USER MOD reduce.3.24.130724 H: found=0, std=0, add=1152, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1147 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 142 LYS NZ :NH3+ -147:sc= 0.0619 (180deg=-0.633) USER MOD Set 1.2: A 146 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 5 TYR OH : rot 180:sc= 0.231 USER MOD Set 2.2: A 61 HIS : no HD1:sc= -6.76! C(o=-6.5!,f=-14!) USER MOD Set 3.1: A 43 CYS SG : rot -25:sc= -2.45 USER MOD Set 3.2: A 45 GLN : amide:sc= -1.79 K(o=-4.2,f=-5.9!) USER MOD Set 4.1: A 39 ASN : amide:sc= -0.546 K(o=-0.55,f=-3.3!) USER MOD Set 4.2: A 48 GLN : amide:sc= 0 K(o=-0.55,f=-2.3) USER MOD Set 5.1: A 25 ASN : amide:sc= 0.0803 X(o=-0.48,f=-0.2) USER MOD Set 5.2: A 38 CYS SG : rot -116:sc= -0.563 USER MOD Set 6.1: A 12 TYR OH : rot 180:sc= 0 USER MOD Set 6.2: A 16 HIS : no HD1:sc= -5.88! C(o=-5.9!,f=-14!) USER MOD Single : A 1 MET CE :methyl -155:sc= -0.106 (180deg=-0.951) USER MOD Single : A 1 MET N :NH3+ -163:sc= -0.0115 (180deg=-0.294) USER MOD Single : A 3 HIS : no HD1:sc= -3.54 K(o=-3.5,f=-10!) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 GLN : amide:sc= -0.0899 X(o=-0.09,f=-0.41) USER MOD Single : A 10 GLN :FLIP amide:sc= -0.149 F(o=-0.94,f=-0.15) USER MOD Single : A 15 GLN : amide:sc=-0.00656 K(o=-0.0066,f=-1.5) USER MOD Single : A 17 ASN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 23 TYR OH : rot 0:sc= 0 USER MOD Single : A 32 HIS :FLIP no HD1:sc= -0.881 F(o=-1.4,f=-0.88) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot -140:sc= 0.689 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot -170:sc= -2.07 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 SER OG : rot 160:sc= -0.581 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 SER OG : rot 114:sc= 1.1 USER MOD Single : A 72 THR OG1 : rot -105:sc= 0.951 USER MOD Single : A 74 GLN : amide:sc= -0.252 K(o=-0.25,f=-0.88) USER MOD Single : A 75 SER OG : rot 180:sc= -2.75! USER MOD Single : A 83 TYR OH : rot 150:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ -162:sc= -0.0389 (180deg=-0.446) USER MOD Single : A 85 ASN :FLIP amide:sc= -0.331 F(o=-1.2,f=-0.33) USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 92 GLN : amide:sc= -0.205 K(o=-0.21,f=-0.8) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot -60:sc= 0.911 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 101 TYR OH : rot 180:sc= -1.4 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 THR OG1 : rot 37:sc= 0.193 USER MOD Single : A 106 SER OG : rot 180:sc=-0.00966 USER MOD Single : A 109 SER OG : rot -32:sc= 0.0478 USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 113 THR OG1 : rot 4:sc= 1.06 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot -99:sc= 0.651 USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ -165:sc= -0.0207 (180deg=-0.237) USER MOD Single : A 126 SER OG : rot 180:sc= -0.0154 USER MOD Single : A 131 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.231) USER MOD Single : A 132 THR OG1 : rot 141:sc= -2.09 USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 MET CE :methyl 145:sc= 0 (180deg=-0.0166) USER MOD Single : A 139 SER OG : rot 79:sc= -0.151 USER MOD Single : A 147 SER OG : rot 130:sc= -0.113 USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 ASN : amide:sc= -0.663 K(o=-0.66,f=-3.9!) USER MOD Single : A 152 ASN : amide:sc= -1.52 K(o=-1.5,f=-3.2!) USER MOD Single : A 153 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -13.735 59.262 11.277 1.00 0.00 N ATOM 2 CA MET A 1 -15.092 59.165 10.665 1.00 0.00 C ATOM 3 C MET A 1 -15.351 57.722 10.235 1.00 0.00 C ATOM 4 O MET A 1 -15.279 56.802 11.049 1.00 0.00 O ATOM 5 CB MET A 1 -15.168 60.096 9.455 1.00 0.00 C ATOM 6 CG MET A 1 -15.079 61.550 9.918 1.00 0.00 C ATOM 7 SD MET A 1 -15.280 62.644 8.489 1.00 0.00 S ATOM 8 CE MET A 1 -13.718 62.249 7.662 1.00 0.00 C ATOM 0 H1 MET A 1 -13.662 60.145 11.822 1.00 0.00 H new ATOM 0 H2 MET A 1 -13.581 58.451 11.910 1.00 0.00 H new ATOM 0 H3 MET A 1 -13.015 59.258 10.527 1.00 0.00 H new ATOM 0 HA MET A 1 -15.849 59.461 11.391 1.00 0.00 H new ATOM 0 HB2 MET A 1 -14.356 59.875 8.762 1.00 0.00 H new ATOM 0 HB3 MET A 1 -16.101 59.932 8.916 1.00 0.00 H new ATOM 0 HG2 MET A 1 -15.851 61.756 10.660 1.00 0.00 H new ATOM 0 HG3 MET A 1 -14.118 61.733 10.399 1.00 0.00 H new ATOM 0 HE1 MET A 1 -13.420 63.085 7.029 1.00 0.00 H new ATOM 0 HE2 MET A 1 -12.946 62.067 8.410 1.00 0.00 H new ATOM 0 HE3 MET A 1 -13.846 61.357 7.048 1.00 0.00 H new ATOM 20 N ASP A 2 -15.651 57.535 8.952 1.00 0.00 N ATOM 21 CA ASP A 2 -15.915 56.204 8.424 1.00 0.00 C ATOM 22 C ASP A 2 -14.629 55.393 8.338 1.00 0.00 C ATOM 23 O ASP A 2 -13.621 55.871 7.817 1.00 0.00 O ATOM 24 CB ASP A 2 -16.548 56.310 7.036 1.00 0.00 C ATOM 25 CG ASP A 2 -16.853 54.918 6.498 1.00 0.00 C ATOM 26 OD1 ASP A 2 -17.615 54.211 7.135 1.00 0.00 O ATOM 27 OD2 ASP A 2 -16.318 54.578 5.455 1.00 0.00 O1- ATOM 0 H ASP A 2 -15.717 58.285 8.264 1.00 0.00 H new ATOM 0 HA ASP A 2 -16.603 55.697 9.100 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -17.464 56.898 7.089 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -15.873 56.832 6.358 1.00 0.00 H new ATOM 32 N HIS A 3 -14.673 54.167 8.851 1.00 0.00 N ATOM 33 CA HIS A 3 -13.504 53.301 8.832 1.00 0.00 C ATOM 34 C HIS A 3 -12.302 54.023 9.425 1.00 0.00 C ATOM 35 O HIS A 3 -12.352 55.227 9.678 1.00 0.00 O ATOM 36 CB HIS A 3 -13.192 52.888 7.400 1.00 0.00 C ATOM 37 CG HIS A 3 -14.238 51.927 6.907 1.00 0.00 C ATOM 38 ND1 HIS A 3 -15.456 52.354 6.403 1.00 0.00 N ATOM 39 CD2 HIS A 3 -14.262 50.556 6.836 1.00 0.00 C ATOM 40 CE1 HIS A 3 -16.157 51.259 6.057 1.00 0.00 C ATOM 41 NE2 HIS A 3 -15.476 50.135 6.300 1.00 0.00 N ATOM 0 H HIS A 3 -15.501 53.755 9.282 1.00 0.00 H new ATOM 0 HA HIS A 3 -13.716 52.414 9.429 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -13.161 53.767 6.757 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -12.207 52.424 7.352 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -13.461 49.903 7.149 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -17.150 51.285 5.634 1.00 0.00 H new ATOM 0 HE2 HIS A 3 -15.780 49.176 6.130 1.00 0.00 H new ATOM 49 N VAL A 4 -11.220 53.276 9.660 1.00 0.00 N ATOM 50 CA VAL A 4 -10.008 53.833 10.236 1.00 0.00 C ATOM 51 C VAL A 4 -8.830 53.744 9.269 1.00 0.00 C ATOM 52 O VAL A 4 -8.195 54.748 8.957 1.00 0.00 O ATOM 53 CB VAL A 4 -9.670 53.069 11.519 1.00 0.00 C ATOM 54 CG1 VAL A 4 -10.746 53.353 12.583 1.00 0.00 C ATOM 55 CG2 VAL A 4 -9.581 51.535 11.266 1.00 0.00 C ATOM 0 H VAL A 4 -11.166 52.278 9.456 1.00 0.00 H new ATOM 0 HA VAL A 4 -10.185 54.887 10.451 1.00 0.00 H new ATOM 0 HB VAL A 4 -8.695 53.410 11.869 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -10.506 52.809 13.497 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -10.776 54.422 12.794 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -11.719 53.029 12.213 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -9.339 51.026 12.199 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -10.538 51.172 10.892 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -8.803 51.332 10.530 1.00 0.00 H new ATOM 65 N TYR A 5 -8.533 52.535 8.826 1.00 0.00 N ATOM 66 CA TYR A 5 -7.413 52.299 7.916 1.00 0.00 C ATOM 67 C TYR A 5 -7.809 52.544 6.472 1.00 0.00 C ATOM 68 O TYR A 5 -6.969 52.875 5.638 1.00 0.00 O ATOM 69 CB TYR A 5 -6.908 50.861 8.112 1.00 0.00 C ATOM 70 CG TYR A 5 -5.976 50.780 9.318 1.00 0.00 C ATOM 71 CD1 TYR A 5 -6.065 51.688 10.384 1.00 0.00 C ATOM 72 CD2 TYR A 5 -5.010 49.787 9.352 1.00 0.00 C ATOM 73 CE1 TYR A 5 -5.189 51.596 11.459 1.00 0.00 C ATOM 74 CE2 TYR A 5 -4.124 49.690 10.434 1.00 0.00 C ATOM 75 CZ TYR A 5 -4.215 50.606 11.485 1.00 0.00 C ATOM 76 OH TYR A 5 -3.354 50.520 12.556 1.00 0.00 O ATOM 0 H TYR A 5 -9.051 51.694 9.080 1.00 0.00 H new ATOM 0 HA TYR A 5 -6.612 53.002 8.147 1.00 0.00 H new ATOM 0 HB2 TYR A 5 -7.754 50.189 8.253 1.00 0.00 H new ATOM 0 HB3 TYR A 5 -6.383 50.529 7.216 1.00 0.00 H new ATOM 0 HD1 TYR A 5 -6.818 52.462 10.369 1.00 0.00 H new ATOM 0 HD2 TYR A 5 -4.939 49.081 8.537 1.00 0.00 H new ATOM 0 HE1 TYR A 5 -5.266 52.297 12.277 1.00 0.00 H new ATOM 0 HE2 TYR A 5 -3.375 48.912 10.455 1.00 0.00 H new ATOM 0 HH TYR A 5 -2.735 49.773 12.419 1.00 0.00 H new ATOM 86 N LYS A 6 -9.083 52.381 6.185 1.00 0.00 N ATOM 87 CA LYS A 6 -9.564 52.583 4.833 1.00 0.00 C ATOM 88 C LYS A 6 -9.236 53.996 4.361 1.00 0.00 C ATOM 89 O LYS A 6 -8.999 54.224 3.177 1.00 0.00 O ATOM 90 CB LYS A 6 -11.072 52.373 4.784 1.00 0.00 C ATOM 91 CG LYS A 6 -11.549 52.393 3.336 1.00 0.00 C ATOM 92 CD LYS A 6 -13.053 52.104 3.290 1.00 0.00 C ATOM 93 CE LYS A 6 -13.527 52.108 1.835 1.00 0.00 C ATOM 94 NZ LYS A 6 -14.983 51.797 1.784 1.00 0.00 N1+ ATOM 0 H LYS A 6 -9.798 52.112 6.861 1.00 0.00 H new ATOM 0 HA LYS A 6 -9.073 51.864 4.178 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -11.331 51.422 5.249 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -11.576 53.154 5.353 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -11.340 53.364 2.887 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -11.007 51.649 2.753 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -13.263 51.138 3.750 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -13.597 52.855 3.863 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -13.336 53.081 1.382 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -12.967 51.373 1.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -15.304 51.800 0.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -15.152 50.859 2.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -15.510 52.515 2.321 1.00 0.00 H new ATOM 108 N GLY A 7 -9.228 54.940 5.295 1.00 0.00 N ATOM 109 CA GLY A 7 -8.928 56.327 4.963 1.00 0.00 C ATOM 110 C GLY A 7 -7.511 56.471 4.417 1.00 0.00 C ATOM 111 O GLY A 7 -7.245 57.330 3.576 1.00 0.00 O ATOM 0 H GLY A 7 -9.424 54.772 6.282 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -9.643 56.690 4.225 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -9.043 56.949 5.851 1.00 0.00 H new ATOM 115 N GLN A 8 -6.603 55.622 4.892 1.00 0.00 N ATOM 116 CA GLN A 8 -5.220 55.659 4.436 1.00 0.00 C ATOM 117 C GLN A 8 -5.079 54.987 3.080 1.00 0.00 C ATOM 118 O GLN A 8 -4.522 55.560 2.146 1.00 0.00 O ATOM 119 CB GLN A 8 -4.312 54.966 5.454 1.00 0.00 C ATOM 120 CG GLN A 8 -2.848 55.271 5.124 1.00 0.00 C ATOM 121 CD GLN A 8 -2.073 55.555 6.405 1.00 0.00 C ATOM 122 OE1 GLN A 8 -2.530 56.327 7.249 1.00 0.00 O ATOM 123 NE2 GLN A 8 -0.921 54.975 6.603 1.00 0.00 N ATOM 0 H GLN A 8 -6.801 54.904 5.589 1.00 0.00 H new ATOM 0 HA GLN A 8 -4.922 56.703 4.338 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -4.548 55.310 6.461 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -4.483 53.890 5.436 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -2.402 54.427 4.599 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -2.789 56.130 4.455 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -0.545 54.336 5.903 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -0.397 55.161 7.458 1.00 0.00 H new ATOM 132 N LEU A 9 -5.580 53.767 2.983 1.00 0.00 N ATOM 133 CA LEU A 9 -5.495 53.020 1.736 1.00 0.00 C ATOM 134 C LEU A 9 -6.249 53.748 0.649 1.00 0.00 C ATOM 135 O LEU A 9 -5.780 53.855 -0.485 1.00 0.00 O ATOM 136 CB LEU A 9 -6.061 51.603 1.934 1.00 0.00 C ATOM 137 CG LEU A 9 -5.735 50.736 0.709 1.00 0.00 C ATOM 138 CD1 LEU A 9 -4.240 50.350 0.697 1.00 0.00 C ATOM 139 CD2 LEU A 9 -6.595 49.469 0.743 1.00 0.00 C ATOM 0 H LEU A 9 -6.046 53.275 3.745 1.00 0.00 H new ATOM 0 HA LEU A 9 -4.450 52.936 1.437 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -5.636 51.154 2.832 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -7.140 51.650 2.081 1.00 0.00 H new ATOM 0 HG LEU A 9 -5.951 51.306 -0.194 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -4.030 49.736 -0.179 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -3.631 51.253 0.661 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -4.002 49.788 1.600 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -6.367 48.851 -0.125 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -6.382 48.909 1.654 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -7.649 49.744 0.725 1.00 0.00 H new ATOM 151 N GLN A 10 -7.422 54.227 0.994 1.00 0.00 N ATOM 152 CA GLN A 10 -8.240 54.920 0.023 1.00 0.00 C ATOM 153 C GLN A 10 -7.510 56.149 -0.508 1.00 0.00 C ATOM 154 O GLN A 10 -7.618 56.490 -1.686 1.00 0.00 O ATOM 155 CB GLN A 10 -9.581 55.337 0.643 1.00 0.00 C ATOM 156 CG GLN A 10 -10.457 56.026 -0.410 1.00 0.00 C ATOM 157 CD GLN A 10 -11.854 56.260 0.154 1.00 0.00 C ATOM 158 OE1 GLN A 10 -12.569 55.239 0.541 1.00 0.00 O flip ATOM 159 NE2 GLN A 10 -12.307 57.403 0.252 1.00 0.00 N flip ATOM 0 H GLN A 10 -7.828 54.152 1.927 1.00 0.00 H new ATOM 0 HA GLN A 10 -8.434 54.238 -0.805 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -10.095 54.461 1.039 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -9.409 56.012 1.482 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -10.010 56.976 -0.704 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -10.516 55.410 -1.307 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -11.748 58.201 -0.050 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -13.241 57.550 0.636 1.00 0.00 H new ATOM 168 N ALA A 11 -6.769 56.805 0.372 1.00 0.00 N ATOM 169 CA ALA A 11 -6.018 57.994 -0.010 1.00 0.00 C ATOM 170 C ALA A 11 -4.934 57.636 -1.021 1.00 0.00 C ATOM 171 O ALA A 11 -4.683 58.381 -1.965 1.00 0.00 O ATOM 172 CB ALA A 11 -5.377 58.622 1.229 1.00 0.00 C ATOM 0 H ALA A 11 -6.671 56.537 1.351 1.00 0.00 H new ATOM 0 HA ALA A 11 -6.704 58.708 -0.466 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -4.817 59.511 0.938 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -6.155 58.900 1.940 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -4.702 57.903 1.693 1.00 0.00 H new ATOM 178 N TYR A 12 -4.297 56.485 -0.818 1.00 0.00 N ATOM 179 CA TYR A 12 -3.243 56.039 -1.722 1.00 0.00 C ATOM 180 C TYR A 12 -3.792 55.856 -3.133 1.00 0.00 C ATOM 181 O TYR A 12 -3.201 56.326 -4.105 1.00 0.00 O ATOM 182 CB TYR A 12 -2.652 54.718 -1.218 1.00 0.00 C ATOM 183 CG TYR A 12 -1.649 54.198 -2.224 1.00 0.00 C ATOM 184 CD1 TYR A 12 -0.418 54.847 -2.384 1.00 0.00 C ATOM 185 CD2 TYR A 12 -1.950 53.069 -2.999 1.00 0.00 C ATOM 186 CE1 TYR A 12 0.508 54.369 -3.317 1.00 0.00 C ATOM 187 CE2 TYR A 12 -1.024 52.591 -3.930 1.00 0.00 C ATOM 188 CZ TYR A 12 0.206 53.240 -4.090 1.00 0.00 C ATOM 189 OH TYR A 12 1.120 52.768 -5.011 1.00 0.00 O ATOM 0 H TYR A 12 -4.490 55.851 -0.043 1.00 0.00 H new ATOM 0 HA TYR A 12 -2.461 56.798 -1.748 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -2.170 54.868 -0.252 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -3.446 53.986 -1.068 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -0.184 55.716 -1.787 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -2.899 52.568 -2.876 1.00 0.00 H new ATOM 0 HE1 TYR A 12 1.456 54.870 -3.442 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -1.257 51.721 -4.526 1.00 0.00 H new ATOM 0 HH TYR A 12 0.753 51.978 -5.461 1.00 0.00 H new ATOM 199 N ALA A 13 -4.925 55.172 -3.236 1.00 0.00 N ATOM 200 CA ALA A 13 -5.547 54.937 -4.532 1.00 0.00 C ATOM 201 C ALA A 13 -5.835 56.266 -5.228 1.00 0.00 C ATOM 202 O ALA A 13 -5.711 56.385 -6.448 1.00 0.00 O ATOM 203 CB ALA A 13 -6.861 54.143 -4.342 1.00 0.00 C ATOM 0 H ALA A 13 -5.428 54.773 -2.444 1.00 0.00 H new ATOM 0 HA ALA A 13 -4.864 54.358 -5.154 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -7.324 53.969 -5.313 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -6.643 53.187 -3.867 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -7.543 54.714 -3.712 1.00 0.00 H new ATOM 209 N LEU A 14 -6.238 57.255 -4.442 1.00 0.00 N ATOM 210 CA LEU A 14 -6.560 58.558 -5.001 1.00 0.00 C ATOM 211 C LEU A 14 -5.334 59.164 -5.669 1.00 0.00 C ATOM 212 O LEU A 14 -5.418 59.697 -6.778 1.00 0.00 O ATOM 213 CB LEU A 14 -7.056 59.499 -3.895 1.00 0.00 C ATOM 214 CG LEU A 14 -7.448 60.863 -4.495 1.00 0.00 C ATOM 215 CD1 LEU A 14 -8.693 60.717 -5.390 1.00 0.00 C ATOM 216 CD2 LEU A 14 -7.733 61.847 -3.361 1.00 0.00 C ATOM 0 H LEU A 14 -6.348 57.182 -3.431 1.00 0.00 H new ATOM 0 HA LEU A 14 -7.346 58.429 -5.745 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -7.913 59.056 -3.388 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -6.277 59.634 -3.145 1.00 0.00 H new ATOM 0 HG LEU A 14 -6.626 61.236 -5.106 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -8.958 61.689 -5.807 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -8.479 60.021 -6.201 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -9.525 60.338 -4.797 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -8.011 62.814 -3.780 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -8.551 61.469 -2.748 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -6.841 61.961 -2.745 1.00 0.00 H new ATOM 228 N GLN A 15 -4.200 59.091 -4.985 1.00 0.00 N ATOM 229 CA GLN A 15 -2.968 59.647 -5.523 1.00 0.00 C ATOM 230 C GLN A 15 -2.487 58.830 -6.719 1.00 0.00 C ATOM 231 O GLN A 15 -2.041 59.386 -7.724 1.00 0.00 O ATOM 232 CB GLN A 15 -1.885 59.653 -4.442 1.00 0.00 C ATOM 233 CG GLN A 15 -0.601 60.278 -4.998 1.00 0.00 C ATOM 234 CD GLN A 15 0.454 60.367 -3.902 1.00 0.00 C ATOM 235 OE1 GLN A 15 0.122 60.346 -2.715 1.00 0.00 O ATOM 236 NE2 GLN A 15 1.714 60.455 -4.230 1.00 0.00 N ATOM 0 H GLN A 15 -4.108 58.657 -4.066 1.00 0.00 H new ATOM 0 HA GLN A 15 -3.165 60.668 -5.850 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -2.228 60.216 -3.574 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -1.689 58.635 -4.105 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -0.225 59.679 -5.828 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -0.812 61.272 -5.392 1.00 0.00 H new ATOM 0 HE21 GLN A 15 1.985 60.472 -5.213 1.00 0.00 H new ATOM 0 HE22 GLN A 15 2.428 60.507 -3.503 1.00 0.00 H new ATOM 245 N HIS A 16 -2.573 57.510 -6.596 1.00 0.00 N ATOM 246 CA HIS A 16 -2.138 56.620 -7.667 1.00 0.00 C ATOM 247 C HIS A 16 -3.221 56.490 -8.728 1.00 0.00 C ATOM 248 O HIS A 16 -3.004 55.878 -9.775 1.00 0.00 O ATOM 249 CB HIS A 16 -1.805 55.240 -7.098 1.00 0.00 C ATOM 250 CG HIS A 16 -1.029 54.448 -8.117 1.00 0.00 C ATOM 251 ND1 HIS A 16 -1.628 53.904 -9.243 1.00 0.00 N ATOM 252 CD2 HIS A 16 0.298 54.103 -8.195 1.00 0.00 C ATOM 253 CE1 HIS A 16 -0.674 53.267 -9.943 1.00 0.00 C ATOM 254 NE2 HIS A 16 0.521 53.357 -9.349 1.00 0.00 N ATOM 0 H HIS A 16 -2.938 57.034 -5.771 1.00 0.00 H new ATOM 0 HA HIS A 16 -1.246 57.045 -8.127 1.00 0.00 H new ATOM 0 HB2 HIS A 16 -1.222 55.344 -6.183 1.00 0.00 H new ATOM 0 HB3 HIS A 16 -2.722 54.713 -6.834 1.00 0.00 H new ATOM 0 HD2 HIS A 16 1.054 54.370 -7.471 1.00 0.00 H new ATOM 0 HE1 HIS A 16 -0.851 52.746 -10.872 1.00 0.00 H new ATOM 0 HE2 HIS A 16 1.405 52.964 -9.672 1.00 0.00 H new ATOM 262 N ASN A 17 -4.389 57.067 -8.454 1.00 0.00 N ATOM 263 CA ASN A 17 -5.497 57.009 -9.401 1.00 0.00 C ATOM 264 C ASN A 17 -5.844 55.562 -9.728 1.00 0.00 C ATOM 265 O ASN A 17 -5.660 55.113 -10.859 1.00 0.00 O ATOM 266 CB ASN A 17 -5.132 57.751 -10.687 1.00 0.00 C ATOM 267 CG ASN A 17 -4.755 59.190 -10.368 1.00 0.00 C ATOM 268 OD1 ASN A 17 -5.477 59.876 -9.644 1.00 0.00 O ATOM 269 ND2 ASN A 17 -3.659 59.694 -10.867 1.00 0.00 N ATOM 0 H ASN A 17 -4.591 57.575 -7.593 1.00 0.00 H new ATOM 0 HA ASN A 17 -6.364 57.487 -8.944 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -4.300 57.250 -11.182 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -5.974 57.732 -11.379 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -3.399 60.658 -10.657 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -3.062 59.124 -11.467 1.00 0.00 H new ATOM 276 N LEU A 18 -6.346 54.835 -8.731 1.00 0.00 N ATOM 277 CA LEU A 18 -6.718 53.428 -8.913 1.00 0.00 C ATOM 278 C LEU A 18 -8.151 53.186 -8.458 1.00 0.00 C ATOM 279 O LEU A 18 -8.665 53.889 -7.588 1.00 0.00 O ATOM 280 CB LEU A 18 -5.767 52.536 -8.112 1.00 0.00 C ATOM 281 CG LEU A 18 -4.328 52.738 -8.612 1.00 0.00 C ATOM 282 CD1 LEU A 18 -3.366 51.936 -7.726 1.00 0.00 C ATOM 283 CD2 LEU A 18 -4.199 52.270 -10.078 1.00 0.00 C ATOM 0 H LEU A 18 -6.505 55.194 -7.790 1.00 0.00 H new ATOM 0 HA LEU A 18 -6.644 53.184 -9.973 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -5.832 52.778 -7.051 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -6.056 51.491 -8.218 1.00 0.00 H new ATOM 0 HG LEU A 18 -4.078 53.798 -8.561 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -2.344 52.077 -8.078 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -3.446 52.282 -6.696 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -3.624 50.878 -7.774 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -3.174 52.419 -10.419 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -4.454 51.212 -10.146 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -4.878 52.848 -10.705 1.00 0.00 H new ATOM 295 N GLU A 19 -8.793 52.186 -9.061 1.00 0.00 N ATOM 296 CA GLU A 19 -10.169 51.854 -8.723 1.00 0.00 C ATOM 297 C GLU A 19 -10.354 51.850 -7.214 1.00 0.00 C ATOM 298 O GLU A 19 -9.555 51.267 -6.479 1.00 0.00 O ATOM 299 CB GLU A 19 -10.527 50.480 -9.282 1.00 0.00 C ATOM 300 CG GLU A 19 -10.564 50.543 -10.810 1.00 0.00 C ATOM 301 CD GLU A 19 -10.834 49.156 -11.385 1.00 0.00 C ATOM 302 OE1 GLU A 19 -11.007 48.236 -10.601 1.00 0.00 O ATOM 303 OE2 GLU A 19 -10.866 49.034 -12.597 1.00 0.00 O1- ATOM 0 H GLU A 19 -8.381 51.596 -9.783 1.00 0.00 H new ATOM 0 HA GLU A 19 -10.825 52.606 -9.162 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -9.795 49.741 -8.956 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -11.496 50.160 -8.897 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -11.339 51.237 -11.135 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -9.616 50.924 -11.189 1.00 0.00 H new ATOM 310 N LEU A 20 -11.403 52.515 -6.762 1.00 0.00 N ATOM 311 CA LEU A 20 -11.679 52.596 -5.339 1.00 0.00 C ATOM 312 C LEU A 20 -11.593 51.216 -4.685 1.00 0.00 C ATOM 313 O LEU A 20 -11.958 50.213 -5.299 1.00 0.00 O ATOM 314 CB LEU A 20 -13.071 53.186 -5.100 1.00 0.00 C ATOM 315 CG LEU A 20 -13.152 54.580 -5.734 1.00 0.00 C ATOM 316 CD1 LEU A 20 -14.618 55.000 -5.856 1.00 0.00 C ATOM 317 CD2 LEU A 20 -12.397 55.608 -4.870 1.00 0.00 C ATOM 0 H LEU A 20 -12.073 53.004 -7.355 1.00 0.00 H new ATOM 0 HA LEU A 20 -10.927 53.245 -4.890 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -13.832 52.535 -5.530 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -13.272 53.249 -4.031 1.00 0.00 H new ATOM 0 HG LEU A 20 -12.693 54.544 -6.722 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -14.676 55.991 -6.307 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -15.151 54.285 -6.483 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -15.073 55.024 -4.866 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -12.464 56.592 -5.334 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -12.842 55.644 -3.876 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -11.350 55.316 -4.789 1.00 0.00 H new ATOM 329 N PRO A 21 -11.135 51.144 -3.457 1.00 0.00 N ATOM 330 CA PRO A 21 -11.016 49.851 -2.721 1.00 0.00 C ATOM 331 C PRO A 21 -12.379 49.288 -2.340 1.00 0.00 C ATOM 332 O PRO A 21 -13.351 50.028 -2.188 1.00 0.00 O ATOM 333 CB PRO A 21 -10.202 50.220 -1.467 1.00 0.00 C ATOM 334 CG PRO A 21 -10.465 51.676 -1.245 1.00 0.00 C ATOM 335 CD PRO A 21 -10.681 52.281 -2.631 1.00 0.00 C ATOM 0 HA PRO A 21 -10.545 49.074 -3.324 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -10.513 49.628 -0.607 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -9.139 50.030 -1.617 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -11.342 51.822 -0.614 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -9.625 52.151 -0.738 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -11.425 53.077 -2.606 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -9.762 52.716 -3.023 1.00 0.00 H new ATOM 343 N VAL A 22 -12.432 47.974 -2.175 1.00 0.00 N ATOM 344 CA VAL A 22 -13.677 47.302 -1.791 1.00 0.00 C ATOM 345 C VAL A 22 -13.423 46.304 -0.660 1.00 0.00 C ATOM 346 O VAL A 22 -12.495 45.502 -0.724 1.00 0.00 O ATOM 347 CB VAL A 22 -14.273 46.572 -3.003 1.00 0.00 C ATOM 348 CG1 VAL A 22 -15.473 45.724 -2.563 1.00 0.00 C ATOM 349 CG2 VAL A 22 -14.725 47.599 -4.047 1.00 0.00 C ATOM 0 H VAL A 22 -11.635 47.350 -2.299 1.00 0.00 H new ATOM 0 HA VAL A 22 -14.382 48.055 -1.440 1.00 0.00 H new ATOM 0 HB VAL A 22 -13.515 45.920 -3.438 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -15.891 45.209 -3.428 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -15.149 44.990 -1.825 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -16.233 46.370 -2.123 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -15.148 47.081 -4.908 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -15.479 48.254 -3.611 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -13.869 48.194 -4.366 1.00 0.00 H new ATOM 359 N TYR A 23 -14.263 46.365 0.375 1.00 0.00 N ATOM 360 CA TYR A 23 -14.150 45.471 1.519 1.00 0.00 C ATOM 361 C TYR A 23 -15.262 44.432 1.499 1.00 0.00 C ATOM 362 O TYR A 23 -16.343 44.669 0.961 1.00 0.00 O ATOM 363 CB TYR A 23 -14.229 46.269 2.800 1.00 0.00 C ATOM 364 CG TYR A 23 -12.977 47.100 2.948 1.00 0.00 C ATOM 365 CD1 TYR A 23 -12.715 48.149 2.068 1.00 0.00 C ATOM 366 CD2 TYR A 23 -12.077 46.812 3.971 1.00 0.00 C ATOM 367 CE1 TYR A 23 -11.554 48.908 2.214 1.00 0.00 C ATOM 368 CE2 TYR A 23 -10.912 47.568 4.126 1.00 0.00 C ATOM 369 CZ TYR A 23 -10.649 48.624 3.244 1.00 0.00 C ATOM 370 OH TYR A 23 -9.501 49.379 3.387 1.00 0.00 O ATOM 0 H TYR A 23 -15.033 47.031 0.440 1.00 0.00 H new ATOM 0 HA TYR A 23 -13.190 44.958 1.464 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -15.108 46.914 2.787 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -14.338 45.599 3.653 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -13.411 48.374 1.273 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -12.281 45.998 4.650 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -11.352 49.719 1.529 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -10.218 47.339 4.921 1.00 0.00 H new ATOM 0 HH TYR A 23 -9.474 50.068 2.691 1.00 0.00 H new ATOM 380 N ALA A 24 -14.988 43.279 2.099 1.00 0.00 N ATOM 381 CA ALA A 24 -15.968 42.193 2.169 1.00 0.00 C ATOM 382 C ALA A 24 -16.355 41.961 3.614 1.00 0.00 C ATOM 383 O ALA A 24 -15.504 41.997 4.494 1.00 0.00 O ATOM 384 CB ALA A 24 -15.381 40.911 1.576 1.00 0.00 C ATOM 0 H ALA A 24 -14.095 43.069 2.545 1.00 0.00 H new ATOM 0 HA ALA A 24 -16.852 42.470 1.594 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -16.120 40.112 1.634 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -15.113 41.082 0.533 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -14.492 40.625 2.137 1.00 0.00 H new ATOM 390 N ASN A 25 -17.644 41.749 3.865 1.00 0.00 N ATOM 391 CA ASN A 25 -18.129 41.524 5.228 1.00 0.00 C ATOM 392 C ASN A 25 -18.835 40.177 5.345 1.00 0.00 C ATOM 393 O ASN A 25 -19.779 39.897 4.605 1.00 0.00 O ATOM 394 CB ASN A 25 -19.118 42.632 5.600 1.00 0.00 C ATOM 395 CG ASN A 25 -18.410 43.983 5.608 1.00 0.00 C ATOM 396 OD1 ASN A 25 -17.366 44.133 6.239 1.00 0.00 O ATOM 397 ND2 ASN A 25 -18.921 44.983 4.940 1.00 0.00 N ATOM 0 H ASN A 25 -18.370 41.728 3.149 1.00 0.00 H new ATOM 0 HA ASN A 25 -17.272 41.530 5.902 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -19.943 42.649 4.888 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -19.548 42.432 6.581 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -18.453 45.890 4.942 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -19.787 44.857 4.417 1.00 0.00 H new ATOM 404 N GLU A 26 -18.392 39.354 6.300 1.00 0.00 N ATOM 405 CA GLU A 26 -19.014 38.060 6.531 1.00 0.00 C ATOM 406 C GLU A 26 -19.173 37.840 8.034 1.00 0.00 C ATOM 407 O GLU A 26 -18.242 38.065 8.806 1.00 0.00 O ATOM 408 CB GLU A 26 -18.162 36.945 5.887 1.00 0.00 C ATOM 409 CG GLU A 26 -18.287 35.658 6.694 1.00 0.00 C ATOM 410 CD GLU A 26 -17.731 34.480 5.916 1.00 0.00 C ATOM 411 OE1 GLU A 26 -17.683 34.567 4.702 1.00 0.00 O ATOM 412 OE2 GLU A 26 -17.364 33.508 6.549 1.00 0.00 O1- ATOM 0 H GLU A 26 -17.609 39.565 6.919 1.00 0.00 H new ATOM 0 HA GLU A 26 -20.002 38.033 6.071 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -18.489 36.773 4.861 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -17.118 37.255 5.841 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -17.752 35.762 7.638 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -19.334 35.477 6.939 1.00 0.00 H new ATOM 419 N ARG A 27 -20.352 37.373 8.439 1.00 0.00 N ATOM 420 CA ARG A 27 -20.618 37.099 9.846 1.00 0.00 C ATOM 421 C ARG A 27 -21.236 35.720 10.007 1.00 0.00 C ATOM 422 O ARG A 27 -22.288 35.433 9.430 1.00 0.00 O ATOM 423 CB ARG A 27 -21.577 38.147 10.401 1.00 0.00 C ATOM 424 CG ARG A 27 -21.736 37.944 11.910 1.00 0.00 C ATOM 425 CD ARG A 27 -22.781 38.917 12.448 1.00 0.00 C ATOM 426 NE ARG A 27 -24.110 38.527 11.993 1.00 0.00 N ATOM 427 CZ ARG A 27 -25.180 39.248 12.308 1.00 0.00 C ATOM 428 NH1 ARG A 27 -25.051 40.324 13.034 1.00 0.00 N ATOM 429 NH2 ARG A 27 -26.360 38.878 11.893 1.00 0.00 N1+ ATOM 0 H ARG A 27 -21.134 37.178 7.814 1.00 0.00 H new ATOM 0 HA ARG A 27 -19.676 37.135 10.393 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -21.197 39.148 10.196 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -22.546 38.066 9.908 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -22.037 36.918 12.120 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -20.782 38.105 12.412 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -22.750 38.930 13.537 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -22.555 39.929 12.111 1.00 0.00 H new ATOM 0 HE ARG A 27 -24.220 37.688 11.424 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -24.128 40.612 13.360 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -25.873 40.878 13.276 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -26.461 38.035 11.327 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -27.182 39.431 12.135 1.00 0.00 H new ATOM 443 N GLU A 28 -20.589 34.865 10.795 1.00 0.00 N ATOM 444 CA GLU A 28 -21.107 33.528 11.015 1.00 0.00 C ATOM 445 C GLU A 28 -20.518 32.942 12.291 1.00 0.00 C ATOM 446 O GLU A 28 -19.311 33.004 12.514 1.00 0.00 O ATOM 447 CB GLU A 28 -20.756 32.616 9.835 1.00 0.00 C ATOM 448 CG GLU A 28 -21.393 31.236 10.039 1.00 0.00 C ATOM 449 CD GLU A 28 -21.099 30.342 8.837 1.00 0.00 C ATOM 450 OE1 GLU A 28 -20.232 30.701 8.057 1.00 0.00 O ATOM 451 OE2 GLU A 28 -21.747 29.317 8.713 1.00 0.00 O1- ATOM 0 H GLU A 28 -19.718 35.074 11.283 1.00 0.00 H new ATOM 0 HA GLU A 28 -22.191 33.593 11.108 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -21.112 33.057 8.904 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -19.674 32.518 9.748 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -21.003 30.777 10.948 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -22.470 31.339 10.171 1.00 0.00 H new ATOM 458 N GLY A 29 -21.368 32.378 13.132 1.00 0.00 N ATOM 459 CA GLY A 29 -20.898 31.779 14.370 1.00 0.00 C ATOM 460 C GLY A 29 -21.960 31.873 15.471 1.00 0.00 C ATOM 461 O GLY A 29 -22.668 32.878 15.568 1.00 0.00 O ATOM 0 H GLY A 29 -22.376 32.322 12.984 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -20.642 30.734 14.197 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -19.987 32.280 14.696 1.00 0.00 H new ATOM 465 N PRO A 30 -22.076 30.870 16.310 1.00 0.00 N ATOM 466 CA PRO A 30 -23.070 30.867 17.408 1.00 0.00 C ATOM 467 C PRO A 30 -23.116 32.210 18.156 1.00 0.00 C ATOM 468 O PRO A 30 -22.214 33.040 18.016 1.00 0.00 O ATOM 469 CB PRO A 30 -22.587 29.748 18.350 1.00 0.00 C ATOM 470 CG PRO A 30 -21.788 28.813 17.492 1.00 0.00 C ATOM 471 CD PRO A 30 -21.309 29.614 16.272 1.00 0.00 C ATOM 0 HA PRO A 30 -24.080 30.709 17.031 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -21.979 30.153 19.159 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -23.430 29.233 18.811 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -20.939 28.412 18.046 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -22.395 27.963 17.180 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -20.237 29.805 16.323 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -21.492 29.069 15.346 1.00 0.00 H new ATOM 479 N PRO A 31 -24.138 32.428 18.947 1.00 0.00 N ATOM 480 CA PRO A 31 -24.290 33.692 19.733 1.00 0.00 C ATOM 481 C PRO A 31 -23.059 34.003 20.587 1.00 0.00 C ATOM 482 O PRO A 31 -22.528 35.112 20.548 1.00 0.00 O ATOM 483 CB PRO A 31 -25.516 33.421 20.628 1.00 0.00 C ATOM 484 CG PRO A 31 -26.288 32.345 19.933 1.00 0.00 C ATOM 485 CD PRO A 31 -25.264 31.500 19.183 1.00 0.00 C ATOM 0 HA PRO A 31 -24.408 34.559 19.083 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -25.211 33.104 21.625 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -26.119 34.321 20.750 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -26.842 31.739 20.650 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -27.018 32.772 19.245 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -24.953 30.636 19.770 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -25.670 31.119 18.246 1.00 0.00 H new ATOM 493 N HIS A 32 -22.620 33.017 21.367 1.00 0.00 N ATOM 494 CA HIS A 32 -21.460 33.195 22.238 1.00 0.00 C ATOM 495 C HIS A 32 -20.176 32.868 21.492 1.00 0.00 C ATOM 496 O HIS A 32 -19.091 32.879 22.072 1.00 0.00 O ATOM 497 CB HIS A 32 -21.586 32.290 23.463 1.00 0.00 C ATOM 498 CG HIS A 32 -20.376 32.467 24.338 1.00 0.00 C ATOM 499 ND1 HIS A 32 -19.284 31.669 24.569 1.00 0.00 N flip ATOM 500 CD2 HIS A 32 -20.186 33.601 25.116 1.00 0.00 C flip ATOM 501 CE1 HIS A 32 -18.430 32.291 25.475 1.00 0.00 C flip ATOM 502 NE2 HIS A 32 -19.020 33.453 25.772 1.00 0.00 N flip ATOM 0 H HIS A 32 -23.047 32.092 21.414 1.00 0.00 H new ATOM 0 HA HIS A 32 -21.424 34.237 22.558 1.00 0.00 H new ATOM 0 HB2 HIS A 32 -22.490 32.536 24.019 1.00 0.00 H new ATOM 0 HB3 HIS A 32 -21.676 31.249 23.153 1.00 0.00 H new ATOM 0 HD2 HIS A 32 -20.853 34.448 25.183 1.00 0.00 H new ATOM 0 HE1 HIS A 32 -17.492 31.915 25.856 1.00 0.00 H new ATOM 0 HE2 HIS A 32 -18.634 34.143 26.417 1.00 0.00 H new ATOM 510 N ALA A 33 -20.308 32.599 20.199 1.00 0.00 N ATOM 511 CA ALA A 33 -19.143 32.297 19.365 1.00 0.00 C ATOM 512 C ALA A 33 -19.262 32.959 17.994 1.00 0.00 C ATOM 513 O ALA A 33 -19.266 32.279 16.969 1.00 0.00 O ATOM 514 CB ALA A 33 -19.006 30.785 19.203 1.00 0.00 C ATOM 0 H ALA A 33 -21.200 32.583 19.705 1.00 0.00 H new ATOM 0 HA ALA A 33 -18.255 32.694 19.857 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -18.138 30.563 18.582 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -18.879 30.324 20.183 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -19.903 30.387 18.729 1.00 0.00 H new ATOM 520 N PRO A 34 -19.331 34.266 17.959 1.00 0.00 N ATOM 521 CA PRO A 34 -19.423 35.027 16.688 1.00 0.00 C ATOM 522 C PRO A 34 -18.059 35.207 16.033 1.00 0.00 C ATOM 523 O PRO A 34 -17.059 35.423 16.719 1.00 0.00 O ATOM 524 CB PRO A 34 -20.014 36.376 17.124 1.00 0.00 C ATOM 525 CG PRO A 34 -19.568 36.564 18.549 1.00 0.00 C ATOM 526 CD PRO A 34 -19.332 35.162 19.134 1.00 0.00 C ATOM 0 HA PRO A 34 -20.027 34.516 15.938 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -19.655 37.186 16.489 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -21.101 36.371 17.050 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -18.656 37.159 18.592 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -20.325 37.099 19.123 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -18.386 35.111 19.673 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -20.116 34.889 19.840 1.00 0.00 H new ATOM 534 N ARG A 35 -18.025 35.144 14.704 1.00 0.00 N ATOM 535 CA ARG A 35 -16.775 35.329 13.972 1.00 0.00 C ATOM 536 C ARG A 35 -16.979 36.308 12.839 1.00 0.00 C ATOM 537 O ARG A 35 -17.916 36.167 12.051 1.00 0.00 O ATOM 538 CB ARG A 35 -16.291 33.990 13.418 1.00 0.00 C ATOM 539 CG ARG A 35 -15.863 33.089 14.578 1.00 0.00 C ATOM 540 CD ARG A 35 -15.406 31.738 14.030 1.00 0.00 C ATOM 541 NE ARG A 35 -15.012 30.857 15.125 1.00 0.00 N ATOM 542 CZ ARG A 35 -14.304 29.757 14.899 1.00 0.00 C ATOM 543 NH1 ARG A 35 -13.946 29.448 13.682 1.00 0.00 N ATOM 544 NH2 ARG A 35 -13.966 28.983 15.894 1.00 0.00 N1+ ATOM 0 H ARG A 35 -18.840 34.968 14.117 1.00 0.00 H new ATOM 0 HA ARG A 35 -16.023 35.725 14.654 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -17.085 33.512 12.845 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -15.455 34.146 12.736 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -15.055 33.559 15.139 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -16.693 32.951 15.271 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -16.211 31.279 13.456 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -14.568 31.879 13.347 1.00 0.00 H new ATOM 0 HE ARG A 35 -15.285 31.090 16.080 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -14.210 30.052 12.904 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -13.402 28.603 13.510 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -14.246 29.223 16.845 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -13.422 28.138 15.721 1.00 0.00 H new ATOM 558 N PHE A 36 -16.089 37.300 12.737 1.00 0.00 N ATOM 559 CA PHE A 36 -16.197 38.287 11.663 1.00 0.00 C ATOM 560 C PHE A 36 -15.025 38.203 10.712 1.00 0.00 C ATOM 561 O PHE A 36 -13.936 38.653 11.020 1.00 0.00 O ATOM 562 CB PHE A 36 -16.206 39.682 12.268 1.00 0.00 C ATOM 563 CG PHE A 36 -17.361 39.800 13.212 1.00 0.00 C ATOM 564 CD1 PHE A 36 -18.605 40.155 12.717 1.00 0.00 C ATOM 565 CD2 PHE A 36 -17.188 39.551 14.570 1.00 0.00 C ATOM 566 CE1 PHE A 36 -19.696 40.279 13.582 1.00 0.00 C ATOM 567 CE2 PHE A 36 -18.266 39.665 15.441 1.00 0.00 C ATOM 568 CZ PHE A 36 -19.527 40.037 14.956 1.00 0.00 C ATOM 0 H PHE A 36 -15.302 37.439 13.371 1.00 0.00 H new ATOM 0 HA PHE A 36 -17.117 38.083 11.114 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -15.270 39.870 12.794 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -16.285 40.432 11.481 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -18.732 40.336 11.660 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -16.216 39.269 14.948 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -20.665 40.560 13.196 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -18.131 39.466 16.494 1.00 0.00 H new ATOM 0 HZ PHE A 36 -20.363 40.137 15.633 1.00 0.00 H new ATOM 578 N ARG A 37 -15.252 37.614 9.550 1.00 0.00 N ATOM 579 CA ARG A 37 -14.185 37.468 8.551 1.00 0.00 C ATOM 580 C ARG A 37 -14.412 38.452 7.420 1.00 0.00 C ATOM 581 O ARG A 37 -15.325 38.292 6.618 1.00 0.00 O ATOM 582 CB ARG A 37 -14.168 36.036 7.983 1.00 0.00 C ATOM 583 CG ARG A 37 -13.694 35.058 9.061 1.00 0.00 C ATOM 584 CD ARG A 37 -13.679 33.635 8.497 1.00 0.00 C ATOM 585 NE ARG A 37 -15.040 33.161 8.278 1.00 0.00 N ATOM 586 CZ ARG A 37 -15.276 31.938 7.815 1.00 0.00 C ATOM 587 NH1 ARG A 37 -14.282 31.138 7.547 1.00 0.00 N ATOM 588 NH2 ARG A 37 -16.503 31.536 7.630 1.00 0.00 N1+ ATOM 0 H ARG A 37 -16.154 37.230 9.268 1.00 0.00 H new ATOM 0 HA ARG A 37 -13.228 37.668 9.032 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -15.165 35.759 7.640 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -13.508 35.986 7.117 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -12.697 35.334 9.403 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -14.354 35.109 9.927 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -13.125 33.615 7.559 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -13.162 32.969 9.187 1.00 0.00 H new ATOM 0 HE ARG A 37 -15.825 33.779 8.484 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -13.322 31.451 7.693 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -14.464 30.199 7.192 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -17.282 32.160 7.841 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -16.684 30.597 7.275 1.00 0.00 H new ATOM 602 N CYS A 38 -13.587 39.490 7.367 1.00 0.00 N ATOM 603 CA CYS A 38 -13.712 40.511 6.325 1.00 0.00 C ATOM 604 C CYS A 38 -12.473 40.526 5.455 1.00 0.00 C ATOM 605 O CYS A 38 -11.349 40.491 5.950 1.00 0.00 O ATOM 606 CB CYS A 38 -13.909 41.889 6.956 1.00 0.00 C ATOM 607 SG CYS A 38 -15.379 41.848 8.014 1.00 0.00 S ATOM 0 H CYS A 38 -12.827 39.650 8.028 1.00 0.00 H new ATOM 0 HA CYS A 38 -14.579 40.271 5.710 1.00 0.00 H new ATOM 0 HB2 CYS A 38 -13.031 42.164 7.541 1.00 0.00 H new ATOM 0 HB3 CYS A 38 -14.025 42.646 6.180 1.00 0.00 H new ATOM 0 HG CYS A 38 -16.282 42.650 7.534 1.00 0.00 H new ATOM 613 N ASN A 39 -12.692 40.580 4.151 1.00 0.00 N ATOM 614 CA ASN A 39 -11.577 40.605 3.185 1.00 0.00 C ATOM 615 C ASN A 39 -11.485 41.968 2.520 1.00 0.00 C ATOM 616 O ASN A 39 -12.457 42.715 2.490 1.00 0.00 O ATOM 617 CB ASN A 39 -11.765 39.530 2.117 1.00 0.00 C ATOM 618 CG ASN A 39 -11.628 38.153 2.751 1.00 0.00 C ATOM 619 OD1 ASN A 39 -11.064 38.020 3.837 1.00 0.00 O ATOM 620 ND2 ASN A 39 -12.115 37.113 2.134 1.00 0.00 N ATOM 0 H ASN A 39 -13.620 40.608 3.728 1.00 0.00 H new ATOM 0 HA ASN A 39 -10.654 40.406 3.729 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -12.746 39.632 1.652 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -11.024 39.654 1.327 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -12.029 36.186 2.551 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -12.582 37.226 1.234 1.00 0.00 H new ATOM 627 N VAL A 40 -10.310 42.295 1.978 1.00 0.00 N ATOM 628 CA VAL A 40 -10.113 43.583 1.306 1.00 0.00 C ATOM 629 C VAL A 40 -9.616 43.350 -0.110 1.00 0.00 C ATOM 630 O VAL A 40 -8.555 42.776 -0.316 1.00 0.00 O ATOM 631 CB VAL A 40 -9.087 44.422 2.077 1.00 0.00 C ATOM 632 CG1 VAL A 40 -7.790 43.618 2.276 1.00 0.00 C ATOM 633 CG2 VAL A 40 -8.780 45.702 1.294 1.00 0.00 C ATOM 0 H VAL A 40 -9.487 41.693 1.990 1.00 0.00 H new ATOM 0 HA VAL A 40 -11.063 44.117 1.274 1.00 0.00 H new ATOM 0 HB VAL A 40 -9.499 44.680 3.052 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -7.068 44.223 2.825 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -8.007 42.711 2.840 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -7.375 43.350 1.304 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -8.051 46.298 1.843 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -8.374 45.442 0.316 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -9.696 46.278 1.165 1.00 0.00 H new ATOM 643 N THR A 41 -10.391 43.815 -1.082 1.00 0.00 N ATOM 644 CA THR A 41 -10.023 43.657 -2.494 1.00 0.00 C ATOM 645 C THR A 41 -9.342 44.914 -3.012 1.00 0.00 C ATOM 646 O THR A 41 -9.885 46.013 -2.907 1.00 0.00 O ATOM 647 CB THR A 41 -11.268 43.373 -3.333 1.00 0.00 C ATOM 648 OG1 THR A 41 -11.844 42.144 -2.917 1.00 0.00 O ATOM 649 CG2 THR A 41 -10.881 43.285 -4.812 1.00 0.00 C ATOM 0 H THR A 41 -11.273 44.302 -0.926 1.00 0.00 H new ATOM 0 HA THR A 41 -9.331 42.819 -2.575 1.00 0.00 H new ATOM 0 HB THR A 41 -11.990 44.178 -3.198 1.00 0.00 H new ATOM 0 HG1 THR A 41 -12.644 41.960 -3.452 1.00 0.00 H new ATOM 0 HG21 THR A 41 -11.770 43.082 -5.409 1.00 0.00 H new ATOM 0 HG22 THR A 41 -10.438 44.229 -5.129 1.00 0.00 H new ATOM 0 HG23 THR A 41 -10.159 42.481 -4.952 1.00 0.00 H new ATOM 657 N PHE A 42 -8.145 44.748 -3.574 1.00 0.00 N ATOM 658 CA PHE A 42 -7.403 45.888 -4.104 1.00 0.00 C ATOM 659 C PHE A 42 -6.554 45.459 -5.298 1.00 0.00 C ATOM 660 O PHE A 42 -5.891 44.427 -5.256 1.00 0.00 O ATOM 661 CB PHE A 42 -6.496 46.476 -3.003 1.00 0.00 C ATOM 662 CG PHE A 42 -6.268 47.953 -3.250 1.00 0.00 C ATOM 663 CD1 PHE A 42 -7.362 48.817 -3.243 1.00 0.00 C ATOM 664 CD2 PHE A 42 -4.983 48.453 -3.494 1.00 0.00 C ATOM 665 CE1 PHE A 42 -7.186 50.179 -3.478 1.00 0.00 C ATOM 666 CE2 PHE A 42 -4.805 49.826 -3.725 1.00 0.00 C ATOM 667 CZ PHE A 42 -5.906 50.684 -3.717 1.00 0.00 C ATOM 0 H PHE A 42 -7.675 43.848 -3.673 1.00 0.00 H new ATOM 0 HA PHE A 42 -8.112 46.648 -4.433 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -6.956 46.330 -2.026 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -5.541 45.950 -2.988 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -8.352 48.428 -3.054 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -4.134 47.786 -3.504 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -8.038 50.843 -3.475 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -3.816 50.219 -3.909 1.00 0.00 H new ATOM 0 HZ PHE A 42 -5.768 51.740 -3.896 1.00 0.00 H new ATOM 677 N CYS A 43 -6.573 46.263 -6.350 1.00 0.00 N ATOM 678 CA CYS A 43 -5.792 45.961 -7.547 1.00 0.00 C ATOM 679 C CYS A 43 -5.911 44.482 -7.913 1.00 0.00 C ATOM 680 O CYS A 43 -4.941 43.860 -8.342 1.00 0.00 O ATOM 681 CB CYS A 43 -4.318 46.322 -7.310 1.00 0.00 C ATOM 682 SG CYS A 43 -3.497 45.031 -6.335 1.00 0.00 S ATOM 0 H CYS A 43 -7.116 47.125 -6.403 1.00 0.00 H new ATOM 0 HA CYS A 43 -6.183 46.554 -8.374 1.00 0.00 H new ATOM 0 HB2 CYS A 43 -3.809 46.443 -8.266 1.00 0.00 H new ATOM 0 HB3 CYS A 43 -4.250 47.277 -6.790 1.00 0.00 H new ATOM 0 HG CYS A 43 -4.381 44.396 -5.624 1.00 0.00 H new ATOM 688 N GLY A 44 -7.110 43.937 -7.757 1.00 0.00 N ATOM 689 CA GLY A 44 -7.345 42.536 -8.087 1.00 0.00 C ATOM 690 C GLY A 44 -6.634 41.609 -7.109 1.00 0.00 C ATOM 691 O GLY A 44 -6.179 40.528 -7.485 1.00 0.00 O ATOM 0 H GLY A 44 -7.928 44.437 -7.408 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -8.416 42.332 -8.072 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -6.996 42.336 -9.100 1.00 0.00 H new ATOM 695 N GLN A 45 -6.531 42.034 -5.854 1.00 0.00 N ATOM 696 CA GLN A 45 -5.868 41.230 -4.827 1.00 0.00 C ATOM 697 C GLN A 45 -6.681 41.251 -3.544 1.00 0.00 C ATOM 698 O GLN A 45 -7.063 42.316 -3.059 1.00 0.00 O ATOM 699 CB GLN A 45 -4.469 41.774 -4.557 1.00 0.00 C ATOM 700 CG GLN A 45 -3.618 41.632 -5.819 1.00 0.00 C ATOM 701 CD GLN A 45 -2.250 42.264 -5.596 1.00 0.00 C ATOM 702 OE1 GLN A 45 -1.944 42.709 -4.490 1.00 0.00 O ATOM 703 NE2 GLN A 45 -1.406 42.334 -6.587 1.00 0.00 N ATOM 0 H GLN A 45 -6.896 42.927 -5.522 1.00 0.00 H new ATOM 0 HA GLN A 45 -5.789 40.203 -5.184 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -4.525 42.821 -4.258 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -4.009 41.231 -3.731 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -3.504 40.579 -6.075 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -4.117 42.112 -6.661 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -1.662 41.964 -7.502 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -0.489 42.758 -6.447 1.00 0.00 H new ATOM 712 N THR A 46 -6.959 40.065 -3.004 1.00 0.00 N ATOM 713 CA THR A 46 -7.747 39.949 -1.773 1.00 0.00 C ATOM 714 C THR A 46 -6.885 39.479 -0.609 1.00 0.00 C ATOM 715 O THR A 46 -6.472 38.321 -0.557 1.00 0.00 O ATOM 716 CB THR A 46 -8.892 38.959 -1.981 1.00 0.00 C ATOM 717 OG1 THR A 46 -9.298 38.440 -0.721 1.00 0.00 O ATOM 718 CG2 THR A 46 -8.425 37.816 -2.880 1.00 0.00 C ATOM 0 H THR A 46 -6.653 39.174 -3.395 1.00 0.00 H new ATOM 0 HA THR A 46 -8.145 40.935 -1.535 1.00 0.00 H new ATOM 0 HB THR A 46 -9.732 39.467 -2.454 1.00 0.00 H new ATOM 0 HG1 THR A 46 -10.034 37.806 -0.850 1.00 0.00 H new ATOM 0 HG21 THR A 46 -9.243 37.111 -3.027 1.00 0.00 H new ATOM 0 HG22 THR A 46 -8.113 38.216 -3.845 1.00 0.00 H new ATOM 0 HG23 THR A 46 -7.585 37.304 -2.411 1.00 0.00 H new ATOM 726 N PHE A 47 -6.612 40.393 0.323 1.00 0.00 N ATOM 727 CA PHE A 47 -5.794 40.067 1.489 1.00 0.00 C ATOM 728 C PHE A 47 -6.688 39.691 2.664 1.00 0.00 C ATOM 729 O PHE A 47 -7.743 40.297 2.872 1.00 0.00 O ATOM 730 CB PHE A 47 -4.920 41.259 1.875 1.00 0.00 C ATOM 731 CG PHE A 47 -3.844 41.440 0.832 1.00 0.00 C ATOM 732 CD1 PHE A 47 -4.150 42.097 -0.357 1.00 0.00 C ATOM 733 CD2 PHE A 47 -2.547 40.971 1.060 1.00 0.00 C ATOM 734 CE1 PHE A 47 -3.157 42.288 -1.328 1.00 0.00 C ATOM 735 CE2 PHE A 47 -1.554 41.155 0.089 1.00 0.00 C ATOM 736 CZ PHE A 47 -1.861 41.816 -1.104 1.00 0.00 C ATOM 0 H PHE A 47 -6.943 41.357 0.293 1.00 0.00 H new ATOM 0 HA PHE A 47 -5.153 39.222 1.237 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -5.527 42.161 1.950 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -4.471 41.094 2.854 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -5.152 42.459 -0.531 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -2.310 40.467 1.985 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -3.394 42.800 -2.249 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -0.553 40.787 0.262 1.00 0.00 H new ATOM 0 HZ PHE A 47 -1.096 41.962 -1.853 1.00 0.00 H new ATOM 746 N GLN A 48 -6.272 38.684 3.424 1.00 0.00 N ATOM 747 CA GLN A 48 -7.048 38.227 4.576 1.00 0.00 C ATOM 748 C GLN A 48 -6.137 37.583 5.612 1.00 0.00 C ATOM 749 O GLN A 48 -5.082 37.046 5.277 1.00 0.00 O ATOM 750 CB GLN A 48 -8.104 37.216 4.123 1.00 0.00 C ATOM 751 CG GLN A 48 -7.421 36.019 3.462 1.00 0.00 C ATOM 752 CD GLN A 48 -8.469 35.058 2.914 1.00 0.00 C ATOM 753 OE1 GLN A 48 -9.552 35.481 2.513 1.00 0.00 O ATOM 754 NE2 GLN A 48 -8.209 33.779 2.871 1.00 0.00 N ATOM 0 H GLN A 48 -5.406 38.169 3.266 1.00 0.00 H new ATOM 0 HA GLN A 48 -7.539 39.089 5.027 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -8.694 36.884 4.977 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -8.794 37.686 3.422 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -6.771 36.360 2.656 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -6.788 35.506 4.186 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -7.310 33.430 3.204 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -8.905 33.129 2.504 1.00 0.00 H new ATOM 763 N SER A 49 -6.553 37.642 6.875 1.00 0.00 N ATOM 764 CA SER A 49 -5.771 37.058 7.963 1.00 0.00 C ATOM 765 C SER A 49 -6.158 35.599 8.173 1.00 0.00 C ATOM 766 O SER A 49 -7.188 35.141 7.678 1.00 0.00 O ATOM 767 CB SER A 49 -6.000 37.842 9.253 1.00 0.00 C ATOM 768 OG SER A 49 -7.184 37.372 9.883 1.00 0.00 O ATOM 0 H SER A 49 -7.423 38.086 7.170 1.00 0.00 H new ATOM 0 HA SER A 49 -4.716 37.108 7.695 1.00 0.00 H new ATOM 0 HB2 SER A 49 -5.147 37.723 9.921 1.00 0.00 H new ATOM 0 HB3 SER A 49 -6.088 38.906 9.035 1.00 0.00 H new ATOM 0 HG SER A 49 -7.682 38.131 10.251 1.00 0.00 H new ATOM 774 N SER A 50 -5.328 34.874 8.917 1.00 0.00 N ATOM 775 CA SER A 50 -5.590 33.462 9.200 1.00 0.00 C ATOM 776 C SER A 50 -6.355 33.310 10.509 1.00 0.00 C ATOM 777 O SER A 50 -6.727 32.203 10.894 1.00 0.00 O ATOM 778 CB SER A 50 -4.274 32.695 9.290 1.00 0.00 C ATOM 779 OG SER A 50 -3.434 33.079 8.210 1.00 0.00 O ATOM 0 H SER A 50 -4.471 35.237 9.334 1.00 0.00 H new ATOM 0 HA SER A 50 -6.194 33.056 8.388 1.00 0.00 H new ATOM 0 HB2 SER A 50 -3.782 32.903 10.240 1.00 0.00 H new ATOM 0 HB3 SER A 50 -4.462 31.622 9.256 1.00 0.00 H new ATOM 0 HG SER A 50 -2.587 32.590 8.265 1.00 0.00 H new ATOM 785 N GLU A 51 -6.584 34.433 11.194 1.00 0.00 N ATOM 786 CA GLU A 51 -7.307 34.425 12.468 1.00 0.00 C ATOM 787 C GLU A 51 -8.511 35.356 12.405 1.00 0.00 C ATOM 788 O GLU A 51 -8.412 36.497 11.958 1.00 0.00 O ATOM 789 CB GLU A 51 -6.379 34.866 13.599 1.00 0.00 C ATOM 790 CG GLU A 51 -7.101 34.719 14.942 1.00 0.00 C ATOM 791 CD GLU A 51 -6.180 35.143 16.077 1.00 0.00 C ATOM 792 OE1 GLU A 51 -6.037 36.338 16.281 1.00 0.00 O ATOM 793 OE2 GLU A 51 -5.631 34.270 16.728 1.00 0.00 O1- ATOM 0 H GLU A 51 -6.280 35.358 10.889 1.00 0.00 H new ATOM 0 HA GLU A 51 -7.655 33.410 12.660 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -5.471 34.263 13.595 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -6.074 35.902 13.450 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -8.004 35.330 14.948 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -7.415 33.685 15.084 1.00 0.00 H new ATOM 800 N PHE A 52 -9.643 34.846 12.858 1.00 0.00 N ATOM 801 CA PHE A 52 -10.883 35.618 12.862 1.00 0.00 C ATOM 802 C PHE A 52 -10.909 36.550 14.054 1.00 0.00 C ATOM 803 O PHE A 52 -10.418 36.233 15.139 1.00 0.00 O ATOM 804 CB PHE A 52 -12.122 34.684 12.899 1.00 0.00 C ATOM 805 CG PHE A 52 -11.675 33.293 13.248 1.00 0.00 C ATOM 806 CD1 PHE A 52 -10.924 32.583 12.327 1.00 0.00 C ATOM 807 CD2 PHE A 52 -12.007 32.735 14.473 1.00 0.00 C ATOM 808 CE1 PHE A 52 -10.492 31.276 12.625 1.00 0.00 C ATOM 809 CE2 PHE A 52 -11.588 31.432 14.788 1.00 0.00 C ATOM 810 CZ PHE A 52 -10.828 30.700 13.861 1.00 0.00 C ATOM 0 H PHE A 52 -9.734 33.900 13.229 1.00 0.00 H new ATOM 0 HA PHE A 52 -10.921 36.203 11.943 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -12.843 35.043 13.634 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -12.625 34.687 11.932 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -10.669 33.032 11.378 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -12.588 33.302 15.185 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -9.906 30.720 11.908 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -11.849 30.994 15.740 1.00 0.00 H new ATOM 0 HZ PHE A 52 -10.503 29.698 14.098 1.00 0.00 H new ATOM 820 N PHE A 53 -11.488 37.705 13.829 1.00 0.00 N ATOM 821 CA PHE A 53 -11.599 38.727 14.885 1.00 0.00 C ATOM 822 C PHE A 53 -12.979 38.664 15.577 1.00 0.00 C ATOM 823 O PHE A 53 -13.980 38.325 14.942 1.00 0.00 O ATOM 824 CB PHE A 53 -11.357 40.140 14.323 1.00 0.00 C ATOM 825 CG PHE A 53 -10.492 40.030 13.104 1.00 0.00 C ATOM 826 CD1 PHE A 53 -11.064 39.723 11.873 1.00 0.00 C ATOM 827 CD2 PHE A 53 -9.122 40.227 13.203 1.00 0.00 C ATOM 828 CE1 PHE A 53 -10.273 39.618 10.730 1.00 0.00 C ATOM 829 CE2 PHE A 53 -8.330 40.117 12.067 1.00 0.00 C ATOM 830 CZ PHE A 53 -8.899 39.815 10.827 1.00 0.00 C ATOM 0 H PHE A 53 -11.893 37.976 12.933 1.00 0.00 H new ATOM 0 HA PHE A 53 -10.828 38.513 15.625 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -12.306 40.614 14.072 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -10.875 40.768 15.073 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -12.130 39.565 11.803 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -8.674 40.464 14.157 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -10.723 39.385 9.776 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -7.263 40.266 12.143 1.00 0.00 H new ATOM 0 HZ PHE A 53 -8.276 39.735 9.949 1.00 0.00 H new ATOM 840 N PRO A 54 -13.049 38.984 16.852 1.00 0.00 N ATOM 841 CA PRO A 54 -14.328 38.959 17.621 1.00 0.00 C ATOM 842 C PRO A 54 -15.225 40.156 17.313 1.00 0.00 C ATOM 843 O PRO A 54 -16.355 40.229 17.790 1.00 0.00 O ATOM 844 CB PRO A 54 -13.862 38.972 19.083 1.00 0.00 C ATOM 845 CG PRO A 54 -12.550 39.696 19.064 1.00 0.00 C ATOM 846 CD PRO A 54 -11.919 39.415 17.703 1.00 0.00 C ATOM 0 HA PRO A 54 -14.941 38.094 17.369 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -14.584 39.479 19.723 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -13.749 37.959 19.470 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -12.696 40.766 19.210 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -11.904 39.349 19.870 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -11.435 40.304 17.299 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -11.156 38.640 17.772 1.00 0.00 H new ATOM 854 N THR A 55 -14.709 41.100 16.531 1.00 0.00 N ATOM 855 CA THR A 55 -15.473 42.304 16.178 1.00 0.00 C ATOM 856 C THR A 55 -15.418 42.559 14.677 1.00 0.00 C ATOM 857 O THR A 55 -14.497 42.118 13.990 1.00 0.00 O ATOM 858 CB THR A 55 -14.899 43.510 16.944 1.00 0.00 C ATOM 859 OG1 THR A 55 -13.496 43.351 17.067 1.00 0.00 O ATOM 860 CG2 THR A 55 -15.518 43.601 18.337 1.00 0.00 C ATOM 0 H THR A 55 -13.772 41.060 16.130 1.00 0.00 H new ATOM 0 HA THR A 55 -16.517 42.157 16.456 1.00 0.00 H new ATOM 0 HB THR A 55 -15.130 44.423 16.396 1.00 0.00 H new ATOM 0 HG1 THR A 55 -13.143 44.026 17.684 1.00 0.00 H new ATOM 0 HG21 THR A 55 -15.101 44.459 18.865 1.00 0.00 H new ATOM 0 HG22 THR A 55 -16.598 43.719 18.248 1.00 0.00 H new ATOM 0 HG23 THR A 55 -15.297 42.690 18.894 1.00 0.00 H new ATOM 868 N LEU A 56 -16.447 43.239 14.178 1.00 0.00 N ATOM 869 CA LEU A 56 -16.530 43.520 12.751 1.00 0.00 C ATOM 870 C LEU A 56 -15.440 44.501 12.320 1.00 0.00 C ATOM 871 O LEU A 56 -14.573 44.170 11.507 1.00 0.00 O ATOM 872 CB LEU A 56 -17.911 44.102 12.417 1.00 0.00 C ATOM 873 CG LEU A 56 -18.350 43.602 11.041 1.00 0.00 C ATOM 874 CD1 LEU A 56 -19.717 44.163 10.721 1.00 0.00 C ATOM 875 CD2 LEU A 56 -17.341 44.051 9.978 1.00 0.00 C ATOM 0 H LEU A 56 -17.223 43.600 14.732 1.00 0.00 H new ATOM 0 HA LEU A 56 -16.384 42.586 12.209 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -18.637 43.804 13.174 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -17.871 45.191 12.425 1.00 0.00 H new ATOM 0 HG LEU A 56 -18.395 42.513 11.046 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -20.035 43.809 9.740 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -20.431 43.833 11.475 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -19.671 45.252 10.717 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -17.659 43.692 8.999 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -17.287 45.140 9.965 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -16.359 43.642 10.213 1.00 0.00 H new ATOM 887 N LYS A 57 -15.496 45.727 12.843 1.00 0.00 N ATOM 888 CA LYS A 57 -14.531 46.742 12.469 1.00 0.00 C ATOM 889 C LYS A 57 -13.115 46.236 12.653 1.00 0.00 C ATOM 890 O LYS A 57 -12.215 46.601 11.898 1.00 0.00 O ATOM 891 CB LYS A 57 -14.746 47.976 13.348 1.00 0.00 C ATOM 892 CG LYS A 57 -14.068 49.193 12.710 1.00 0.00 C ATOM 893 CD LYS A 57 -14.335 50.452 13.552 1.00 0.00 C ATOM 894 CE LYS A 57 -15.767 50.955 13.329 1.00 0.00 C ATOM 895 NZ LYS A 57 -15.897 52.332 13.871 1.00 0.00 N1+ ATOM 0 H LYS A 57 -16.195 46.032 13.520 1.00 0.00 H new ATOM 0 HA LYS A 57 -14.673 46.993 11.418 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -15.812 48.165 13.470 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -14.337 47.801 14.343 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -12.995 49.020 12.631 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -14.443 49.338 11.697 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -14.182 50.229 14.608 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -13.623 51.233 13.284 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -16.005 50.947 12.265 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -16.478 50.291 13.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -16.867 52.674 13.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -15.686 52.326 14.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -15.228 52.962 13.383 1.00 0.00 H new ATOM 909 N SER A 58 -12.923 45.388 13.648 1.00 0.00 N ATOM 910 CA SER A 58 -11.607 44.834 13.909 1.00 0.00 C ATOM 911 C SER A 58 -11.088 44.118 12.666 1.00 0.00 C ATOM 912 O SER A 58 -9.894 44.148 12.377 1.00 0.00 O ATOM 913 CB SER A 58 -11.676 43.856 15.071 1.00 0.00 C ATOM 914 OG SER A 58 -10.505 43.055 15.085 1.00 0.00 O ATOM 0 H SER A 58 -13.655 45.070 14.283 1.00 0.00 H new ATOM 0 HA SER A 58 -10.927 45.646 14.165 1.00 0.00 H new ATOM 0 HB2 SER A 58 -11.770 44.398 16.012 1.00 0.00 H new ATOM 0 HB3 SER A 58 -12.560 43.225 14.977 1.00 0.00 H new ATOM 0 HG SER A 58 -10.387 42.664 15.976 1.00 0.00 H new ATOM 920 N ALA A 59 -11.994 43.475 11.939 1.00 0.00 N ATOM 921 CA ALA A 59 -11.611 42.760 10.732 1.00 0.00 C ATOM 922 C ALA A 59 -11.191 43.728 9.631 1.00 0.00 C ATOM 923 O ALA A 59 -10.189 43.511 8.953 1.00 0.00 O ATOM 924 CB ALA A 59 -12.780 41.908 10.244 1.00 0.00 C ATOM 0 H ALA A 59 -12.988 43.435 12.162 1.00 0.00 H new ATOM 0 HA ALA A 59 -10.762 42.120 10.970 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -12.488 41.374 9.340 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -13.054 41.190 11.017 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -13.633 42.551 10.027 1.00 0.00 H new ATOM 930 N GLU A 60 -11.959 44.799 9.468 1.00 0.00 N ATOM 931 CA GLU A 60 -11.652 45.797 8.446 1.00 0.00 C ATOM 932 C GLU A 60 -10.319 46.479 8.760 1.00 0.00 C ATOM 933 O GLU A 60 -9.519 46.746 7.863 1.00 0.00 O ATOM 934 CB GLU A 60 -12.762 46.845 8.400 1.00 0.00 C ATOM 935 CG GLU A 60 -14.044 46.200 7.873 1.00 0.00 C ATOM 936 CD GLU A 60 -15.192 47.198 7.933 1.00 0.00 C ATOM 937 OE1 GLU A 60 -14.954 48.322 8.344 1.00 0.00 O ATOM 938 OE2 GLU A 60 -16.296 46.823 7.573 1.00 0.00 O1- ATOM 0 H GLU A 60 -12.791 44.999 10.023 1.00 0.00 H new ATOM 0 HA GLU A 60 -11.579 45.300 7.478 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -12.931 47.257 9.395 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -12.468 47.675 7.757 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -13.897 45.864 6.847 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -14.287 45.318 8.465 1.00 0.00 H new ATOM 945 N HIS A 61 -10.083 46.750 10.043 1.00 0.00 N ATOM 946 CA HIS A 61 -8.838 47.389 10.468 1.00 0.00 C ATOM 947 C HIS A 61 -7.655 46.447 10.238 1.00 0.00 C ATOM 948 O HIS A 61 -6.610 46.859 9.739 1.00 0.00 O ATOM 949 CB HIS A 61 -8.926 47.761 11.954 1.00 0.00 C ATOM 950 CG HIS A 61 -7.568 48.177 12.456 1.00 0.00 C ATOM 951 ND1 HIS A 61 -6.552 47.258 12.667 1.00 0.00 N ATOM 952 CD2 HIS A 61 -7.039 49.400 12.780 1.00 0.00 C ATOM 953 CE1 HIS A 61 -5.476 47.936 13.098 1.00 0.00 C ATOM 954 NE2 HIS A 61 -5.720 49.245 13.186 1.00 0.00 N ATOM 0 H HIS A 61 -10.732 46.539 10.801 1.00 0.00 H new ATOM 0 HA HIS A 61 -8.687 48.294 9.879 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -9.640 48.573 12.094 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -9.292 46.911 12.530 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -7.568 50.340 12.727 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -4.529 47.478 13.343 1.00 0.00 H new ATOM 0 HE2 HIS A 61 -5.075 49.976 13.487 1.00 0.00 H new ATOM 962 N ALA A 62 -7.827 45.184 10.620 1.00 0.00 N ATOM 963 CA ALA A 62 -6.765 44.198 10.455 1.00 0.00 C ATOM 964 C ALA A 62 -6.539 43.877 8.981 1.00 0.00 C ATOM 965 O ALA A 62 -5.403 43.735 8.533 1.00 0.00 O ATOM 966 CB ALA A 62 -7.123 42.917 11.211 1.00 0.00 C ATOM 0 H ALA A 62 -8.683 44.823 11.042 1.00 0.00 H new ATOM 0 HA ALA A 62 -5.845 44.618 10.861 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -6.326 42.185 11.084 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -7.244 43.142 12.271 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -8.055 42.511 10.818 1.00 0.00 H new ATOM 972 N ALA A 63 -7.628 43.757 8.233 1.00 0.00 N ATOM 973 CA ALA A 63 -7.533 43.445 6.811 1.00 0.00 C ATOM 974 C ALA A 63 -6.727 44.513 6.083 1.00 0.00 C ATOM 975 O ALA A 63 -5.762 44.203 5.380 1.00 0.00 O ATOM 976 CB ALA A 63 -8.939 43.369 6.208 1.00 0.00 C ATOM 0 H ALA A 63 -8.580 43.870 8.582 1.00 0.00 H new ATOM 0 HA ALA A 63 -7.030 42.485 6.697 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -8.867 43.136 5.146 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -9.510 42.590 6.713 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -9.442 44.327 6.336 1.00 0.00 H new ATOM 982 N ALA A 64 -7.113 45.777 6.264 1.00 0.00 N ATOM 983 CA ALA A 64 -6.407 46.874 5.622 1.00 0.00 C ATOM 984 C ALA A 64 -4.969 46.925 6.108 1.00 0.00 C ATOM 985 O ALA A 64 -4.069 47.253 5.352 1.00 0.00 O ATOM 986 CB ALA A 64 -7.103 48.195 5.940 1.00 0.00 C ATOM 0 H ALA A 64 -7.903 46.059 6.844 1.00 0.00 H new ATOM 0 HA ALA A 64 -6.413 46.713 4.544 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -6.569 49.013 5.456 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -8.129 48.163 5.573 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -7.108 48.353 7.018 1.00 0.00 H new ATOM 992 N LYS A 65 -4.764 46.604 7.380 1.00 0.00 N ATOM 993 CA LYS A 65 -3.420 46.624 7.949 1.00 0.00 C ATOM 994 C LYS A 65 -2.504 45.687 7.170 1.00 0.00 C ATOM 995 O LYS A 65 -1.364 46.039 6.874 1.00 0.00 O ATOM 996 CB LYS A 65 -3.462 46.175 9.412 1.00 0.00 C ATOM 997 CG LYS A 65 -2.069 46.294 10.038 1.00 0.00 C ATOM 998 CD LYS A 65 -2.132 45.880 11.508 1.00 0.00 C ATOM 999 CE LYS A 65 -0.743 46.016 12.134 1.00 0.00 C ATOM 1000 NZ LYS A 65 -0.800 45.597 13.563 1.00 0.00 N1+ ATOM 0 H LYS A 65 -5.500 46.330 8.031 1.00 0.00 H new ATOM 0 HA LYS A 65 -3.036 47.642 7.888 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -4.173 46.786 9.968 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -3.811 45.144 9.475 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -1.362 45.661 9.501 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -1.707 47.319 9.953 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -2.847 46.505 12.043 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -2.482 44.851 11.593 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -0.026 45.400 11.591 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -0.398 47.047 12.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 0.144 45.689 13.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -1.472 46.203 14.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -1.112 44.607 13.622 1.00 0.00 H new ATOM 1014 N ILE A 66 -2.995 44.490 6.835 1.00 0.00 N ATOM 1015 CA ILE A 66 -2.180 43.540 6.103 1.00 0.00 C ATOM 1016 C ILE A 66 -1.761 44.128 4.759 1.00 0.00 C ATOM 1017 O ILE A 66 -0.617 43.975 4.328 1.00 0.00 O ATOM 1018 CB ILE A 66 -2.993 42.256 5.888 1.00 0.00 C ATOM 1019 CG1 ILE A 66 -3.215 41.556 7.233 1.00 0.00 C ATOM 1020 CG2 ILE A 66 -2.242 41.319 4.952 1.00 0.00 C ATOM 1021 CD1 ILE A 66 -4.289 40.478 7.079 1.00 0.00 C ATOM 0 H ILE A 66 -3.937 44.168 7.058 1.00 0.00 H new ATOM 0 HA ILE A 66 -1.278 43.315 6.673 1.00 0.00 H new ATOM 0 HB ILE A 66 -3.955 42.514 5.446 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -2.283 41.109 7.580 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -3.520 42.282 7.987 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -2.824 40.410 4.803 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -2.087 41.811 3.992 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -1.277 41.064 5.390 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -4.446 39.981 8.036 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -5.222 40.938 6.752 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -3.966 39.746 6.339 1.00 0.00 H new ATOM 1033 N ALA A 67 -2.699 44.784 4.101 1.00 0.00 N ATOM 1034 CA ALA A 67 -2.428 45.382 2.791 1.00 0.00 C ATOM 1035 C ALA A 67 -1.551 46.618 2.934 1.00 0.00 C ATOM 1036 O ALA A 67 -0.549 46.770 2.238 1.00 0.00 O ATOM 1037 CB ALA A 67 -3.733 45.745 2.084 1.00 0.00 C ATOM 0 H ALA A 67 -3.651 44.920 4.442 1.00 0.00 H new ATOM 0 HA ALA A 67 -1.897 44.646 2.188 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -3.510 46.188 1.113 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -4.333 44.846 1.944 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -4.288 46.461 2.690 1.00 0.00 H new ATOM 1043 N VAL A 68 -1.936 47.493 3.848 1.00 0.00 N ATOM 1044 CA VAL A 68 -1.195 48.716 4.090 1.00 0.00 C ATOM 1045 C VAL A 68 0.238 48.388 4.487 1.00 0.00 C ATOM 1046 O VAL A 68 1.171 49.059 4.050 1.00 0.00 O ATOM 1047 CB VAL A 68 -1.879 49.528 5.212 1.00 0.00 C ATOM 1048 CG1 VAL A 68 -0.906 50.569 5.782 1.00 0.00 C ATOM 1049 CG2 VAL A 68 -3.106 50.255 4.654 1.00 0.00 C ATOM 0 H VAL A 68 -2.761 47.377 4.436 1.00 0.00 H new ATOM 0 HA VAL A 68 -1.181 49.310 3.176 1.00 0.00 H new ATOM 0 HB VAL A 68 -2.181 48.840 6.001 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -1.400 51.135 6.572 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -0.031 50.064 6.191 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -0.595 51.249 4.989 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -3.584 50.826 5.450 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -2.797 50.932 3.857 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -3.812 49.525 4.257 1.00 0.00 H new ATOM 1059 N ALA A 69 0.409 47.371 5.319 1.00 0.00 N ATOM 1060 CA ALA A 69 1.739 46.993 5.760 1.00 0.00 C ATOM 1061 C ALA A 69 2.499 46.298 4.638 1.00 0.00 C ATOM 1062 O ALA A 69 3.729 46.241 4.651 1.00 0.00 O ATOM 1063 CB ALA A 69 1.642 46.058 6.966 1.00 0.00 C ATOM 0 H ALA A 69 -0.347 46.801 5.697 1.00 0.00 H new ATOM 0 HA ALA A 69 2.278 47.898 6.042 1.00 0.00 H new ATOM 0 HB1 ALA A 69 2.644 45.779 7.291 1.00 0.00 H new ATOM 0 HB2 ALA A 69 1.125 46.566 7.780 1.00 0.00 H new ATOM 0 HB3 ALA A 69 1.088 45.162 6.688 1.00 0.00 H new ATOM 1069 N SER A 70 1.760 45.766 3.670 1.00 0.00 N ATOM 1070 CA SER A 70 2.377 45.073 2.540 1.00 0.00 C ATOM 1071 C SER A 70 2.780 46.065 1.455 1.00 0.00 C ATOM 1072 O SER A 70 3.821 45.909 0.814 1.00 0.00 O ATOM 1073 CB SER A 70 1.400 44.046 1.963 1.00 0.00 C ATOM 1074 OG SER A 70 1.163 43.033 2.930 1.00 0.00 O ATOM 0 H SER A 70 0.741 45.800 3.643 1.00 0.00 H new ATOM 0 HA SER A 70 3.272 44.563 2.895 1.00 0.00 H new ATOM 0 HB2 SER A 70 0.463 44.531 1.690 1.00 0.00 H new ATOM 0 HB3 SER A 70 1.809 43.608 1.053 1.00 0.00 H new ATOM 0 HG SER A 70 0.230 43.076 3.227 1.00 0.00 H new ATOM 1080 N LEU A 71 1.952 47.081 1.249 1.00 0.00 N ATOM 1081 CA LEU A 71 2.226 48.095 0.239 1.00 0.00 C ATOM 1082 C LEU A 71 3.333 49.027 0.695 1.00 0.00 C ATOM 1083 O LEU A 71 4.113 49.533 -0.114 1.00 0.00 O ATOM 1084 CB LEU A 71 0.960 48.906 -0.039 1.00 0.00 C ATOM 1085 CG LEU A 71 -0.107 48.000 -0.667 1.00 0.00 C ATOM 1086 CD1 LEU A 71 -1.435 48.756 -0.755 1.00 0.00 C ATOM 1087 CD2 LEU A 71 0.331 47.554 -2.076 1.00 0.00 C ATOM 0 H LEU A 71 1.086 47.225 1.768 1.00 0.00 H new ATOM 0 HA LEU A 71 2.548 47.591 -0.672 1.00 0.00 H new ATOM 0 HB2 LEU A 71 0.583 49.339 0.888 1.00 0.00 H new ATOM 0 HB3 LEU A 71 1.187 49.735 -0.709 1.00 0.00 H new ATOM 0 HG LEU A 71 -0.232 47.116 -0.042 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -2.192 48.111 -1.201 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -1.753 49.050 0.245 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -1.307 49.646 -1.372 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -0.436 46.912 -2.509 1.00 0.00 H new ATOM 0 HD22 LEU A 71 0.470 48.431 -2.708 1.00 0.00 H new ATOM 0 HD23 LEU A 71 1.269 47.004 -2.008 1.00 0.00 H new ATOM 1099 N THR A 72 3.383 49.266 1.993 1.00 0.00 N ATOM 1100 CA THR A 72 4.387 50.158 2.548 1.00 0.00 C ATOM 1101 C THR A 72 5.776 49.504 2.529 1.00 0.00 C ATOM 1102 O THR A 72 5.895 48.288 2.679 1.00 0.00 O ATOM 1103 CB THR A 72 4.029 50.548 3.986 1.00 0.00 C ATOM 1104 OG1 THR A 72 3.610 49.392 4.699 1.00 0.00 O ATOM 1105 CG2 THR A 72 2.900 51.581 3.968 1.00 0.00 C ATOM 0 H THR A 72 2.746 48.859 2.678 1.00 0.00 H new ATOM 0 HA THR A 72 4.410 51.054 1.927 1.00 0.00 H new ATOM 0 HB THR A 72 4.903 50.978 4.476 1.00 0.00 H new ATOM 0 HG1 THR A 72 2.637 49.414 4.815 1.00 0.00 H new ATOM 0 HG21 THR A 72 2.645 51.859 4.991 1.00 0.00 H new ATOM 0 HG22 THR A 72 3.226 52.466 3.422 1.00 0.00 H new ATOM 0 HG23 THR A 72 2.024 51.154 3.479 1.00 0.00 H new ATOM 1113 N PRO A 73 6.822 50.282 2.360 1.00 0.00 N ATOM 1114 CA PRO A 73 8.218 49.755 2.334 1.00 0.00 C ATOM 1115 C PRO A 73 8.696 49.329 3.719 1.00 0.00 C ATOM 1116 O PRO A 73 8.803 50.153 4.626 1.00 0.00 O ATOM 1117 CB PRO A 73 9.043 50.945 1.815 1.00 0.00 C ATOM 1118 CG PRO A 73 8.256 52.163 2.199 1.00 0.00 C ATOM 1119 CD PRO A 73 6.791 51.745 2.175 1.00 0.00 C ATOM 0 HA PRO A 73 8.308 48.862 1.715 1.00 0.00 H new ATOM 0 HB2 PRO A 73 10.037 50.961 2.262 1.00 0.00 H new ATOM 0 HB3 PRO A 73 9.180 50.889 0.735 1.00 0.00 H new ATOM 0 HG2 PRO A 73 8.544 52.517 3.189 1.00 0.00 H new ATOM 0 HG3 PRO A 73 8.439 52.981 1.502 1.00 0.00 H new ATOM 0 HD2 PRO A 73 6.226 52.234 2.969 1.00 0.00 H new ATOM 0 HD3 PRO A 73 6.316 52.016 1.232 1.00 0.00 H new ATOM 1127 N GLN A 74 8.987 48.037 3.870 1.00 0.00 N ATOM 1128 CA GLN A 74 9.463 47.502 5.150 1.00 0.00 C ATOM 1129 C GLN A 74 10.879 46.957 5.004 1.00 0.00 C ATOM 1130 O GLN A 74 11.077 45.776 4.715 1.00 0.00 O ATOM 1131 CB GLN A 74 8.533 46.386 5.626 1.00 0.00 C ATOM 1132 CG GLN A 74 8.918 45.974 7.051 1.00 0.00 C ATOM 1133 CD GLN A 74 8.626 47.118 8.018 1.00 0.00 C ATOM 1134 OE1 GLN A 74 7.599 47.786 7.899 1.00 0.00 O ATOM 1135 NE2 GLN A 74 9.481 47.395 8.964 1.00 0.00 N ATOM 0 H GLN A 74 8.903 47.343 3.127 1.00 0.00 H new ATOM 0 HA GLN A 74 9.467 48.309 5.883 1.00 0.00 H new ATOM 0 HB2 GLN A 74 7.498 46.725 5.601 1.00 0.00 H new ATOM 0 HB3 GLN A 74 8.603 45.529 4.956 1.00 0.00 H new ATOM 0 HG2 GLN A 74 8.360 45.085 7.346 1.00 0.00 H new ATOM 0 HG3 GLN A 74 9.976 45.713 7.091 1.00 0.00 H new ATOM 0 HE21 GLN A 74 10.332 46.840 9.061 1.00 0.00 H new ATOM 0 HE22 GLN A 74 9.299 48.166 9.606 1.00 0.00 H new ATOM 1144 N SER A 75 11.858 47.829 5.195 1.00 0.00 N ATOM 1145 CA SER A 75 13.260 47.441 5.066 1.00 0.00 C ATOM 1146 C SER A 75 14.170 48.659 5.244 1.00 0.00 C ATOM 1147 O SER A 75 15.007 48.693 6.149 1.00 0.00 O ATOM 1148 CB SER A 75 13.505 46.796 3.677 1.00 0.00 C ATOM 1149 OG SER A 75 12.401 47.085 2.829 1.00 0.00 O ATOM 0 H SER A 75 11.711 48.808 5.439 1.00 0.00 H new ATOM 0 HA SER A 75 13.494 46.714 5.844 1.00 0.00 H new ATOM 0 HB2 SER A 75 14.426 47.182 3.240 1.00 0.00 H new ATOM 0 HB3 SER A 75 13.628 45.718 3.779 1.00 0.00 H new ATOM 0 HG SER A 75 12.550 46.681 1.949 1.00 0.00 H new ATOM 1155 N PRO A 76 14.037 49.640 4.383 1.00 0.00 N ATOM 1156 CA PRO A 76 14.880 50.870 4.430 1.00 0.00 C ATOM 1157 C PRO A 76 14.809 51.557 5.790 1.00 0.00 C ATOM 1158 O PRO A 76 15.839 51.821 6.413 1.00 0.00 O ATOM 1159 CB PRO A 76 14.296 51.767 3.308 1.00 0.00 C ATOM 1160 CG PRO A 76 12.952 51.184 2.992 1.00 0.00 C ATOM 1161 CD PRO A 76 13.070 49.696 3.271 1.00 0.00 C ATOM 0 HA PRO A 76 15.938 50.651 4.284 1.00 0.00 H new ATOM 0 HB2 PRO A 76 14.208 52.802 3.638 1.00 0.00 H new ATOM 0 HB3 PRO A 76 14.941 51.767 2.429 1.00 0.00 H new ATOM 0 HG2 PRO A 76 12.175 51.637 3.608 1.00 0.00 H new ATOM 0 HG3 PRO A 76 12.681 51.367 1.952 1.00 0.00 H new ATOM 0 HD2 PRO A 76 12.110 49.261 3.549 1.00 0.00 H new ATOM 0 HD3 PRO A 76 13.427 49.149 2.398 1.00 0.00 H new ATOM 1169 N GLU A 77 13.594 51.854 6.238 1.00 0.00 N ATOM 1170 CA GLU A 77 13.396 52.525 7.521 1.00 0.00 C ATOM 1171 C GLU A 77 12.136 52.010 8.202 1.00 0.00 C ATOM 1172 O GLU A 77 11.104 51.820 7.562 1.00 0.00 O ATOM 1173 CB GLU A 77 13.285 54.034 7.297 1.00 0.00 C ATOM 1174 CG GLU A 77 12.051 54.341 6.440 1.00 0.00 C ATOM 1175 CD GLU A 77 12.033 55.817 6.064 1.00 0.00 C ATOM 1176 OE1 GLU A 77 13.080 56.331 5.705 1.00 0.00 O ATOM 1177 OE2 GLU A 77 10.972 56.415 6.139 1.00 0.00 O1- ATOM 0 H GLU A 77 12.733 51.642 5.735 1.00 0.00 H new ATOM 0 HA GLU A 77 14.250 52.314 8.165 1.00 0.00 H new ATOM 0 HB2 GLU A 77 13.211 54.549 8.255 1.00 0.00 H new ATOM 0 HB3 GLU A 77 14.183 54.405 6.804 1.00 0.00 H new ATOM 0 HG2 GLU A 77 12.062 53.728 5.539 1.00 0.00 H new ATOM 0 HG3 GLU A 77 11.144 54.086 6.988 1.00 0.00 H new ATOM 1184 N GLY A 78 12.235 51.780 9.506 1.00 0.00 N ATOM 1185 CA GLY A 78 11.099 51.282 10.268 1.00 0.00 C ATOM 1186 C GLY A 78 10.076 52.383 10.496 1.00 0.00 C ATOM 1187 O GLY A 78 9.114 52.517 9.739 1.00 0.00 O ATOM 0 H GLY A 78 13.083 51.929 10.053 1.00 0.00 H new ATOM 0 HA2 GLY A 78 10.634 50.452 9.735 1.00 0.00 H new ATOM 0 HA3 GLY A 78 11.441 50.893 11.227 1.00 0.00 H new ATOM 1191 N ILE A 79 10.293 53.176 11.543 1.00 0.00 N ATOM 1192 CA ILE A 79 9.386 54.279 11.870 1.00 0.00 C ATOM 1193 C ILE A 79 10.038 55.627 11.575 1.00 0.00 C ATOM 1194 O ILE A 79 9.352 56.613 11.309 1.00 0.00 O ATOM 1195 CB ILE A 79 8.993 54.204 13.351 1.00 0.00 C ATOM 1196 CG1 ILE A 79 7.876 55.227 13.636 1.00 0.00 C ATOM 1197 CG2 ILE A 79 10.211 54.510 14.230 1.00 0.00 C ATOM 1198 CD1 ILE A 79 6.602 54.873 12.852 1.00 0.00 C ATOM 0 H ILE A 79 11.085 53.078 12.178 1.00 0.00 H new ATOM 0 HA ILE A 79 8.494 54.187 11.250 1.00 0.00 H new ATOM 0 HB ILE A 79 8.634 53.200 13.579 1.00 0.00 H new ATOM 0 HG12 ILE A 79 7.658 55.247 14.704 1.00 0.00 H new ATOM 0 HG13 ILE A 79 8.213 56.227 13.361 1.00 0.00 H new ATOM 0 HG21 ILE A 79 9.925 54.455 15.280 1.00 0.00 H new ATOM 0 HG22 ILE A 79 10.997 53.782 14.029 1.00 0.00 H new ATOM 0 HG23 ILE A 79 10.579 55.511 14.006 1.00 0.00 H new ATOM 0 HD11 ILE A 79 5.826 55.608 13.068 1.00 0.00 H new ATOM 0 HD12 ILE A 79 6.819 54.877 11.784 1.00 0.00 H new ATOM 0 HD13 ILE A 79 6.256 53.883 13.148 1.00 0.00 H new ATOM 1210 N ASP A 80 11.364 55.664 11.629 1.00 0.00 N ATOM 1211 CA ASP A 80 12.096 56.903 11.369 1.00 0.00 C ATOM 1212 C ASP A 80 13.552 56.602 11.045 1.00 0.00 C ATOM 1213 O ASP A 80 13.932 56.603 9.878 1.00 0.00 O ATOM 1214 CB ASP A 80 12.001 57.829 12.580 1.00 0.00 C ATOM 1215 CG ASP A 80 12.384 57.076 13.849 1.00 0.00 C ATOM 1216 OD1 ASP A 80 12.601 55.876 13.760 1.00 0.00 O ATOM 1217 OD2 ASP A 80 12.458 57.707 14.889 1.00 0.00 O1- ATOM 0 H ASP A 80 11.952 54.860 11.848 1.00 0.00 H new ATOM 0 HA ASP A 80 11.649 57.401 10.509 1.00 0.00 H new ATOM 0 HB2 ASP A 80 12.660 58.686 12.444 1.00 0.00 H new ATOM 0 HB3 ASP A 80 10.987 58.218 12.671 1.00 0.00 H new ATOM 1222 N VAL A 81 14.354 56.340 12.080 1.00 0.00 N ATOM 1223 CA VAL A 81 15.758 56.013 11.913 1.00 0.00 C ATOM 1224 C VAL A 81 16.530 57.265 11.556 1.00 0.00 C ATOM 1225 O VAL A 81 17.549 57.573 12.178 1.00 0.00 O ATOM 1226 CB VAL A 81 15.938 54.924 10.846 1.00 0.00 C ATOM 1227 CG1 VAL A 81 17.354 54.364 10.926 1.00 0.00 C ATOM 1228 CG2 VAL A 81 14.918 53.789 11.081 1.00 0.00 C ATOM 0 H VAL A 81 14.042 56.350 13.051 1.00 0.00 H new ATOM 0 HA VAL A 81 16.149 55.619 12.851 1.00 0.00 H new ATOM 0 HB VAL A 81 15.773 55.355 9.859 1.00 0.00 H new ATOM 0 HG11 VAL A 81 17.483 53.591 10.169 1.00 0.00 H new ATOM 0 HG12 VAL A 81 18.072 55.165 10.752 1.00 0.00 H new ATOM 0 HG13 VAL A 81 17.520 53.935 11.914 1.00 0.00 H new ATOM 0 HG21 VAL A 81 15.050 53.019 10.321 1.00 0.00 H new ATOM 0 HG22 VAL A 81 15.077 53.356 12.069 1.00 0.00 H new ATOM 0 HG23 VAL A 81 13.906 54.190 11.019 1.00 0.00 H new ATOM 1238 N ALA A 82 16.019 58.006 10.574 1.00 0.00 N ATOM 1239 CA ALA A 82 16.645 59.241 10.169 1.00 0.00 C ATOM 1240 C ALA A 82 15.595 60.231 9.703 1.00 0.00 C ATOM 1241 O ALA A 82 15.339 60.389 8.508 1.00 0.00 O ATOM 1242 CB ALA A 82 17.603 58.965 9.018 1.00 0.00 C ATOM 0 H ALA A 82 15.176 57.765 10.052 1.00 0.00 H new ATOM 0 HA ALA A 82 17.185 59.659 11.019 1.00 0.00 H new ATOM 0 HB1 ALA A 82 18.078 59.896 8.709 1.00 0.00 H new ATOM 0 HB2 ALA A 82 18.367 58.258 9.342 1.00 0.00 H new ATOM 0 HB3 ALA A 82 17.051 58.543 8.178 1.00 0.00 H new ATOM 1248 N TYR A 83 15.055 60.940 10.669 1.00 0.00 N ATOM 1249 CA TYR A 83 14.057 61.991 10.396 1.00 0.00 C ATOM 1250 C TYR A 83 14.562 62.890 9.268 1.00 0.00 C ATOM 1251 O TYR A 83 13.805 63.630 8.650 1.00 0.00 O ATOM 1252 CB TYR A 83 13.797 62.826 11.664 1.00 0.00 C ATOM 1253 CG TYR A 83 15.072 62.950 12.462 1.00 0.00 C ATOM 1254 CD1 TYR A 83 15.492 61.890 13.277 1.00 0.00 C ATOM 1255 CD2 TYR A 83 15.833 64.123 12.388 1.00 0.00 C ATOM 1256 CE1 TYR A 83 16.673 62.008 14.019 1.00 0.00 C ATOM 1257 CE2 TYR A 83 17.014 64.238 13.132 1.00 0.00 C ATOM 1258 CZ TYR A 83 17.433 63.181 13.947 1.00 0.00 C ATOM 1259 OH TYR A 83 18.597 63.295 14.677 1.00 0.00 O ATOM 0 H TYR A 83 15.280 60.820 11.657 1.00 0.00 H new ATOM 0 HA TYR A 83 13.120 61.524 10.094 1.00 0.00 H new ATOM 0 HB2 TYR A 83 13.430 63.815 11.391 1.00 0.00 H new ATOM 0 HB3 TYR A 83 13.022 62.355 12.269 1.00 0.00 H new ATOM 0 HD1 TYR A 83 14.906 60.985 13.332 1.00 0.00 H new ATOM 0 HD2 TYR A 83 15.510 64.938 11.758 1.00 0.00 H new ATOM 0 HE1 TYR A 83 16.998 61.193 14.648 1.00 0.00 H new ATOM 0 HE2 TYR A 83 17.601 65.143 13.077 1.00 0.00 H new ATOM 0 HH TYR A 83 19.224 63.881 14.204 1.00 0.00 H new ATOM 1269 N LYS A 84 15.847 62.781 9.021 1.00 0.00 N ATOM 1270 CA LYS A 84 16.477 63.587 7.965 1.00 0.00 C ATOM 1271 C LYS A 84 15.714 63.353 6.669 1.00 0.00 C ATOM 1272 O LYS A 84 15.436 64.288 5.916 1.00 0.00 O ATOM 1273 CB LYS A 84 17.951 63.214 7.788 1.00 0.00 C ATOM 1274 CG LYS A 84 18.728 63.654 9.028 1.00 0.00 C ATOM 1275 CD LYS A 84 20.190 63.247 8.881 1.00 0.00 C ATOM 1276 CE LYS A 84 20.946 63.591 10.165 1.00 0.00 C ATOM 1277 NZ LYS A 84 20.895 65.063 10.394 1.00 0.00 N1+ ATOM 0 H LYS A 84 16.480 62.156 9.520 1.00 0.00 H new ATOM 0 HA LYS A 84 16.440 64.640 8.242 1.00 0.00 H new ATOM 0 HB2 LYS A 84 18.052 62.139 7.642 1.00 0.00 H new ATOM 0 HB3 LYS A 84 18.357 63.696 6.899 1.00 0.00 H new ATOM 0 HG2 LYS A 84 18.651 64.734 9.155 1.00 0.00 H new ATOM 0 HG3 LYS A 84 18.300 63.197 9.920 1.00 0.00 H new ATOM 0 HD2 LYS A 84 20.263 62.178 8.679 1.00 0.00 H new ATOM 0 HD3 LYS A 84 20.639 63.763 8.032 1.00 0.00 H new ATOM 0 HE2 LYS A 84 20.504 63.065 11.011 1.00 0.00 H new ATOM 0 HE3 LYS A 84 21.982 63.260 10.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 21.639 65.336 11.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 21.045 65.560 9.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 19.965 65.322 10.782 1.00 0.00 H new ATOM 1291 N ASN A 85 15.386 62.097 6.418 1.00 0.00 N ATOM 1292 CA ASN A 85 14.649 61.751 5.196 1.00 0.00 C ATOM 1293 C ASN A 85 13.265 62.398 5.203 1.00 0.00 C ATOM 1294 O ASN A 85 12.784 62.884 4.182 1.00 0.00 O ATOM 1295 CB ASN A 85 14.509 60.232 5.077 1.00 0.00 C ATOM 1296 CG ASN A 85 13.082 59.870 4.679 1.00 0.00 C ATOM 1297 OD1 ASN A 85 12.163 59.770 5.600 1.00 0.00 O flip ATOM 1298 ND2 ASN A 85 12.797 59.672 3.498 1.00 0.00 N flip ATOM 0 H ASN A 85 15.609 61.308 7.025 1.00 0.00 H new ATOM 0 HA ASN A 85 15.208 62.128 4.339 1.00 0.00 H new ATOM 0 HB2 ASN A 85 15.210 59.851 4.335 1.00 0.00 H new ATOM 0 HB3 ASN A 85 14.762 59.760 6.026 1.00 0.00 H new ATOM 0 HD21 ASN A 85 13.517 59.751 2.780 1.00 0.00 H new ATOM 0 HD22 ASN A 85 11.841 59.429 3.238 1.00 0.00 H new ATOM 1305 N LEU A 86 12.630 62.398 6.370 1.00 0.00 N ATOM 1306 CA LEU A 86 11.297 62.977 6.503 1.00 0.00 C ATOM 1307 C LEU A 86 11.299 64.441 6.084 1.00 0.00 C ATOM 1308 O LEU A 86 10.488 64.866 5.264 1.00 0.00 O ATOM 1309 CB LEU A 86 10.845 62.868 7.955 1.00 0.00 C ATOM 1310 CG LEU A 86 9.298 62.974 8.030 1.00 0.00 C ATOM 1311 CD1 LEU A 86 8.666 61.574 8.098 1.00 0.00 C ATOM 1312 CD2 LEU A 86 8.904 63.771 9.266 1.00 0.00 C ATOM 0 H LEU A 86 13.012 62.007 7.231 1.00 0.00 H new ATOM 0 HA LEU A 86 10.612 62.431 5.854 1.00 0.00 H new ATOM 0 HB2 LEU A 86 11.175 61.920 8.379 1.00 0.00 H new ATOM 0 HB3 LEU A 86 11.303 63.659 8.549 1.00 0.00 H new ATOM 0 HG LEU A 86 8.936 63.479 7.134 1.00 0.00 H new ATOM 0 HD11 LEU A 86 7.581 61.667 8.150 1.00 0.00 H new ATOM 0 HD12 LEU A 86 8.939 61.008 7.208 1.00 0.00 H new ATOM 0 HD13 LEU A 86 9.029 61.054 8.984 1.00 0.00 H new ATOM 0 HD21 LEU A 86 7.818 63.846 9.320 1.00 0.00 H new ATOM 0 HD22 LEU A 86 9.277 63.268 10.158 1.00 0.00 H new ATOM 0 HD23 LEU A 86 9.334 64.771 9.207 1.00 0.00 H new ATOM 1324 N LEU A 87 12.213 65.207 6.653 1.00 0.00 N ATOM 1325 CA LEU A 87 12.304 66.623 6.331 1.00 0.00 C ATOM 1326 C LEU A 87 12.502 66.800 4.832 1.00 0.00 C ATOM 1327 O LEU A 87 12.022 67.766 4.240 1.00 0.00 O ATOM 1328 CB LEU A 87 13.469 67.254 7.089 1.00 0.00 C ATOM 1329 CG LEU A 87 13.336 66.947 8.586 1.00 0.00 C ATOM 1330 CD1 LEU A 87 14.549 67.517 9.328 1.00 0.00 C ATOM 1331 CD2 LEU A 87 12.051 67.589 9.137 1.00 0.00 C ATOM 0 H LEU A 87 12.897 64.878 7.334 1.00 0.00 H new ATOM 0 HA LEU A 87 11.379 67.117 6.628 1.00 0.00 H new ATOM 0 HB2 LEU A 87 14.415 66.866 6.711 1.00 0.00 H new ATOM 0 HB3 LEU A 87 13.479 68.332 6.928 1.00 0.00 H new ATOM 0 HG LEU A 87 13.289 65.868 8.732 1.00 0.00 H new ATOM 0 HD11 LEU A 87 14.459 67.301 10.393 1.00 0.00 H new ATOM 0 HD12 LEU A 87 15.460 67.060 8.941 1.00 0.00 H new ATOM 0 HD13 LEU A 87 14.593 68.596 9.179 1.00 0.00 H new ATOM 0 HD21 LEU A 87 11.961 67.368 10.201 1.00 0.00 H new ATOM 0 HD22 LEU A 87 12.093 68.669 8.993 1.00 0.00 H new ATOM 0 HD23 LEU A 87 11.187 67.186 8.608 1.00 0.00 H new ATOM 1343 N GLN A 88 13.210 65.859 4.220 1.00 0.00 N ATOM 1344 CA GLN A 88 13.456 65.911 2.785 1.00 0.00 C ATOM 1345 C GLN A 88 12.201 65.519 2.007 1.00 0.00 C ATOM 1346 O GLN A 88 11.992 65.975 0.883 1.00 0.00 O ATOM 1347 CB GLN A 88 14.600 64.967 2.417 1.00 0.00 C ATOM 1348 CG GLN A 88 15.918 65.531 2.947 1.00 0.00 C ATOM 1349 CD GLN A 88 17.062 64.578 2.619 1.00 0.00 C ATOM 1350 OE1 GLN A 88 17.194 64.133 1.477 1.00 0.00 O ATOM 1351 NE2 GLN A 88 17.901 64.233 3.556 1.00 0.00 N ATOM 0 H GLN A 88 13.622 65.054 4.692 1.00 0.00 H new ATOM 0 HA GLN A 88 13.728 66.933 2.521 1.00 0.00 H new ATOM 0 HB2 GLN A 88 14.420 63.978 2.839 1.00 0.00 H new ATOM 0 HB3 GLN A 88 14.653 64.847 1.335 1.00 0.00 H new ATOM 0 HG2 GLN A 88 16.109 66.508 2.504 1.00 0.00 H new ATOM 0 HG3 GLN A 88 15.853 65.677 4.025 1.00 0.00 H new ATOM 0 HE21 GLN A 88 17.791 64.602 4.501 1.00 0.00 H new ATOM 0 HE22 GLN A 88 18.668 63.594 3.344 1.00 0.00 H new ATOM 1360 N GLU A 89 11.370 64.674 2.615 1.00 0.00 N ATOM 1361 CA GLU A 89 10.137 64.234 1.957 1.00 0.00 C ATOM 1362 C GLU A 89 9.146 65.389 1.830 1.00 0.00 C ATOM 1363 O GLU A 89 8.556 65.598 0.770 1.00 0.00 O ATOM 1364 CB GLU A 89 9.503 63.086 2.751 1.00 0.00 C ATOM 1365 CG GLU A 89 10.286 61.795 2.506 1.00 0.00 C ATOM 1366 CD GLU A 89 10.013 61.282 1.100 1.00 0.00 C ATOM 1367 OE1 GLU A 89 8.990 61.652 0.545 1.00 0.00 O ATOM 1368 OE2 GLU A 89 10.825 60.525 0.599 1.00 0.00 O1- ATOM 0 H GLU A 89 11.522 64.285 3.546 1.00 0.00 H new ATOM 0 HA GLU A 89 10.387 63.885 0.955 1.00 0.00 H new ATOM 0 HB2 GLU A 89 9.500 63.325 3.815 1.00 0.00 H new ATOM 0 HB3 GLU A 89 8.463 62.954 2.451 1.00 0.00 H new ATOM 0 HG2 GLU A 89 11.353 61.977 2.635 1.00 0.00 H new ATOM 0 HG3 GLU A 89 10.000 61.041 3.239 1.00 0.00 H new ATOM 1375 N ILE A 90 8.977 66.133 2.912 1.00 0.00 N ATOM 1376 CA ILE A 90 8.060 67.268 2.913 1.00 0.00 C ATOM 1377 C ILE A 90 8.607 68.396 2.046 1.00 0.00 C ATOM 1378 O ILE A 90 7.863 69.043 1.317 1.00 0.00 O ATOM 1379 CB ILE A 90 7.840 67.759 4.345 1.00 0.00 C ATOM 1380 CG1 ILE A 90 9.189 68.101 4.979 1.00 0.00 C ATOM 1381 CG2 ILE A 90 7.157 66.664 5.167 1.00 0.00 C ATOM 1382 CD1 ILE A 90 8.992 68.463 6.451 1.00 0.00 C ATOM 0 H ILE A 90 9.459 65.975 3.797 1.00 0.00 H new ATOM 0 HA ILE A 90 7.105 66.947 2.498 1.00 0.00 H new ATOM 0 HB ILE A 90 7.207 68.646 4.328 1.00 0.00 H new ATOM 0 HG12 ILE A 90 9.868 67.253 4.891 1.00 0.00 H new ATOM 0 HG13 ILE A 90 9.650 68.934 4.449 1.00 0.00 H new ATOM 0 HG21 ILE A 90 7.002 67.017 6.186 1.00 0.00 H new ATOM 0 HG22 ILE A 90 6.195 66.419 4.718 1.00 0.00 H new ATOM 0 HG23 ILE A 90 7.787 65.775 5.183 1.00 0.00 H new ATOM 0 HD11 ILE A 90 9.956 68.706 6.898 1.00 0.00 H new ATOM 0 HD12 ILE A 90 8.329 69.325 6.528 1.00 0.00 H new ATOM 0 HD13 ILE A 90 8.550 67.617 6.978 1.00 0.00 H new ATOM 1394 N ALA A 91 9.907 68.631 2.144 1.00 0.00 N ATOM 1395 CA ALA A 91 10.539 69.697 1.376 1.00 0.00 C ATOM 1396 C ALA A 91 10.189 69.560 -0.101 1.00 0.00 C ATOM 1397 O ALA A 91 9.788 70.529 -0.747 1.00 0.00 O ATOM 1398 CB ALA A 91 12.059 69.640 1.551 1.00 0.00 C ATOM 0 H ALA A 91 10.542 68.103 2.743 1.00 0.00 H new ATOM 0 HA ALA A 91 10.171 70.655 1.742 1.00 0.00 H new ATOM 0 HB1 ALA A 91 12.522 70.440 0.974 1.00 0.00 H new ATOM 0 HB2 ALA A 91 12.309 69.762 2.605 1.00 0.00 H new ATOM 0 HB3 ALA A 91 12.430 68.677 1.199 1.00 0.00 H new ATOM 1404 N GLN A 92 10.341 68.353 -0.626 1.00 0.00 N ATOM 1405 CA GLN A 92 10.037 68.102 -2.027 1.00 0.00 C ATOM 1406 C GLN A 92 8.530 68.151 -2.266 1.00 0.00 C ATOM 1407 O GLN A 92 8.073 68.634 -3.303 1.00 0.00 O ATOM 1408 CB GLN A 92 10.578 66.731 -2.446 1.00 0.00 C ATOM 1409 CG GLN A 92 10.458 66.566 -3.965 1.00 0.00 C ATOM 1410 CD GLN A 92 11.397 67.542 -4.668 1.00 0.00 C ATOM 1411 OE1 GLN A 92 12.538 67.721 -4.243 1.00 0.00 O ATOM 1412 NE2 GLN A 92 10.977 68.196 -5.715 1.00 0.00 N ATOM 0 H GLN A 92 10.670 67.538 -0.108 1.00 0.00 H new ATOM 0 HA GLN A 92 10.515 68.878 -2.626 1.00 0.00 H new ATOM 0 HB2 GLN A 92 11.620 66.633 -2.142 1.00 0.00 H new ATOM 0 HB3 GLN A 92 10.023 65.941 -1.940 1.00 0.00 H new ATOM 0 HG2 GLN A 92 10.703 65.543 -4.249 1.00 0.00 H new ATOM 0 HG3 GLN A 92 9.430 66.746 -4.279 1.00 0.00 H new ATOM 0 HE21 GLN A 92 10.031 68.045 -6.065 1.00 0.00 H new ATOM 0 HE22 GLN A 92 11.595 68.858 -6.184 1.00 0.00 H new ATOM 1421 N LYS A 93 7.762 67.634 -1.312 1.00 0.00 N ATOM 1422 CA LYS A 93 6.310 67.615 -1.453 1.00 0.00 C ATOM 1423 C LYS A 93 5.760 69.035 -1.534 1.00 0.00 C ATOM 1424 O LYS A 93 5.001 69.366 -2.443 1.00 0.00 O ATOM 1425 CB LYS A 93 5.695 66.907 -0.248 1.00 0.00 C ATOM 1426 CG LYS A 93 4.199 66.655 -0.491 1.00 0.00 C ATOM 1427 CD LYS A 93 3.492 66.376 0.837 1.00 0.00 C ATOM 1428 CE LYS A 93 3.991 65.054 1.422 1.00 0.00 C ATOM 1429 NZ LYS A 93 3.164 64.699 2.608 1.00 0.00 N1+ ATOM 0 H LYS A 93 8.114 67.228 -0.445 1.00 0.00 H new ATOM 0 HA LYS A 93 6.055 67.085 -2.371 1.00 0.00 H new ATOM 0 HB2 LYS A 93 6.207 65.961 -0.072 1.00 0.00 H new ATOM 0 HB3 LYS A 93 5.829 67.514 0.648 1.00 0.00 H new ATOM 0 HG2 LYS A 93 3.750 67.522 -0.976 1.00 0.00 H new ATOM 0 HG3 LYS A 93 4.069 65.809 -1.166 1.00 0.00 H new ATOM 0 HD2 LYS A 93 3.681 67.189 1.538 1.00 0.00 H new ATOM 0 HD3 LYS A 93 2.414 66.332 0.683 1.00 0.00 H new ATOM 0 HE2 LYS A 93 3.930 64.265 0.672 1.00 0.00 H new ATOM 0 HE3 LYS A 93 5.039 65.142 1.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 3.500 63.800 3.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 3.244 65.449 3.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 2.170 64.599 2.321 1.00 0.00 H new ATOM 1443 N GLU A 94 6.148 69.870 -0.578 1.00 0.00 N ATOM 1444 CA GLU A 94 5.686 71.254 -0.549 1.00 0.00 C ATOM 1445 C GLU A 94 6.451 72.091 -1.569 1.00 0.00 C ATOM 1446 O GLU A 94 6.237 73.296 -1.682 1.00 0.00 O ATOM 1447 CB GLU A 94 5.878 71.845 0.850 1.00 0.00 C ATOM 1448 CG GLU A 94 5.006 71.088 1.855 1.00 0.00 C ATOM 1449 CD GLU A 94 3.530 71.310 1.543 1.00 0.00 C ATOM 1450 OE1 GLU A 94 3.229 72.267 0.849 1.00 0.00 O ATOM 1451 OE2 GLU A 94 2.722 70.517 2.001 1.00 0.00 O1- ATOM 0 H GLU A 94 6.777 69.616 0.183 1.00 0.00 H new ATOM 0 HA GLU A 94 4.626 71.269 -0.802 1.00 0.00 H new ATOM 0 HB2 GLU A 94 6.926 71.780 1.142 1.00 0.00 H new ATOM 0 HB3 GLU A 94 5.613 72.902 0.848 1.00 0.00 H new ATOM 0 HG2 GLU A 94 5.237 70.023 1.818 1.00 0.00 H new ATOM 0 HG3 GLU A 94 5.226 71.427 2.867 1.00 0.00 H new ATOM 1458 N SER A 95 7.343 71.439 -2.306 1.00 0.00 N ATOM 1459 CA SER A 95 8.136 72.131 -3.316 1.00 0.00 C ATOM 1460 C SER A 95 9.149 73.064 -2.655 1.00 0.00 C ATOM 1461 O SER A 95 9.900 73.761 -3.336 1.00 0.00 O ATOM 1462 CB SER A 95 7.217 72.944 -4.234 1.00 0.00 C ATOM 1463 OG SER A 95 7.050 74.248 -3.694 1.00 0.00 O ATOM 0 H SER A 95 7.535 70.440 -2.225 1.00 0.00 H new ATOM 0 HA SER A 95 8.672 71.386 -3.904 1.00 0.00 H new ATOM 0 HB2 SER A 95 7.644 73.004 -5.235 1.00 0.00 H new ATOM 0 HB3 SER A 95 6.250 72.451 -4.329 1.00 0.00 H new ATOM 0 HG SER A 95 6.649 74.184 -2.802 1.00 0.00 H new ATOM 1469 N SER A 96 9.163 73.069 -1.327 1.00 0.00 N ATOM 1470 CA SER A 96 10.087 73.917 -0.581 1.00 0.00 C ATOM 1471 C SER A 96 11.522 73.434 -0.764 1.00 0.00 C ATOM 1472 O SER A 96 11.759 72.265 -1.070 1.00 0.00 O ATOM 1473 CB SER A 96 9.730 73.905 0.904 1.00 0.00 C ATOM 1474 OG SER A 96 8.333 74.124 1.051 1.00 0.00 O ATOM 0 H SER A 96 8.548 72.498 -0.746 1.00 0.00 H new ATOM 0 HA SER A 96 10.004 74.934 -0.964 1.00 0.00 H new ATOM 0 HB2 SER A 96 10.009 72.950 1.350 1.00 0.00 H new ATOM 0 HB3 SER A 96 10.289 74.678 1.431 1.00 0.00 H new ATOM 0 HG SER A 96 8.099 74.115 2.003 1.00 0.00 H new ATOM 1480 N LEU A 97 12.475 74.342 -0.585 1.00 0.00 N ATOM 1481 CA LEU A 97 13.882 73.999 -0.741 1.00 0.00 C ATOM 1482 C LEU A 97 14.332 73.084 0.383 1.00 0.00 C ATOM 1483 O LEU A 97 13.953 73.274 1.540 1.00 0.00 O ATOM 1484 CB LEU A 97 14.732 75.271 -0.730 1.00 0.00 C ATOM 1485 CG LEU A 97 14.208 76.246 -1.788 1.00 0.00 C ATOM 1486 CD1 LEU A 97 15.027 77.538 -1.740 1.00 0.00 C ATOM 1487 CD2 LEU A 97 14.321 75.611 -3.187 1.00 0.00 C ATOM 0 H LEU A 97 12.300 75.315 -0.333 1.00 0.00 H new ATOM 0 HA LEU A 97 14.009 73.483 -1.693 1.00 0.00 H new ATOM 0 HB2 LEU A 97 14.698 75.735 0.256 1.00 0.00 H new ATOM 0 HB3 LEU A 97 15.775 75.026 -0.931 1.00 0.00 H new ATOM 0 HG LEU A 97 13.161 76.471 -1.583 1.00 0.00 H new ATOM 0 HD11 LEU A 97 14.655 78.233 -2.493 1.00 0.00 H new ATOM 0 HD12 LEU A 97 14.936 77.990 -0.752 1.00 0.00 H new ATOM 0 HD13 LEU A 97 16.074 77.313 -1.941 1.00 0.00 H new ATOM 0 HD21 LEU A 97 13.947 76.310 -3.935 1.00 0.00 H new ATOM 0 HD22 LEU A 97 15.365 75.379 -3.398 1.00 0.00 H new ATOM 0 HD23 LEU A 97 13.732 74.695 -3.219 1.00 0.00 H new ATOM 1499 N LEU A 98 15.132 72.079 0.041 1.00 0.00 N ATOM 1500 CA LEU A 98 15.609 71.134 1.032 1.00 0.00 C ATOM 1501 C LEU A 98 16.077 71.861 2.298 1.00 0.00 C ATOM 1502 O LEU A 98 16.498 73.016 2.239 1.00 0.00 O ATOM 1503 CB LEU A 98 16.779 70.312 0.447 1.00 0.00 C ATOM 1504 CG LEU A 98 16.232 69.111 -0.331 1.00 0.00 C ATOM 1505 CD1 LEU A 98 15.316 69.609 -1.446 1.00 0.00 C ATOM 1506 CD2 LEU A 98 17.396 68.325 -0.935 1.00 0.00 C ATOM 0 H LEU A 98 15.459 71.903 -0.909 1.00 0.00 H new ATOM 0 HA LEU A 98 14.787 70.469 1.297 1.00 0.00 H new ATOM 0 HB2 LEU A 98 17.383 70.938 -0.210 1.00 0.00 H new ATOM 0 HB3 LEU A 98 17.432 69.970 1.250 1.00 0.00 H new ATOM 0 HG LEU A 98 15.669 68.463 0.340 1.00 0.00 H new ATOM 0 HD11 LEU A 98 14.924 68.758 -2.003 1.00 0.00 H new ATOM 0 HD12 LEU A 98 14.489 70.171 -1.013 1.00 0.00 H new ATOM 0 HD13 LEU A 98 15.880 70.254 -2.119 1.00 0.00 H new ATOM 0 HD21 LEU A 98 17.009 67.470 -1.489 1.00 0.00 H new ATOM 0 HD22 LEU A 98 17.959 68.970 -1.610 1.00 0.00 H new ATOM 0 HD23 LEU A 98 18.051 67.974 -0.137 1.00 0.00 H new ATOM 1518 N PRO A 99 16.012 71.200 3.427 1.00 0.00 N ATOM 1519 CA PRO A 99 16.437 71.775 4.735 1.00 0.00 C ATOM 1520 C PRO A 99 17.945 71.988 4.794 1.00 0.00 C ATOM 1521 O PRO A 99 18.678 71.575 3.897 1.00 0.00 O ATOM 1522 CB PRO A 99 15.967 70.743 5.770 1.00 0.00 C ATOM 1523 CG PRO A 99 15.901 69.453 5.021 1.00 0.00 C ATOM 1524 CD PRO A 99 15.523 69.815 3.590 1.00 0.00 C ATOM 0 HA PRO A 99 16.009 72.762 4.912 1.00 0.00 H new ATOM 0 HB2 PRO A 99 16.661 70.679 6.608 1.00 0.00 H new ATOM 0 HB3 PRO A 99 14.994 71.011 6.182 1.00 0.00 H new ATOM 0 HG2 PRO A 99 16.859 68.935 5.052 1.00 0.00 H new ATOM 0 HG3 PRO A 99 15.162 68.784 5.462 1.00 0.00 H new ATOM 0 HD2 PRO A 99 15.989 69.141 2.872 1.00 0.00 H new ATOM 0 HD3 PRO A 99 14.446 69.752 3.434 1.00 0.00 H new ATOM 1532 N PHE A 100 18.408 72.609 5.878 1.00 0.00 N ATOM 1533 CA PHE A 100 19.841 72.833 6.064 1.00 0.00 C ATOM 1534 C PHE A 100 20.221 72.547 7.510 1.00 0.00 C ATOM 1535 O PHE A 100 19.750 73.215 8.432 1.00 0.00 O ATOM 1536 CB PHE A 100 20.188 74.274 5.713 1.00 0.00 C ATOM 1537 CG PHE A 100 21.681 74.419 5.595 1.00 0.00 C ATOM 1538 CD1 PHE A 100 22.337 73.943 4.455 1.00 0.00 C ATOM 1539 CD2 PHE A 100 22.410 75.026 6.621 1.00 0.00 C ATOM 1540 CE1 PHE A 100 23.725 74.076 4.341 1.00 0.00 C ATOM 1541 CE2 PHE A 100 23.797 75.159 6.509 1.00 0.00 C ATOM 1542 CZ PHE A 100 24.455 74.684 5.369 1.00 0.00 C ATOM 0 H PHE A 100 17.820 72.962 6.633 1.00 0.00 H new ATOM 0 HA PHE A 100 20.397 72.163 5.408 1.00 0.00 H new ATOM 0 HB2 PHE A 100 19.710 74.556 4.775 1.00 0.00 H new ATOM 0 HB3 PHE A 100 19.806 74.948 6.480 1.00 0.00 H new ATOM 0 HD1 PHE A 100 21.772 73.473 3.663 1.00 0.00 H new ATOM 0 HD2 PHE A 100 21.902 75.392 7.501 1.00 0.00 H new ATOM 0 HE1 PHE A 100 24.233 73.710 3.461 1.00 0.00 H new ATOM 0 HE2 PHE A 100 24.361 75.628 7.302 1.00 0.00 H new ATOM 0 HZ PHE A 100 25.527 74.787 5.282 1.00 0.00 H new ATOM 1552 N TYR A 101 21.071 71.539 7.712 1.00 0.00 N ATOM 1553 CA TYR A 101 21.493 71.168 9.061 1.00 0.00 C ATOM 1554 C TYR A 101 22.779 71.897 9.438 1.00 0.00 C ATOM 1555 O TYR A 101 23.795 71.778 8.753 1.00 0.00 O ATOM 1556 CB TYR A 101 21.745 69.659 9.125 1.00 0.00 C ATOM 1557 CG TYR A 101 20.501 68.924 8.689 1.00 0.00 C ATOM 1558 CD1 TYR A 101 19.436 68.756 9.582 1.00 0.00 C ATOM 1559 CD2 TYR A 101 20.411 68.417 7.388 1.00 0.00 C ATOM 1560 CE1 TYR A 101 18.282 68.078 9.173 1.00 0.00 C ATOM 1561 CE2 TYR A 101 19.258 67.739 6.978 1.00 0.00 C ATOM 1562 CZ TYR A 101 18.193 67.570 7.869 1.00 0.00 C ATOM 1563 OH TYR A 101 17.057 66.903 7.466 1.00 0.00 O ATOM 0 H TYR A 101 21.476 70.971 6.968 1.00 0.00 H new ATOM 0 HA TYR A 101 20.703 71.447 9.758 1.00 0.00 H new ATOM 0 HB2 TYR A 101 22.583 69.392 8.481 1.00 0.00 H new ATOM 0 HB3 TYR A 101 22.016 69.367 10.140 1.00 0.00 H new ATOM 0 HD1 TYR A 101 19.505 69.149 10.586 1.00 0.00 H new ATOM 0 HD2 TYR A 101 21.233 68.549 6.700 1.00 0.00 H new ATOM 0 HE1 TYR A 101 17.460 67.946 9.861 1.00 0.00 H new ATOM 0 HE2 TYR A 101 19.190 67.346 5.974 1.00 0.00 H new ATOM 0 HH TYR A 101 17.159 66.617 6.534 1.00 0.00 H new ATOM 1573 N ALA A 102 22.732 72.645 10.538 1.00 0.00 N ATOM 1574 CA ALA A 102 23.898 73.394 11.016 1.00 0.00 C ATOM 1575 C ALA A 102 24.171 73.044 12.468 1.00 0.00 C ATOM 1576 O ALA A 102 23.314 73.222 13.335 1.00 0.00 O ATOM 1577 CB ALA A 102 23.642 74.897 10.888 1.00 0.00 C ATOM 0 H ALA A 102 21.899 72.750 11.118 1.00 0.00 H new ATOM 0 HA ALA A 102 24.765 73.127 10.411 1.00 0.00 H new ATOM 0 HB1 ALA A 102 24.513 75.446 11.245 1.00 0.00 H new ATOM 0 HB2 ALA A 102 23.459 75.147 9.843 1.00 0.00 H new ATOM 0 HB3 ALA A 102 22.771 75.170 11.484 1.00 0.00 H new ATOM 1583 N THR A 103 25.376 72.543 12.733 1.00 0.00 N ATOM 1584 CA THR A 103 25.762 72.164 14.092 1.00 0.00 C ATOM 1585 C THR A 103 26.748 73.178 14.663 1.00 0.00 C ATOM 1586 O THR A 103 27.841 73.360 14.126 1.00 0.00 O ATOM 1587 CB THR A 103 26.411 70.781 14.085 1.00 0.00 C ATOM 1588 OG1 THR A 103 25.508 69.845 13.516 1.00 0.00 O ATOM 1589 CG2 THR A 103 26.737 70.366 15.521 1.00 0.00 C ATOM 0 H THR A 103 26.099 72.390 12.030 1.00 0.00 H new ATOM 0 HA THR A 103 24.866 72.143 14.713 1.00 0.00 H new ATOM 0 HB THR A 103 27.329 70.808 13.498 1.00 0.00 H new ATOM 0 HG1 THR A 103 25.920 68.956 13.508 1.00 0.00 H new ATOM 0 HG21 THR A 103 27.200 69.379 15.518 1.00 0.00 H new ATOM 0 HG22 THR A 103 27.424 71.088 15.961 1.00 0.00 H new ATOM 0 HG23 THR A 103 25.819 70.334 16.108 1.00 0.00 H new ATOM 1597 N ALA A 104 26.365 73.841 15.756 1.00 0.00 N ATOM 1598 CA ALA A 104 27.230 74.835 16.391 1.00 0.00 C ATOM 1599 C ALA A 104 27.817 74.267 17.677 1.00 0.00 C ATOM 1600 O ALA A 104 27.083 73.789 18.543 1.00 0.00 O ATOM 1601 CB ALA A 104 26.421 76.092 16.712 1.00 0.00 C ATOM 0 H ALA A 104 25.465 73.708 16.218 1.00 0.00 H new ATOM 0 HA ALA A 104 28.040 75.089 15.708 1.00 0.00 H new ATOM 0 HB1 ALA A 104 27.068 76.830 17.185 1.00 0.00 H new ATOM 0 HB2 ALA A 104 26.011 76.506 15.791 1.00 0.00 H new ATOM 0 HB3 ALA A 104 25.606 75.837 17.389 1.00 0.00 H new ATOM 1607 N THR A 105 29.145 74.324 17.807 1.00 0.00 N ATOM 1608 CA THR A 105 29.822 73.818 18.989 1.00 0.00 C ATOM 1609 C THR A 105 30.344 74.973 19.832 1.00 0.00 C ATOM 1610 O THR A 105 31.042 75.857 19.331 1.00 0.00 O ATOM 1611 CB THR A 105 30.983 72.929 18.560 1.00 0.00 C ATOM 1612 OG1 THR A 105 31.807 73.631 17.638 1.00 0.00 O ATOM 1613 CG2 THR A 105 30.446 71.653 17.907 1.00 0.00 C ATOM 0 H THR A 105 29.768 74.718 17.102 1.00 0.00 H new ATOM 0 HA THR A 105 29.117 73.240 19.586 1.00 0.00 H new ATOM 0 HB THR A 105 31.572 72.660 19.437 1.00 0.00 H new ATOM 0 HG1 THR A 105 31.857 74.575 17.897 1.00 0.00 H new ATOM 0 HG21 THR A 105 31.280 71.021 17.602 1.00 0.00 H new ATOM 0 HG22 THR A 105 29.824 71.113 18.621 1.00 0.00 H new ATOM 0 HG23 THR A 105 29.851 71.915 17.032 1.00 0.00 H new ATOM 1621 N SER A 106 30.001 74.962 21.117 1.00 0.00 N ATOM 1622 CA SER A 106 30.440 76.016 22.019 1.00 0.00 C ATOM 1623 C SER A 106 30.137 75.634 23.460 1.00 0.00 C ATOM 1624 O SER A 106 29.220 74.858 23.725 1.00 0.00 O ATOM 1625 CB SER A 106 29.734 77.328 21.679 1.00 0.00 C ATOM 1626 OG SER A 106 30.178 78.344 22.568 1.00 0.00 O ATOM 0 H SER A 106 29.426 74.241 21.552 1.00 0.00 H new ATOM 0 HA SER A 106 31.516 76.147 21.902 1.00 0.00 H new ATOM 0 HB2 SER A 106 29.946 77.612 20.648 1.00 0.00 H new ATOM 0 HB3 SER A 106 28.654 77.205 21.760 1.00 0.00 H new ATOM 0 HG SER A 106 29.728 79.187 22.352 1.00 0.00 H new ATOM 1632 N GLY A 107 30.907 76.188 24.391 1.00 0.00 N ATOM 1633 CA GLY A 107 30.708 75.903 25.810 1.00 0.00 C ATOM 1634 C GLY A 107 32.044 75.722 26.518 1.00 0.00 C ATOM 1635 O GLY A 107 33.088 75.601 25.877 1.00 0.00 O ATOM 0 H GLY A 107 31.671 76.834 24.191 1.00 0.00 H new ATOM 0 HA2 GLY A 107 30.153 76.718 26.275 1.00 0.00 H new ATOM 0 HA3 GLY A 107 30.106 75.001 25.924 1.00 0.00 H new ATOM 1639 N PRO A 108 32.022 75.691 27.823 1.00 0.00 N ATOM 1640 CA PRO A 108 33.252 75.510 28.654 1.00 0.00 C ATOM 1641 C PRO A 108 33.931 74.170 28.385 1.00 0.00 C ATOM 1642 O PRO A 108 33.274 73.181 28.070 1.00 0.00 O ATOM 1643 CB PRO A 108 32.733 75.583 30.107 1.00 0.00 C ATOM 1644 CG PRO A 108 31.275 75.304 30.014 1.00 0.00 C ATOM 1645 CD PRO A 108 30.821 75.832 28.657 1.00 0.00 C ATOM 0 HA PRO A 108 34.009 76.263 28.433 1.00 0.00 H new ATOM 0 HB2 PRO A 108 33.234 74.852 30.741 1.00 0.00 H new ATOM 0 HB3 PRO A 108 32.919 76.564 30.543 1.00 0.00 H new ATOM 0 HG2 PRO A 108 31.078 74.235 30.101 1.00 0.00 H new ATOM 0 HG3 PRO A 108 30.733 75.795 30.823 1.00 0.00 H new ATOM 0 HD2 PRO A 108 29.985 75.256 28.260 1.00 0.00 H new ATOM 0 HD3 PRO A 108 30.493 76.870 28.718 1.00 0.00 H new ATOM 1653 N SER A 109 35.250 74.149 28.535 1.00 0.00 N ATOM 1654 CA SER A 109 36.005 72.926 28.322 1.00 0.00 C ATOM 1655 C SER A 109 35.606 71.878 29.357 1.00 0.00 C ATOM 1656 O SER A 109 35.883 70.692 29.189 1.00 0.00 O ATOM 1657 CB SER A 109 37.506 73.211 28.438 1.00 0.00 C ATOM 1658 OG SER A 109 38.238 72.057 28.045 1.00 0.00 O ATOM 0 H SER A 109 35.812 74.958 28.801 1.00 0.00 H new ATOM 0 HA SER A 109 35.785 72.548 27.324 1.00 0.00 H new ATOM 0 HB2 SER A 109 37.776 74.058 27.808 1.00 0.00 H new ATOM 0 HB3 SER A 109 37.758 73.483 29.463 1.00 0.00 H new ATOM 0 HG SER A 109 37.731 71.252 28.281 1.00 0.00 H new ATOM 1664 N HIS A 110 34.949 72.327 30.432 1.00 0.00 N ATOM 1665 CA HIS A 110 34.514 71.415 31.492 1.00 0.00 C ATOM 1666 C HIS A 110 33.117 70.907 31.203 1.00 0.00 C ATOM 1667 O HIS A 110 32.832 69.720 31.368 1.00 0.00 O ATOM 1668 CB HIS A 110 34.531 72.125 32.842 1.00 0.00 C ATOM 1669 CG HIS A 110 34.330 71.114 33.937 1.00 0.00 C ATOM 1670 ND1 HIS A 110 33.076 70.814 34.445 1.00 0.00 N ATOM 1671 CD2 HIS A 110 35.214 70.326 34.633 1.00 0.00 C ATOM 1672 CE1 HIS A 110 33.236 69.883 35.403 1.00 0.00 C ATOM 1673 NE2 HIS A 110 34.520 69.549 35.557 1.00 0.00 N ATOM 0 H HIS A 110 34.709 73.306 30.589 1.00 0.00 H new ATOM 0 HA HIS A 110 35.203 70.571 31.525 1.00 0.00 H new ATOM 0 HB2 HIS A 110 35.479 72.645 32.981 1.00 0.00 H new ATOM 0 HB3 HIS A 110 33.745 72.880 32.879 1.00 0.00 H new ATOM 0 HD2 HIS A 110 36.284 70.311 34.486 1.00 0.00 H new ATOM 0 HE1 HIS A 110 32.426 69.458 35.977 1.00 0.00 H new ATOM 0 HE2 HIS A 110 34.909 68.870 36.211 1.00 0.00 H new ATOM 1681 N ALA A 111 32.247 71.812 30.743 1.00 0.00 N ATOM 1682 CA ALA A 111 30.869 71.447 30.396 1.00 0.00 C ATOM 1683 C ALA A 111 30.535 71.886 28.964 1.00 0.00 C ATOM 1684 O ALA A 111 29.858 72.890 28.750 1.00 0.00 O ATOM 1685 CB ALA A 111 29.884 72.079 31.403 1.00 0.00 C ATOM 0 H ALA A 111 32.470 72.797 30.603 1.00 0.00 H new ATOM 0 HA ALA A 111 30.773 70.362 30.447 1.00 0.00 H new ATOM 0 HB1 ALA A 111 28.864 71.802 31.137 1.00 0.00 H new ATOM 0 HB2 ALA A 111 30.108 71.718 32.407 1.00 0.00 H new ATOM 0 HB3 ALA A 111 29.984 73.164 31.377 1.00 0.00 H new ATOM 1691 N PRO A 112 30.977 71.143 27.985 1.00 0.00 N ATOM 1692 CA PRO A 112 30.719 71.458 26.551 1.00 0.00 C ATOM 1693 C PRO A 112 29.235 71.386 26.200 1.00 0.00 C ATOM 1694 O PRO A 112 28.455 70.735 26.894 1.00 0.00 O ATOM 1695 CB PRO A 112 31.537 70.400 25.775 1.00 0.00 C ATOM 1696 CG PRO A 112 32.475 69.803 26.780 1.00 0.00 C ATOM 1697 CD PRO A 112 31.778 69.923 28.127 1.00 0.00 C ATOM 0 HA PRO A 112 31.011 72.478 26.302 1.00 0.00 H new ATOM 0 HB2 PRO A 112 30.886 69.639 25.345 1.00 0.00 H new ATOM 0 HB3 PRO A 112 32.084 70.855 24.949 1.00 0.00 H new ATOM 0 HG2 PRO A 112 32.689 68.761 26.543 1.00 0.00 H new ATOM 0 HG3 PRO A 112 33.429 70.331 26.786 1.00 0.00 H new ATOM 0 HD2 PRO A 112 31.154 69.054 28.336 1.00 0.00 H new ATOM 0 HD3 PRO A 112 32.494 70.005 28.945 1.00 0.00 H new ATOM 1705 N THR A 113 28.858 72.056 25.113 1.00 0.00 N ATOM 1706 CA THR A 113 27.469 72.053 24.670 1.00 0.00 C ATOM 1707 C THR A 113 27.386 72.328 23.183 1.00 0.00 C ATOM 1708 O THR A 113 28.238 73.017 22.620 1.00 0.00 O ATOM 1709 CB THR A 113 26.666 73.103 25.442 1.00 0.00 C ATOM 1710 OG1 THR A 113 27.319 74.362 25.334 1.00 0.00 O ATOM 1711 CG2 THR A 113 26.562 72.704 26.918 1.00 0.00 C ATOM 0 H THR A 113 29.490 72.603 24.528 1.00 0.00 H new ATOM 0 HA THR A 113 27.046 71.068 24.867 1.00 0.00 H new ATOM 0 HB THR A 113 25.662 73.170 25.022 1.00 0.00 H new ATOM 0 HG1 THR A 113 28.098 74.277 24.745 1.00 0.00 H new ATOM 0 HG21 THR A 113 25.989 73.457 27.459 1.00 0.00 H new ATOM 0 HG22 THR A 113 26.061 71.739 27.000 1.00 0.00 H new ATOM 0 HG23 THR A 113 27.562 72.632 27.347 1.00 0.00 H new ATOM 1719 N PHE A 114 26.351 71.790 22.542 1.00 0.00 N ATOM 1720 CA PHE A 114 26.164 71.990 21.101 1.00 0.00 C ATOM 1721 C PHE A 114 24.713 72.361 20.815 1.00 0.00 C ATOM 1722 O PHE A 114 23.801 71.890 21.493 1.00 0.00 O ATOM 1723 CB PHE A 114 26.533 70.701 20.343 1.00 0.00 C ATOM 1724 CG PHE A 114 27.524 69.910 21.164 1.00 0.00 C ATOM 1725 CD1 PHE A 114 28.844 70.351 21.293 1.00 0.00 C ATOM 1726 CD2 PHE A 114 27.116 68.738 21.800 1.00 0.00 C ATOM 1727 CE1 PHE A 114 29.758 69.614 22.054 1.00 0.00 C ATOM 1728 CE2 PHE A 114 28.022 68.003 22.553 1.00 0.00 C ATOM 1729 CZ PHE A 114 29.346 68.437 22.685 1.00 0.00 C ATOM 0 H PHE A 114 25.634 71.218 22.989 1.00 0.00 H new ATOM 0 HA PHE A 114 26.812 72.799 20.765 1.00 0.00 H new ATOM 0 HB2 PHE A 114 25.639 70.106 20.157 1.00 0.00 H new ATOM 0 HB3 PHE A 114 26.961 70.946 19.371 1.00 0.00 H new ATOM 0 HD1 PHE A 114 29.159 71.261 20.805 1.00 0.00 H new ATOM 0 HD2 PHE A 114 26.094 68.402 21.707 1.00 0.00 H new ATOM 0 HE1 PHE A 114 30.778 69.954 22.153 1.00 0.00 H new ATOM 0 HE2 PHE A 114 27.704 67.093 23.039 1.00 0.00 H new ATOM 0 HZ PHE A 114 30.048 67.864 23.273 1.00 0.00 H new ATOM 1739 N THR A 115 24.508 73.197 19.800 1.00 0.00 N ATOM 1740 CA THR A 115 23.158 73.620 19.417 1.00 0.00 C ATOM 1741 C THR A 115 22.884 73.248 17.966 1.00 0.00 C ATOM 1742 O THR A 115 23.614 73.654 17.063 1.00 0.00 O ATOM 1743 CB THR A 115 23.023 75.131 19.591 1.00 0.00 C ATOM 1744 OG1 THR A 115 23.304 75.473 20.942 1.00 0.00 O ATOM 1745 CG2 THR A 115 21.598 75.554 19.243 1.00 0.00 C ATOM 0 H THR A 115 25.254 73.595 19.229 1.00 0.00 H new ATOM 0 HA THR A 115 22.435 73.114 20.057 1.00 0.00 H new ATOM 0 HB THR A 115 23.724 75.642 18.932 1.00 0.00 H new ATOM 0 HG1 THR A 115 23.220 76.442 21.058 1.00 0.00 H new ATOM 0 HG21 THR A 115 21.498 76.632 19.366 1.00 0.00 H new ATOM 0 HG22 THR A 115 21.381 75.285 18.209 1.00 0.00 H new ATOM 0 HG23 THR A 115 20.896 75.047 19.905 1.00 0.00 H new ATOM 1753 N SER A 116 21.822 72.477 17.750 1.00 0.00 N ATOM 1754 CA SER A 116 21.449 72.057 16.401 1.00 0.00 C ATOM 1755 C SER A 116 20.291 72.902 15.894 1.00 0.00 C ATOM 1756 O SER A 116 19.230 72.953 16.517 1.00 0.00 O ATOM 1757 CB SER A 116 21.033 70.586 16.409 1.00 0.00 C ATOM 1758 OG SER A 116 22.190 69.774 16.553 1.00 0.00 O ATOM 0 H SER A 116 21.207 72.131 18.487 1.00 0.00 H new ATOM 0 HA SER A 116 22.309 72.189 15.744 1.00 0.00 H new ATOM 0 HB2 SER A 116 20.337 70.397 17.227 1.00 0.00 H new ATOM 0 HB3 SER A 116 20.513 70.338 15.484 1.00 0.00 H new ATOM 0 HG SER A 116 22.464 69.436 15.675 1.00 0.00 H new ATOM 1764 N THR A 117 20.502 73.572 14.765 1.00 0.00 N ATOM 1765 CA THR A 117 19.473 74.428 14.171 1.00 0.00 C ATOM 1766 C THR A 117 19.218 74.028 12.726 1.00 0.00 C ATOM 1767 O THR A 117 20.143 73.670 11.996 1.00 0.00 O ATOM 1768 CB THR A 117 19.923 75.891 14.223 1.00 0.00 C ATOM 1769 OG1 THR A 117 19.980 76.321 15.574 1.00 0.00 O ATOM 1770 CG2 THR A 117 18.932 76.758 13.446 1.00 0.00 C ATOM 0 H THR A 117 21.376 73.540 14.241 1.00 0.00 H new ATOM 0 HA THR A 117 18.551 74.308 14.739 1.00 0.00 H new ATOM 0 HB THR A 117 20.912 75.984 13.774 1.00 0.00 H new ATOM 0 HG1 THR A 117 20.270 77.257 15.608 1.00 0.00 H new ATOM 0 HG21 THR A 117 19.252 77.799 13.483 1.00 0.00 H new ATOM 0 HG22 THR A 117 18.894 76.427 12.408 1.00 0.00 H new ATOM 0 HG23 THR A 117 17.942 76.667 13.892 1.00 0.00 H new ATOM 1778 N VAL A 118 17.952 74.088 12.319 1.00 0.00 N ATOM 1779 CA VAL A 118 17.566 73.729 10.952 1.00 0.00 C ATOM 1780 C VAL A 118 16.948 74.927 10.257 1.00 0.00 C ATOM 1781 O VAL A 118 16.352 75.787 10.901 1.00 0.00 O ATOM 1782 CB VAL A 118 16.566 72.571 10.974 1.00 0.00 C ATOM 1783 CG1 VAL A 118 15.232 73.047 11.549 1.00 0.00 C ATOM 1784 CG2 VAL A 118 16.357 72.066 9.544 1.00 0.00 C ATOM 0 H VAL A 118 17.176 74.381 12.913 1.00 0.00 H new ATOM 0 HA VAL A 118 18.457 73.418 10.406 1.00 0.00 H new ATOM 0 HB VAL A 118 16.954 71.766 11.598 1.00 0.00 H new ATOM 0 HG11 VAL A 118 14.525 72.218 11.562 1.00 0.00 H new ATOM 0 HG12 VAL A 118 15.383 73.411 12.565 1.00 0.00 H new ATOM 0 HG13 VAL A 118 14.836 73.852 10.930 1.00 0.00 H new ATOM 0 HG21 VAL A 118 15.645 71.240 9.550 1.00 0.00 H new ATOM 0 HG22 VAL A 118 15.969 72.875 8.926 1.00 0.00 H new ATOM 0 HG23 VAL A 118 17.308 71.722 9.137 1.00 0.00 H new ATOM 1794 N GLU A 119 17.095 74.978 8.935 1.00 0.00 N ATOM 1795 CA GLU A 119 16.546 76.086 8.152 1.00 0.00 C ATOM 1796 C GLU A 119 15.819 75.576 6.917 1.00 0.00 C ATOM 1797 O GLU A 119 16.448 75.122 5.957 1.00 0.00 O ATOM 1798 CB GLU A 119 17.674 77.023 7.713 1.00 0.00 C ATOM 1799 CG GLU A 119 17.082 78.276 7.071 1.00 0.00 C ATOM 1800 CD GLU A 119 18.202 79.228 6.658 1.00 0.00 C ATOM 1801 OE1 GLU A 119 19.312 79.044 7.128 1.00 0.00 O ATOM 1802 OE2 GLU A 119 17.933 80.123 5.874 1.00 0.00 O1- ATOM 0 H GLU A 119 17.585 74.272 8.386 1.00 0.00 H new ATOM 0 HA GLU A 119 15.837 76.623 8.782 1.00 0.00 H new ATOM 0 HB2 GLU A 119 18.287 77.298 8.572 1.00 0.00 H new ATOM 0 HB3 GLU A 119 18.328 76.514 7.005 1.00 0.00 H new ATOM 0 HG2 GLU A 119 16.486 78.002 6.200 1.00 0.00 H new ATOM 0 HG3 GLU A 119 16.411 78.772 7.773 1.00 0.00 H new ATOM 1809 N PHE A 120 14.489 75.637 6.966 1.00 0.00 N ATOM 1810 CA PHE A 120 13.662 75.173 5.848 1.00 0.00 C ATOM 1811 C PHE A 120 12.472 76.103 5.661 1.00 0.00 C ATOM 1812 O PHE A 120 12.119 76.853 6.568 1.00 0.00 O ATOM 1813 CB PHE A 120 13.168 73.748 6.092 1.00 0.00 C ATOM 1814 CG PHE A 120 12.185 73.732 7.233 1.00 0.00 C ATOM 1815 CD1 PHE A 120 12.639 73.565 8.545 1.00 0.00 C ATOM 1816 CD2 PHE A 120 10.818 73.888 6.979 1.00 0.00 C ATOM 1817 CE1 PHE A 120 11.725 73.551 9.603 1.00 0.00 C ATOM 1818 CE2 PHE A 120 9.904 73.873 8.037 1.00 0.00 C ATOM 1819 CZ PHE A 120 10.358 73.707 9.350 1.00 0.00 C ATOM 0 H PHE A 120 13.962 76.000 7.761 1.00 0.00 H new ATOM 0 HA PHE A 120 14.273 75.179 4.945 1.00 0.00 H new ATOM 0 HB2 PHE A 120 12.697 73.358 5.190 1.00 0.00 H new ATOM 0 HB3 PHE A 120 14.011 73.096 6.319 1.00 0.00 H new ATOM 0 HD1 PHE A 120 13.695 73.447 8.741 1.00 0.00 H new ATOM 0 HD2 PHE A 120 10.469 74.020 5.966 1.00 0.00 H new ATOM 0 HE1 PHE A 120 12.075 73.420 10.616 1.00 0.00 H new ATOM 0 HE2 PHE A 120 8.848 73.989 7.841 1.00 0.00 H new ATOM 0 HZ PHE A 120 9.653 73.699 10.168 1.00 0.00 H new ATOM 1829 N ALA A 121 11.842 76.041 4.489 1.00 0.00 N ATOM 1830 CA ALA A 121 10.687 76.884 4.208 1.00 0.00 C ATOM 1831 C ALA A 121 11.023 78.358 4.414 1.00 0.00 C ATOM 1832 O ALA A 121 10.133 79.198 4.531 1.00 0.00 O ATOM 1833 CB ALA A 121 9.513 76.487 5.106 1.00 0.00 C ATOM 0 H ALA A 121 12.111 75.420 3.726 1.00 0.00 H new ATOM 0 HA ALA A 121 10.407 76.738 3.165 1.00 0.00 H new ATOM 0 HB1 ALA A 121 8.656 77.124 4.887 1.00 0.00 H new ATOM 0 HB2 ALA A 121 9.249 75.446 4.920 1.00 0.00 H new ATOM 0 HB3 ALA A 121 9.797 76.608 6.151 1.00 0.00 H new ATOM 1839 N GLY A 122 12.315 78.661 4.456 1.00 0.00 N ATOM 1840 CA GLY A 122 12.758 80.038 4.644 1.00 0.00 C ATOM 1841 C GLY A 122 12.671 80.450 6.108 1.00 0.00 C ATOM 1842 O GLY A 122 12.765 81.633 6.436 1.00 0.00 O ATOM 0 H GLY A 122 13.068 77.979 4.363 1.00 0.00 H new ATOM 0 HA2 GLY A 122 13.785 80.143 4.294 1.00 0.00 H new ATOM 0 HA3 GLY A 122 12.145 80.706 4.039 1.00 0.00 H new ATOM 1846 N LYS A 123 12.488 79.470 6.988 1.00 0.00 N ATOM 1847 CA LYS A 123 12.386 79.728 8.426 1.00 0.00 C ATOM 1848 C LYS A 123 13.378 78.860 9.184 1.00 0.00 C ATOM 1849 O LYS A 123 13.723 77.765 8.743 1.00 0.00 O ATOM 1850 CB LYS A 123 10.967 79.434 8.909 1.00 0.00 C ATOM 1851 CG LYS A 123 10.008 80.476 8.338 1.00 0.00 C ATOM 1852 CD LYS A 123 8.580 80.152 8.783 1.00 0.00 C ATOM 1853 CE LYS A 123 7.610 81.145 8.142 1.00 0.00 C ATOM 1854 NZ LYS A 123 7.828 82.499 8.721 1.00 0.00 N1+ ATOM 0 H LYS A 123 12.407 78.486 6.732 1.00 0.00 H new ATOM 0 HA LYS A 123 12.617 80.777 8.613 1.00 0.00 H new ATOM 0 HB2 LYS A 123 10.664 78.435 8.595 1.00 0.00 H new ATOM 0 HB3 LYS A 123 10.932 79.450 9.998 1.00 0.00 H new ATOM 0 HG2 LYS A 123 10.290 81.472 8.680 1.00 0.00 H new ATOM 0 HG3 LYS A 123 10.068 80.484 7.250 1.00 0.00 H new ATOM 0 HD2 LYS A 123 8.319 79.134 8.494 1.00 0.00 H new ATOM 0 HD3 LYS A 123 8.505 80.204 9.869 1.00 0.00 H new ATOM 0 HE2 LYS A 123 7.761 81.171 7.063 1.00 0.00 H new ATOM 0 HE3 LYS A 123 6.582 80.826 8.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 7.021 83.111 8.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 7.915 82.425 9.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 8.700 82.908 8.328 1.00 0.00 H new ATOM 1868 N VAL A 124 13.843 79.366 10.325 1.00 0.00 N ATOM 1869 CA VAL A 124 14.813 78.639 11.145 1.00 0.00 C ATOM 1870 C VAL A 124 14.194 78.191 12.460 1.00 0.00 C ATOM 1871 O VAL A 124 13.733 79.011 13.255 1.00 0.00 O ATOM 1872 CB VAL A 124 16.013 79.542 11.441 1.00 0.00 C ATOM 1873 CG1 VAL A 124 15.584 80.705 12.354 1.00 0.00 C ATOM 1874 CG2 VAL A 124 17.103 78.721 12.131 1.00 0.00 C ATOM 0 H VAL A 124 13.566 80.272 10.702 1.00 0.00 H new ATOM 0 HA VAL A 124 15.132 77.756 10.590 1.00 0.00 H new ATOM 0 HB VAL A 124 16.397 79.950 10.506 1.00 0.00 H new ATOM 0 HG11 VAL A 124 16.444 81.342 12.560 1.00 0.00 H new ATOM 0 HG12 VAL A 124 14.809 81.290 11.858 1.00 0.00 H new ATOM 0 HG13 VAL A 124 15.195 80.307 13.291 1.00 0.00 H new ATOM 0 HG21 VAL A 124 17.960 79.360 12.344 1.00 0.00 H new ATOM 0 HG22 VAL A 124 16.715 78.312 13.064 1.00 0.00 H new ATOM 0 HG23 VAL A 124 17.412 77.905 11.478 1.00 0.00 H new ATOM 1884 N PHE A 125 14.173 76.879 12.681 1.00 0.00 N ATOM 1885 CA PHE A 125 13.601 76.319 13.906 1.00 0.00 C ATOM 1886 C PHE A 125 14.707 75.876 14.854 1.00 0.00 C ATOM 1887 O PHE A 125 15.500 74.984 14.529 1.00 0.00 O ATOM 1888 CB PHE A 125 12.718 75.120 13.565 1.00 0.00 C ATOM 1889 CG PHE A 125 11.506 75.590 12.800 1.00 0.00 C ATOM 1890 CD1 PHE A 125 11.600 75.830 11.426 1.00 0.00 C ATOM 1891 CD2 PHE A 125 10.284 75.776 13.458 1.00 0.00 C ATOM 1892 CE1 PHE A 125 10.478 76.259 10.711 1.00 0.00 C ATOM 1893 CE2 PHE A 125 9.167 76.209 12.743 1.00 0.00 C ATOM 1894 CZ PHE A 125 9.262 76.451 11.369 1.00 0.00 C ATOM 0 H PHE A 125 14.543 76.185 12.032 1.00 0.00 H new ATOM 0 HA PHE A 125 13.002 77.089 14.392 1.00 0.00 H new ATOM 0 HB2 PHE A 125 13.279 74.399 12.971 1.00 0.00 H new ATOM 0 HB3 PHE A 125 12.410 74.610 14.478 1.00 0.00 H new ATOM 0 HD1 PHE A 125 12.541 75.684 10.916 1.00 0.00 H new ATOM 0 HD2 PHE A 125 10.206 75.584 14.518 1.00 0.00 H new ATOM 0 HE1 PHE A 125 10.552 76.442 9.649 1.00 0.00 H new ATOM 0 HE2 PHE A 125 8.226 76.358 13.252 1.00 0.00 H new ATOM 0 HZ PHE A 125 8.396 76.786 10.818 1.00 0.00 H new ATOM 1904 N SER A 126 14.767 76.522 16.014 1.00 0.00 N ATOM 1905 CA SER A 126 15.792 76.200 17.005 1.00 0.00 C ATOM 1906 C SER A 126 15.369 74.987 17.820 1.00 0.00 C ATOM 1907 O SER A 126 14.220 74.890 18.250 1.00 0.00 O ATOM 1908 CB SER A 126 16.016 77.394 17.938 1.00 0.00 C ATOM 1909 OG SER A 126 15.087 77.327 19.011 1.00 0.00 O ATOM 0 H SER A 126 14.125 77.265 16.291 1.00 0.00 H new ATOM 0 HA SER A 126 16.722 75.974 16.484 1.00 0.00 H new ATOM 0 HB2 SER A 126 17.036 77.384 18.323 1.00 0.00 H new ATOM 0 HB3 SER A 126 15.891 78.328 17.390 1.00 0.00 H new ATOM 0 HG SER A 126 15.227 78.088 19.613 1.00 0.00 H new ATOM 1915 N GLY A 127 16.301 74.061 18.032 1.00 0.00 N ATOM 1916 CA GLY A 127 16.014 72.849 18.803 1.00 0.00 C ATOM 1917 C GLY A 127 16.495 72.994 20.245 1.00 0.00 C ATOM 1918 O GLY A 127 16.999 74.047 20.634 1.00 0.00 O ATOM 0 H GLY A 127 17.258 74.124 17.684 1.00 0.00 H new ATOM 0 HA2 GLY A 127 14.942 72.651 18.791 1.00 0.00 H new ATOM 0 HA3 GLY A 127 16.502 71.993 18.337 1.00 0.00 H new ATOM 1922 N GLU A 128 16.340 71.928 21.033 1.00 0.00 N ATOM 1923 CA GLU A 128 16.757 71.944 22.411 1.00 0.00 C ATOM 1924 C GLU A 128 18.278 71.969 22.507 1.00 0.00 C ATOM 1925 O GLU A 128 18.973 71.647 21.545 1.00 0.00 O ATOM 1926 CB GLU A 128 16.200 70.717 23.134 1.00 0.00 C ATOM 1927 CG GLU A 128 16.692 70.717 24.571 1.00 0.00 C ATOM 1928 CD GLU A 128 15.907 69.706 25.400 1.00 0.00 C ATOM 1929 OE1 GLU A 128 15.208 68.900 24.810 1.00 0.00 O ATOM 1930 OE2 GLU A 128 16.020 69.753 26.613 1.00 0.00 O1- ATOM 0 H GLU A 128 15.926 71.047 20.727 1.00 0.00 H new ATOM 0 HA GLU A 128 16.368 72.844 22.887 1.00 0.00 H new ATOM 0 HB2 GLU A 128 15.110 70.730 23.110 1.00 0.00 H new ATOM 0 HB3 GLU A 128 16.519 69.806 22.628 1.00 0.00 H new ATOM 0 HG2 GLU A 128 17.754 70.474 24.599 1.00 0.00 H new ATOM 0 HG3 GLU A 128 16.582 71.713 25.000 1.00 0.00 H new ATOM 1937 N GLU A 129 18.790 72.340 23.681 1.00 0.00 N ATOM 1938 CA GLU A 129 20.236 72.392 23.911 1.00 0.00 C ATOM 1939 C GLU A 129 20.654 71.285 24.873 1.00 0.00 C ATOM 1940 O GLU A 129 19.916 70.937 25.796 1.00 0.00 O ATOM 1941 CB GLU A 129 20.622 73.753 24.484 1.00 0.00 C ATOM 1942 CG GLU A 129 19.932 73.960 25.833 1.00 0.00 C ATOM 1943 CD GLU A 129 20.243 75.352 26.363 1.00 0.00 C ATOM 1944 OE1 GLU A 129 21.341 75.824 26.118 1.00 0.00 O ATOM 1945 OE2 GLU A 129 19.379 75.927 27.004 1.00 0.00 O1- ATOM 0 H GLU A 129 18.226 72.609 24.487 1.00 0.00 H new ATOM 0 HA GLU A 129 20.750 72.246 22.961 1.00 0.00 H new ATOM 0 HB2 GLU A 129 21.704 73.814 24.605 1.00 0.00 H new ATOM 0 HB3 GLU A 129 20.334 74.544 23.792 1.00 0.00 H new ATOM 0 HG2 GLU A 129 18.855 73.835 25.724 1.00 0.00 H new ATOM 0 HG3 GLU A 129 20.270 73.206 26.544 1.00 0.00 H new ATOM 1952 N ALA A 130 21.842 70.741 24.643 1.00 0.00 N ATOM 1953 CA ALA A 130 22.361 69.676 25.490 1.00 0.00 C ATOM 1954 C ALA A 130 23.795 69.326 25.102 1.00 0.00 C ATOM 1955 O ALA A 130 24.282 69.736 24.049 1.00 0.00 O ATOM 1956 CB ALA A 130 21.475 68.433 25.370 1.00 0.00 C ATOM 0 H ALA A 130 22.461 71.018 23.881 1.00 0.00 H new ATOM 0 HA ALA A 130 22.356 70.026 26.522 1.00 0.00 H new ATOM 0 HB1 ALA A 130 21.870 67.642 26.007 1.00 0.00 H new ATOM 0 HB2 ALA A 130 20.460 68.678 25.683 1.00 0.00 H new ATOM 0 HB3 ALA A 130 21.463 68.093 24.334 1.00 0.00 H new ATOM 1962 N LYS A 131 24.449 68.542 25.945 1.00 0.00 N ATOM 1963 CA LYS A 131 25.819 68.103 25.685 1.00 0.00 C ATOM 1964 C LYS A 131 25.821 66.912 24.738 1.00 0.00 C ATOM 1965 O LYS A 131 26.659 66.020 24.848 1.00 0.00 O ATOM 1966 CB LYS A 131 26.522 67.728 26.988 1.00 0.00 C ATOM 1967 CG LYS A 131 25.764 66.585 27.661 1.00 0.00 C ATOM 1968 CD LYS A 131 26.439 66.236 28.986 1.00 0.00 C ATOM 1969 CE LYS A 131 25.782 64.988 29.580 1.00 0.00 C ATOM 1970 NZ LYS A 131 24.374 65.302 29.958 1.00 0.00 N1+ ATOM 0 H LYS A 131 24.055 68.194 26.819 1.00 0.00 H new ATOM 0 HA LYS A 131 26.358 68.929 25.221 1.00 0.00 H new ATOM 0 HB2 LYS A 131 27.550 67.428 26.786 1.00 0.00 H new ATOM 0 HB3 LYS A 131 26.566 68.591 27.652 1.00 0.00 H new ATOM 0 HG2 LYS A 131 24.727 66.874 27.834 1.00 0.00 H new ATOM 0 HG3 LYS A 131 25.747 65.712 27.008 1.00 0.00 H new ATOM 0 HD2 LYS A 131 27.503 66.060 28.829 1.00 0.00 H new ATOM 0 HD3 LYS A 131 26.353 67.071 29.681 1.00 0.00 H new ATOM 0 HE2 LYS A 131 25.803 64.173 28.856 1.00 0.00 H new ATOM 0 HE3 LYS A 131 26.339 64.652 30.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 23.991 64.531 30.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 24.350 66.190 30.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 23.798 65.405 29.098 1.00 0.00 H new ATOM 1984 N THR A 132 24.884 66.911 23.800 1.00 0.00 N ATOM 1985 CA THR A 132 24.784 65.830 22.819 1.00 0.00 C ATOM 1986 C THR A 132 24.192 66.339 21.508 1.00 0.00 C ATOM 1987 O THR A 132 23.289 67.175 21.504 1.00 0.00 O ATOM 1988 CB THR A 132 23.917 64.706 23.390 1.00 0.00 C ATOM 1989 OG1 THR A 132 23.418 63.908 22.332 1.00 0.00 O ATOM 1990 CG2 THR A 132 22.758 65.312 24.179 1.00 0.00 C ATOM 0 H THR A 132 24.182 67.643 23.694 1.00 0.00 H new ATOM 0 HA THR A 132 25.784 65.449 22.611 1.00 0.00 H new ATOM 0 HB THR A 132 24.516 64.082 24.054 1.00 0.00 H new ATOM 0 HG1 THR A 132 23.431 62.965 22.599 1.00 0.00 H new ATOM 0 HG21 THR A 132 22.139 64.513 24.587 1.00 0.00 H new ATOM 0 HG22 THR A 132 23.151 65.919 24.995 1.00 0.00 H new ATOM 0 HG23 THR A 132 22.156 65.937 23.519 1.00 0.00 H new ATOM 1998 N LYS A 133 24.708 65.819 20.397 1.00 0.00 N ATOM 1999 CA LYS A 133 24.226 66.217 19.073 1.00 0.00 C ATOM 2000 C LYS A 133 22.962 65.456 18.690 1.00 0.00 C ATOM 2001 O LYS A 133 22.011 66.035 18.162 1.00 0.00 O ATOM 2002 CB LYS A 133 25.307 65.968 18.025 1.00 0.00 C ATOM 2003 CG LYS A 133 26.463 66.942 18.252 1.00 0.00 C ATOM 2004 CD LYS A 133 27.558 66.688 17.210 1.00 0.00 C ATOM 2005 CE LYS A 133 28.727 67.646 17.450 1.00 0.00 C ATOM 2006 NZ LYS A 133 29.798 67.382 16.445 1.00 0.00 N1+ ATOM 0 H LYS A 133 25.455 65.125 20.384 1.00 0.00 H new ATOM 0 HA LYS A 133 23.989 67.280 19.111 1.00 0.00 H new ATOM 0 HB2 LYS A 133 25.664 64.940 18.091 1.00 0.00 H new ATOM 0 HB3 LYS A 133 24.897 66.099 17.024 1.00 0.00 H new ATOM 0 HG2 LYS A 133 26.107 67.969 18.178 1.00 0.00 H new ATOM 0 HG3 LYS A 133 26.866 66.816 19.257 1.00 0.00 H new ATOM 0 HD2 LYS A 133 27.902 65.656 17.273 1.00 0.00 H new ATOM 0 HD3 LYS A 133 27.159 66.830 16.206 1.00 0.00 H new ATOM 0 HE2 LYS A 133 28.387 68.679 17.373 1.00 0.00 H new ATOM 0 HE3 LYS A 133 29.119 67.514 18.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 30.593 68.032 16.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 30.128 66.400 16.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 29.420 67.529 15.488 1.00 0.00 H new ATOM 2020 N LYS A 134 22.968 64.157 18.937 1.00 0.00 N ATOM 2021 CA LYS A 134 21.827 63.322 18.595 1.00 0.00 C ATOM 2022 C LYS A 134 20.540 63.902 19.168 1.00 0.00 C ATOM 2023 O LYS A 134 19.544 64.035 18.455 1.00 0.00 O ATOM 2024 CB LYS A 134 22.040 61.897 19.128 1.00 0.00 C ATOM 2025 CG LYS A 134 22.601 61.949 20.554 1.00 0.00 C ATOM 2026 CD LYS A 134 22.749 60.536 21.114 1.00 0.00 C ATOM 2027 CE LYS A 134 23.975 59.853 20.502 1.00 0.00 C ATOM 2028 NZ LYS A 134 24.311 58.647 21.300 1.00 0.00 N1+ ATOM 0 H LYS A 134 23.745 63.659 19.371 1.00 0.00 H new ATOM 0 HA LYS A 134 21.738 63.291 17.509 1.00 0.00 H new ATOM 0 HB2 LYS A 134 21.096 61.352 19.119 1.00 0.00 H new ATOM 0 HB3 LYS A 134 22.727 61.355 18.478 1.00 0.00 H new ATOM 0 HG2 LYS A 134 23.568 62.451 20.554 1.00 0.00 H new ATOM 0 HG3 LYS A 134 21.938 62.534 21.192 1.00 0.00 H new ATOM 0 HD2 LYS A 134 22.848 60.575 22.199 1.00 0.00 H new ATOM 0 HD3 LYS A 134 21.853 59.955 20.897 1.00 0.00 H new ATOM 0 HE2 LYS A 134 23.773 59.575 19.468 1.00 0.00 H new ATOM 0 HE3 LYS A 134 24.820 60.541 20.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 25.144 58.179 20.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 24.520 58.926 22.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 23.505 57.990 21.292 1.00 0.00 H new ATOM 2042 N LEU A 135 20.550 64.234 20.453 1.00 0.00 N ATOM 2043 CA LEU A 135 19.380 64.780 21.092 1.00 0.00 C ATOM 2044 C LEU A 135 19.042 66.151 20.518 1.00 0.00 C ATOM 2045 O LEU A 135 17.875 66.472 20.297 1.00 0.00 O ATOM 2046 CB LEU A 135 19.638 64.902 22.603 1.00 0.00 C ATOM 2047 CG LEU A 135 18.300 64.843 23.368 1.00 0.00 C ATOM 2048 CD1 LEU A 135 17.902 63.368 23.589 1.00 0.00 C ATOM 2049 CD2 LEU A 135 18.440 65.552 24.720 1.00 0.00 C ATOM 0 H LEU A 135 21.359 64.131 21.065 1.00 0.00 H new ATOM 0 HA LEU A 135 18.537 64.113 20.911 1.00 0.00 H new ATOM 0 HB2 LEU A 135 20.293 64.097 22.935 1.00 0.00 H new ATOM 0 HB3 LEU A 135 20.150 65.840 22.819 1.00 0.00 H new ATOM 0 HG LEU A 135 17.527 65.344 22.785 1.00 0.00 H new ATOM 0 HD11 LEU A 135 16.957 63.323 24.130 1.00 0.00 H new ATOM 0 HD12 LEU A 135 17.792 62.872 22.624 1.00 0.00 H new ATOM 0 HD13 LEU A 135 18.676 62.865 24.169 1.00 0.00 H new ATOM 0 HD21 LEU A 135 17.491 65.506 25.255 1.00 0.00 H new ATOM 0 HD22 LEU A 135 19.213 65.060 25.310 1.00 0.00 H new ATOM 0 HD23 LEU A 135 18.715 66.594 24.558 1.00 0.00 H new ATOM 2061 N ALA A 136 20.074 66.962 20.297 1.00 0.00 N ATOM 2062 CA ALA A 136 19.872 68.302 19.768 1.00 0.00 C ATOM 2063 C ALA A 136 19.117 68.247 18.447 1.00 0.00 C ATOM 2064 O ALA A 136 18.096 68.911 18.281 1.00 0.00 O ATOM 2065 CB ALA A 136 21.226 68.985 19.556 1.00 0.00 C ATOM 0 H ALA A 136 21.048 66.715 20.475 1.00 0.00 H new ATOM 0 HA ALA A 136 19.283 68.873 20.486 1.00 0.00 H new ATOM 0 HB1 ALA A 136 21.069 69.988 19.160 1.00 0.00 H new ATOM 0 HB2 ALA A 136 21.754 69.049 20.507 1.00 0.00 H new ATOM 0 HB3 ALA A 136 21.820 68.405 18.850 1.00 0.00 H new ATOM 2071 N GLU A 137 19.621 67.448 17.513 1.00 0.00 N ATOM 2072 CA GLU A 137 18.981 67.317 16.210 1.00 0.00 C ATOM 2073 C GLU A 137 17.564 66.771 16.368 1.00 0.00 C ATOM 2074 O GLU A 137 16.635 67.221 15.698 1.00 0.00 O ATOM 2075 CB GLU A 137 19.801 66.373 15.325 1.00 0.00 C ATOM 2076 CG GLU A 137 21.176 66.991 15.057 1.00 0.00 C ATOM 2077 CD GLU A 137 21.032 68.191 14.125 1.00 0.00 C ATOM 2078 OE1 GLU A 137 19.945 68.393 13.613 1.00 0.00 O ATOM 2079 OE2 GLU A 137 22.012 68.899 13.949 1.00 0.00 O1- ATOM 0 H GLU A 137 20.464 66.886 17.632 1.00 0.00 H new ATOM 0 HA GLU A 137 18.930 68.301 15.743 1.00 0.00 H new ATOM 0 HB2 GLU A 137 19.914 65.405 15.814 1.00 0.00 H new ATOM 0 HB3 GLU A 137 19.280 66.196 14.384 1.00 0.00 H new ATOM 0 HG2 GLU A 137 21.634 67.301 15.996 1.00 0.00 H new ATOM 0 HG3 GLU A 137 21.837 66.249 14.610 1.00 0.00 H new ATOM 2086 N MET A 138 17.410 65.790 17.251 1.00 0.00 N ATOM 2087 CA MET A 138 16.103 65.186 17.481 1.00 0.00 C ATOM 2088 C MET A 138 15.111 66.231 17.975 1.00 0.00 C ATOM 2089 O MET A 138 13.967 66.276 17.520 1.00 0.00 O ATOM 2090 CB MET A 138 16.224 64.064 18.520 1.00 0.00 C ATOM 2091 CG MET A 138 16.798 62.808 17.860 1.00 0.00 C ATOM 2092 SD MET A 138 15.559 62.086 16.757 1.00 0.00 S ATOM 2093 CE MET A 138 14.680 61.107 18.002 1.00 0.00 C ATOM 0 H MET A 138 18.166 65.399 17.814 1.00 0.00 H new ATOM 0 HA MET A 138 15.741 64.774 16.539 1.00 0.00 H new ATOM 0 HB2 MET A 138 16.868 64.382 19.340 1.00 0.00 H new ATOM 0 HB3 MET A 138 15.246 63.846 18.949 1.00 0.00 H new ATOM 0 HG2 MET A 138 17.698 63.058 17.299 1.00 0.00 H new ATOM 0 HG3 MET A 138 17.088 62.084 18.622 1.00 0.00 H new ATOM 0 HE1 MET A 138 13.616 61.086 17.764 1.00 0.00 H new ATOM 0 HE2 MET A 138 15.071 60.089 18.007 1.00 0.00 H new ATOM 0 HE3 MET A 138 14.823 61.555 18.985 1.00 0.00 H new ATOM 2103 N SER A 139 15.545 67.070 18.910 1.00 0.00 N ATOM 2104 CA SER A 139 14.681 68.106 19.453 1.00 0.00 C ATOM 2105 C SER A 139 14.356 69.146 18.393 1.00 0.00 C ATOM 2106 O SER A 139 13.260 69.696 18.379 1.00 0.00 O ATOM 2107 CB SER A 139 15.364 68.781 20.642 1.00 0.00 C ATOM 2108 OG SER A 139 15.376 67.885 21.745 1.00 0.00 O ATOM 0 H SER A 139 16.485 67.051 19.304 1.00 0.00 H new ATOM 0 HA SER A 139 13.751 67.641 19.782 1.00 0.00 H new ATOM 0 HB2 SER A 139 16.383 69.065 20.378 1.00 0.00 H new ATOM 0 HB3 SER A 139 14.836 69.697 20.908 1.00 0.00 H new ATOM 0 HG SER A 139 16.098 67.232 21.629 1.00 0.00 H new ATOM 2114 N ALA A 140 15.322 69.421 17.517 1.00 0.00 N ATOM 2115 CA ALA A 140 15.130 70.411 16.460 1.00 0.00 C ATOM 2116 C ALA A 140 14.108 69.923 15.435 1.00 0.00 C ATOM 2117 O ALA A 140 13.183 70.643 15.065 1.00 0.00 O ATOM 2118 CB ALA A 140 16.462 70.688 15.762 1.00 0.00 C ATOM 0 H ALA A 140 16.239 68.975 17.518 1.00 0.00 H new ATOM 0 HA ALA A 140 14.755 71.328 16.914 1.00 0.00 H new ATOM 0 HB1 ALA A 140 16.313 71.427 14.975 1.00 0.00 H new ATOM 0 HB2 ALA A 140 17.180 71.070 16.487 1.00 0.00 H new ATOM 0 HB3 ALA A 140 16.843 69.765 15.326 1.00 0.00 H new ATOM 2124 N ALA A 141 14.290 68.700 14.969 1.00 0.00 N ATOM 2125 CA ALA A 141 13.382 68.132 13.989 1.00 0.00 C ATOM 2126 C ALA A 141 12.000 67.933 14.593 1.00 0.00 C ATOM 2127 O ALA A 141 10.998 67.911 13.875 1.00 0.00 O ATOM 2128 CB ALA A 141 13.914 66.785 13.499 1.00 0.00 C ATOM 0 H ALA A 141 15.053 68.085 15.251 1.00 0.00 H new ATOM 0 HA ALA A 141 13.309 68.824 13.150 1.00 0.00 H new ATOM 0 HB1 ALA A 141 13.226 66.367 12.764 1.00 0.00 H new ATOM 0 HB2 ALA A 141 14.893 66.925 13.040 1.00 0.00 H new ATOM 0 HB3 ALA A 141 14.003 66.100 14.343 1.00 0.00 H new ATOM 2134 N LYS A 142 11.941 67.783 15.917 1.00 0.00 N ATOM 2135 CA LYS A 142 10.665 67.588 16.597 1.00 0.00 C ATOM 2136 C LYS A 142 9.835 68.870 16.615 1.00 0.00 C ATOM 2137 O LYS A 142 8.659 68.865 16.256 1.00 0.00 O ATOM 2138 CB LYS A 142 10.920 67.132 18.033 1.00 0.00 C ATOM 2139 CG LYS A 142 9.591 66.790 18.707 1.00 0.00 C ATOM 2140 CD LYS A 142 9.851 66.266 20.120 1.00 0.00 C ATOM 2141 CE LYS A 142 8.524 65.895 20.780 1.00 0.00 C ATOM 2142 NZ LYS A 142 7.657 67.104 20.870 1.00 0.00 N1+ ATOM 0 H LYS A 142 12.754 67.793 16.532 1.00 0.00 H new ATOM 0 HA LYS A 142 10.105 66.829 16.051 1.00 0.00 H new ATOM 0 HB2 LYS A 142 11.576 66.262 18.038 1.00 0.00 H new ATOM 0 HB3 LYS A 142 11.430 67.918 18.590 1.00 0.00 H new ATOM 0 HG2 LYS A 142 8.954 67.674 18.748 1.00 0.00 H new ATOM 0 HG3 LYS A 142 9.058 66.040 18.123 1.00 0.00 H new ATOM 0 HD2 LYS A 142 10.506 65.395 20.081 1.00 0.00 H new ATOM 0 HD3 LYS A 142 10.364 67.024 20.712 1.00 0.00 H new ATOM 0 HE2 LYS A 142 8.023 65.118 20.202 1.00 0.00 H new ATOM 0 HE3 LYS A 142 8.702 65.488 21.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 7.074 67.050 21.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 8.252 67.956 20.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 7.039 67.151 20.035 1.00 0.00 H new ATOM 2156 N VAL A 143 10.459 69.963 17.046 1.00 0.00 N ATOM 2157 CA VAL A 143 9.773 71.246 17.118 1.00 0.00 C ATOM 2158 C VAL A 143 9.414 71.742 15.728 1.00 0.00 C ATOM 2159 O VAL A 143 8.357 72.340 15.534 1.00 0.00 O ATOM 2160 CB VAL A 143 10.651 72.284 17.824 1.00 0.00 C ATOM 2161 CG1 VAL A 143 11.993 72.388 17.108 1.00 0.00 C ATOM 2162 CG2 VAL A 143 9.966 73.652 17.798 1.00 0.00 C ATOM 0 H VAL A 143 11.433 69.985 17.349 1.00 0.00 H new ATOM 0 HA VAL A 143 8.856 71.106 17.690 1.00 0.00 H new ATOM 0 HB VAL A 143 10.804 71.973 18.858 1.00 0.00 H new ATOM 0 HG11 VAL A 143 12.617 73.127 17.611 1.00 0.00 H new ATOM 0 HG12 VAL A 143 12.491 71.419 17.126 1.00 0.00 H new ATOM 0 HG13 VAL A 143 11.831 72.693 16.074 1.00 0.00 H new ATOM 0 HG21 VAL A 143 10.597 74.384 18.302 1.00 0.00 H new ATOM 0 HG22 VAL A 143 9.807 73.960 16.764 1.00 0.00 H new ATOM 0 HG23 VAL A 143 9.005 73.588 18.309 1.00 0.00 H new ATOM 2172 N ALA A 144 10.300 71.512 14.760 1.00 0.00 N ATOM 2173 CA ALA A 144 10.058 71.956 13.400 1.00 0.00 C ATOM 2174 C ALA A 144 8.846 71.262 12.795 1.00 0.00 C ATOM 2175 O ALA A 144 7.942 71.913 12.285 1.00 0.00 O ATOM 2176 CB ALA A 144 11.296 71.647 12.552 1.00 0.00 C ATOM 0 H ALA A 144 11.185 71.023 14.897 1.00 0.00 H new ATOM 0 HA ALA A 144 9.859 73.028 13.415 1.00 0.00 H new ATOM 0 HB1 ALA A 144 11.126 71.976 11.527 1.00 0.00 H new ATOM 0 HB2 ALA A 144 12.159 72.171 12.963 1.00 0.00 H new ATOM 0 HB3 ALA A 144 11.485 70.574 12.562 1.00 0.00 H new ATOM 2182 N PHE A 145 8.844 69.937 12.848 1.00 0.00 N ATOM 2183 CA PHE A 145 7.751 69.166 12.278 1.00 0.00 C ATOM 2184 C PHE A 145 6.428 69.541 12.933 1.00 0.00 C ATOM 2185 O PHE A 145 5.422 69.726 12.249 1.00 0.00 O ATOM 2186 CB PHE A 145 8.008 67.667 12.467 1.00 0.00 C ATOM 2187 CG PHE A 145 7.157 66.876 11.500 1.00 0.00 C ATOM 2188 CD1 PHE A 145 7.579 66.721 10.171 1.00 0.00 C ATOM 2189 CD2 PHE A 145 5.952 66.304 11.922 1.00 0.00 C ATOM 2190 CE1 PHE A 145 6.794 65.994 9.269 1.00 0.00 C ATOM 2191 CE2 PHE A 145 5.169 65.575 11.017 1.00 0.00 C ATOM 2192 CZ PHE A 145 5.590 65.422 9.692 1.00 0.00 C ATOM 0 H PHE A 145 9.582 69.378 13.277 1.00 0.00 H new ATOM 0 HA PHE A 145 7.694 69.393 11.213 1.00 0.00 H new ATOM 0 HB2 PHE A 145 9.063 67.446 12.303 1.00 0.00 H new ATOM 0 HB3 PHE A 145 7.777 67.375 13.492 1.00 0.00 H new ATOM 0 HD1 PHE A 145 8.509 67.162 9.844 1.00 0.00 H new ATOM 0 HD2 PHE A 145 5.626 66.424 12.944 1.00 0.00 H new ATOM 0 HE1 PHE A 145 7.118 65.875 8.246 1.00 0.00 H new ATOM 0 HE2 PHE A 145 4.240 65.131 11.343 1.00 0.00 H new ATOM 0 HZ PHE A 145 4.985 64.862 8.995 1.00 0.00 H new ATOM 2202 N MET A 146 6.429 69.641 14.257 1.00 0.00 N ATOM 2203 CA MET A 146 5.217 69.988 14.984 1.00 0.00 C ATOM 2204 C MET A 146 4.696 71.358 14.559 1.00 0.00 C ATOM 2205 O MET A 146 3.488 71.552 14.419 1.00 0.00 O ATOM 2206 CB MET A 146 5.499 69.996 16.488 1.00 0.00 C ATOM 2207 CG MET A 146 6.022 68.624 16.916 1.00 0.00 C ATOM 2208 SD MET A 146 5.229 68.135 18.468 1.00 0.00 S ATOM 2209 CE MET A 146 5.102 66.366 18.109 1.00 0.00 C ATOM 0 H MET A 146 7.249 69.488 14.844 1.00 0.00 H new ATOM 0 HA MET A 146 4.457 69.241 14.754 1.00 0.00 H new ATOM 0 HB2 MET A 146 6.231 70.767 16.727 1.00 0.00 H new ATOM 0 HB3 MET A 146 4.590 70.238 17.038 1.00 0.00 H new ATOM 0 HG2 MET A 146 5.815 67.886 16.141 1.00 0.00 H new ATOM 0 HG3 MET A 146 7.104 68.659 17.043 1.00 0.00 H new ATOM 0 HE1 MET A 146 4.632 65.857 18.950 1.00 0.00 H new ATOM 0 HE2 MET A 146 4.499 66.219 17.213 1.00 0.00 H new ATOM 0 HE3 MET A 146 6.099 65.955 17.947 1.00 0.00 H new ATOM 2219 N SER A 147 5.608 72.306 14.364 1.00 0.00 N ATOM 2220 CA SER A 147 5.223 73.651 13.963 1.00 0.00 C ATOM 2221 C SER A 147 4.581 73.648 12.577 1.00 0.00 C ATOM 2222 O SER A 147 3.626 74.383 12.322 1.00 0.00 O ATOM 2223 CB SER A 147 6.443 74.561 13.954 1.00 0.00 C ATOM 2224 OG SER A 147 6.024 75.878 13.628 1.00 0.00 O ATOM 0 H SER A 147 6.612 72.167 14.477 1.00 0.00 H new ATOM 0 HA SER A 147 4.494 74.022 14.683 1.00 0.00 H new ATOM 0 HB2 SER A 147 6.930 74.550 14.929 1.00 0.00 H new ATOM 0 HB3 SER A 147 7.174 74.206 13.228 1.00 0.00 H new ATOM 0 HG SER A 147 6.389 76.509 14.283 1.00 0.00 H new ATOM 2230 N ILE A 148 5.114 72.821 11.687 1.00 0.00 N ATOM 2231 CA ILE A 148 4.593 72.732 10.329 1.00 0.00 C ATOM 2232 C ILE A 148 3.133 72.295 10.349 1.00 0.00 C ATOM 2233 O ILE A 148 2.313 72.821 9.596 1.00 0.00 O ATOM 2234 CB ILE A 148 5.416 71.734 9.505 1.00 0.00 C ATOM 2235 CG1 ILE A 148 6.818 72.305 9.264 1.00 0.00 C ATOM 2236 CG2 ILE A 148 4.728 71.476 8.157 1.00 0.00 C ATOM 2237 CD1 ILE A 148 7.713 71.241 8.618 1.00 0.00 C ATOM 0 H ILE A 148 5.904 72.205 11.880 1.00 0.00 H new ATOM 0 HA ILE A 148 4.665 73.718 9.870 1.00 0.00 H new ATOM 0 HB ILE A 148 5.493 70.794 10.052 1.00 0.00 H new ATOM 0 HG12 ILE A 148 6.757 73.181 8.619 1.00 0.00 H new ATOM 0 HG13 ILE A 148 7.253 72.634 10.208 1.00 0.00 H new ATOM 0 HG21 ILE A 148 5.318 70.766 7.577 1.00 0.00 H new ATOM 0 HG22 ILE A 148 3.733 71.065 8.329 1.00 0.00 H new ATOM 0 HG23 ILE A 148 4.644 72.413 7.606 1.00 0.00 H new ATOM 0 HD11 ILE A 148 8.707 71.655 8.450 1.00 0.00 H new ATOM 0 HD12 ILE A 148 7.786 70.377 9.279 1.00 0.00 H new ATOM 0 HD13 ILE A 148 7.283 70.933 7.665 1.00 0.00 H new ATOM 2249 N LYS A 149 2.814 71.334 11.202 1.00 0.00 N ATOM 2250 CA LYS A 149 1.450 70.845 11.295 1.00 0.00 C ATOM 2251 C LYS A 149 0.505 71.955 11.741 1.00 0.00 C ATOM 2252 O LYS A 149 -0.713 71.773 11.767 1.00 0.00 O ATOM 2253 CB LYS A 149 1.380 69.692 12.289 1.00 0.00 C ATOM 2254 CG LYS A 149 2.098 68.471 11.708 1.00 0.00 C ATOM 2255 CD LYS A 149 2.022 67.304 12.706 1.00 0.00 C ATOM 2256 CE LYS A 149 0.615 66.690 12.693 1.00 0.00 C ATOM 2257 NZ LYS A 149 0.645 65.366 13.364 1.00 0.00 N1+ ATOM 0 H LYS A 149 3.475 70.882 11.834 1.00 0.00 H new ATOM 0 HA LYS A 149 1.143 70.499 10.308 1.00 0.00 H new ATOM 0 HB2 LYS A 149 1.841 69.983 13.233 1.00 0.00 H new ATOM 0 HB3 LYS A 149 0.340 69.447 12.505 1.00 0.00 H new ATOM 0 HG2 LYS A 149 1.640 68.184 10.762 1.00 0.00 H new ATOM 0 HG3 LYS A 149 3.139 68.715 11.497 1.00 0.00 H new ATOM 0 HD2 LYS A 149 2.761 66.545 12.447 1.00 0.00 H new ATOM 0 HD3 LYS A 149 2.264 67.656 13.709 1.00 0.00 H new ATOM 0 HE2 LYS A 149 -0.086 67.351 13.202 1.00 0.00 H new ATOM 0 HE3 LYS A 149 0.264 66.581 11.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 -0.308 64.951 13.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 1.302 64.736 12.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 0.963 65.482 14.347 1.00 0.00 H new ATOM 2271 N ASN A 150 1.072 73.105 12.089 1.00 0.00 N ATOM 2272 CA ASN A 150 0.266 74.237 12.532 1.00 0.00 C ATOM 2273 C ASN A 150 -0.588 73.856 13.733 1.00 0.00 C ATOM 2274 O ASN A 150 -1.794 74.099 13.751 1.00 0.00 O ATOM 2275 CB ASN A 150 -0.638 74.712 11.392 1.00 0.00 C ATOM 2276 CG ASN A 150 -1.312 76.025 11.775 1.00 0.00 C ATOM 2277 OD1 ASN A 150 -1.119 76.523 12.884 1.00 0.00 O ATOM 2278 ND2 ASN A 150 -2.099 76.618 10.919 1.00 0.00 N ATOM 0 H ASN A 150 2.077 73.278 12.073 1.00 0.00 H new ATOM 0 HA ASN A 150 0.940 75.042 12.824 1.00 0.00 H new ATOM 0 HB2 ASN A 150 -0.051 74.846 10.483 1.00 0.00 H new ATOM 0 HB3 ASN A 150 -1.393 73.956 11.176 1.00 0.00 H new ATOM 0 HD21 ASN A 150 -2.555 77.495 11.169 1.00 0.00 H new ATOM 0 HD22 ASN A 150 -2.258 76.204 10.000 1.00 0.00 H new ATOM 2285 N GLY A 151 0.045 73.253 14.738 1.00 0.00 N ATOM 2286 CA GLY A 151 -0.668 72.837 15.943 1.00 0.00 C ATOM 2287 C GLY A 151 -1.228 71.430 15.785 1.00 0.00 C ATOM 2288 O GLY A 151 -0.751 70.650 14.962 1.00 0.00 O ATOM 0 H GLY A 151 1.043 73.043 14.742 1.00 0.00 H new ATOM 0 HA2 GLY A 151 0.006 72.870 16.799 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -1.480 73.535 16.149 1.00 0.00 H new ATOM 2292 N ASN A 152 -2.244 71.112 16.581 1.00 0.00 N ATOM 2293 CA ASN A 152 -2.862 69.793 16.522 1.00 0.00 C ATOM 2294 C ASN A 152 -3.524 69.571 15.166 1.00 0.00 C ATOM 2295 O ASN A 152 -3.889 70.524 14.478 1.00 0.00 O ATOM 2296 CB ASN A 152 -3.909 69.657 17.632 1.00 0.00 C ATOM 2297 CG ASN A 152 -4.957 70.756 17.494 1.00 0.00 C ATOM 2298 OD1 ASN A 152 -4.959 71.495 16.509 1.00 0.00 O ATOM 2299 ND2 ASN A 152 -5.854 70.909 18.430 1.00 0.00 N ATOM 0 H ASN A 152 -2.654 71.744 17.269 1.00 0.00 H new ATOM 0 HA ASN A 152 -2.085 69.042 16.661 1.00 0.00 H new ATOM 0 HB2 ASN A 152 -4.386 68.678 17.576 1.00 0.00 H new ATOM 0 HB3 ASN A 152 -3.428 69.722 18.608 1.00 0.00 H new ATOM 0 HD21 ASN A 152 -6.559 71.642 18.346 1.00 0.00 H new ATOM 0 HD22 ASN A 152 -5.850 70.296 19.245 1.00 0.00 H new ATOM 2306 N SER A 153 -3.672 68.305 14.788 1.00 0.00 N ATOM 2307 CA SER A 153 -4.289 67.965 13.511 1.00 0.00 C ATOM 2308 C SER A 153 -5.799 68.164 13.578 1.00 0.00 C ATOM 2309 O SER A 153 -6.360 68.371 14.653 1.00 0.00 O ATOM 2310 CB SER A 153 -3.982 66.512 13.150 1.00 0.00 C ATOM 2311 OG SER A 153 -4.664 65.653 14.054 1.00 0.00 O ATOM 2312 OXT SER A 153 -6.405 68.106 12.521 1.00 0.00 O ATOM 0 H SER A 153 -3.375 67.503 15.344 1.00 0.00 H new ATOM 0 HA SER A 153 -3.878 68.623 12.745 1.00 0.00 H new ATOM 0 HB2 SER A 153 -4.295 66.305 12.127 1.00 0.00 H new ATOM 0 HB3 SER A 153 -2.908 66.332 13.198 1.00 0.00 H new ATOM 0 HG SER A 153 -4.472 64.719 13.826 1.00 0.00 H new TER 2318 SER A 153