1.00 52.32 H new ATOM 0 HA3 GLY A 92 8.317 9.991 -10.845 1.00 52.32 H new ATOM 1480 N PHE A 93 9.476 7.858 -8.533 1.00 15.31 N ATOM 1481 CA PHE A 93 10.707 7.416 -7.858 1.00 53.32 C ATOM 1482 C PHE A 93 11.292 6.193 -8.555 1.00 34.12 C ATOM 1483 O PHE A 93 10.621 5.558 -9.368 1.00 24.43 O ATOM 1484 CB PHE A 93 10.430 7.183 -6.367 1.00 64.44 C ATOM 1485 CG PHE A 93 10.271 8.433 -5.516 1.00 1.32 C ATOM 1486 CD1 PHE A 93 10.764 9.686 -5.930 1.00 54.12 C ATOM 1487 CD2 PHE A 93 9.628 8.342 -4.269 1.00 4.43 C ATOM 1488 CE1 PHE A 93 10.574 10.822 -5.138 1.00 64.14 C ATOM 1489 CE2 PHE A 93 9.427 9.486 -3.479 1.00 62.22 C ATOM 1490 CZ PHE A 93 9.886 10.734 -3.919 1.00 22.22 C ATOM 0 H PHE A 93 8.641 7.339 -8.260 1.00 15.31 H new ATOM 0 HA PHE A 93 11.464 8.198 -7.925 1.00 53.32 H new ATOM 0 HB2 PHE A 93 9.522 6.587 -6.275 1.00 64.44 H new ATOM 0 HB3 PHE A 93 11.245 6.588 -5.955 1.00 64.44 H new ATOM 0 HD1 PHE A 93 11.293 9.770 -6.868 1.00 54.12 H new ATOM 0 HD2 PHE A 93 9.285 7.381 -3.914 1.00 4.43 H new ATOM 0 HE1 PHE A 93 10.960 11.775 -5.467 1.00 64.14 H new ATOM 0 HE2 PHE A 93 8.917 9.403 -2.530 1.00 62.22 H new ATOM 0 HZ PHE A 93 9.712 11.619 -3.326 1.00 22.22 H new ATOM 1500 N ASN A 94 12.546 5.858 -8.249 1.00 73.34 N ATOM 1501 CA ASN A 94 13.169 4.605 -8.681 1.00 34.42 C ATOM 1502 C ASN A 94 13.197 3.642 -7.493 1.00 11.52 C ATOM 1503 O ASN A 94 12.835 4.023 -6.377 1.00 54.05 O ATOM 1504 CB ASN A 94 14.578 4.856 -9.246 1.00 15.01 C ATOM 1505 CG ASN A 94 14.599 5.662 -10.542 1.00 74.22 C ATOM 1506 OD1 ASN A 94 15.373 6.596 -10.683 1.00 75.51 O ATOM 1507 ND2 ASN A 94 13.786 5.330 -11.536 1.00 1.00 N ATOM 0 H ASN A 94 13.162 6.451 -7.692 1.00 73.34 H new ATOM 0 HA ASN A 94 12.587 4.160 -9.488 1.00 34.42 H new ATOM 0 HB2 ASN A 94 15.170 5.380 -8.496 1.00 15.01 H new ATOM 0 HB3 ASN A 94 15.063 3.896 -9.421 1.00 15.01 H new ATOM 0 HD21 ASN A 94 13.810 5.854 -12.411 1.00 1.00 H new ATOM 0 HD22 ASN A 94 13.137 4.551 -11.425 1.00 1.00 H new ATOM 1514 N LEU A 95 13.601 2.386 -7.721 1.00 31.02 N ATOM 1515 CA LEU A 95 13.474 1.308 -6.737 1.00 54.11 C ATOM 1516 C LEU A 95 14.216 1.613 -5.434 1.00 50.11 C ATOM 1517 O LEU A 95 13.756 1.197 -4.373 1.00 45.02 O ATOM 1518 CB LEU A 95 13.954 -0.039 -7.330 1.00 41.31 C ATOM 1519 CG LEU A 95 13.140 -1.240 -6.809 1.00 21.13 C ATOM 1520 CD1 LEU A 95 11.732 -1.255 -7.423 1.00 52.32 C ATOM 1521 CD2 LEU A 95 13.801 -2.587 -7.134 1.00 35.11 C ATOM 0 H LEU A 95 14.027 2.089 -8.599 1.00 31.02 H new ATOM 0 HA LEU A 95 12.415 1.230 -6.493 1.00 54.11 H new ATOM 0 HB2 LEU A 95 13.881 0.000 -8.417 1.00 41.31 H new ATOM 0 HB3 LEU A 95 15.006 -0.185 -7.086 1.00 41.31 H new ATOM 0 HG LEU A 95 13.092 -1.117 -5.727 1.00 21.13 H new ATOM 0 HD11 LEU A 95 11.177 -2.112 -7.040 1.00 52.32 H new ATOM 0 HD12 LEU A 95 11.209 -0.336 -7.157 1.00 52.32 H new ATOM 0 HD13 LEU A 95 11.809 -1.328 -8.508 1.00 52.32 H new ATOM 0 HD21 LEU A 95 13.186 -3.398 -6.744 1.00 35.11 H new ATOM 0 HD22 LEU A 95 13.899 -2.693 -8.214 1.00 35.11 H new ATOM 0 HD23 LEU A 95 14.789 -2.628 -6.674 1.00 35.11 H new ATOM 1533 N GLU A 96 15.335 2.339 -5.514 1.00 54.22 N ATOM 1534 CA GLU A 96 16.057 2.816 -4.348 1.00 44.32 C ATOM 1535 C GLU A 96 15.181 3.803 -3.578 1.00 61.34 C ATOM 1536 O GLU A 96 14.822 3.526 -2.439 1.00 74.41 O ATOM 1537 CB GLU A 96 17.387 3.447 -4.776 1.00 24.25 C ATOM 1538 CG GLU A 96 18.229 3.889 -3.568 1.00 63.31 C ATOM 1539 CD GLU A 96 19.022 5.155 -3.876 1.00 72.41 C ATOM 1540 OE1 GLU A 96 18.488 6.265 -3.657 1.00 41.03 O ATOM 1541 OE2 GLU A 96 20.185 5.015 -4.318 1.00 52.00 O ATOM 0 H GLU A 96 15.762 2.610 -6.400 1.00 54.22 H new ATOM 0 HA GLU A 96 16.289 1.982 -3.686 1.00 44.32 H new ATOM 0 HB2 GLU A 96 17.954 2.730 -5.370 1.00 24.25 H new ATOM 0 HB3 GLU A 96 17.191 4.307 -5.416 1.00 24.25 H new ATOM 0 HG2 GLU A 96 17.577 4.065 -2.713 1.00 63.31 H new ATOM 0 HG3 GLU A 96 18.913 3.088 -3.287 1.00 63.31 H new ATOM 1548 N GLU A 97 14.826 4.943 -4.178 1.00 75.52 N ATOM 1549 CA GLU A 97 14.032 5.986 -3.532 1.00 23.34 C ATOM 1550 C GLU A 97 12.760 5.408 -2.917 1.00 0.32 C ATOM 1551 O GLU A 97 12.430 5.725 -1.776 1.00 51.34 O ATOM 1552 CB GLU A 97 13.666 7.076 -4.540 1.00 64.13 C ATOM 1553 CG GLU A 97 14.823 8.021 -4.849 1.00 63.22 C ATOM 1554 CD GLU A 97 14.331 9.150 -5.751 1.00 11.52 C ATOM 1555 OE1 GLU A 97 14.125 8.894 -6.961 1.00 62.23 O ATOM 1556 OE2 GLU A 97 14.110 10.277 -5.253 1.00 74.51 O ATOM 0 H GLU A 97 15.087 5.168 -5.138 1.00 75.52 H new ATOM 0 HA GLU A 97 14.636 6.419 -2.735 1.00 23.34 H new ATOM 0 HB2 GLU A 97 13.330 6.608 -5.465 1.00 64.13 H new ATOM 0 HB3 GLU A 97 12.827 7.654 -4.152 1.00 64.13 H new ATOM 0 HG2 GLU A 97 15.229 8.431 -3.924 1.00 63.22 H new ATOM 0 HG3 GLU A 97 15.631 7.476 -5.338 1.00 63.22 H new ATOM 1563 N ALA A 98 12.076 4.519 -3.635 1.00 41.45 N ATOM 1564 CA ALA A 98 10.882 3.839 -3.158 1.00 4.34 C ATOM 1565 C ALA A 98 11.115 3.051 -1.867 1.00 12.40 C ATOM 1566 O ALA A 98 10.221 2.969 -1.021 1.00 5.32 O ATOM 1567 CB ALA A 98 10.394 2.899 -4.255 1.00 21.04 C ATOM 0 H ALA A 98 12.344 4.249 -4.581 1.00 41.45 H new ATOM 0 HA ALA A 98 10.135 4.598 -2.925 1.00 4.34 H new ATOM 0 HB1 ALA A 98 9.498 2.379 -3.916 1.00 21.04 H new ATOM 0 HB2 ALA A 98 10.163 3.475 -5.151 1.00 21.04 H new ATOM 0 HB3 ALA A 98 11.172 2.171 -4.483 1.00 21.04 H new ATOM 1573 N ALA A 99 12.284 2.436 -1.708 1.00 21.33 N ATOM 1574 CA ALA A 99 12.686 1.804 -0.462 1.00 3.41 C ATOM 1575 C ALA A 99 13.043 2.863 0.583 1.00 1.23 C ATOM 1576 O ALA A 99 12.571 2.771 1.715 1.00 13.53 O ATOM 1577 CB ALA A 99 13.858 0.858 -0.721 1.00 40.40 C ATOM 0 H ALA A 99 12.982 2.364 -2.448 1.00 21.33 H new ATOM 0 HA ALA A 99 11.854 1.220 -0.067 1.00 3.41 H new ATOM 0 HB1 ALA A 99 14.158 0.385 0.214 1.00 40.40 H new ATOM 0 HB2 ALA A 99 13.556 0.091 -1.434 1.00 40.40 H new ATOM 0 HB3 ALA A 99 14.698 1.422 -1.128 1.00 40.40 H new ATOM 1583 N ARG A 100 13.842 3.880 0.234 1.00 1.01 N ATOM 1584 CA ARG A 100 14.320 4.895 1.187 1.00 74.21 C ATOM 1585 C ARG A 100 13.146 5.676 1.769 1.00 61.13 C ATOM 1586 O ARG A 100 13.208 6.104 2.924 1.00 31.02 O ATOM 1587 CB ARG A 100 15.363 5.852 0.565 1.00 13.11 C ATOM 1588 CG ARG A 100 16.481 5.117 -0.197 1.00 24.12 C ATOM 1589 CD ARG A 100 17.887 5.720 -0.083 1.00 41.22 C ATOM 1590 NE ARG A 100 18.025 7.007 -0.785 1.00 52.32 N ATOM 1591 CZ ARG A 100 19.109 7.798 -0.773 1.00 35.32 C ATOM 1592 NH1 ARG A 100 20.212 7.446 -0.115 1.00 20.35 N ATOM 1593 NH2 ARG A 100 19.082 8.953 -1.420 1.00 32.00 N ATOM 0 H ARG A 100 14.177 4.024 -0.719 1.00 1.01 H new ATOM 0 HA ARG A 100 14.826 4.363 1.993 1.00 74.21 H new ATOM 0 HB2 ARG A 100 14.858 6.537 -0.116 1.00 13.11 H new ATOM 0 HB3 ARG A 100 15.808 6.458 1.355 1.00 13.11 H new ATOM 0 HG2 ARG A 100 16.520 4.088 0.160 1.00 24.12 H new ATOM 0 HG3 ARG A 100 16.209 5.079 -1.252 1.00 24.12 H new ATOM 0 HD2 ARG A 100 18.131 5.860 0.970 1.00 41.22 H new ATOM 0 HD3 ARG A 100 18.612 5.014 -0.487 1.00 41.22 H new ATOM 0 HE ARG A 100 17.224 7.326 -1.330 1.00 52.32 H new ATOM 0 HH11 ARG A 100 20.243 6.561 0.392 1.00 20.35 H new ATOM 0 HH12 ARG A 100 21.026 8.061 -0.118 1.00 20.35 H new ATOM 0 HH21 ARG A 100 18.241 9.236 -1.923 1.00 32.00 H new ATOM 0 HH22 ARG A 100 19.902 9.559 -1.415 1.00 32.00 H new ATOM 1607 N CYS A 101 12.072 5.819 0.996 1.00 23.31 N ATOM 1608 CA CYS A 101 10.757 6.236 1.438 1.00 32.33 C ATOM 1609 C CYS A 101 10.203 5.222 2.436 1.00 41.24 C ATOM 1610 O CYS A 101 10.225 5.491 3.638 1.00 42.12 O ATOM 1611 CB CYS A 101 9.828 6.392 0.230 1.00 20.32 C ATOM 1612 SG CYS A 101 10.363 7.803 -0.762 1.00 14.53 S ATOM 0 H CYS A 101 12.104 5.636 -0.007 1.00 23.31 H new ATOM 0 HA CYS A 101 10.827 7.202 1.938 1.00 32.33 H new ATOM 0 HB2 CYS A 101 9.842 5.484 -0.373 1.00 20.32 H new ATOM 0 HB3 CYS A 101 8.801 6.537 0.564 1.00 20.32 H new ATOM 0 HG CYS A 101 9.671 7.847 -1.862 1.00 14.53 H new ATOM 1618 N MET A 102 9.721 4.071 1.946 1.00 23.33 N ATOM 1619 CA MET A 102 8.856 3.164 2.705 1.00 3.45 C ATOM 1620 C MET A 102 9.490 2.750 4.034 1.00 73.42 C ATOM 1621 O MET A 102 8.811 2.753 5.065 1.00 64.05 O ATOM 1622 CB MET A 102 8.519 1.915 1.873 1.00 13.32 C ATOM 1623 CG MET A 102 7.500 2.182 0.755 1.00 34.35 C ATOM 1624 SD MET A 102 5.814 2.580 1.300 1.00 21.32 S ATOM 1625 CE MET A 102 5.204 0.956 1.823 1.00 64.31 C ATOM 0 H MET A 102 9.924 3.743 1.002 1.00 23.33 H new ATOM 0 HA MET A 102 7.937 3.706 2.927 1.00 3.45 H new ATOM 0 HB2 MET A 102 9.436 1.523 1.433 1.00 13.32 H new ATOM 0 HB3 MET A 102 8.127 1.142 2.534 1.00 13.32 H new ATOM 0 HG2 MET A 102 7.868 3.006 0.143 1.00 34.35 H new ATOM 0 HG3 MET A 102 7.456 1.303 0.112 1.00 34.35 H new ATOM 0 HE1 MET A 102 4.206 1.062 2.247 1.00 64.31 H new ATOM 0 HE2 MET A 102 5.164 0.288 0.963 1.00 64.31 H new ATOM 0 HE3 MET A 102 5.875 0.540 2.574 1.00 64.31 H new ATOM 1635 N ARG A 103 10.792 2.452 4.016 1.00 72.13 N ATOM 1636 CA ARG A 103 11.582 2.010 5.161 1.00 0.00 C ATOM 1637 C ARG A 103 11.574 3.013 6.319 1.00 62.42 C ATOM 1638 O ARG A 103 11.853 2.617 7.449 1.00 1.22 O ATOM 1639 CB ARG A 103 12.995 1.718 4.625 1.00 72.44 C ATOM 1640 CG ARG A 103 14.024 1.201 5.636 1.00 12.14 C ATOM 1641 CD ARG A 103 15.000 2.307 6.044 1.00 24.10 C ATOM 1642 NE ARG A 103 16.050 1.785 6.926 1.00 51.33 N ATOM 1643 CZ ARG A 103 16.934 2.514 7.610 1.00 13.42 C ATOM 1644 NH1 ARG A 103 16.949 3.833 7.473 1.00 2.41 N ATOM 1645 NH2 ARG A 103 17.779 1.905 8.433 1.00 61.03 N ATOM 0 H ARG A 103 11.346 2.516 3.162 1.00 72.13 H new ATOM 0 HA ARG A 103 11.148 1.113 5.601 1.00 0.00 H new ATOM 0 HB2 ARG A 103 12.909 0.985 3.823 1.00 72.44 H new ATOM 0 HB3 ARG A 103 13.386 2.633 4.180 1.00 72.44 H new ATOM 0 HG2 ARG A 103 13.511 0.820 6.519 1.00 12.14 H new ATOM 0 HG3 ARG A 103 14.576 0.366 5.203 1.00 12.14 H new ATOM 0 HD2 ARG A 103 15.452 2.744 5.154 1.00 24.10 H new ATOM 0 HD3 ARG A 103 14.458 3.106 6.551 1.00 24.10 H new ATOM 0 HE ARG A 103 16.110 0.772 7.025 1.00 51.33 H new ATOM 0 HH11 ARG A 103 16.286 4.288 6.846 1.00 2.41 H new ATOM 0 HH12 ARG A 103 17.624 4.392 7.995 1.00 2.41 H new ATOM 0 HH21 ARG A 103 17.748 0.891 8.537 1.00 61.03 H new ATOM 0 HH22 ARG A 103 18.459 2.451 8.961 1.00 61.03 H new ATOM 1659 N SER A 104 11.258 4.286 6.075 1.00 31.22 N ATOM 1660 CA SER A 104 11.187 5.319 7.108 1.00 63.13 C ATOM 1661 C SER A 104 9.933 5.207 7.992 1.00 74.44 C ATOM 1662 O SER A 104 9.818 5.927 8.989 1.00 45.11 O ATOM 1663 CB SER A 104 11.242 6.695 6.433 1.00 12.53 C ATOM 1664 OG SER A 104 12.349 6.769 5.549 1.00 74.45 O ATOM 0 H SER A 104 11.041 4.633 5.141 1.00 31.22 H new ATOM 0 HA SER A 104 12.039 5.181 7.774 1.00 63.13 H new ATOM 0 HB2 SER A 104 10.318 6.875 5.884 1.00 12.53 H new ATOM 0 HB3 SER A 104 11.320 7.475 7.190 1.00 12.53 H new ATOM 0 HG SER A 104 12.108 6.366 4.689 1.00 74.45 H new ATOM 1670 N LEU A 105 8.977 4.335 7.652 1.00 74.45 N ATOM 1671 CA LEU A 105 7.863 4.011 8.530 1.00 71.14 C ATOM 1672 C LEU A 105 8.351 3.132 9.688 1.00 44.54 C ATOM 1673 O LEU A 105 9.453 2.586 9.678 1.00 23.51 O ATOM 1674 CB LEU A 105 6.761 3.355 7.684 1.00 42.03 C ATOM 1675 CG LEU A 105 5.442 3.015 8.401 1.00 1.44 C ATOM 1676 CD1 LEU A 105 4.797 4.209 9.125 1.00 62.50 C ATOM 1677 CD2 LEU A 105 4.435 2.481 7.384 1.00 41.44 C ATOM 0 H LEU A 105 8.960 3.839 6.761 1.00 74.45 H new ATOM 0 HA LEU A 105 7.441 4.905 8.989 1.00 71.14 H new ATOM 0 HB2 LEU A 105 6.533 4.019 6.850 1.00 42.03 H new ATOM 0 HB3 LEU A 105 7.162 2.435 7.258 1.00 42.03 H new ATOM 0 HG LEU A 105 5.696 2.273 9.158 1.00 1.44 H new ATOM 0 HD11 LEU A 105 3.873 3.887 9.605 1.00 62.50 H new ATOM 0 HD12 LEU A 105 5.484 4.591 9.880 1.00 62.50 H new ATOM 0 HD13 LEU A 105 4.577 4.996 8.404 1.00 62.50 H new ATOM 0 HD21 LEU A 105 3.500 2.240 7.890 1.00 41.44 H new ATOM 0 HD22 LEU A 105 4.250 3.239 6.622 1.00 41.44 H new ATOM 0 HD23 LEU A 105 4.835 1.583 6.913 1.00 41.44 H new ATOM 1689 N LYS A 106 7.526 3.038 10.724 1.00 61.45 N ATOM 1690 CA LYS A 106 7.736 2.383 11.991 1.00 15.30 C ATOM 1691 C LYS A 106 6.805 1.169 12.118 1.00 41.54 C ATOM 1692 O LYS A 106 7.227 0.143 12.653 1.00 64.43 O ATOM 1693 CB LYS A 106 7.501 3.495 13.025 1.00 14.20 C ATOM 1694 CG LYS A 106 7.053 2.995 14.388 1.00 41.45 C ATOM 1695 CD LYS A 106 7.619 3.842 15.523 1.00 71.22 C ATOM 1696 CE LYS A 106 7.043 3.335 16.846 1.00 51.51 C ATOM 1697 NZ LYS A 106 7.508 4.119 18.006 1.00 1.10 N ATOM 0 H LYS A 106 6.601 3.466 10.684 1.00 61.45 H new ATOM 0 HA LYS A 106 8.730 1.958 12.126 1.00 15.30 H new ATOM 0 HB2 LYS A 106 8.422 4.065 13.145 1.00 14.20 H new ATOM 0 HB3 LYS A 106 6.749 4.183 12.638 1.00 14.20 H new ATOM 0 HG2 LYS A 106 5.964 3.004 14.437 1.00 41.45 H new ATOM 0 HG3 LYS A 106 7.369 1.960 14.516 1.00 41.45 H new ATOM 0 HD2 LYS A 106 8.707 3.779 15.535 1.00 71.22 H new ATOM 0 HD3 LYS A 106 7.362 4.891 15.376 1.00 71.22 H new ATOM 0 HE2 LYS A 106 5.955 3.371 16.801 1.00 51.51 H new ATOM 0 HE3 LYS A 106 7.322 2.290 16.983 1.00 51.51 H new ATOM 0 HZ1 LYS A 106 7.088 3.734 18.876 1.00 1.10 H new ATOM 0 HZ2 LYS A 106 8.545 4.065 18.068 1.00 1.10 H new ATOM 0 HZ3 LYS A 106 7.219 5.112 17.892 1.00 1.10 H new ATOM 1711 N ALA A 107 5.555 1.287 11.660 1.00 3.42 N ATOM 1712 CA ALA A 107 4.609 0.178 11.619 1.00 14.33 C ATOM 1713 C ALA A 107 5.057 -0.847 10.571 1.00 34.23 C ATOM 1714 O ALA A 107 5.599 -0.430 9.539 1.00 13.23 O ATOM 1715 CB ALA A 107 3.215 0.718 11.281 1.00 13.35 C ATOM 0 H ALA A 107 5.172 2.164 11.305 1.00 3.42 H new ATOM 0 HA ALA A 107 4.574 -0.315 12.591 1.00 14.33 H new ATOM 0 HB1 ALA A 107 2.503 -0.107 11.249 1.00 13.35 H new ATOM 0 HB2 ALA A 107 2.907 1.433 12.044 1.00 13.35 H new ATOM 0 HB3 ALA A 107 3.242 1.212 10.310 1.00 13.35 H new ATOM 1721 N PRO A 108 4.822 -2.152 10.794 1.00 21.12 N ATOM 1722 CA PRO A 108 5.201 -3.179 9.840 1.00 11.45 C ATOM 1723 C PRO A 108 4.331 -3.083 8.584 1.00 32.10 C ATOM 1724 O PRO A 108 3.105 -2.985 8.668 1.00 51.12 O ATOM 1725 CB PRO A 108 5.036 -4.514 10.572 1.00 23.02 C ATOM 1726 CG PRO A 108 3.985 -4.224 11.642 1.00 23.41 C ATOM 1727 CD PRO A 108 4.216 -2.751 11.977 1.00 73.13 C ATOM 0 HA PRO A 108 6.229 -3.067 9.495 1.00 11.45 H new ATOM 0 HB2 PRO A 108 4.708 -5.302 9.894 1.00 23.02 H new ATOM 0 HB3 PRO A 108 5.975 -4.845 11.015 1.00 23.02 H new ATOM 0 HG2 PRO A 108 2.975 -4.398 11.270 1.00 23.41 H new ATOM 0 HG3 PRO A 108 4.117 -4.860 12.517 1.00 23.41 H new ATOM 0 HD2 PRO A 108 3.277 -2.257 12.225 1.00 73.13 H new ATOM 0 HD3 PRO A 108 4.869 -2.647 12.843 1.00 73.13 H new ATOM 1735 N ALA A 109 4.957 -3.135 7.410 1.00 64.42 N ATOM 1736 CA ALA A 109 4.294 -3.081 6.123 1.00 50.44 C ATOM 1737 C ALA A 109 4.775 -4.268 5.304 1.00 75.25 C ATOM 1738 O ALA A 109 5.962 -4.389 4.991 1.00 4.20 O ATOM 1739 CB ALA A 109 4.589 -1.751 5.418 1.00 14.53 C ATOM 0 H ALA A 109 5.971 -3.218 7.333 1.00 64.42 H new ATOM 0 HA ALA A 109 3.212 -3.136 6.246 1.00 50.44 H new ATOM 0 HB1 ALA A 109 4.082 -1.730 4.453 1.00 14.53 H new ATOM 0 HB2 ALA A 109 4.231 -0.926 6.034 1.00 14.53 H new ATOM 0 HB3 ALA A 109 5.664 -1.651 5.265 1.00 14.53 H new ATOM 1745 N VAL A 110 3.847 -5.147 4.938 1.00 41.54 N ATOM 1746 CA VAL A 110 4.067 -6.019 3.801 1.00 51.00 C ATOM 1747 C VAL A 110 4.115 -5.100 2.587 1.00 10.15 C ATOM 1748 O VAL A 110 3.226 -4.261 2.402 1.00 2.01 O ATOM 1749 CB VAL A 110 2.964 -7.083 3.693 1.00 22.31 C ATOM 1750 CG1 VAL A 110 3.281 -8.079 2.571 1.00 72.50 C ATOM 1751 CG2 VAL A 110 2.836 -7.824 5.027 1.00 10.40 C ATOM 0 H VAL A 110 2.950 -5.270 5.407 1.00 41.54 H new ATOM 0 HA VAL A 110 4.994 -6.585 3.893 1.00 51.00 H new ATOM 0 HB VAL A 110 2.021 -6.589 3.458 1.00 22.31 H new ATOM 0 HG11 VAL A 110 2.488 -8.824 2.511 1.00 72.50 H new ATOM 0 HG12 VAL A 110 3.352 -7.548 1.622 1.00 72.50 H new ATOM 0 HG13 VAL A 110 4.229 -8.574 2.781 1.00 72.50 H new ATOM 0 HG21 VAL A 110 2.053 -8.579 4.950 1.00 10.40 H new ATOM 0 HG22 VAL A 110 3.783 -8.307 5.268 1.00 10.40 H new ATOM 0 HG23 VAL A 110 2.580 -7.115 5.814 1.00 10.40 H new ATOM 1761 N VAL A 111 5.163 -5.247 1.788 1.00 2.23 N ATOM 1762 CA VAL A 111 5.357 -4.466 0.576 1.00 20.24 C ATOM 1763 C VAL A 111 5.356 -5.448 -0.588 1.00 65.01 C ATOM 1764 O VAL A 111 5.946 -6.521 -0.470 1.00 3.42 O ATOM 1765 CB VAL A 111 6.619 -3.588 0.684 1.00 62.21 C ATOM 1766 CG1 VAL A 111 6.880 -2.781 -0.597 1.00 2.14 C ATOM 1767 CG2 VAL A 111 6.502 -2.597 1.855 1.00 44.22 C ATOM 0 H VAL A 111 5.910 -5.919 1.966 1.00 2.23 H new ATOM 0 HA VAL A 111 4.553 -3.748 0.413 1.00 20.24 H new ATOM 0 HB VAL A 111 7.449 -4.275 0.848 1.00 62.21 H new ATOM 0 HG11 VAL A 111 7.780 -2.179 -0.471 1.00 2.14 H new ATOM 0 HG12 VAL A 111 7.015 -3.464 -1.436 1.00 2.14 H new ATOM 0 HG13 VAL A 111 6.031 -2.127 -0.795 1.00 2.14 H new ATOM 0 HG21 VAL A 111 7.405 -1.990 1.909 1.00 44.22 H new ATOM 0 HG22 VAL A 111 5.639 -1.950 1.699 1.00 44.22 H new ATOM 0 HG23 VAL A 111 6.379 -3.148 2.787 1.00 44.22 H new ATOM 1777 N SER A 112 4.702 -5.125 -1.701 1.00 61.42 N ATOM 1778 CA SER A 112 4.825 -5.954 -2.890 1.00 71.22 C ATOM 1779 C SER A 112 5.884 -5.389 -3.835 1.00 51.05 C ATOM 1780 O SER A 112 6.211 -4.199 -3.794 1.00 1.11 O ATOM 1781 CB SER A 112 3.467 -6.160 -3.557 1.00 50.23 C ATOM 1782 OG SER A 112 2.812 -4.950 -3.894 1.00 4.22 O ATOM 0 H SER A 112 4.094 -4.312 -1.802 1.00 61.42 H new ATOM 0 HA SER A 112 5.171 -6.945 -2.597 1.00 71.22 H new ATOM 0 HB2 SER A 112 3.602 -6.754 -4.461 1.00 50.23 H new ATOM 0 HB3 SER A 112 2.827 -6.736 -2.889 1.00 50.23 H new ATOM 0 HG SER A 112 1.842 -5.083 -3.859 1.00 4.22 H new ATOM 1788 N VAL A 113 6.372 -6.239 -4.729 1.00 33.21 N ATOM 1789 CA VAL A 113 7.016 -5.899 -5.988 1.00 73.10 C ATOM 1790 C VAL A 113 6.308 -6.719 -7.079 1.00 4.43 C ATOM 1791 O VAL A 113 5.393 -7.496 -6.785 1.00 3.11 O ATOM 1792 CB VAL A 113 8.524 -6.242 -5.960 1.00 54.12 C ATOM 1793 CG1 VAL A 113 9.343 -5.366 -5.007 1.00 41.24 C ATOM 1794 CG2 VAL A 113 8.782 -7.705 -5.595 1.00 75.04 C ATOM 0 H VAL A 113 6.325 -7.247 -4.584 1.00 33.21 H new ATOM 0 HA VAL A 113 6.938 -4.828 -6.177 1.00 73.10 H new ATOM 0 HB VAL A 113 8.853 -6.045 -6.980 1.00 54.12 H new ATOM 0 HG11 VAL A 113 10.390 -5.668 -5.044 1.00 41.24 H new ATOM 0 HG12 VAL A 113 9.256 -4.322 -5.307 1.00 41.24 H new ATOM 0 HG13 VAL A 113 8.967 -5.484 -3.991 1.00 41.24 H new ATOM 0 HG21 VAL A 113 9.855 -7.895 -5.589 1.00 75.04 H new ATOM 0 HG22 VAL A 113 8.372 -7.911 -4.606 1.00 75.04 H new ATOM 0 HG23 VAL A 113 8.303 -8.353 -6.329 1.00 75.04 H new ATOM 1804 N SER A 114 6.751 -6.577 -8.330 1.00 2.34 N ATOM 1805 CA SER A 114 6.347 -7.439 -9.419 1.00 71.33 C ATOM 1806 C SER A 114 7.035 -8.807 -9.286 1.00 63.41 C ATOM 1807 O SER A 114 6.432 -9.752 -8.777 1.00 12.23 O ATOM 1808 CB SER A 114 6.586 -6.727 -10.763 1.00 12.21 C ATOM 1809 OG SER A 114 5.761 -7.282 -11.769 1.00 5.51 O ATOM 0 H SER A 114 7.408 -5.848 -8.608 1.00 2.34 H new ATOM 0 HA SER A 114 5.277 -7.643 -9.378 1.00 71.33 H new ATOM 0 HB2 SER A 114 6.378 -5.662 -10.660 1.00 12.21 H new ATOM 0 HB3 SER A 114 7.633 -6.821 -11.050 1.00 12.21 H new ATOM 0 HG SER A 114 5.923 -6.818 -12.617 1.00 5.51 H new ATOM 1815 N SER A 115 8.272 -8.949 -9.767 1.00 30.11 N ATOM 1816 CA SER A 115 8.912 -10.251 -9.919 1.00 64.35 C ATOM 1817 C SER A 115 9.405 -10.758 -8.561 1.00 51.14 C ATOM 1818 O SER A 115 9.826 -9.932 -7.749 1.00 22.30 O ATOM 1819 CB SER A 115 10.100 -10.137 -10.887 1.00 31.30 C ATOM 1820 OG SER A 115 9.777 -9.316 -11.995 1.00 53.21 O ATOM 0 H SER A 115 8.854 -8.165 -10.061 1.00 30.11 H new ATOM 0 HA SER A 115 8.184 -10.956 -10.320 1.00 64.35 H new ATOM 0 HB2 SER A 115 10.962 -9.724 -10.363 1.00 31.30 H new ATOM 0 HB3 SER A 115 10.385 -11.129 -11.236 1.00 31.30 H new ATOM 0 HG SER A 115 10.549 -9.258 -12.595 1.00 53.21 H new ATOM 1826 N PRO A 116 9.483 -12.081 -8.328 1.00 61.54 N ATOM 1827 CA PRO A 116 10.168 -12.640 -7.166 1.00 30.43 C ATOM 1828 C PRO A 116 11.609 -12.135 -7.089 1.00 64.14 C ATOM 1829 O PRO A 116 12.151 -11.921 -6.008 1.00 61.10 O ATOM 1830 CB PRO A 116 10.092 -14.161 -7.329 1.00 44.21 C ATOM 1831 CG PRO A 116 9.908 -14.358 -8.827 1.00 63.42 C ATOM 1832 CD PRO A 116 9.089 -13.141 -9.239 1.00 52.10 C ATOM 0 HA PRO A 116 9.702 -12.332 -6.230 1.00 30.43 H new ATOM 0 HB2 PRO A 116 10.999 -14.647 -6.970 1.00 44.21 H new ATOM 0 HB3 PRO A 116 9.260 -14.582 -6.765 1.00 44.21 H new ATOM 0 HG2 PRO A 116 10.864 -14.396 -9.349 1.00 63.42 H new ATOM 0 HG3 PRO A 116 9.386 -15.289 -9.050 1.00 63.42 H new ATOM 0 HD2 PRO A 116 9.291 -12.864 -10.274 1.00 52.10 H new ATOM 0 HD3 PRO A 116 8.021 -13.344 -9.166 1.00 52.10 H new ATOM 1840 N ASP A 117 12.238 -11.881 -8.231 1.00 30.23 N ATOM 1841 CA ASP A 117 13.616 -11.431 -8.311 1.00 72.51 C ATOM 1842 C ASP A 117 13.776 -10.052 -7.676 1.00 21.42 C ATOM 1843 O ASP A 117 14.797 -9.790 -7.042 1.00 11.42 O ATOM 1844 CB ASP A 117 14.076 -11.362 -9.781 1.00 32.44 C ATOM 1845 CG ASP A 117 13.658 -12.565 -10.623 1.00 61.40 C ATOM 1846 OD1 ASP A 117 12.437 -12.708 -10.861 1.00 34.02 O ATOM 1847 OD2 ASP A 117 14.538 -13.343 -11.049 1.00 72.12 O ATOM 0 H ASP A 117 11.793 -11.985 -9.143 1.00 30.23 H new ATOM 0 HA ASP A 117 14.231 -12.149 -7.768 1.00 72.51 H new ATOM 0 HB2 ASP A 117 13.672 -10.457 -10.235 1.00 32.44 H new ATOM 0 HB3 ASP A 117 15.162 -11.274 -9.807 1.00 32.44 H new ATOM 1852 N ALA A 118 12.761 -9.185 -7.819 1.00 1.14 N ATOM 1853 CA ALA A 118 12.789 -7.815 -7.314 1.00 24.43 C ATOM 1854 C ALA A 118 12.662 -7.769 -5.796 1.00 32.34 C ATOM 1855 O ALA A 118 12.979 -6.738 -5.207 1.00 73.12 O ATOM 1856 CB ALA A 118 11.668 -6.977 -7.947 1.00 34.43 C ATOM 0 H ALA A 118 11.891 -9.424 -8.295 1.00 1.14 H new ATOM 0 HA ALA A 118 13.756 -7.394 -7.591 1.00 24.43 H new ATOM 0 HB1 ALA A 118 11.709 -5.960 -7.556 1.00 34.43 H new ATOM 0 HB2 ALA A 118 11.797 -6.955 -9.029 1.00 34.43 H new ATOM 0 HB3 ALA A 118 10.702 -7.420 -7.706 1.00 34.43 H new ATOM 1862 N VAL A 119 12.203 -8.855 -5.168 1.00 55.51 N ATOM 1863 CA VAL A 119 11.951 -8.920 -3.739 1.00 62.34 C ATOM 1864 C VAL A 119 13.269 -8.620 -3.029 1.00 51.02 C ATOM 1865 O VAL A 119 13.349 -7.662 -2.264 1.00 32.35 O ATOM 1866 CB VAL A 119 11.352 -10.297 -3.381 1.00 64.32 C ATOM 1867 CG1 VAL A 119 10.943 -10.377 -1.904 1.00 11.40 C ATOM 1868 CG2 VAL A 119 10.057 -10.576 -4.157 1.00 14.44 C ATOM 0 H VAL A 119 11.994 -9.727 -5.655 1.00 55.51 H new ATOM 0 HA VAL A 119 11.216 -8.183 -3.414 1.00 62.34 H new ATOM 0 HB VAL A 119 12.137 -11.013 -3.626 1.00 64.32 H new ATOM 0 HG11 VAL A 119 10.526 -11.362 -1.695 1.00 11.40 H new ATOM 0 HG12 VAL A 119 11.818 -10.212 -1.275 1.00 11.40 H new ATOM 0 HG13 VAL A 119 10.194 -9.614 -1.692 1.00 11.40 H new ATOM 0 HG21 VAL A 119 9.668 -11.555 -3.876 1.00 14.44 H new ATOM 0 HG22 VAL A 119 9.318 -9.810 -3.920 1.00 14.44 H new ATOM 0 HG23 VAL A 119 10.264 -10.561 -5.227 1.00 14.44 H new ATOM 1878 N THR A 120 14.321 -9.380 -3.338 1.00 43.31 N ATOM 1879 CA THR A 120 15.632 -9.203 -2.733 1.00 34.21 C ATOM 1880 C THR A 120 16.275 -7.874 -3.148 1.00 50.40 C ATOM 1881 O THR A 120 16.912 -7.245 -2.300 1.00 71.04 O ATOM 1882 CB THR A 120 16.502 -10.416 -3.085 1.00 62.31 C ATOM 1883 OG1 THR A 120 15.828 -11.589 -2.666 1.00 13.41 O ATOM 1884 CG2 THR A 120 17.851 -10.384 -2.364 1.00 71.40 C ATOM 0 H THR A 120 14.282 -10.138 -4.019 1.00 43.31 H new ATOM 0 HA THR A 120 15.531 -9.149 -1.649 1.00 34.21 H new ATOM 0 HB THR A 120 16.676 -10.398 -4.161 1.00 62.31 H new ATOM 0 HG1 THR A 120 16.371 -12.375 -2.886 1.00 13.41 H new ATOM 0 HG21 THR A 120 18.434 -11.262 -2.643 1.00 71.40 H new ATOM 0 HG22 THR A 120 18.394 -9.483 -2.648 1.00 71.40 H new ATOM 0 HG23 THR A 120 17.688 -10.385 -1.286 1.00 71.40 H new ATOM 1892 N THR A 121 16.105 -7.428 -4.398 1.00 53.34 N ATOM 1893 CA THR A 121 16.634 -6.153 -4.873 1.00 2.21 C ATOM 1894 C THR A 121 16.083 -5.014 -3.998 1.00 63.30 C ATOM 1895 O THR A 121 16.844 -4.282 -3.360 1.00 61.02 O ATOM 1896 CB THR A 121 16.272 -5.979 -6.363 1.00 53.23 C ATOM 1897 OG1 THR A 121 16.452 -7.177 -7.101 1.00 61.12 O ATOM 1898 CG2 THR A 121 17.065 -4.871 -7.052 1.00 61.44 C ATOM 0 H THR A 121 15.592 -7.948 -5.110 1.00 53.34 H new ATOM 0 HA THR A 121 17.721 -6.130 -4.792 1.00 2.21 H new ATOM 0 HB THR A 121 15.218 -5.702 -6.356 1.00 53.23 H new ATOM 0 HG1 THR A 121 16.210 -7.023 -8.038 1.00 61.12 H new ATOM 0 HG21 THR A 121 16.762 -4.802 -8.097 1.00 61.44 H new ATOM 0 HG22 THR A 121 16.871 -3.921 -6.554 1.00 61.44 H new ATOM 0 HG23 THR A 121 18.130 -5.098 -6.998 1.00 61.44 H new ATOM 1906 N TYR A 122 14.753 -4.896 -3.918 1.00 24.30 N ATOM 1907 CA TYR A 122 14.082 -3.873 -3.132 1.00 32.33 C ATOM 1908 C TYR A 122 14.456 -4.023 -1.657 1.00 2.31 C ATOM 1909 O TYR A 122 14.812 -3.035 -1.017 1.00 10.12 O ATOM 1910 CB TYR A 122 12.563 -3.970 -3.335 1.00 33.34 C ATOM 1911 CG TYR A 122 11.759 -2.865 -2.663 1.00 52.23 C ATOM 1912 CD1 TYR A 122 11.498 -2.895 -1.278 1.00 43.14 C ATOM 1913 CD2 TYR A 122 11.265 -1.795 -3.431 1.00 55.53 C ATOM 1914 CE1 TYR A 122 10.732 -1.878 -0.678 1.00 61.24 C ATOM 1915 CE2 TYR A 122 10.544 -0.749 -2.831 1.00 45.12 C ATOM 1916 CZ TYR A 122 10.267 -0.791 -1.450 1.00 75.43 C ATOM 1917 OH TYR A 122 9.521 0.183 -0.866 1.00 42.55 O ATOM 0 H TYR A 122 14.111 -5.520 -4.406 1.00 24.30 H new ATOM 0 HA TYR A 122 14.405 -2.887 -3.465 1.00 32.33 H new ATOM 0 HB2 TYR A 122 12.351 -3.956 -4.404 1.00 33.34 H new ATOM 0 HB3 TYR A 122 12.220 -4.932 -2.955 1.00 33.34 H new ATOM 0 HD1 TYR A 122 11.887 -3.702 -0.675 1.00 43.14 H new ATOM 0 HD2 TYR A 122 11.442 -1.777 -4.496 1.00 55.53 H new ATOM 0 HE1 TYR A 122 10.499 -1.929 0.375 1.00 61.24 H new ATOM 0 HE2 TYR A 122 10.203 0.085 -3.427 1.00 45.12 H new ATOM 0 HH TYR A 122 9.932 1.056 -1.037 1.00 42.55 H new ATOM 1927 N ASN A 123 14.398 -5.245 -1.104 1.00 60.33 N ATOM 1928 CA ASN A 123 14.689 -5.453 0.317 1.00 52.43 C ATOM 1929 C ASN A 123 16.139 -5.088 0.650 1.00 72.40 C ATOM 1930 O ASN A 123 16.444 -4.788 1.801 1.00 11.42 O ATOM 1931 CB ASN A 123 14.396 -6.888 0.795 1.00 31.31 C ATOM 1932 CG ASN A 123 13.733 -6.945 2.171 1.00 65.52 C ATOM 1933 OD1 ASN A 123 13.755 -6.003 2.959 1.00 2.41 O ATOM 1934 ND2 ASN A 123 13.060 -8.035 2.495 1.00 24.51 N ATOM 0 H ASN A 123 14.155 -6.093 -1.615 1.00 60.33 H new ATOM 0 HA ASN A 123 14.014 -4.786 0.852 1.00 52.43 H new ATOM 0 HB2 ASN A 123 13.750 -7.381 0.068 1.00 31.31 H new ATOM 0 HB3 ASN A 123 15.329 -7.451 0.826 1.00 31.31 H new ATOM 0 HD21 ASN A 123 12.569 -8.085 3.388 1.00 24.51 H new ATOM 0 HD22 ASN A 123 13.031 -8.827 1.852 1.00 24.51 H new ATOM 1941 N GLY A 124 17.034 -5.097 -0.341 1.00 73.43 N ATOM 1942 CA GLY A 124 18.409 -4.658 -0.198 1.00 73.23 C ATOM 1943 C GLY A 124 18.467 -3.141 -0.083 1.00 34.53 C ATOM 1944 O GLY A 124 19.085 -2.621 0.846 1.00 71.41 O ATOM 0 H GLY A 124 16.810 -5.418 -1.283 1.00 73.43 H new ATOM 0 HA2 GLY A 124 18.854 -5.114 0.686 1.00 73.23 H new ATOM 0 HA3 GLY A 124 18.995 -4.988 -1.056 1.00 73.23 H new ATOM 1948 N TYR A 125 17.797 -2.414 -0.989 1.00 20.44 N ATOM 1949 CA TYR A 125 17.764 -0.951 -0.954 1.00 50.44 C ATOM 1950 C TYR A 125 17.252 -0.394 0.382 1.00 74.43 C ATOM 1951 O TYR A 125 17.592 0.740 0.713 1.00 23.52 O ATOM 1952 CB TYR A 125 16.954 -0.365 -2.117 1.00 64.43 C ATOM 1953 CG TYR A 125 17.546 -0.525 -3.509 1.00 25.25 C ATOM 1954 CD1 TYR A 125 18.825 -0.015 -3.825 1.00 35.22 C ATOM 1955 CD2 TYR A 125 16.769 -1.109 -4.523 1.00 23.33 C ATOM 1956 CE1 TYR A 125 19.322 -0.097 -5.142 1.00 1.23 C ATOM 1957 CE2 TYR A 125 17.262 -1.202 -5.833 1.00 24.14 C ATOM 1958 CZ TYR A 125 18.537 -0.691 -6.156 1.00 31.21 C ATOM 1959 OH TYR A 125 18.954 -0.751 -7.454 1.00 63.45 O ATOM 0 H TYR A 125 17.268 -2.823 -1.759 1.00 20.44 H new ATOM 0 HA TYR A 125 18.802 -0.636 -1.063 1.00 50.44 H new ATOM 0 HB2 TYR A 125 15.967 -0.827 -2.112 1.00 64.43 H new ATOM 0 HB3 TYR A 125 16.809 0.699 -1.929 1.00 64.43 H new ATOM 0 HD1 TYR A 125 19.426 0.441 -3.052 1.00 35.22 H new ATOM 0 HD2 TYR A 125 15.785 -1.489 -4.292 1.00 23.33 H new ATOM 0 HE1 TYR A 125 20.301 0.294 -5.376 1.00 1.23 H new ATOM 0 HE2 TYR A 125 16.661 -1.668 -6.600 1.00 24.14 H new ATOM 0 HH TYR A 125 18.272 -1.199 -7.996 1.00 63.45 H new ATOM 1969 N LEU A 126 16.528 -1.184 1.190 1.00 32.12 N ATOM 1970 CA LEU A 126 16.132 -0.807 2.552 1.00 72.44 C ATOM 1971 C LEU A 126 17.332 -0.386 3.403 1.00 24.44 C ATOM 1972 O LEU A 126 17.166 0.401 4.336 1.00 43.44 O ATOM 1973 CB LEU A 126 15.416 -1.968 3.284 1.00 3.03 C ATOM 1974 CG LEU A 126 14.024 -2.417 2.800 1.00 1.34 C ATOM 1975 CD1 LEU A 126 13.040 -2.582 3.955 1.00 72.33 C ATOM 1976 CD2 LEU A 126 13.373 -1.496 1.781 1.00 3.14 C ATOM 0 H LEU A 126 16.199 -2.109 0.913 1.00 32.12 H new ATOM 0 HA LEU A 126 15.451 0.036 2.436 1.00 72.44 H new ATOM 0 HB2 LEU A 126 16.073 -2.837 3.243 1.00 3.03 H new ATOM 0 HB3 LEU A 126 15.324 -1.687 4.333 1.00 3.03 H new ATOM 0 HG LEU A 126 14.229 -3.372 2.316 1.00 1.34 H new ATOM 0 HD11 LEU A 126 12.072 -2.899 3.566 1.00 72.33 H new ATOM 0 HD12 LEU A 126 13.416 -3.333 4.649 1.00 72.33 H new ATOM 0 HD13 LEU A 126 12.927 -1.631 4.476 1.00 72.33 H new ATOM 0 HD21 LEU A 126 12.398 -1.895 1.501 1.00 3.14 H new ATOM 0 HD22 LEU A 126 13.248 -0.504 2.215 1.00 3.14 H new ATOM 0 HD23 LEU A 126 14.005 -1.428 0.896 1.00 3.14 H new ATOM 1988 N THR A 127 18.523 -0.920 3.129 1.00 41.54 N ATOM 1989 CA THR A 127 19.694 -0.796 3.988 1.00 11.33 C ATOM 1990 C THR A 127 20.930 -0.380 3.183 1.00 0.44 C ATOM 1991 O THR A 127 22.035 -0.426 3.718 1.00 11.31 O ATOM 1992 CB THR A 127 19.898 -2.120 4.760 1.00 21.21 C ATOM 1993 OG1 THR A 127 20.444 -3.139 3.941 1.00 35.24 O ATOM 1994 CG2 THR A 127 18.584 -2.677 5.321 1.00 31.41 C ATOM 0 H THR A 127 18.701 -1.462 2.284 1.00 41.54 H new ATOM 0 HA THR A 127 19.534 -0.002 4.717 1.00 11.33 H new ATOM 0 HB THR A 127 20.583 -1.863 5.568 1.00 21.21 H new ATOM 0 HG1 THR A 127 20.558 -3.957 4.469 1.00 35.24 H new ATOM 0 HG21 THR A 127 18.781 -3.607 5.854 1.00 31.41 H new ATOM 0 HG22 THR A 127 18.145 -1.952 6.006 1.00 31.41 H new ATOM 0 HG23 THR A 127 17.891 -2.868 4.502 1.00 31.41 H new ATOM 2002 N SER A 128 20.765 -0.078 1.892 1.00 35.11 N ATOM 2003 CA SER A 128 21.871 0.002 0.955 1.00 41.12 C ATOM 2004 C SER A 128 22.553 1.376 1.016 1.00 10.44 C ATOM 2005 O SER A 128 22.117 2.286 1.729 1.00 73.22 O ATOM 2006 CB SER A 128 21.356 -0.344 -0.451 1.00 50.43 C ATOM 2007 OG SER A 128 22.383 -0.598 -1.392 1.00 25.32 O ATOM 0 H SER A 128 19.855 0.117 1.474 1.00 35.11 H new ATOM 0 HA SER A 128 22.640 -0.722 1.226 1.00 41.12 H new ATOM 0 HB2 SER A 128 20.712 -1.221 -0.386 1.00 50.43 H new ATOM 0 HB3 SER A 128 20.739 0.478 -0.814 1.00 50.43 H new ATOM 0 HG SER A 128 21.984 -0.812 -2.261 1.00 25.32 H new ATOM 2013 N SER A 129 23.604 1.501 0.202 1.00 51.03 N ATOM 2014 CA SER A 129 24.581 2.573 0.125 1.00 33.51 C ATOM 2015 C SER A 129 25.051 2.949 1.522 1.00 23.23 C ATOM 2016 O SER A 129 24.592 3.959 2.097 1.00 11.54 O ATOM 2017 CB SER A 129 24.076 3.736 -0.733 1.00 74.12 C ATOM 2018 OG SER A 129 23.337 3.277 -1.861 1.00 41.41 O ATOM 0 H SER A 129 23.806 0.776 -0.487 1.00 51.03 H new ATOM 0 HA SER A 129 25.471 2.228 -0.402 1.00 33.51 H new ATOM 0 HB2 SER A 129 23.447 4.389 -0.127 1.00 74.12 H new ATOM 0 HB3 SER A 129 24.923 4.333 -1.071 1.00 74.12 H new ATOM 0 HG SER A 129 23.029 4.046 -2.385 1.00 41.41 H new TER 2024 SER A 129