USER MOD reduce.3.24.130724 H: found=0, std=0, add=1152, rem=0, adj=46 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 123 LYS NZ :NH3+ 142:sc= 0.446 (180deg=0) USER MOD Set 1.2: A 152 ASN :FLIP amide:sc= -3.54! C(o=-10!,f=-3.1!) USER MOD Set 2.1: A 117 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 126 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 83 TYR OH : rot 30:sc= 0 USER MOD Set 3.2: A 138 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 4.1: A 25 ASN :FLIP amide:sc= -0.0364 F(o=-2.1,f=-0.79) USER MOD Set 4.2: A 38 CYS SG : rot 42:sc= -0.751 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -179:sc= -0.71 (180deg=-0.711) USER MOD Single : A 3 HIS : no HE2:sc= -2.45! C(o=-2.5!,f=-8.2!) USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ -154:sc= 0.93 (180deg=-0.0734) USER MOD Single : A 8 GLN :FLIP amide:sc= -0.605 F(o=-3.6!,f=-0.61) USER MOD Single : A 10 GLN : amide:sc= -0.189 X(o=-0.19,f=-0.61) USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= -0.0115 K(o=-0.012,f=-1.4!) USER MOD Single : A 16 HIS : no HE2:sc= -3.13! C(o=-3.1!,f=-4.2!) USER MOD Single : A 17 ASN : amide:sc= -1.16 K(o=-1.2,f=-5!) USER MOD Single : A 23 TYR OH : rot 130:sc= -1.78! USER MOD Single : A 32 HIS : no HD1:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 39 ASN :FLIP amide:sc= -5.61 F(o=-7.4!,f=-5.6) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 CYS SG : rot 73:sc= 0.675 USER MOD Single : A 45 GLN :FLIP amide:sc= -1.4 F(o=-2.1!,f=-1.4) USER MOD Single : A 46 THR OG1 : rot 40:sc= 0.776 USER MOD Single : A 48 GLN : amide:sc= -5.34! C(o=-5.3!,f=-6.7!) USER MOD Single : A 49 SER OG : rot -160:sc= 0.535 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ -166:sc=-0.00596 (180deg=-0.205) USER MOD Single : A 58 SER OG : rot 150:sc= -0.728 USER MOD Single : A 61 HIS : no HE2:sc= -4.65 K(o=-4.6,f=-5.2!) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 THR OG1 : rot 36:sc= 1.08 USER MOD Single : A 74 GLN : amide:sc= -0.256 K(o=-0.26,f=-0.97) USER MOD Single : A 75 SER OG : rot 180:sc= -0.288 USER MOD Single : A 84 LYS NZ :NH3+ 156:sc= 0 (180deg=-0.51) USER MOD Single : A 85 ASN : amide:sc= -2.67! C(o=-2.7!,f=-2.7!) USER MOD Single : A 88 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 92 GLN : amide:sc= -0.186 K(o=-0.19,f=-1.1) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot 5:sc= 1.03 USER MOD Single : A 96 SER OG : rot 49:sc= 0.00231 USER MOD Single : A 101 TYR OH : rot 180:sc= -0.217 USER MOD Single : A 103 THR OG1 : rot -112:sc= 0.709 USER MOD Single : A 105 THR OG1 : rot 12:sc= 0.199! USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 113 THR OG1 : rot -25:sc= 0.203 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot -110:sc= -0.818 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 THR OG1 : rot 180:sc= 0.118 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 139 SER OG : rot 76:sc= 0.324 USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 MET CE :methyl 175:sc= 0 (180deg=-0.034) USER MOD Single : A 147 SER OG : rot 100:sc= 0.836 USER MOD Single : A 149 LYS NZ :NH3+ -138:sc= -1.35! (180deg=-3.07!) USER MOD Single : A 150 ASN : amide:sc= -0.113 K(o=-0.11,f=-4!) USER MOD Single : A 153 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -17.462 56.006 12.417 1.00 0.00 N ATOM 2 CA MET A 1 -16.262 56.522 11.700 1.00 0.00 C ATOM 3 C MET A 1 -15.004 56.127 12.465 1.00 0.00 C ATOM 4 O MET A 1 -13.956 56.754 12.323 1.00 0.00 O ATOM 5 CB MET A 1 -16.350 58.046 11.598 1.00 0.00 C ATOM 6 CG MET A 1 -17.490 58.430 10.651 1.00 0.00 C ATOM 7 SD MET A 1 -17.669 60.232 10.615 1.00 0.00 S ATOM 8 CE MET A 1 -16.438 60.566 9.330 1.00 0.00 C ATOM 0 H1 MET A 1 -18.320 56.261 11.886 1.00 0.00 H new ATOM 0 H2 MET A 1 -17.400 54.971 12.498 1.00 0.00 H new ATOM 0 H3 MET A 1 -17.506 56.426 13.368 1.00 0.00 H new ATOM 0 HA MET A 1 -16.221 56.095 10.698 1.00 0.00 H new ATOM 0 HB2 MET A 1 -16.521 58.478 12.584 1.00 0.00 H new ATOM 0 HB3 MET A 1 -15.407 58.452 11.232 1.00 0.00 H new ATOM 0 HG2 MET A 1 -17.285 58.055 9.648 1.00 0.00 H new ATOM 0 HG3 MET A 1 -18.421 57.968 10.980 1.00 0.00 H new ATOM 0 HE1 MET A 1 -16.385 61.639 9.147 1.00 0.00 H new ATOM 0 HE2 MET A 1 -15.463 60.205 9.658 1.00 0.00 H new ATOM 0 HE3 MET A 1 -16.724 60.055 8.411 1.00 0.00 H new ATOM 20 N ASP A 2 -15.118 55.080 13.279 1.00 0.00 N ATOM 21 CA ASP A 2 -13.985 54.610 14.067 1.00 0.00 C ATOM 22 C ASP A 2 -12.919 54.003 13.159 1.00 0.00 C ATOM 23 O ASP A 2 -11.767 53.843 13.561 1.00 0.00 O ATOM 24 CB ASP A 2 -14.453 53.563 15.076 1.00 0.00 C ATOM 25 CG ASP A 2 -15.310 54.223 16.152 1.00 0.00 C ATOM 26 OD1 ASP A 2 -15.244 55.435 16.272 1.00 0.00 O ATOM 27 OD2 ASP A 2 -16.019 53.507 16.836 1.00 0.00 O1- ATOM 0 H ASP A 2 -15.977 54.546 13.409 1.00 0.00 H new ATOM 0 HA ASP A 2 -13.555 55.460 14.597 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -15.026 52.787 14.568 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -13.592 53.076 15.533 1.00 0.00 H new ATOM 32 N HIS A 3 -13.313 53.666 11.934 1.00 0.00 N ATOM 33 CA HIS A 3 -12.382 53.078 10.978 1.00 0.00 C ATOM 34 C HIS A 3 -11.264 54.058 10.643 1.00 0.00 C ATOM 35 O HIS A 3 -11.486 55.268 10.586 1.00 0.00 O ATOM 36 CB HIS A 3 -13.123 52.700 9.694 1.00 0.00 C ATOM 37 CG HIS A 3 -13.882 53.896 9.182 1.00 0.00 C ATOM 38 ND1 HIS A 3 -13.282 55.134 9.006 1.00 0.00 N ATOM 39 CD2 HIS A 3 -15.193 54.060 8.804 1.00 0.00 C ATOM 40 CE1 HIS A 3 -14.220 55.979 8.543 1.00 0.00 C ATOM 41 NE2 HIS A 3 -15.403 55.377 8.402 1.00 0.00 N ATOM 0 H HIS A 3 -14.263 53.789 11.583 1.00 0.00 H new ATOM 0 HA HIS A 3 -11.947 52.186 11.429 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -12.415 52.356 8.941 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -13.809 51.875 9.887 1.00 0.00 H new ATOM 0 HD1 HIS A 3 -12.306 55.362 9.194 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -15.946 53.286 8.817 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -14.038 57.018 8.313 1.00 0.00 H new ATOM 49 N VAL A 4 -10.054 53.538 10.428 1.00 0.00 N ATOM 50 CA VAL A 4 -8.917 54.368 10.105 1.00 0.00 C ATOM 51 C VAL A 4 -8.085 53.740 8.994 1.00 0.00 C ATOM 52 O VAL A 4 -7.517 54.442 8.160 1.00 0.00 O ATOM 53 CB VAL A 4 -8.054 54.530 11.342 1.00 0.00 C ATOM 54 CG1 VAL A 4 -8.873 55.181 12.458 1.00 0.00 C ATOM 55 CG2 VAL A 4 -7.538 53.163 11.810 1.00 0.00 C ATOM 0 H VAL A 4 -9.847 52.540 10.475 1.00 0.00 H new ATOM 0 HA VAL A 4 -9.278 55.338 9.764 1.00 0.00 H new ATOM 0 HB VAL A 4 -7.202 55.165 11.099 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -8.251 55.296 13.346 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -9.222 56.160 12.130 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -9.730 54.551 12.695 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -6.920 53.292 12.698 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -8.383 52.517 12.047 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -6.944 52.708 11.018 1.00 0.00 H new ATOM 65 N TYR A 5 -8.000 52.415 9.002 1.00 0.00 N ATOM 66 CA TYR A 5 -7.209 51.700 8.006 1.00 0.00 C ATOM 67 C TYR A 5 -7.788 51.898 6.611 1.00 0.00 C ATOM 68 O TYR A 5 -7.053 52.102 5.644 1.00 0.00 O ATOM 69 CB TYR A 5 -7.182 50.205 8.339 1.00 0.00 C ATOM 70 CG TYR A 5 -6.528 49.989 9.686 1.00 0.00 C ATOM 71 CD1 TYR A 5 -7.256 50.198 10.860 1.00 0.00 C ATOM 72 CD2 TYR A 5 -5.192 49.588 9.755 1.00 0.00 C ATOM 73 CE1 TYR A 5 -6.641 50.014 12.107 1.00 0.00 C ATOM 74 CE2 TYR A 5 -4.578 49.397 10.998 1.00 0.00 C ATOM 75 CZ TYR A 5 -5.304 49.611 12.176 1.00 0.00 C ATOM 76 OH TYR A 5 -4.698 49.430 13.403 1.00 0.00 O ATOM 0 H TYR A 5 -8.466 51.816 9.683 1.00 0.00 H new ATOM 0 HA TYR A 5 -6.195 52.099 8.024 1.00 0.00 H new ATOM 0 HB2 TYR A 5 -8.197 49.808 8.350 1.00 0.00 H new ATOM 0 HB3 TYR A 5 -6.635 49.662 7.568 1.00 0.00 H new ATOM 0 HD1 TYR A 5 -8.291 50.501 10.807 1.00 0.00 H new ATOM 0 HD2 TYR A 5 -4.631 49.425 8.847 1.00 0.00 H new ATOM 0 HE1 TYR A 5 -7.201 50.184 13.015 1.00 0.00 H new ATOM 0 HE2 TYR A 5 -3.545 49.085 11.049 1.00 0.00 H new ATOM 0 HH TYR A 5 -3.769 49.148 13.271 1.00 0.00 H new ATOM 86 N LYS A 6 -9.109 51.830 6.513 1.00 0.00 N ATOM 87 CA LYS A 6 -9.775 51.993 5.231 1.00 0.00 C ATOM 88 C LYS A 6 -9.487 53.375 4.655 1.00 0.00 C ATOM 89 O LYS A 6 -9.246 53.523 3.457 1.00 0.00 O ATOM 90 CB LYS A 6 -11.286 51.814 5.399 1.00 0.00 C ATOM 91 CG LYS A 6 -11.597 50.350 5.725 1.00 0.00 C ATOM 92 CD LYS A 6 -13.114 50.123 5.707 1.00 0.00 C ATOM 93 CE LYS A 6 -13.766 50.778 6.929 1.00 0.00 C ATOM 94 NZ LYS A 6 -15.172 50.298 7.057 1.00 0.00 N1+ ATOM 0 H LYS A 6 -9.735 51.664 7.301 1.00 0.00 H new ATOM 0 HA LYS A 6 -9.395 51.236 4.545 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -11.652 52.460 6.196 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -11.801 52.111 4.486 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -11.114 49.696 4.999 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -11.193 50.093 6.704 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -13.540 50.538 4.793 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -13.328 49.054 5.701 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -13.203 50.534 7.830 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -13.748 51.863 6.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -15.738 51.012 7.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -15.573 50.141 6.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -15.187 49.406 7.591 1.00 0.00 H new ATOM 108 N GLY A 7 -9.511 54.386 5.516 1.00 0.00 N ATOM 109 CA GLY A 7 -9.248 55.754 5.088 1.00 0.00 C ATOM 110 C GLY A 7 -7.803 55.914 4.625 1.00 0.00 C ATOM 111 O GLY A 7 -7.500 56.752 3.776 1.00 0.00 O ATOM 0 H GLY A 7 -9.709 54.284 6.511 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -9.925 56.022 4.277 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -9.448 56.441 5.910 1.00 0.00 H new ATOM 115 N GLN A 8 -6.916 55.100 5.189 1.00 0.00 N ATOM 116 CA GLN A 8 -5.505 55.153 4.831 1.00 0.00 C ATOM 117 C GLN A 8 -5.267 54.476 3.491 1.00 0.00 C ATOM 118 O GLN A 8 -4.589 55.019 2.621 1.00 0.00 O ATOM 119 CB GLN A 8 -4.662 54.471 5.911 1.00 0.00 C ATOM 120 CG GLN A 8 -3.252 55.065 5.908 1.00 0.00 C ATOM 121 CD GLN A 8 -2.850 55.457 7.326 1.00 0.00 C ATOM 122 OE1 GLN A 8 -3.690 55.270 8.308 1.00 0.00 O flip ATOM 123 NE2 GLN A 8 -1.742 55.946 7.545 1.00 0.00 N flip ATOM 0 H GLN A 8 -7.149 54.399 5.893 1.00 0.00 H new ATOM 0 HA GLN A 8 -5.210 56.199 4.752 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -5.124 54.608 6.889 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -4.616 53.397 5.728 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -2.544 54.340 5.507 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -3.217 55.938 5.256 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -1.088 56.091 6.776 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -1.478 56.206 8.495 1.00 0.00 H new ATOM 132 N LEU A 9 -5.830 53.285 3.330 1.00 0.00 N ATOM 133 CA LEU A 9 -5.669 52.546 2.086 1.00 0.00 C ATOM 134 C LEU A 9 -6.284 53.313 0.942 1.00 0.00 C ATOM 135 O LEU A 9 -5.707 53.409 -0.143 1.00 0.00 O ATOM 136 CB LEU A 9 -6.323 51.164 2.212 1.00 0.00 C ATOM 137 CG LEU A 9 -6.162 50.378 0.902 1.00 0.00 C ATOM 138 CD1 LEU A 9 -4.671 50.179 0.582 1.00 0.00 C ATOM 139 CD2 LEU A 9 -6.850 49.013 1.043 1.00 0.00 C ATOM 0 H LEU A 9 -6.396 52.815 4.037 1.00 0.00 H new ATOM 0 HA LEU A 9 -4.606 52.416 1.885 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -5.867 50.612 3.034 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -7.381 51.275 2.450 1.00 0.00 H new ATOM 0 HG LEU A 9 -6.622 50.938 0.088 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -4.570 49.621 -0.349 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -4.189 51.151 0.476 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -4.196 49.624 1.391 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -6.738 48.452 0.115 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -6.392 48.457 1.861 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -7.910 49.160 1.253 1.00 0.00 H new ATOM 151 N GLN A 10 -7.460 53.847 1.181 1.00 0.00 N ATOM 152 CA GLN A 10 -8.140 54.586 0.146 1.00 0.00 C ATOM 153 C GLN A 10 -7.275 55.746 -0.327 1.00 0.00 C ATOM 154 O GLN A 10 -7.249 56.073 -1.515 1.00 0.00 O ATOM 155 CB GLN A 10 -9.487 55.101 0.653 1.00 0.00 C ATOM 156 CG GLN A 10 -10.293 55.702 -0.503 1.00 0.00 C ATOM 157 CD GLN A 10 -10.740 54.603 -1.461 1.00 0.00 C ATOM 158 OE1 GLN A 10 -10.314 54.571 -2.617 1.00 0.00 O ATOM 159 NE2 GLN A 10 -11.584 53.696 -1.047 1.00 0.00 N ATOM 0 H GLN A 10 -7.958 53.785 2.069 1.00 0.00 H new ATOM 0 HA GLN A 10 -8.321 53.918 -0.696 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -10.047 54.286 1.111 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -9.329 55.853 1.426 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -11.163 56.231 -0.113 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -9.687 56.435 -1.036 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -11.935 53.725 -0.090 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -11.892 52.959 -1.681 1.00 0.00 H new ATOM 168 N ALA A 11 -6.567 56.364 0.608 1.00 0.00 N ATOM 169 CA ALA A 11 -5.699 57.483 0.276 1.00 0.00 C ATOM 170 C ALA A 11 -4.535 57.021 -0.598 1.00 0.00 C ATOM 171 O ALA A 11 -4.171 57.688 -1.566 1.00 0.00 O ATOM 172 CB ALA A 11 -5.160 58.117 1.558 1.00 0.00 C ATOM 0 H ALA A 11 -6.577 56.111 1.596 1.00 0.00 H new ATOM 0 HA ALA A 11 -6.280 58.220 -0.279 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -4.510 58.955 1.304 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -5.992 58.474 2.165 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -4.593 57.375 2.120 1.00 0.00 H new ATOM 178 N TYR A 12 -3.955 55.875 -0.247 1.00 0.00 N ATOM 179 CA TYR A 12 -2.834 55.334 -1.009 1.00 0.00 C ATOM 180 C TYR A 12 -3.265 54.988 -2.434 1.00 0.00 C ATOM 181 O TYR A 12 -2.634 55.409 -3.402 1.00 0.00 O ATOM 182 CB TYR A 12 -2.292 54.082 -0.318 1.00 0.00 C ATOM 183 CG TYR A 12 -1.193 53.477 -1.159 1.00 0.00 C ATOM 184 CD1 TYR A 12 0.086 54.048 -1.158 1.00 0.00 C ATOM 185 CD2 TYR A 12 -1.452 52.343 -1.941 1.00 0.00 C ATOM 186 CE1 TYR A 12 1.103 53.488 -1.940 1.00 0.00 C ATOM 187 CE2 TYR A 12 -0.433 51.783 -2.720 1.00 0.00 C ATOM 188 CZ TYR A 12 0.843 52.357 -2.721 1.00 0.00 C ATOM 189 OH TYR A 12 1.846 51.805 -3.491 1.00 0.00 O ATOM 0 H TYR A 12 -4.240 55.309 0.552 1.00 0.00 H new ATOM 0 HA TYR A 12 -2.052 56.092 -1.056 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -1.910 54.336 0.671 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -3.094 53.358 -0.173 1.00 0.00 H new ATOM 0 HD1 TYR A 12 0.288 54.920 -0.554 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -2.438 51.901 -1.942 1.00 0.00 H new ATOM 0 HE1 TYR A 12 2.089 53.929 -1.940 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -0.632 50.908 -3.320 1.00 0.00 H new ATOM 0 HH TYR A 12 1.498 51.024 -3.971 1.00 0.00 H new ATOM 199 N ALA A 13 -4.345 54.222 -2.546 1.00 0.00 N ATOM 200 CA ALA A 13 -4.860 53.826 -3.854 1.00 0.00 C ATOM 201 C ALA A 13 -5.265 55.066 -4.651 1.00 0.00 C ATOM 202 O ALA A 13 -5.029 55.147 -5.853 1.00 0.00 O ATOM 203 CB ALA A 13 -6.075 52.888 -3.679 1.00 0.00 C ATOM 0 H ALA A 13 -4.878 53.864 -1.753 1.00 0.00 H new ATOM 0 HA ALA A 13 -4.079 53.295 -4.399 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -6.454 52.597 -4.659 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -5.771 51.998 -3.128 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -6.858 53.407 -3.127 1.00 0.00 H new ATOM 209 N LEU A 14 -5.890 56.018 -3.967 1.00 0.00 N ATOM 210 CA LEU A 14 -6.333 57.238 -4.627 1.00 0.00 C ATOM 211 C LEU A 14 -5.140 58.001 -5.184 1.00 0.00 C ATOM 212 O LEU A 14 -5.178 58.491 -6.313 1.00 0.00 O ATOM 213 CB LEU A 14 -7.097 58.128 -3.638 1.00 0.00 C ATOM 214 CG LEU A 14 -7.593 59.405 -4.339 1.00 0.00 C ATOM 215 CD1 LEU A 14 -8.667 59.057 -5.383 1.00 0.00 C ATOM 216 CD2 LEU A 14 -8.177 60.357 -3.292 1.00 0.00 C ATOM 0 H LEU A 14 -6.099 55.970 -2.970 1.00 0.00 H new ATOM 0 HA LEU A 14 -6.995 56.965 -5.448 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -7.944 57.580 -3.225 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -6.450 58.392 -2.802 1.00 0.00 H new ATOM 0 HG LEU A 14 -6.757 59.884 -4.847 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -9.009 59.970 -5.871 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -8.245 58.383 -6.128 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -9.509 58.571 -4.890 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -8.530 61.264 -3.782 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -9.010 59.872 -2.783 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -7.407 60.614 -2.564 1.00 0.00 H new ATOM 228 N GLN A 15 -4.088 58.112 -4.382 1.00 0.00 N ATOM 229 CA GLN A 15 -2.896 58.832 -4.808 1.00 0.00 C ATOM 230 C GLN A 15 -2.209 58.112 -5.964 1.00 0.00 C ATOM 231 O GLN A 15 -1.808 58.736 -6.947 1.00 0.00 O ATOM 232 CB GLN A 15 -1.922 58.966 -3.635 1.00 0.00 C ATOM 233 CG GLN A 15 -0.651 59.685 -4.096 1.00 0.00 C ATOM 234 CD GLN A 15 0.251 59.966 -2.901 1.00 0.00 C ATOM 235 OE1 GLN A 15 -0.219 60.020 -1.765 1.00 0.00 O ATOM 236 NE2 GLN A 15 1.530 60.137 -3.094 1.00 0.00 N ATOM 0 H GLN A 15 -4.036 57.717 -3.443 1.00 0.00 H new ATOM 0 HA GLN A 15 -3.198 59.823 -5.147 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -2.391 59.521 -2.823 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -1.672 57.980 -3.244 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -0.121 59.073 -4.826 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -0.912 60.619 -4.593 1.00 0.00 H new ATOM 0 HE21 GLN A 15 1.914 60.091 -4.038 1.00 0.00 H new ATOM 0 HE22 GLN A 15 2.146 60.317 -2.301 1.00 0.00 H new ATOM 245 N HIS A 16 -2.068 56.797 -5.832 1.00 0.00 N ATOM 246 CA HIS A 16 -1.414 55.997 -6.863 1.00 0.00 C ATOM 247 C HIS A 16 -2.403 55.620 -7.961 1.00 0.00 C ATOM 248 O HIS A 16 -2.011 55.130 -9.020 1.00 0.00 O ATOM 249 CB HIS A 16 -0.830 54.725 -6.239 1.00 0.00 C ATOM 250 CG HIS A 16 0.347 55.087 -5.376 1.00 0.00 C ATOM 251 ND1 HIS A 16 0.195 55.651 -4.119 1.00 0.00 N ATOM 252 CD2 HIS A 16 1.701 54.966 -5.572 1.00 0.00 C ATOM 253 CE1 HIS A 16 1.427 55.847 -3.611 1.00 0.00 C ATOM 254 NE2 HIS A 16 2.380 55.447 -4.456 1.00 0.00 N ATOM 0 H HIS A 16 -2.396 56.264 -5.026 1.00 0.00 H new ATOM 0 HA HIS A 16 -0.613 56.590 -7.304 1.00 0.00 H new ATOM 0 HB2 HIS A 16 -1.589 54.217 -5.644 1.00 0.00 H new ATOM 0 HB3 HIS A 16 -0.522 54.031 -7.021 1.00 0.00 H new ATOM 0 HD1 HIS A 16 -0.689 55.876 -3.662 1.00 0.00 H new ATOM 0 HD2 HIS A 16 2.168 54.560 -6.457 1.00 0.00 H new ATOM 0 HE1 HIS A 16 1.620 56.275 -2.639 1.00 0.00 H new ATOM 262 N ASN A 17 -3.685 55.852 -7.702 1.00 0.00 N ATOM 263 CA ASN A 17 -4.721 55.533 -8.677 1.00 0.00 C ATOM 264 C ASN A 17 -4.687 54.050 -9.034 1.00 0.00 C ATOM 265 O ASN A 17 -4.389 53.681 -10.171 1.00 0.00 O ATOM 266 CB ASN A 17 -4.528 56.371 -9.941 1.00 0.00 C ATOM 267 CG ASN A 17 -5.730 56.203 -10.860 1.00 0.00 C ATOM 268 OD1 ASN A 17 -6.406 55.175 -10.822 1.00 0.00 O ATOM 269 ND2 ASN A 17 -6.044 57.161 -11.690 1.00 0.00 N ATOM 0 H ASN A 17 -4.030 56.257 -6.832 1.00 0.00 H new ATOM 0 HA ASN A 17 -5.690 55.764 -8.235 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -4.405 57.421 -9.677 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -3.618 56.063 -10.457 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -6.850 57.058 -12.307 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -5.484 58.013 -11.721 1.00 0.00 H new ATOM 276 N LEU A 18 -4.988 53.202 -8.052 1.00 0.00 N ATOM 277 CA LEU A 18 -4.987 51.752 -8.263 1.00 0.00 C ATOM 278 C LEU A 18 -6.413 51.231 -8.413 1.00 0.00 C ATOM 279 O LEU A 18 -7.376 51.985 -8.290 1.00 0.00 O ATOM 280 CB LEU A 18 -4.305 51.059 -7.080 1.00 0.00 C ATOM 281 CG LEU A 18 -2.901 51.641 -6.881 1.00 0.00 C ATOM 282 CD1 LEU A 18 -2.252 50.992 -5.657 1.00 0.00 C ATOM 283 CD2 LEU A 18 -2.037 51.373 -8.127 1.00 0.00 C ATOM 0 H LEU A 18 -5.235 53.491 -7.105 1.00 0.00 H new ATOM 0 HA LEU A 18 -4.438 51.533 -9.179 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -4.897 51.195 -6.175 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -4.242 49.986 -7.261 1.00 0.00 H new ATOM 0 HG LEU A 18 -2.977 52.718 -6.728 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -1.253 51.404 -5.513 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -2.858 51.194 -4.774 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -2.181 49.915 -5.811 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -1.041 51.790 -7.976 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -1.959 50.298 -8.291 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -2.498 51.841 -8.997 1.00 0.00 H new ATOM 295 N GLU A 19 -6.536 49.933 -8.684 1.00 0.00 N ATOM 296 CA GLU A 19 -7.842 49.316 -8.859 1.00 0.00 C ATOM 297 C GLU A 19 -8.786 49.765 -7.757 1.00 0.00 C ATOM 298 O GLU A 19 -8.411 49.820 -6.586 1.00 0.00 O ATOM 299 CB GLU A 19 -7.710 47.792 -8.837 1.00 0.00 C ATOM 300 CG GLU A 19 -9.075 47.156 -9.111 1.00 0.00 C ATOM 301 CD GLU A 19 -8.940 45.639 -9.161 1.00 0.00 C ATOM 302 OE1 GLU A 19 -7.892 45.145 -8.778 1.00 0.00 O ATOM 303 OE2 GLU A 19 -9.887 44.994 -9.580 1.00 0.00 O1- ATOM 0 H GLU A 19 -5.748 49.293 -8.786 1.00 0.00 H new ATOM 0 HA GLU A 19 -8.248 49.626 -9.822 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -6.989 47.468 -9.588 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -7.332 47.463 -7.869 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -9.782 47.441 -8.332 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -9.475 47.525 -10.055 1.00 0.00 H new ATOM 310 N LEU A 20 -10.008 50.104 -8.145 1.00 0.00 N ATOM 311 CA LEU A 20 -10.989 50.570 -7.180 1.00 0.00 C ATOM 312 C LEU A 20 -10.993 49.668 -5.937 1.00 0.00 C ATOM 313 O LEU A 20 -11.452 48.528 -6.001 1.00 0.00 O ATOM 314 CB LEU A 20 -12.389 50.570 -7.801 1.00 0.00 C ATOM 315 CG LEU A 20 -13.353 51.376 -6.905 1.00 0.00 C ATOM 316 CD1 LEU A 20 -13.277 52.871 -7.244 1.00 0.00 C ATOM 317 CD2 LEU A 20 -14.789 50.890 -7.126 1.00 0.00 C ATOM 0 H LEU A 20 -10.339 50.065 -9.109 1.00 0.00 H new ATOM 0 HA LEU A 20 -10.719 51.585 -6.889 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -12.355 51.006 -8.800 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -12.749 49.547 -7.912 1.00 0.00 H new ATOM 0 HG LEU A 20 -13.063 51.228 -5.865 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -13.963 53.425 -6.603 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -12.260 53.229 -7.083 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -13.554 53.022 -8.287 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -15.468 51.461 -6.492 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -15.064 51.031 -8.171 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -14.858 49.832 -6.872 1.00 0.00 H new ATOM 329 N PRO A 21 -10.495 50.144 -4.813 1.00 0.00 N ATOM 330 CA PRO A 21 -10.470 49.342 -3.546 1.00 0.00 C ATOM 331 C PRO A 21 -11.858 48.867 -3.132 1.00 0.00 C ATOM 332 O PRO A 21 -12.837 49.607 -3.241 1.00 0.00 O ATOM 333 CB PRO A 21 -9.901 50.316 -2.501 1.00 0.00 C ATOM 334 CG PRO A 21 -9.174 51.362 -3.282 1.00 0.00 C ATOM 335 CD PRO A 21 -9.899 51.480 -4.615 1.00 0.00 C ATOM 0 HA PRO A 21 -9.879 48.433 -3.659 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -10.697 50.757 -1.901 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -9.230 49.804 -1.812 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -9.176 52.315 -2.752 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -8.131 51.082 -3.430 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -10.662 52.258 -4.588 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -9.212 51.735 -5.422 1.00 0.00 H new ATOM 343 N VAL A 22 -11.930 47.633 -2.637 1.00 0.00 N ATOM 344 CA VAL A 22 -13.209 47.076 -2.190 1.00 0.00 C ATOM 345 C VAL A 22 -13.011 46.091 -1.035 1.00 0.00 C ATOM 346 O VAL A 22 -12.105 45.263 -1.063 1.00 0.00 O ATOM 347 CB VAL A 22 -13.919 46.372 -3.357 1.00 0.00 C ATOM 348 CG1 VAL A 22 -15.174 45.652 -2.854 1.00 0.00 C ATOM 349 CG2 VAL A 22 -14.318 47.399 -4.420 1.00 0.00 C ATOM 0 H VAL A 22 -11.132 47.006 -2.535 1.00 0.00 H new ATOM 0 HA VAL A 22 -13.827 47.901 -1.835 1.00 0.00 H new ATOM 0 HB VAL A 22 -13.235 45.643 -3.792 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -15.669 45.157 -3.689 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -14.893 44.910 -2.107 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -15.855 46.377 -2.407 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -14.821 46.893 -5.244 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -14.992 48.134 -3.981 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -13.426 47.902 -4.793 1.00 0.00 H new ATOM 359 N TYR A 23 -13.877 46.189 -0.029 1.00 0.00 N ATOM 360 CA TYR A 23 -13.825 45.311 1.132 1.00 0.00 C ATOM 361 C TYR A 23 -14.983 44.325 1.117 1.00 0.00 C ATOM 362 O TYR A 23 -16.052 44.611 0.579 1.00 0.00 O ATOM 363 CB TYR A 23 -13.883 46.142 2.398 1.00 0.00 C ATOM 364 CG TYR A 23 -12.572 46.867 2.573 1.00 0.00 C ATOM 365 CD1 TYR A 23 -12.191 47.871 1.677 1.00 0.00 C ATOM 366 CD2 TYR A 23 -11.735 46.525 3.631 1.00 0.00 C ATOM 367 CE1 TYR A 23 -10.971 48.533 1.846 1.00 0.00 C ATOM 368 CE2 TYR A 23 -10.513 47.179 3.811 1.00 0.00 C ATOM 369 CZ TYR A 23 -10.128 48.188 2.916 1.00 0.00 C ATOM 370 OH TYR A 23 -8.924 48.840 3.085 1.00 0.00 O ATOM 0 H TYR A 23 -14.630 46.876 0.002 1.00 0.00 H new ATOM 0 HA TYR A 23 -12.892 44.749 1.100 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -14.704 46.857 2.341 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -14.077 45.502 3.259 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -12.839 48.135 0.854 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -12.032 45.747 4.319 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -10.677 49.309 1.155 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -9.869 46.909 4.635 1.00 0.00 H new ATOM 0 HH TYR A 23 -8.846 49.148 4.012 1.00 0.00 H new ATOM 380 N ALA A 24 -14.761 43.166 1.730 1.00 0.00 N ATOM 381 CA ALA A 24 -15.795 42.131 1.819 1.00 0.00 C ATOM 382 C ALA A 24 -16.255 42.000 3.262 1.00 0.00 C ATOM 383 O ALA A 24 -15.460 42.149 4.183 1.00 0.00 O ATOM 384 CB ALA A 24 -15.244 40.791 1.326 1.00 0.00 C ATOM 0 H ALA A 24 -13.877 42.917 2.173 1.00 0.00 H new ATOM 0 HA ALA A 24 -16.640 42.414 1.192 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -16.021 40.030 1.397 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -14.925 40.888 0.288 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -14.393 40.499 1.941 1.00 0.00 H new ATOM 390 N ASN A 25 -17.541 41.730 3.460 1.00 0.00 N ATOM 391 CA ASN A 25 -18.090 41.596 4.808 1.00 0.00 C ATOM 392 C ASN A 25 -18.790 40.254 4.982 1.00 0.00 C ATOM 393 O ASN A 25 -19.713 39.926 4.239 1.00 0.00 O ATOM 394 CB ASN A 25 -19.101 42.717 5.060 1.00 0.00 C ATOM 395 CG ASN A 25 -18.422 44.073 4.917 1.00 0.00 C ATOM 396 OD1 ASN A 25 -17.149 44.186 5.175 1.00 0.00 O flip ATOM 397 ND2 ASN A 25 -19.070 45.056 4.559 1.00 0.00 N flip ATOM 0 H ASN A 25 -18.220 41.600 2.710 1.00 0.00 H new ATOM 0 HA ASN A 25 -17.267 41.659 5.520 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -19.927 42.638 4.353 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -19.526 42.617 6.059 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -20.066 44.965 4.358 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -18.611 45.962 4.463 1.00 0.00 H new ATOM 404 N GLU A 26 -18.359 39.494 5.986 1.00 0.00 N ATOM 405 CA GLU A 26 -18.977 38.195 6.276 1.00 0.00 C ATOM 406 C GLU A 26 -19.209 38.057 7.776 1.00 0.00 C ATOM 407 O GLU A 26 -18.296 38.258 8.574 1.00 0.00 O ATOM 408 CB GLU A 26 -18.076 37.065 5.783 1.00 0.00 C ATOM 409 CG GLU A 26 -17.948 37.146 4.262 1.00 0.00 C ATOM 410 CD GLU A 26 -16.972 36.085 3.763 1.00 0.00 C ATOM 411 OE1 GLU A 26 -16.440 35.364 4.591 1.00 0.00 O ATOM 412 OE2 GLU A 26 -16.772 36.013 2.564 1.00 0.00 O1- ATOM 0 H GLU A 26 -17.592 39.748 6.609 1.00 0.00 H new ATOM 0 HA GLU A 26 -19.935 38.134 5.759 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -17.092 37.141 6.246 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -18.492 36.100 6.073 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -18.924 37.001 3.799 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -17.601 38.137 3.970 1.00 0.00 H new ATOM 419 N ARG A 27 -20.441 37.720 8.159 1.00 0.00 N ATOM 420 CA ARG A 27 -20.782 37.569 9.573 1.00 0.00 C ATOM 421 C ARG A 27 -21.551 36.277 9.786 1.00 0.00 C ATOM 422 O ARG A 27 -22.634 36.094 9.231 1.00 0.00 O ATOM 423 CB ARG A 27 -21.651 38.745 10.023 1.00 0.00 C ATOM 424 CG ARG A 27 -21.888 38.660 11.534 1.00 0.00 C ATOM 425 CD ARG A 27 -22.843 39.772 11.966 1.00 0.00 C ATOM 426 NE ARG A 27 -22.895 39.843 13.421 1.00 0.00 N ATOM 427 CZ ARG A 27 -23.877 40.486 14.042 1.00 0.00 C ATOM 428 NH1 ARG A 27 -24.820 41.061 13.349 1.00 0.00 N ATOM 429 NH2 ARG A 27 -23.900 40.537 15.346 1.00 0.00 N1+ ATOM 0 H ARG A 27 -21.213 37.548 7.515 1.00 0.00 H new ATOM 0 HA ARG A 27 -19.861 37.546 10.156 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -21.163 39.687 9.774 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -22.604 38.730 9.494 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -22.306 37.687 11.793 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -20.941 38.752 12.067 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -22.512 40.727 11.558 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -23.839 39.583 11.566 1.00 0.00 H new ATOM 0 HE ARG A 27 -22.165 39.391 13.971 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -24.803 41.017 12.330 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -25.574 41.555 13.826 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -23.164 40.083 15.887 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -24.654 41.031 15.824 1.00 0.00 H new ATOM 443 N GLU A 28 -21.000 35.387 10.597 1.00 0.00 N ATOM 444 CA GLU A 28 -21.667 34.127 10.872 1.00 0.00 C ATOM 445 C GLU A 28 -21.104 33.510 12.140 1.00 0.00 C ATOM 446 O GLU A 28 -19.890 33.467 12.332 1.00 0.00 O ATOM 447 CB GLU A 28 -21.476 33.156 9.704 1.00 0.00 C ATOM 448 CG GLU A 28 -22.260 31.867 9.970 1.00 0.00 C ATOM 449 CD GLU A 28 -22.142 30.927 8.775 1.00 0.00 C ATOM 450 OE1 GLU A 28 -21.314 31.191 7.919 1.00 0.00 O ATOM 451 OE2 GLU A 28 -22.883 29.957 8.733 1.00 0.00 O1- ATOM 0 H GLU A 28 -20.105 35.512 11.070 1.00 0.00 H new ATOM 0 HA GLU A 28 -22.732 34.320 11.003 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -21.818 33.616 8.777 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -20.417 32.929 9.576 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -21.878 31.378 10.866 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -23.308 32.101 10.156 1.00 0.00 H new ATOM 458 N GLY A 29 -21.984 33.026 13.006 1.00 0.00 N ATOM 459 CA GLY A 29 -21.542 32.396 14.244 1.00 0.00 C ATOM 460 C GLY A 29 -22.529 32.645 15.385 1.00 0.00 C ATOM 461 O GLY A 29 -23.206 33.673 15.409 1.00 0.00 O ATOM 0 H GLY A 29 -22.995 33.056 12.878 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -21.429 31.323 14.087 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -20.561 32.783 14.520 1.00 0.00 H new ATOM 465 N PRO A 30 -22.611 31.743 16.341 1.00 0.00 N ATOM 466 CA PRO A 30 -23.522 31.903 17.516 1.00 0.00 C ATOM 467 C PRO A 30 -23.448 33.318 18.113 1.00 0.00 C ATOM 468 O PRO A 30 -22.476 34.041 17.887 1.00 0.00 O ATOM 469 CB PRO A 30 -22.999 30.858 18.520 1.00 0.00 C ATOM 470 CG PRO A 30 -22.330 29.804 17.697 1.00 0.00 C ATOM 471 CD PRO A 30 -21.855 30.476 16.404 1.00 0.00 C ATOM 0 HA PRO A 30 -24.569 31.761 17.249 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -22.299 31.308 19.224 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -23.815 30.437 19.107 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -21.489 29.370 18.237 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -23.021 28.991 17.477 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -20.780 30.657 16.423 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -22.058 29.850 15.535 1.00 0.00 H new ATOM 479 N PRO A 31 -24.444 33.714 18.871 1.00 0.00 N ATOM 480 CA PRO A 31 -24.479 35.065 19.520 1.00 0.00 C ATOM 481 C PRO A 31 -23.258 35.305 20.415 1.00 0.00 C ATOM 482 O PRO A 31 -22.657 36.379 20.383 1.00 0.00 O ATOM 483 CB PRO A 31 -25.786 35.043 20.343 1.00 0.00 C ATOM 484 CG PRO A 31 -26.154 33.597 20.463 1.00 0.00 C ATOM 485 CD PRO A 31 -25.646 32.934 19.193 1.00 0.00 C ATOM 0 HA PRO A 31 -24.451 35.874 18.791 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -25.640 35.494 21.324 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -26.573 35.609 19.846 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -25.699 33.150 21.347 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -27.232 33.475 20.563 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -25.413 31.881 19.353 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -26.383 32.979 18.391 1.00 0.00 H new ATOM 493 N HIS A 32 -22.901 34.298 21.212 1.00 0.00 N ATOM 494 CA HIS A 32 -21.754 34.407 22.114 1.00 0.00 C ATOM 495 C HIS A 32 -20.477 33.960 21.411 1.00 0.00 C ATOM 496 O HIS A 32 -19.392 33.982 21.994 1.00 0.00 O ATOM 497 CB HIS A 32 -21.983 33.542 23.354 1.00 0.00 C ATOM 498 CG HIS A 32 -23.081 34.143 24.189 1.00 0.00 C ATOM 499 ND1 HIS A 32 -24.422 33.924 23.918 1.00 0.00 N ATOM 500 CD2 HIS A 32 -23.050 34.954 25.296 1.00 0.00 C ATOM 501 CE1 HIS A 32 -25.137 34.590 24.842 1.00 0.00 C ATOM 502 NE2 HIS A 32 -24.350 35.236 25.707 1.00 0.00 N ATOM 0 H HIS A 32 -23.386 33.402 21.252 1.00 0.00 H new ATOM 0 HA HIS A 32 -21.647 35.450 22.412 1.00 0.00 H new ATOM 0 HB2 HIS A 32 -22.250 32.527 23.058 1.00 0.00 H new ATOM 0 HB3 HIS A 32 -21.065 33.473 23.937 1.00 0.00 H new ATOM 0 HD2 HIS A 32 -22.153 35.318 25.775 1.00 0.00 H new ATOM 0 HE1 HIS A 32 -26.216 34.601 24.880 1.00 0.00 H new ATOM 0 HE2 HIS A 32 -24.639 35.812 26.498 1.00 0.00 H new ATOM 510 N ALA A 33 -20.617 33.577 20.146 1.00 0.00 N ATOM 511 CA ALA A 33 -19.467 33.150 19.350 1.00 0.00 C ATOM 512 C ALA A 33 -19.568 33.685 17.924 1.00 0.00 C ATOM 513 O ALA A 33 -19.597 32.915 16.964 1.00 0.00 O ATOM 514 CB ALA A 33 -19.384 31.620 19.332 1.00 0.00 C ATOM 0 H ALA A 33 -21.508 33.553 19.651 1.00 0.00 H new ATOM 0 HA ALA A 33 -18.562 33.553 19.805 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -18.525 31.309 18.737 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -19.273 31.250 20.351 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -20.295 31.211 18.895 1.00 0.00 H new ATOM 520 N PRO A 34 -19.601 34.983 17.769 1.00 0.00 N ATOM 521 CA PRO A 34 -19.675 35.629 16.430 1.00 0.00 C ATOM 522 C PRO A 34 -18.314 35.670 15.742 1.00 0.00 C ATOM 523 O PRO A 34 -17.285 35.833 16.398 1.00 0.00 O ATOM 524 CB PRO A 34 -20.183 37.040 16.747 1.00 0.00 C ATOM 525 CG PRO A 34 -19.673 37.335 18.125 1.00 0.00 C ATOM 526 CD PRO A 34 -19.573 35.981 18.855 1.00 0.00 C ATOM 0 HA PRO A 34 -20.320 35.087 15.738 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -19.810 37.766 16.024 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -21.271 37.085 16.711 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -18.700 37.825 18.082 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -20.347 38.011 18.652 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -18.655 35.910 19.438 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -20.403 35.840 19.548 1.00 0.00 H new ATOM 534 N ARG A 35 -18.317 35.535 14.417 1.00 0.00 N ATOM 535 CA ARG A 35 -17.074 35.579 13.650 1.00 0.00 C ATOM 536 C ARG A 35 -17.205 36.579 12.519 1.00 0.00 C ATOM 537 O ARG A 35 -18.134 36.494 11.716 1.00 0.00 O ATOM 538 CB ARG A 35 -16.760 34.198 13.083 1.00 0.00 C ATOM 539 CG ARG A 35 -16.448 33.240 14.231 1.00 0.00 C ATOM 540 CD ARG A 35 -16.206 31.836 13.675 1.00 0.00 C ATOM 541 NE ARG A 35 -15.873 30.917 14.758 1.00 0.00 N ATOM 542 CZ ARG A 35 -15.674 29.625 14.523 1.00 0.00 C ATOM 543 NH1 ARG A 35 -15.781 29.159 13.310 1.00 0.00 N ATOM 544 NH2 ARG A 35 -15.371 28.823 15.508 1.00 0.00 N1+ ATOM 0 H ARG A 35 -19.158 35.396 13.857 1.00 0.00 H new ATOM 0 HA ARG A 35 -16.262 35.885 14.309 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -17.607 33.828 12.506 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -15.911 34.256 12.402 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -15.568 33.583 14.776 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -17.276 33.224 14.940 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -17.096 31.486 13.151 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -15.396 31.860 12.946 1.00 0.00 H new ATOM 0 HE ARG A 35 -15.792 31.272 15.711 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -16.018 29.787 12.542 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -15.628 28.167 13.130 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -15.287 29.189 16.456 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -15.218 27.831 15.329 1.00 0.00 H new ATOM 558 N PHE A 36 -16.269 37.528 12.445 1.00 0.00 N ATOM 559 CA PHE A 36 -16.306 38.530 11.383 1.00 0.00 C ATOM 560 C PHE A 36 -15.131 38.380 10.448 1.00 0.00 C ATOM 561 O PHE A 36 -14.024 38.777 10.772 1.00 0.00 O ATOM 562 CB PHE A 36 -16.228 39.918 11.999 1.00 0.00 C ATOM 563 CG PHE A 36 -17.386 40.104 12.916 1.00 0.00 C ATOM 564 CD1 PHE A 36 -18.585 40.569 12.400 1.00 0.00 C ATOM 565 CD2 PHE A 36 -17.264 39.815 14.273 1.00 0.00 C ATOM 566 CE1 PHE A 36 -19.682 40.759 13.240 1.00 0.00 C ATOM 567 CE2 PHE A 36 -18.353 40.000 15.120 1.00 0.00 C ATOM 568 CZ PHE A 36 -19.568 40.477 14.607 1.00 0.00 C ATOM 0 H PHE A 36 -15.490 37.622 13.096 1.00 0.00 H new ATOM 0 HA PHE A 36 -17.233 38.392 10.827 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -15.292 40.036 12.545 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -16.240 40.678 11.218 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -18.670 40.785 11.345 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -16.327 39.449 14.667 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -20.616 41.122 12.838 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -18.262 39.776 16.173 1.00 0.00 H new ATOM 0 HZ PHE A 36 -20.412 40.626 15.264 1.00 0.00 H new ATOM 578 N ARG A 37 -15.378 37.813 9.281 1.00 0.00 N ATOM 579 CA ARG A 37 -14.313 37.623 8.294 1.00 0.00 C ATOM 580 C ARG A 37 -14.435 38.658 7.183 1.00 0.00 C ATOM 581 O ARG A 37 -15.338 38.590 6.348 1.00 0.00 O ATOM 582 CB ARG A 37 -14.396 36.213 7.689 1.00 0.00 C ATOM 583 CG ARG A 37 -14.013 35.165 8.737 1.00 0.00 C ATOM 584 CD ARG A 37 -14.130 33.762 8.129 1.00 0.00 C ATOM 585 NE ARG A 37 -15.528 33.436 7.865 1.00 0.00 N ATOM 586 CZ ARG A 37 -15.873 32.270 7.327 1.00 0.00 C ATOM 587 NH1 ARG A 37 -14.955 31.392 7.025 1.00 0.00 N ATOM 588 NH2 ARG A 37 -17.130 32.002 7.102 1.00 0.00 N1+ ATOM 0 H ARG A 37 -16.295 37.476 8.989 1.00 0.00 H new ATOM 0 HA ARG A 37 -13.352 37.744 8.795 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -15.407 36.024 7.327 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -13.730 36.138 6.829 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -12.994 35.338 9.084 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -14.664 35.251 9.607 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -13.557 33.711 7.203 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -13.701 33.027 8.810 1.00 0.00 H new ATOM 0 HE ARG A 37 -16.253 34.115 8.097 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -13.972 31.600 7.202 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -15.221 30.498 6.612 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -17.848 32.687 7.339 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -17.395 31.108 6.689 1.00 0.00 H new ATOM 602 N CYS A 38 -13.527 39.627 7.183 1.00 0.00 N ATOM 603 CA CYS A 38 -13.540 40.683 6.173 1.00 0.00 C ATOM 604 C CYS A 38 -12.322 40.573 5.273 1.00 0.00 C ATOM 605 O CYS A 38 -11.189 40.509 5.748 1.00 0.00 O ATOM 606 CB CYS A 38 -13.541 42.054 6.844 1.00 0.00 C ATOM 607 SG CYS A 38 -13.543 43.345 5.577 1.00 0.00 S ATOM 0 H CYS A 38 -12.775 39.705 7.867 1.00 0.00 H new ATOM 0 HA CYS A 38 -14.443 40.568 5.573 1.00 0.00 H new ATOM 0 HB2 CYS A 38 -14.417 42.157 7.484 1.00 0.00 H new ATOM 0 HB3 CYS A 38 -12.665 42.158 7.484 1.00 0.00 H new ATOM 0 HG CYS A 38 -14.367 43.018 4.626 1.00 0.00 H new ATOM 613 N ASN A 39 -12.564 40.565 3.969 1.00 0.00 N ATOM 614 CA ASN A 39 -11.474 40.484 2.990 1.00 0.00 C ATOM 615 C ASN A 39 -11.265 41.838 2.330 1.00 0.00 C ATOM 616 O ASN A 39 -12.183 42.657 2.271 1.00 0.00 O ATOM 617 CB ASN A 39 -11.789 39.434 1.922 1.00 0.00 C ATOM 618 CG ASN A 39 -10.723 39.463 0.831 1.00 0.00 C ATOM 619 OD1 ASN A 39 -11.087 39.591 -0.416 1.00 0.00 O flip ATOM 620 ND2 ASN A 39 -9.531 39.376 1.123 1.00 0.00 N flip ATOM 0 H ASN A 39 -13.497 40.613 3.561 1.00 0.00 H new ATOM 0 HA ASN A 39 -10.563 40.192 3.512 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -11.830 38.444 2.375 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -12.770 39.627 1.488 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -9.251 39.276 2.099 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -8.823 39.404 0.389 1.00 0.00 H new ATOM 627 N VAL A 40 -10.055 42.076 1.825 1.00 0.00 N ATOM 628 CA VAL A 40 -9.745 43.345 1.159 1.00 0.00 C ATOM 629 C VAL A 40 -9.258 43.090 -0.260 1.00 0.00 C ATOM 630 O VAL A 40 -8.247 42.426 -0.472 1.00 0.00 O ATOM 631 CB VAL A 40 -8.662 44.091 1.944 1.00 0.00 C ATOM 632 CG1 VAL A 40 -7.407 43.216 2.069 1.00 0.00 C ATOM 633 CG2 VAL A 40 -8.305 45.393 1.217 1.00 0.00 C ATOM 0 H VAL A 40 -9.279 41.415 1.862 1.00 0.00 H new ATOM 0 HA VAL A 40 -10.650 43.951 1.121 1.00 0.00 H new ATOM 0 HB VAL A 40 -9.040 44.320 2.940 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -6.642 43.755 2.629 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -7.657 42.293 2.592 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -7.029 42.978 1.075 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -7.534 45.923 1.777 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -7.934 45.162 0.218 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -9.192 46.021 1.138 1.00 0.00 H new ATOM 643 N THR A 41 -9.981 43.636 -1.232 1.00 0.00 N ATOM 644 CA THR A 41 -9.610 43.472 -2.637 1.00 0.00 C ATOM 645 C THR A 41 -8.726 44.628 -3.085 1.00 0.00 C ATOM 646 O THR A 41 -9.139 45.789 -3.040 1.00 0.00 O ATOM 647 CB THR A 41 -10.861 43.427 -3.513 1.00 0.00 C ATOM 648 OG1 THR A 41 -11.713 42.384 -3.063 1.00 0.00 O ATOM 649 CG2 THR A 41 -10.463 43.173 -4.969 1.00 0.00 C ATOM 0 H THR A 41 -10.822 44.192 -1.077 1.00 0.00 H new ATOM 0 HA THR A 41 -9.063 42.535 -2.741 1.00 0.00 H new ATOM 0 HB THR A 41 -11.385 44.380 -3.446 1.00 0.00 H new ATOM 0 HG1 THR A 41 -12.517 42.354 -3.622 1.00 0.00 H new ATOM 0 HG21 THR A 41 -11.358 43.142 -5.591 1.00 0.00 H new ATOM 0 HG22 THR A 41 -9.810 43.975 -5.313 1.00 0.00 H new ATOM 0 HG23 THR A 41 -9.937 42.221 -5.042 1.00 0.00 H new ATOM 657 N PHE A 42 -7.502 44.307 -3.511 1.00 0.00 N ATOM 658 CA PHE A 42 -6.561 45.332 -3.958 1.00 0.00 C ATOM 659 C PHE A 42 -5.826 44.870 -5.218 1.00 0.00 C ATOM 660 O PHE A 42 -5.294 43.762 -5.263 1.00 0.00 O ATOM 661 CB PHE A 42 -5.544 45.622 -2.829 1.00 0.00 C ATOM 662 CG PHE A 42 -5.292 47.108 -2.734 1.00 0.00 C ATOM 663 CD1 PHE A 42 -6.336 47.941 -2.338 1.00 0.00 C ATOM 664 CD2 PHE A 42 -4.036 47.650 -3.039 1.00 0.00 C ATOM 665 CE1 PHE A 42 -6.134 49.315 -2.240 1.00 0.00 C ATOM 666 CE2 PHE A 42 -3.833 49.035 -2.939 1.00 0.00 C ATOM 667 CZ PHE A 42 -4.884 49.865 -2.542 1.00 0.00 C ATOM 0 H PHE A 42 -7.143 43.353 -3.555 1.00 0.00 H new ATOM 0 HA PHE A 42 -7.112 46.242 -4.195 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -5.925 45.247 -1.879 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -4.609 45.098 -3.026 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -7.303 47.520 -2.107 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -3.228 47.005 -3.350 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -6.945 49.958 -1.930 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -2.866 49.458 -3.169 1.00 0.00 H new ATOM 0 HZ PHE A 42 -4.731 50.932 -2.468 1.00 0.00 H new ATOM 677 N CYS A 43 -5.791 45.730 -6.230 1.00 0.00 N ATOM 678 CA CYS A 43 -5.106 45.406 -7.476 1.00 0.00 C ATOM 679 C CYS A 43 -5.386 43.962 -7.892 1.00 0.00 C ATOM 680 O CYS A 43 -4.539 43.306 -8.497 1.00 0.00 O ATOM 681 CB CYS A 43 -3.598 45.612 -7.308 1.00 0.00 C ATOM 682 SG CYS A 43 -3.296 47.215 -6.524 1.00 0.00 S ATOM 0 H CYS A 43 -6.227 46.652 -6.213 1.00 0.00 H new ATOM 0 HA CYS A 43 -5.480 46.069 -8.256 1.00 0.00 H new ATOM 0 HB2 CYS A 43 -3.176 44.812 -6.700 1.00 0.00 H new ATOM 0 HB3 CYS A 43 -3.103 45.570 -8.278 1.00 0.00 H new ATOM 0 HG CYS A 43 -3.632 47.155 -5.270 1.00 0.00 H new ATOM 688 N GLY A 44 -6.577 43.477 -7.561 1.00 0.00 N ATOM 689 CA GLY A 44 -6.956 42.111 -7.903 1.00 0.00 C ATOM 690 C GLY A 44 -6.336 41.109 -6.936 1.00 0.00 C ATOM 691 O GLY A 44 -6.004 39.987 -7.320 1.00 0.00 O ATOM 0 H GLY A 44 -7.292 44.004 -7.060 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -8.042 42.016 -7.883 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -6.635 41.885 -8.920 1.00 0.00 H new ATOM 695 N GLN A 45 -6.182 41.517 -5.677 1.00 0.00 N ATOM 696 CA GLN A 45 -5.601 40.646 -4.654 1.00 0.00 C ATOM 697 C GLN A 45 -6.456 40.670 -3.395 1.00 0.00 C ATOM 698 O GLN A 45 -6.898 41.732 -2.959 1.00 0.00 O ATOM 699 CB GLN A 45 -4.191 41.110 -4.317 1.00 0.00 C ATOM 700 CG GLN A 45 -3.327 41.086 -5.577 1.00 0.00 C ATOM 701 CD GLN A 45 -3.072 39.646 -6.006 1.00 0.00 C ATOM 702 OE1 GLN A 45 -1.924 39.091 -5.737 1.00 0.00 O flip ATOM 703 NE2 GLN A 45 -3.943 39.008 -6.599 1.00 0.00 N flip ATOM 0 H GLN A 45 -6.450 42.442 -5.341 1.00 0.00 H new ATOM 0 HA GLN A 45 -5.565 39.628 -5.043 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -4.219 42.118 -3.902 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -3.757 40.463 -3.554 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -3.824 41.631 -6.380 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -2.380 41.591 -5.388 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -4.841 39.444 -6.809 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -3.766 38.044 -6.880 1.00 0.00 H new ATOM 712 N THR A 46 -6.696 39.492 -2.819 1.00 0.00 N ATOM 713 CA THR A 46 -7.520 39.387 -1.613 1.00 0.00 C ATOM 714 C THR A 46 -6.695 38.948 -0.410 1.00 0.00 C ATOM 715 O THR A 46 -6.338 37.777 -0.282 1.00 0.00 O ATOM 716 CB THR A 46 -8.641 38.373 -1.849 1.00 0.00 C ATOM 717 OG1 THR A 46 -8.073 37.135 -2.252 1.00 0.00 O ATOM 718 CG2 THR A 46 -9.583 38.883 -2.941 1.00 0.00 C ATOM 0 H THR A 46 -6.335 38.603 -3.164 1.00 0.00 H new ATOM 0 HA THR A 46 -7.936 40.372 -1.402 1.00 0.00 H new ATOM 0 HB THR A 46 -9.206 38.237 -0.927 1.00 0.00 H new ATOM 0 HG1 THR A 46 -7.264 36.960 -1.728 1.00 0.00 H new ATOM 0 HG21 THR A 46 -10.379 38.156 -3.104 1.00 0.00 H new ATOM 0 HG22 THR A 46 -10.018 39.834 -2.632 1.00 0.00 H new ATOM 0 HG23 THR A 46 -9.025 39.023 -3.867 1.00 0.00 H new ATOM 726 N PHE A 47 -6.407 39.898 0.476 1.00 0.00 N ATOM 727 CA PHE A 47 -5.635 39.606 1.682 1.00 0.00 C ATOM 728 C PHE A 47 -6.573 39.322 2.848 1.00 0.00 C ATOM 729 O PHE A 47 -7.602 39.987 3.016 1.00 0.00 O ATOM 730 CB PHE A 47 -4.731 40.789 2.028 1.00 0.00 C ATOM 731 CG PHE A 47 -3.576 40.836 1.062 1.00 0.00 C ATOM 732 CD1 PHE A 47 -3.764 41.380 -0.209 1.00 0.00 C ATOM 733 CD2 PHE A 47 -2.317 40.358 1.442 1.00 0.00 C ATOM 734 CE1 PHE A 47 -2.692 41.446 -1.107 1.00 0.00 C ATOM 735 CE2 PHE A 47 -1.244 40.418 0.547 1.00 0.00 C ATOM 736 CZ PHE A 47 -1.432 40.965 -0.729 1.00 0.00 C ATOM 0 H PHE A 47 -6.695 40.872 0.383 1.00 0.00 H new ATOM 0 HA PHE A 47 -5.018 38.727 1.496 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -5.297 41.719 1.981 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -4.362 40.692 3.049 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -4.736 41.750 -0.500 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -2.174 39.942 2.428 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -2.836 41.868 -2.091 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -0.274 40.044 0.839 1.00 0.00 H new ATOM 0 HZ PHE A 47 -0.605 41.016 -1.422 1.00 0.00 H new ATOM 746 N GLN A 48 -6.214 38.319 3.643 1.00 0.00 N ATOM 747 CA GLN A 48 -7.022 37.928 4.793 1.00 0.00 C ATOM 748 C GLN A 48 -6.168 37.211 5.834 1.00 0.00 C ATOM 749 O GLN A 48 -5.171 36.572 5.499 1.00 0.00 O ATOM 750 CB GLN A 48 -8.164 37.012 4.342 1.00 0.00 C ATOM 751 CG GLN A 48 -7.605 35.824 3.550 1.00 0.00 C ATOM 752 CD GLN A 48 -6.992 34.802 4.500 1.00 0.00 C ATOM 753 OE1 GLN A 48 -7.598 34.452 5.512 1.00 0.00 O ATOM 754 NE2 GLN A 48 -5.817 34.299 4.232 1.00 0.00 N ATOM 0 H GLN A 48 -5.369 37.762 3.512 1.00 0.00 H new ATOM 0 HA GLN A 48 -7.437 38.829 5.244 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -8.717 36.653 5.210 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -8.867 37.571 3.725 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -8.400 35.359 2.967 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -6.852 36.171 2.842 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -5.317 34.591 3.392 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -5.400 33.614 4.862 1.00 0.00 H new ATOM 763 N SER A 49 -6.573 37.312 7.098 1.00 0.00 N ATOM 764 CA SER A 49 -5.844 36.658 8.183 1.00 0.00 C ATOM 765 C SER A 49 -6.318 35.216 8.351 1.00 0.00 C ATOM 766 O SER A 49 -7.371 34.836 7.837 1.00 0.00 O ATOM 767 CB SER A 49 -6.058 37.423 9.491 1.00 0.00 C ATOM 768 OG SER A 49 -7.283 37.010 10.082 1.00 0.00 O ATOM 0 H SER A 49 -7.396 37.836 7.395 1.00 0.00 H new ATOM 0 HA SER A 49 -4.783 36.655 7.934 1.00 0.00 H new ATOM 0 HB2 SER A 49 -5.230 37.236 10.175 1.00 0.00 H new ATOM 0 HB3 SER A 49 -6.077 38.496 9.299 1.00 0.00 H new ATOM 0 HG SER A 49 -7.582 37.688 10.723 1.00 0.00 H new ATOM 774 N SER A 50 -5.537 34.419 9.075 1.00 0.00 N ATOM 775 CA SER A 50 -5.883 33.017 9.310 1.00 0.00 C ATOM 776 C SER A 50 -6.717 32.878 10.580 1.00 0.00 C ATOM 777 O SER A 50 -7.159 31.781 10.928 1.00 0.00 O ATOM 778 CB SER A 50 -4.609 32.184 9.446 1.00 0.00 C ATOM 779 OG SER A 50 -3.923 32.564 10.631 1.00 0.00 O ATOM 0 H SER A 50 -4.663 34.717 9.508 1.00 0.00 H new ATOM 0 HA SER A 50 -6.466 32.658 8.462 1.00 0.00 H new ATOM 0 HB2 SER A 50 -4.857 31.123 9.480 1.00 0.00 H new ATOM 0 HB3 SER A 50 -3.968 32.334 8.577 1.00 0.00 H new ATOM 0 HG SER A 50 -3.106 32.030 10.722 1.00 0.00 H new ATOM 785 N GLU A 51 -6.929 33.999 11.268 1.00 0.00 N ATOM 786 CA GLU A 51 -7.713 34.006 12.505 1.00 0.00 C ATOM 787 C GLU A 51 -8.867 34.990 12.401 1.00 0.00 C ATOM 788 O GLU A 51 -8.706 36.116 11.928 1.00 0.00 O ATOM 789 CB GLU A 51 -6.825 34.383 13.692 1.00 0.00 C ATOM 790 CG GLU A 51 -7.637 34.293 14.988 1.00 0.00 C ATOM 791 CD GLU A 51 -6.740 34.580 16.187 1.00 0.00 C ATOM 792 OE1 GLU A 51 -5.532 34.550 16.017 1.00 0.00 O ATOM 793 OE2 GLU A 51 -7.273 34.825 17.256 1.00 0.00 O1- ATOM 0 H GLU A 51 -6.570 34.913 10.992 1.00 0.00 H new ATOM 0 HA GLU A 51 -8.115 33.005 12.659 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -5.965 33.715 13.742 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -6.437 35.393 13.563 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -8.461 35.006 14.961 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -8.078 33.301 15.082 1.00 0.00 H new ATOM 800 N PHE A 52 -10.034 34.548 12.850 1.00 0.00 N ATOM 801 CA PHE A 52 -11.232 35.380 12.815 1.00 0.00 C ATOM 802 C PHE A 52 -11.246 36.318 14.003 1.00 0.00 C ATOM 803 O PHE A 52 -10.838 35.963 15.107 1.00 0.00 O ATOM 804 CB PHE A 52 -12.512 34.514 12.823 1.00 0.00 C ATOM 805 CG PHE A 52 -12.155 33.118 13.225 1.00 0.00 C ATOM 806 CD1 PHE A 52 -11.414 32.345 12.346 1.00 0.00 C ATOM 807 CD2 PHE A 52 -12.553 32.607 14.457 1.00 0.00 C ATOM 808 CE1 PHE A 52 -11.061 31.034 12.688 1.00 0.00 C ATOM 809 CE2 PHE A 52 -12.206 31.294 14.814 1.00 0.00 C ATOM 810 CZ PHE A 52 -11.457 30.505 13.923 1.00 0.00 C ATOM 0 H PHE A 52 -10.178 33.618 13.243 1.00 0.00 H new ATOM 0 HA PHE A 52 -11.213 35.959 11.892 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -13.243 34.930 13.516 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -12.973 34.515 11.835 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -11.108 32.755 11.395 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -13.127 33.219 15.137 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -10.485 30.432 12.001 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -12.513 30.892 15.768 1.00 0.00 H new ATOM 0 HZ PHE A 52 -11.188 29.494 14.190 1.00 0.00 H new ATOM 820 N PHE A 53 -11.722 37.516 13.754 1.00 0.00 N ATOM 821 CA PHE A 53 -11.803 38.544 14.796 1.00 0.00 C ATOM 822 C PHE A 53 -13.209 38.591 15.416 1.00 0.00 C ATOM 823 O PHE A 53 -14.200 38.335 14.729 1.00 0.00 O ATOM 824 CB PHE A 53 -11.446 39.924 14.218 1.00 0.00 C ATOM 825 CG PHE A 53 -10.523 39.741 13.047 1.00 0.00 C ATOM 826 CD1 PHE A 53 -11.051 39.471 11.785 1.00 0.00 C ATOM 827 CD2 PHE A 53 -9.148 39.826 13.226 1.00 0.00 C ATOM 828 CE1 PHE A 53 -10.199 39.285 10.694 1.00 0.00 C ATOM 829 CE2 PHE A 53 -8.297 39.640 12.141 1.00 0.00 C ATOM 830 CZ PHE A 53 -8.818 39.370 10.872 1.00 0.00 C ATOM 0 H PHE A 53 -12.063 37.815 12.840 1.00 0.00 H new ATOM 0 HA PHE A 53 -11.087 38.285 15.576 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -12.350 40.447 13.906 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -10.969 40.539 14.981 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -12.121 39.406 11.651 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -8.741 40.036 14.204 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -10.608 39.076 9.716 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -7.228 39.705 12.280 1.00 0.00 H new ATOM 0 HZ PHE A 53 -8.154 39.228 10.032 1.00 0.00 H new ATOM 840 N PRO A 54 -13.316 38.916 16.689 1.00 0.00 N ATOM 841 CA PRO A 54 -14.631 38.992 17.398 1.00 0.00 C ATOM 842 C PRO A 54 -15.399 40.278 17.079 1.00 0.00 C ATOM 843 O PRO A 54 -16.528 40.456 17.533 1.00 0.00 O ATOM 844 CB PRO A 54 -14.240 38.934 18.880 1.00 0.00 C ATOM 845 CG PRO A 54 -12.881 39.552 18.944 1.00 0.00 C ATOM 846 CD PRO A 54 -12.200 39.245 17.601 1.00 0.00 C ATOM 0 HA PRO A 54 -15.305 38.191 17.095 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -14.952 39.481 19.498 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -14.224 37.907 19.245 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -12.951 40.627 19.107 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -12.306 39.141 19.774 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -11.631 40.101 17.239 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -11.502 38.413 17.691 1.00 0.00 H new ATOM 854 N THR A 55 -14.777 41.181 16.321 1.00 0.00 N ATOM 855 CA THR A 55 -15.413 42.456 15.974 1.00 0.00 C ATOM 856 C THR A 55 -15.315 42.724 14.479 1.00 0.00 C ATOM 857 O THR A 55 -14.402 42.244 13.806 1.00 0.00 O ATOM 858 CB THR A 55 -14.733 43.592 16.737 1.00 0.00 C ATOM 859 OG1 THR A 55 -14.722 43.291 18.124 1.00 0.00 O ATOM 860 CG2 THR A 55 -15.491 44.897 16.499 1.00 0.00 C ATOM 0 H THR A 55 -13.840 41.057 15.937 1.00 0.00 H new ATOM 0 HA THR A 55 -16.466 42.400 16.249 1.00 0.00 H new ATOM 0 HB THR A 55 -13.708 43.703 16.383 1.00 0.00 H new ATOM 0 HG1 THR A 55 -14.284 44.019 18.613 1.00 0.00 H new ATOM 0 HG21 THR A 55 -15.004 45.705 17.044 1.00 0.00 H new ATOM 0 HG22 THR A 55 -15.493 45.128 15.434 1.00 0.00 H new ATOM 0 HG23 THR A 55 -16.518 44.790 16.849 1.00 0.00 H new ATOM 868 N LEU A 56 -16.282 43.476 13.961 1.00 0.00 N ATOM 869 CA LEU A 56 -16.313 43.779 12.534 1.00 0.00 C ATOM 870 C LEU A 56 -15.127 44.655 12.124 1.00 0.00 C ATOM 871 O LEU A 56 -14.314 44.251 11.294 1.00 0.00 O ATOM 872 CB LEU A 56 -17.629 44.482 12.185 1.00 0.00 C ATOM 873 CG LEU A 56 -18.091 44.039 10.797 1.00 0.00 C ATOM 874 CD1 LEU A 56 -19.397 44.731 10.462 1.00 0.00 C ATOM 875 CD2 LEU A 56 -17.026 44.395 9.750 1.00 0.00 C ATOM 0 H LEU A 56 -17.046 43.883 14.501 1.00 0.00 H new ATOM 0 HA LEU A 56 -16.242 42.840 11.984 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -18.390 44.241 12.927 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -17.493 45.563 12.207 1.00 0.00 H new ATOM 0 HG LEU A 56 -18.239 42.959 10.791 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -19.731 44.418 9.473 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -20.151 44.462 11.201 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -19.249 45.811 10.471 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -17.364 44.076 8.764 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -16.865 45.473 9.747 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -16.092 43.889 9.995 1.00 0.00 H new ATOM 887 N LYS A 57 -15.046 45.865 12.682 1.00 0.00 N ATOM 888 CA LYS A 57 -13.981 46.790 12.334 1.00 0.00 C ATOM 889 C LYS A 57 -12.626 46.123 12.487 1.00 0.00 C ATOM 890 O LYS A 57 -11.691 46.417 11.744 1.00 0.00 O ATOM 891 CB LYS A 57 -14.058 48.009 13.262 1.00 0.00 C ATOM 892 CG LYS A 57 -15.360 48.780 13.007 1.00 0.00 C ATOM 893 CD LYS A 57 -15.456 49.955 13.986 1.00 0.00 C ATOM 894 CE LYS A 57 -16.774 50.706 13.769 1.00 0.00 C ATOM 895 NZ LYS A 57 -16.732 51.412 12.455 1.00 0.00 N1+ ATOM 0 H LYS A 57 -15.706 46.220 13.374 1.00 0.00 H new ATOM 0 HA LYS A 57 -14.101 47.099 11.296 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -14.014 47.688 14.303 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -13.201 48.660 13.093 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -15.384 49.145 11.980 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -16.217 48.118 13.130 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -15.399 49.591 15.012 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -14.614 50.631 13.840 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -17.611 50.008 13.793 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -16.934 51.423 14.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -17.507 52.103 12.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -15.822 51.905 12.355 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -16.838 50.720 11.686 1.00 0.00 H new ATOM 909 N SER A 58 -12.528 45.221 13.443 1.00 0.00 N ATOM 910 CA SER A 58 -11.281 44.519 13.666 1.00 0.00 C ATOM 911 C SER A 58 -10.881 43.771 12.397 1.00 0.00 C ATOM 912 O SER A 58 -9.702 43.709 12.047 1.00 0.00 O ATOM 913 CB SER A 58 -11.425 43.535 14.824 1.00 0.00 C ATOM 914 OG SER A 58 -10.270 42.710 14.879 1.00 0.00 O ATOM 0 H SER A 58 -13.288 44.959 14.071 1.00 0.00 H new ATOM 0 HA SER A 58 -10.508 45.244 13.919 1.00 0.00 H new ATOM 0 HB2 SER A 58 -11.547 44.075 15.763 1.00 0.00 H new ATOM 0 HB3 SER A 58 -12.318 42.924 14.690 1.00 0.00 H new ATOM 0 HG SER A 58 -10.105 42.439 15.806 1.00 0.00 H new ATOM 920 N ALA A 59 -11.870 43.206 11.712 1.00 0.00 N ATOM 921 CA ALA A 59 -11.609 42.470 10.480 1.00 0.00 C ATOM 922 C ALA A 59 -11.173 43.411 9.358 1.00 0.00 C ATOM 923 O ALA A 59 -10.172 43.166 8.685 1.00 0.00 O ATOM 924 CB ALA A 59 -12.862 41.697 10.066 1.00 0.00 C ATOM 0 H ALA A 59 -12.852 43.243 11.986 1.00 0.00 H new ATOM 0 HA ALA A 59 -10.795 41.768 10.663 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -12.663 41.148 9.145 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -13.134 40.996 10.855 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -13.683 42.395 9.902 1.00 0.00 H new ATOM 930 N GLU A 60 -11.918 44.494 9.175 1.00 0.00 N ATOM 931 CA GLU A 60 -11.585 45.479 8.147 1.00 0.00 C ATOM 932 C GLU A 60 -10.210 46.069 8.428 1.00 0.00 C ATOM 933 O GLU A 60 -9.416 46.283 7.512 1.00 0.00 O ATOM 934 CB GLU A 60 -12.638 46.590 8.150 1.00 0.00 C ATOM 935 CG GLU A 60 -13.974 46.032 7.653 1.00 0.00 C ATOM 936 CD GLU A 60 -15.073 47.075 7.818 1.00 0.00 C ATOM 937 OE1 GLU A 60 -14.765 48.164 8.273 1.00 0.00 O ATOM 938 OE2 GLU A 60 -16.206 46.768 7.487 1.00 0.00 O1- ATOM 0 H GLU A 60 -12.752 44.714 9.720 1.00 0.00 H new ATOM 0 HA GLU A 60 -11.571 44.996 7.170 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -12.753 46.994 9.156 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -12.316 47.412 7.511 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -13.889 45.745 6.605 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -14.230 45.131 8.211 1.00 0.00 H new ATOM 945 N HIS A 61 -9.936 46.329 9.701 1.00 0.00 N ATOM 946 CA HIS A 61 -8.651 46.891 10.090 1.00 0.00 C ATOM 947 C HIS A 61 -7.537 45.871 9.889 1.00 0.00 C ATOM 948 O HIS A 61 -6.494 46.189 9.322 1.00 0.00 O ATOM 949 CB HIS A 61 -8.687 47.309 11.559 1.00 0.00 C ATOM 950 CG HIS A 61 -9.717 48.387 11.742 1.00 0.00 C ATOM 951 ND1 HIS A 61 -9.857 49.085 12.931 1.00 0.00 N ATOM 952 CD2 HIS A 61 -10.679 48.882 10.899 1.00 0.00 C ATOM 953 CE1 HIS A 61 -10.870 49.955 12.771 1.00 0.00 C ATOM 954 NE2 HIS A 61 -11.407 49.871 11.550 1.00 0.00 N ATOM 0 H HIS A 61 -10.580 46.161 10.474 1.00 0.00 H new ATOM 0 HA HIS A 61 -8.456 47.762 9.464 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -8.926 46.451 12.188 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -7.707 47.670 11.871 1.00 0.00 H new ATOM 0 HD1 HIS A 61 -9.295 48.962 13.773 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -10.846 48.553 9.884 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -11.208 50.638 13.536 1.00 0.00 H new ATOM 962 N ALA A 62 -7.765 44.648 10.357 1.00 0.00 N ATOM 963 CA ALA A 62 -6.767 43.593 10.228 1.00 0.00 C ATOM 964 C ALA A 62 -6.491 43.288 8.760 1.00 0.00 C ATOM 965 O ALA A 62 -5.347 43.067 8.368 1.00 0.00 O ATOM 966 CB ALA A 62 -7.252 42.324 10.933 1.00 0.00 C ATOM 0 H ALA A 62 -8.626 44.365 10.826 1.00 0.00 H new ATOM 0 HA ALA A 62 -5.844 43.937 10.694 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -6.500 41.541 10.831 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -7.416 42.535 11.990 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -8.186 41.991 10.481 1.00 0.00 H new ATOM 972 N ALA A 63 -7.544 43.279 7.954 1.00 0.00 N ATOM 973 CA ALA A 63 -7.391 42.998 6.530 1.00 0.00 C ATOM 974 C ALA A 63 -6.496 44.040 5.873 1.00 0.00 C ATOM 975 O ALA A 63 -5.515 43.695 5.214 1.00 0.00 O ATOM 976 CB ALA A 63 -8.763 43.002 5.856 1.00 0.00 C ATOM 0 H ALA A 63 -8.502 43.460 8.255 1.00 0.00 H new ATOM 0 HA ALA A 63 -6.929 42.018 6.415 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -8.647 42.792 4.793 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -9.394 42.238 6.310 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -9.228 43.979 5.984 1.00 0.00 H new ATOM 982 N ALA A 64 -6.827 45.314 6.057 1.00 0.00 N ATOM 983 CA ALA A 64 -6.031 46.387 5.476 1.00 0.00 C ATOM 984 C ALA A 64 -4.655 46.436 6.136 1.00 0.00 C ATOM 985 O ALA A 64 -3.653 46.688 5.477 1.00 0.00 O ATOM 986 CB ALA A 64 -6.755 47.726 5.658 1.00 0.00 C ATOM 0 H ALA A 64 -7.633 45.626 6.599 1.00 0.00 H new ATOM 0 HA ALA A 64 -5.899 46.197 4.411 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -6.156 48.526 5.222 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -7.724 47.686 5.161 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -6.900 47.920 6.721 1.00 0.00 H new ATOM 992 N LYS A 65 -4.618 46.191 7.443 1.00 0.00 N ATOM 993 CA LYS A 65 -3.356 46.208 8.179 1.00 0.00 C ATOM 994 C LYS A 65 -2.355 45.265 7.521 1.00 0.00 C ATOM 995 O LYS A 65 -1.167 45.569 7.421 1.00 0.00 O ATOM 996 CB LYS A 65 -3.586 45.782 9.630 1.00 0.00 C ATOM 997 CG LYS A 65 -2.281 45.911 10.417 1.00 0.00 C ATOM 998 CD LYS A 65 -2.532 45.540 11.878 1.00 0.00 C ATOM 999 CE LYS A 65 -1.234 45.681 12.670 1.00 0.00 C ATOM 1000 NZ LYS A 65 -1.479 45.322 14.093 1.00 0.00 N1+ ATOM 0 H LYS A 65 -5.439 45.980 8.011 1.00 0.00 H new ATOM 0 HA LYS A 65 -2.957 47.222 8.164 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -4.359 46.403 10.084 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -3.943 44.753 9.665 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -1.520 45.258 9.990 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -1.901 46.931 10.349 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -3.301 46.186 12.301 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -2.903 44.517 11.946 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -0.466 45.033 12.248 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -0.862 46.703 12.601 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -0.595 45.418 14.632 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -2.199 45.957 14.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -1.814 44.339 14.150 1.00 0.00 H new ATOM 1014 N ILE A 66 -2.837 44.117 7.068 1.00 0.00 N ATOM 1015 CA ILE A 66 -1.976 43.151 6.403 1.00 0.00 C ATOM 1016 C ILE A 66 -1.514 43.682 5.044 1.00 0.00 C ATOM 1017 O ILE A 66 -0.369 43.480 4.642 1.00 0.00 O ATOM 1018 CB ILE A 66 -2.718 41.820 6.227 1.00 0.00 C ATOM 1019 CG1 ILE A 66 -2.925 41.176 7.596 1.00 0.00 C ATOM 1020 CG2 ILE A 66 -1.898 40.878 5.350 1.00 0.00 C ATOM 1021 CD1 ILE A 66 -3.906 40.012 7.468 1.00 0.00 C ATOM 0 H ILE A 66 -3.813 43.833 7.148 1.00 0.00 H new ATOM 0 HA ILE A 66 -1.095 42.988 7.024 1.00 0.00 H new ATOM 0 HB ILE A 66 -3.681 42.006 5.752 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -1.973 40.821 7.991 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -3.308 41.913 8.302 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -2.432 39.935 5.230 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -1.743 41.334 4.372 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -0.933 40.691 5.820 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -4.054 39.552 8.445 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -4.860 40.380 7.092 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -3.504 39.272 6.776 1.00 0.00 H new ATOM 1033 N ALA A 67 -2.427 44.338 4.335 1.00 0.00 N ATOM 1034 CA ALA A 67 -2.132 44.862 3.005 1.00 0.00 C ATOM 1035 C ALA A 67 -1.192 46.060 3.060 1.00 0.00 C ATOM 1036 O ALA A 67 -0.171 46.085 2.383 1.00 0.00 O ATOM 1037 CB ALA A 67 -3.431 45.271 2.310 1.00 0.00 C ATOM 0 H ALA A 67 -3.377 44.520 4.659 1.00 0.00 H new ATOM 0 HA ALA A 67 -1.636 44.070 2.443 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -3.205 45.661 1.318 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -4.084 44.403 2.219 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -3.931 46.041 2.898 1.00 0.00 H new ATOM 1043 N VAL A 68 -1.548 47.045 3.869 1.00 0.00 N ATOM 1044 CA VAL A 68 -0.738 48.248 3.991 1.00 0.00 C ATOM 1045 C VAL A 68 0.690 47.888 4.392 1.00 0.00 C ATOM 1046 O VAL A 68 1.660 48.452 3.868 1.00 0.00 O ATOM 1047 CB VAL A 68 -1.352 49.182 5.039 1.00 0.00 C ATOM 1048 CG1 VAL A 68 -1.293 48.515 6.409 1.00 0.00 C ATOM 1049 CG2 VAL A 68 -0.571 50.496 5.080 1.00 0.00 C ATOM 0 H VAL A 68 -2.388 47.037 4.448 1.00 0.00 H new ATOM 0 HA VAL A 68 -0.714 48.754 3.026 1.00 0.00 H new ATOM 0 HB VAL A 68 -2.390 49.387 4.776 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -1.729 49.178 7.156 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -1.853 47.580 6.383 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -0.255 48.309 6.669 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -1.011 51.157 5.826 1.00 0.00 H new ATOM 0 HG22 VAL A 68 0.468 50.294 5.341 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -0.613 50.975 4.102 1.00 0.00 H new ATOM 1059 N ALA A 69 0.820 46.935 5.311 1.00 0.00 N ATOM 1060 CA ALA A 69 2.138 46.513 5.758 1.00 0.00 C ATOM 1061 C ALA A 69 2.850 45.734 4.658 1.00 0.00 C ATOM 1062 O ALA A 69 4.072 45.616 4.664 1.00 0.00 O ATOM 1063 CB ALA A 69 2.017 45.646 7.012 1.00 0.00 C ATOM 0 H ALA A 69 0.040 46.449 5.753 1.00 0.00 H new ATOM 0 HA ALA A 69 2.723 47.402 5.994 1.00 0.00 H new ATOM 0 HB1 ALA A 69 3.010 45.336 7.337 1.00 0.00 H new ATOM 0 HB2 ALA A 69 1.538 46.219 7.806 1.00 0.00 H new ATOM 0 HB3 ALA A 69 1.417 44.764 6.788 1.00 0.00 H new ATOM 1069 N SER A 70 2.075 45.207 3.718 1.00 0.00 N ATOM 1070 CA SER A 70 2.643 44.447 2.607 1.00 0.00 C ATOM 1071 C SER A 70 3.102 45.388 1.502 1.00 0.00 C ATOM 1072 O SER A 70 4.050 45.094 0.775 1.00 0.00 O ATOM 1073 CB SER A 70 1.603 43.475 2.052 1.00 0.00 C ATOM 1074 OG SER A 70 2.214 42.643 1.076 1.00 0.00 O ATOM 0 H SER A 70 1.059 45.290 3.701 1.00 0.00 H new ATOM 0 HA SER A 70 3.502 43.885 2.975 1.00 0.00 H new ATOM 0 HB2 SER A 70 1.189 42.868 2.857 1.00 0.00 H new ATOM 0 HB3 SER A 70 0.773 44.026 1.609 1.00 0.00 H new ATOM 0 HG SER A 70 1.550 42.017 0.718 1.00 0.00 H new ATOM 1080 N LEU A 71 2.414 46.518 1.376 1.00 0.00 N ATOM 1081 CA LEU A 71 2.756 47.495 0.350 1.00 0.00 C ATOM 1082 C LEU A 71 4.114 48.103 0.618 1.00 0.00 C ATOM 1083 O LEU A 71 4.824 48.463 -0.316 1.00 0.00 O ATOM 1084 CB LEU A 71 1.703 48.603 0.291 1.00 0.00 C ATOM 1085 CG LEU A 71 0.373 48.032 -0.213 1.00 0.00 C ATOM 1086 CD1 LEU A 71 -0.709 49.111 -0.123 1.00 0.00 C ATOM 1087 CD2 LEU A 71 0.518 47.548 -1.667 1.00 0.00 C ATOM 0 H LEU A 71 1.624 46.778 1.966 1.00 0.00 H new ATOM 0 HA LEU A 71 2.784 46.976 -0.608 1.00 0.00 H new ATOM 0 HB2 LEU A 71 1.569 49.042 1.280 1.00 0.00 H new ATOM 0 HB3 LEU A 71 2.040 49.402 -0.370 1.00 0.00 H new ATOM 0 HG LEU A 71 0.089 47.182 0.407 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -1.656 48.707 -0.481 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -0.819 49.430 0.913 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -0.423 49.965 -0.737 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -0.434 47.145 -2.013 1.00 0.00 H new ATOM 0 HD22 LEU A 71 0.810 48.385 -2.302 1.00 0.00 H new ATOM 0 HD23 LEU A 71 1.281 46.771 -1.718 1.00 0.00 H new ATOM 1099 N THR A 72 4.464 48.196 1.899 1.00 0.00 N ATOM 1100 CA THR A 72 5.756 48.756 2.315 1.00 0.00 C ATOM 1101 C THR A 72 6.243 49.821 1.322 1.00 0.00 C ATOM 1102 O THR A 72 6.756 49.489 0.252 1.00 0.00 O ATOM 1103 CB THR A 72 6.807 47.647 2.425 1.00 0.00 C ATOM 1104 OG1 THR A 72 7.046 47.080 1.143 1.00 0.00 O ATOM 1105 CG2 THR A 72 6.306 46.569 3.384 1.00 0.00 C ATOM 0 H THR A 72 3.872 47.891 2.672 1.00 0.00 H new ATOM 0 HA THR A 72 5.616 49.224 3.290 1.00 0.00 H new ATOM 0 HB THR A 72 7.739 48.066 2.805 1.00 0.00 H new ATOM 0 HG1 THR A 72 6.992 47.781 0.460 1.00 0.00 H new ATOM 0 HG21 THR A 72 7.052 45.778 3.464 1.00 0.00 H new ATOM 0 HG22 THR A 72 6.135 47.008 4.367 1.00 0.00 H new ATOM 0 HG23 THR A 72 5.373 46.151 3.006 1.00 0.00 H new ATOM 1113 N PRO A 73 6.093 51.084 1.632 1.00 0.00 N ATOM 1114 CA PRO A 73 6.512 52.177 0.707 1.00 0.00 C ATOM 1115 C PRO A 73 7.896 51.932 0.107 1.00 0.00 C ATOM 1116 O PRO A 73 8.822 51.500 0.795 1.00 0.00 O ATOM 1117 CB PRO A 73 6.505 53.425 1.600 1.00 0.00 C ATOM 1118 CG PRO A 73 5.504 53.135 2.673 1.00 0.00 C ATOM 1119 CD PRO A 73 5.519 51.617 2.882 1.00 0.00 C ATOM 0 HA PRO A 73 5.851 52.262 -0.156 1.00 0.00 H new ATOM 0 HB2 PRO A 73 7.492 53.612 2.023 1.00 0.00 H new ATOM 0 HB3 PRO A 73 6.228 54.313 1.033 1.00 0.00 H new ATOM 0 HG2 PRO A 73 5.761 53.656 3.595 1.00 0.00 H new ATOM 0 HG3 PRO A 73 4.511 53.477 2.380 1.00 0.00 H new ATOM 0 HD2 PRO A 73 6.122 51.340 3.747 1.00 0.00 H new ATOM 0 HD3 PRO A 73 4.515 51.229 3.056 1.00 0.00 H new ATOM 1127 N GLN A 74 8.020 52.202 -1.195 1.00 0.00 N ATOM 1128 CA GLN A 74 9.284 51.999 -1.909 1.00 0.00 C ATOM 1129 C GLN A 74 9.891 53.333 -2.334 1.00 0.00 C ATOM 1130 O GLN A 74 11.097 53.427 -2.566 1.00 0.00 O ATOM 1131 CB GLN A 74 9.053 51.122 -3.145 1.00 0.00 C ATOM 1132 CG GLN A 74 10.396 50.617 -3.684 1.00 0.00 C ATOM 1133 CD GLN A 74 11.014 49.627 -2.700 1.00 0.00 C ATOM 1134 OE1 GLN A 74 10.307 48.789 -2.139 1.00 0.00 O ATOM 1135 NE2 GLN A 74 12.294 49.673 -2.455 1.00 0.00 N ATOM 0 H GLN A 74 7.262 52.561 -1.776 1.00 0.00 H new ATOM 0 HA GLN A 74 9.979 51.501 -1.233 1.00 0.00 H new ATOM 0 HB2 GLN A 74 8.413 50.278 -2.888 1.00 0.00 H new ATOM 0 HB3 GLN A 74 8.534 51.693 -3.915 1.00 0.00 H new ATOM 0 HG2 GLN A 74 10.252 50.138 -4.652 1.00 0.00 H new ATOM 0 HG3 GLN A 74 11.073 51.457 -3.841 1.00 0.00 H new ATOM 0 HE21 GLN A 74 12.878 50.368 -2.921 1.00 0.00 H new ATOM 0 HE22 GLN A 74 12.711 49.014 -1.798 1.00 0.00 H new ATOM 1144 N SER A 75 9.061 54.365 -2.420 1.00 0.00 N ATOM 1145 CA SER A 75 9.544 55.685 -2.807 1.00 0.00 C ATOM 1146 C SER A 75 10.544 56.217 -1.776 1.00 0.00 C ATOM 1147 O SER A 75 11.622 56.691 -2.138 1.00 0.00 O ATOM 1148 CB SER A 75 8.353 56.654 -2.938 1.00 0.00 C ATOM 1149 OG SER A 75 8.527 57.759 -2.058 1.00 0.00 O ATOM 0 H SER A 75 8.060 54.315 -2.229 1.00 0.00 H new ATOM 0 HA SER A 75 10.052 55.605 -3.768 1.00 0.00 H new ATOM 0 HB2 SER A 75 8.271 57.006 -3.966 1.00 0.00 H new ATOM 0 HB3 SER A 75 7.423 56.135 -2.704 1.00 0.00 H new ATOM 0 HG SER A 75 7.767 58.372 -2.148 1.00 0.00 H new ATOM 1155 N PRO A 76 10.204 56.161 -0.509 1.00 0.00 N ATOM 1156 CA PRO A 76 11.086 56.664 0.579 1.00 0.00 C ATOM 1157 C PRO A 76 12.157 55.651 0.968 1.00 0.00 C ATOM 1158 O PRO A 76 12.063 54.470 0.634 1.00 0.00 O ATOM 1159 CB PRO A 76 10.107 56.926 1.726 1.00 0.00 C ATOM 1160 CG PRO A 76 9.019 55.915 1.541 1.00 0.00 C ATOM 1161 CD PRO A 76 8.952 55.601 0.031 1.00 0.00 C ATOM 0 HA PRO A 76 11.651 57.550 0.288 1.00 0.00 H new ATOM 0 HB2 PRO A 76 10.593 56.811 2.695 1.00 0.00 H new ATOM 0 HB3 PRO A 76 9.714 57.942 1.686 1.00 0.00 H new ATOM 0 HG2 PRO A 76 9.229 55.012 2.114 1.00 0.00 H new ATOM 0 HG3 PRO A 76 8.065 56.304 1.897 1.00 0.00 H new ATOM 0 HD2 PRO A 76 8.884 54.528 -0.150 1.00 0.00 H new ATOM 0 HD3 PRO A 76 8.078 56.058 -0.433 1.00 0.00 H new ATOM 1169 N GLU A 77 13.178 56.126 1.674 1.00 0.00 N ATOM 1170 CA GLU A 77 14.273 55.263 2.112 1.00 0.00 C ATOM 1171 C GLU A 77 14.833 55.747 3.441 1.00 0.00 C ATOM 1172 O GLU A 77 15.653 55.072 4.063 1.00 0.00 O ATOM 1173 CB GLU A 77 15.389 55.251 1.064 1.00 0.00 C ATOM 1174 CG GLU A 77 14.935 54.464 -0.168 1.00 0.00 C ATOM 1175 CD GLU A 77 16.053 54.434 -1.205 1.00 0.00 C ATOM 1176 OE1 GLU A 77 17.123 54.938 -0.908 1.00 0.00 O ATOM 1177 OE2 GLU A 77 15.819 53.908 -2.281 1.00 0.00 O1- ATOM 0 H GLU A 77 13.271 57.102 1.955 1.00 0.00 H new ATOM 0 HA GLU A 77 13.883 54.253 2.236 1.00 0.00 H new ATOM 0 HB2 GLU A 77 15.645 56.272 0.781 1.00 0.00 H new ATOM 0 HB3 GLU A 77 16.289 54.801 1.483 1.00 0.00 H new ATOM 0 HG2 GLU A 77 14.665 53.447 0.118 1.00 0.00 H new ATOM 0 HG3 GLU A 77 14.043 54.923 -0.595 1.00 0.00 H new ATOM 1184 N GLY A 78 14.385 56.917 3.873 1.00 0.00 N ATOM 1185 CA GLY A 78 14.851 57.474 5.133 1.00 0.00 C ATOM 1186 C GLY A 78 14.433 56.594 6.301 1.00 0.00 C ATOM 1187 O GLY A 78 15.025 55.538 6.531 1.00 0.00 O ATOM 0 H GLY A 78 13.706 57.493 3.375 1.00 0.00 H new ATOM 0 HA2 GLY A 78 15.937 57.569 5.114 1.00 0.00 H new ATOM 0 HA3 GLY A 78 14.445 58.477 5.264 1.00 0.00 H new ATOM 1191 N ILE A 79 13.412 57.039 7.040 1.00 0.00 N ATOM 1192 CA ILE A 79 12.911 56.299 8.197 1.00 0.00 C ATOM 1193 C ILE A 79 14.042 55.551 8.896 1.00 0.00 C ATOM 1194 O ILE A 79 14.221 54.350 8.729 1.00 0.00 O ATOM 1195 CB ILE A 79 11.795 55.335 7.765 1.00 0.00 C ATOM 1196 CG1 ILE A 79 11.384 54.417 8.934 1.00 0.00 C ATOM 1197 CG2 ILE A 79 12.257 54.490 6.568 1.00 0.00 C ATOM 1198 CD1 ILE A 79 11.127 55.255 10.194 1.00 0.00 C ATOM 0 H ILE A 79 12.917 57.911 6.855 1.00 0.00 H new ATOM 0 HA ILE A 79 12.495 57.010 8.911 1.00 0.00 H new ATOM 0 HB ILE A 79 10.928 55.925 7.469 1.00 0.00 H new ATOM 0 HG12 ILE A 79 10.486 53.858 8.670 1.00 0.00 H new ATOM 0 HG13 ILE A 79 12.170 53.686 9.127 1.00 0.00 H new ATOM 0 HG21 ILE A 79 11.457 53.811 6.272 1.00 0.00 H new ATOM 0 HG22 ILE A 79 12.504 55.146 5.733 1.00 0.00 H new ATOM 0 HG23 ILE A 79 13.138 53.912 6.849 1.00 0.00 H new ATOM 0 HD11 ILE A 79 10.837 54.599 11.015 1.00 0.00 H new ATOM 0 HD12 ILE A 79 12.035 55.794 10.464 1.00 0.00 H new ATOM 0 HD13 ILE A 79 10.326 55.968 10.000 1.00 0.00 H new ATOM 1210 N ASP A 80 14.830 56.276 9.668 1.00 0.00 N ATOM 1211 CA ASP A 80 15.938 55.649 10.358 1.00 0.00 C ATOM 1212 C ASP A 80 16.432 56.506 11.508 1.00 0.00 C ATOM 1213 O ASP A 80 17.636 56.577 11.740 1.00 0.00 O ATOM 1214 CB ASP A 80 17.078 55.375 9.381 1.00 0.00 C ATOM 1215 CG ASP A 80 17.567 56.683 8.775 1.00 0.00 C ATOM 1216 OD1 ASP A 80 16.957 57.702 9.048 1.00 0.00 O ATOM 1217 OD2 ASP A 80 18.546 56.646 8.047 1.00 0.00 O1- ATOM 0 H ASP A 80 14.727 57.278 9.830 1.00 0.00 H new ATOM 0 HA ASP A 80 15.583 54.705 10.772 1.00 0.00 H new ATOM 0 HB2 ASP A 80 17.898 54.874 9.896 1.00 0.00 H new ATOM 0 HB3 ASP A 80 16.739 54.703 8.592 1.00 0.00 H new ATOM 1222 N VAL A 81 15.501 57.144 12.224 1.00 0.00 N ATOM 1223 CA VAL A 81 15.853 57.962 13.363 1.00 0.00 C ATOM 1224 C VAL A 81 16.263 59.337 12.887 1.00 0.00 C ATOM 1225 O VAL A 81 16.765 60.149 13.661 1.00 0.00 O ATOM 1226 CB VAL A 81 16.972 57.290 14.199 1.00 0.00 C ATOM 1227 CG1 VAL A 81 16.980 57.876 15.616 1.00 0.00 C ATOM 1228 CG2 VAL A 81 16.739 55.751 14.275 1.00 0.00 C ATOM 0 H VAL A 81 14.501 57.103 12.026 1.00 0.00 H new ATOM 0 HA VAL A 81 14.986 58.066 14.015 1.00 0.00 H new ATOM 0 HB VAL A 81 17.932 57.480 13.719 1.00 0.00 H new ATOM 0 HG11 VAL A 81 17.768 57.402 16.201 1.00 0.00 H new ATOM 0 HG12 VAL A 81 17.162 58.949 15.565 1.00 0.00 H new ATOM 0 HG13 VAL A 81 16.016 57.694 16.090 1.00 0.00 H new ATOM 0 HG21 VAL A 81 17.532 55.292 14.865 1.00 0.00 H new ATOM 0 HG22 VAL A 81 15.776 55.552 14.744 1.00 0.00 H new ATOM 0 HG23 VAL A 81 16.746 55.332 13.269 1.00 0.00 H new ATOM 1238 N ALA A 82 16.003 59.616 11.603 1.00 0.00 N ATOM 1239 CA ALA A 82 16.298 60.913 11.053 1.00 0.00 C ATOM 1240 C ALA A 82 15.103 61.448 10.296 1.00 0.00 C ATOM 1241 O ALA A 82 15.047 61.426 9.067 1.00 0.00 O ATOM 1242 CB ALA A 82 17.490 60.800 10.112 1.00 0.00 C ATOM 0 H ALA A 82 15.592 58.956 10.943 1.00 0.00 H new ATOM 0 HA ALA A 82 16.533 61.600 11.866 1.00 0.00 H new ATOM 0 HB1 ALA A 82 17.717 61.780 9.693 1.00 0.00 H new ATOM 0 HB2 ALA A 82 18.355 60.432 10.663 1.00 0.00 H new ATOM 0 HB3 ALA A 82 17.252 60.107 9.305 1.00 0.00 H new ATOM 1248 N TYR A 83 14.194 62.006 11.070 1.00 0.00 N ATOM 1249 CA TYR A 83 13.002 62.665 10.526 1.00 0.00 C ATOM 1250 C TYR A 83 13.423 63.612 9.418 1.00 0.00 C ATOM 1251 O TYR A 83 12.607 64.067 8.617 1.00 0.00 O ATOM 1252 CB TYR A 83 12.262 63.440 11.624 1.00 0.00 C ATOM 1253 CG TYR A 83 12.216 62.618 12.900 1.00 0.00 C ATOM 1254 CD1 TYR A 83 11.828 61.271 12.862 1.00 0.00 C ATOM 1255 CD2 TYR A 83 12.567 63.207 14.124 1.00 0.00 C ATOM 1256 CE1 TYR A 83 11.794 60.519 14.042 1.00 0.00 C ATOM 1257 CE2 TYR A 83 12.533 62.451 15.303 1.00 0.00 C ATOM 1258 CZ TYR A 83 12.146 61.109 15.261 1.00 0.00 C ATOM 1259 OH TYR A 83 12.113 60.362 16.422 1.00 0.00 O ATOM 0 H TYR A 83 14.251 62.021 12.088 1.00 0.00 H new ATOM 0 HA TYR A 83 12.325 61.908 10.129 1.00 0.00 H new ATOM 0 HB2 TYR A 83 12.764 64.389 11.811 1.00 0.00 H new ATOM 0 HB3 TYR A 83 11.249 63.674 11.296 1.00 0.00 H new ATOM 0 HD1 TYR A 83 11.555 60.814 11.922 1.00 0.00 H new ATOM 0 HD2 TYR A 83 12.864 64.245 14.157 1.00 0.00 H new ATOM 0 HE1 TYR A 83 11.496 59.482 14.012 1.00 0.00 H new ATOM 0 HE2 TYR A 83 12.806 62.905 16.244 1.00 0.00 H new ATOM 0 HH TYR A 83 12.301 59.423 16.212 1.00 0.00 H new ATOM 1269 N LYS A 84 14.721 63.891 9.389 1.00 0.00 N ATOM 1270 CA LYS A 84 15.271 64.785 8.378 1.00 0.00 C ATOM 1271 C LYS A 84 14.752 64.349 7.017 1.00 0.00 C ATOM 1272 O LYS A 84 14.481 65.174 6.145 1.00 0.00 O ATOM 1273 CB LYS A 84 16.798 64.750 8.389 1.00 0.00 C ATOM 1274 CG LYS A 84 17.307 65.409 9.670 1.00 0.00 C ATOM 1275 CD LYS A 84 18.834 65.357 9.700 1.00 0.00 C ATOM 1276 CE LYS A 84 19.336 66.054 10.961 1.00 0.00 C ATOM 1277 NZ LYS A 84 20.824 65.994 10.996 1.00 0.00 N1+ ATOM 0 H LYS A 84 15.405 63.516 10.046 1.00 0.00 H new ATOM 0 HA LYS A 84 14.960 65.807 8.593 1.00 0.00 H new ATOM 0 HB2 LYS A 84 17.150 63.720 8.331 1.00 0.00 H new ATOM 0 HB3 LYS A 84 17.192 65.271 7.517 1.00 0.00 H new ATOM 0 HG2 LYS A 84 16.967 66.443 9.719 1.00 0.00 H new ATOM 0 HG3 LYS A 84 16.898 64.898 10.541 1.00 0.00 H new ATOM 0 HD2 LYS A 84 19.175 64.322 9.682 1.00 0.00 H new ATOM 0 HD3 LYS A 84 19.244 65.843 8.814 1.00 0.00 H new ATOM 0 HE2 LYS A 84 19.002 67.091 10.975 1.00 0.00 H new ATOM 0 HE3 LYS A 84 18.920 65.573 11.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 21.189 66.771 11.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 21.125 65.084 11.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 21.198 66.084 10.030 1.00 0.00 H new ATOM 1291 N ASN A 85 14.598 63.041 6.856 1.00 0.00 N ATOM 1292 CA ASN A 85 14.079 62.504 5.599 1.00 0.00 C ATOM 1293 C ASN A 85 12.686 63.052 5.309 1.00 0.00 C ATOM 1294 O ASN A 85 12.374 63.415 4.175 1.00 0.00 O ATOM 1295 CB ASN A 85 14.020 60.977 5.673 1.00 0.00 C ATOM 1296 CG ASN A 85 12.569 60.511 5.684 1.00 0.00 C ATOM 1297 OD1 ASN A 85 11.858 60.669 4.691 1.00 0.00 O ATOM 1298 ND2 ASN A 85 12.082 59.943 6.754 1.00 0.00 N ATOM 0 H ASN A 85 14.820 62.341 7.564 1.00 0.00 H new ATOM 0 HA ASN A 85 14.748 62.808 4.794 1.00 0.00 H new ATOM 0 HB2 ASN A 85 14.543 60.543 4.821 1.00 0.00 H new ATOM 0 HB3 ASN A 85 14.529 60.628 6.571 1.00 0.00 H new ATOM 0 HD21 ASN A 85 11.111 59.629 6.768 1.00 0.00 H new ATOM 0 HD22 ASN A 85 12.672 59.813 7.576 1.00 0.00 H new ATOM 1305 N LEU A 86 11.849 63.103 6.338 1.00 0.00 N ATOM 1306 CA LEU A 86 10.486 63.603 6.177 1.00 0.00 C ATOM 1307 C LEU A 86 10.505 65.077 5.807 1.00 0.00 C ATOM 1308 O LEU A 86 9.753 65.526 4.943 1.00 0.00 O ATOM 1309 CB LEU A 86 9.701 63.408 7.482 1.00 0.00 C ATOM 1310 CG LEU A 86 8.179 63.635 7.259 1.00 0.00 C ATOM 1311 CD1 LEU A 86 7.373 62.705 8.175 1.00 0.00 C ATOM 1312 CD2 LEU A 86 7.800 65.089 7.581 1.00 0.00 C ATOM 0 H LEU A 86 12.085 62.808 7.285 1.00 0.00 H new ATOM 0 HA LEU A 86 10.001 63.044 5.377 1.00 0.00 H new ATOM 0 HB2 LEU A 86 9.869 62.401 7.864 1.00 0.00 H new ATOM 0 HB3 LEU A 86 10.068 64.102 8.238 1.00 0.00 H new ATOM 0 HG LEU A 86 7.952 63.422 6.215 1.00 0.00 H new ATOM 0 HD11 LEU A 86 6.308 62.869 8.014 1.00 0.00 H new ATOM 0 HD12 LEU A 86 7.619 61.668 7.948 1.00 0.00 H new ATOM 0 HD13 LEU A 86 7.619 62.916 9.216 1.00 0.00 H new ATOM 0 HD21 LEU A 86 6.731 65.231 7.420 1.00 0.00 H new ATOM 0 HD22 LEU A 86 8.042 65.306 8.621 1.00 0.00 H new ATOM 0 HD23 LEU A 86 8.358 65.763 6.931 1.00 0.00 H new ATOM 1324 N LEU A 87 11.363 65.830 6.478 1.00 0.00 N ATOM 1325 CA LEU A 87 11.465 67.256 6.224 1.00 0.00 C ATOM 1326 C LEU A 87 11.769 67.499 4.750 1.00 0.00 C ATOM 1327 O LEU A 87 11.375 68.515 4.178 1.00 0.00 O ATOM 1328 CB LEU A 87 12.563 67.861 7.101 1.00 0.00 C ATOM 1329 CG LEU A 87 12.355 67.435 8.563 1.00 0.00 C ATOM 1330 CD1 LEU A 87 13.417 68.110 9.437 1.00 0.00 C ATOM 1331 CD2 LEU A 87 10.958 67.860 9.038 1.00 0.00 C ATOM 0 H LEU A 87 11.995 65.479 7.198 1.00 0.00 H new ATOM 0 HA LEU A 87 10.517 67.734 6.469 1.00 0.00 H new ATOM 0 HB2 LEU A 87 13.542 67.532 6.753 1.00 0.00 H new ATOM 0 HB3 LEU A 87 12.546 68.948 7.023 1.00 0.00 H new ATOM 0 HG LEU A 87 12.444 66.351 8.641 1.00 0.00 H new ATOM 0 HD11 LEU A 87 13.276 67.813 10.476 1.00 0.00 H new ATOM 0 HD12 LEU A 87 14.409 67.806 9.104 1.00 0.00 H new ATOM 0 HD13 LEU A 87 13.322 69.193 9.354 1.00 0.00 H new ATOM 0 HD21 LEU A 87 10.818 67.555 10.075 1.00 0.00 H new ATOM 0 HD22 LEU A 87 10.862 68.943 8.962 1.00 0.00 H new ATOM 0 HD23 LEU A 87 10.201 67.384 8.414 1.00 0.00 H new ATOM 1343 N GLN A 88 12.467 66.551 4.138 1.00 0.00 N ATOM 1344 CA GLN A 88 12.803 66.652 2.724 1.00 0.00 C ATOM 1345 C GLN A 88 11.590 66.316 1.858 1.00 0.00 C ATOM 1346 O GLN A 88 11.459 66.809 0.736 1.00 0.00 O ATOM 1347 CB GLN A 88 13.951 65.697 2.393 1.00 0.00 C ATOM 1348 CG GLN A 88 15.234 66.193 3.062 1.00 0.00 C ATOM 1349 CD GLN A 88 16.365 65.199 2.823 1.00 0.00 C ATOM 1350 OE1 GLN A 88 16.181 64.206 2.118 1.00 0.00 O ATOM 1351 NE2 GLN A 88 17.529 65.407 3.372 1.00 0.00 N ATOM 0 H GLN A 88 12.810 65.707 4.596 1.00 0.00 H new ATOM 0 HA GLN A 88 13.110 67.676 2.514 1.00 0.00 H new ATOM 0 HB2 GLN A 88 13.713 64.691 2.739 1.00 0.00 H new ATOM 0 HB3 GLN A 88 14.090 65.638 1.313 1.00 0.00 H new ATOM 0 HG2 GLN A 88 15.507 67.170 2.663 1.00 0.00 H new ATOM 0 HG3 GLN A 88 15.070 66.320 4.132 1.00 0.00 H new ATOM 0 HE21 GLN A 88 17.678 66.230 3.955 1.00 0.00 H new ATOM 0 HE22 GLN A 88 18.291 64.746 3.218 1.00 0.00 H new ATOM 1360 N GLU A 89 10.705 65.474 2.389 1.00 0.00 N ATOM 1361 CA GLU A 89 9.505 65.083 1.648 1.00 0.00 C ATOM 1362 C GLU A 89 8.555 66.264 1.492 1.00 0.00 C ATOM 1363 O GLU A 89 8.050 66.529 0.403 1.00 0.00 O ATOM 1364 CB GLU A 89 8.787 63.936 2.363 1.00 0.00 C ATOM 1365 CG GLU A 89 9.644 62.670 2.299 1.00 0.00 C ATOM 1366 CD GLU A 89 9.756 62.181 0.857 1.00 0.00 C ATOM 1367 OE1 GLU A 89 8.901 62.538 0.064 1.00 0.00 O ATOM 1368 OE2 GLU A 89 10.692 61.452 0.570 1.00 0.00 O1- ATOM 0 H GLU A 89 10.792 65.055 3.315 1.00 0.00 H new ATOM 0 HA GLU A 89 9.815 64.750 0.657 1.00 0.00 H new ATOM 0 HB2 GLU A 89 8.596 64.205 3.402 1.00 0.00 H new ATOM 0 HB3 GLU A 89 7.818 63.755 1.898 1.00 0.00 H new ATOM 0 HG2 GLU A 89 10.637 62.874 2.700 1.00 0.00 H new ATOM 0 HG3 GLU A 89 9.203 61.892 2.921 1.00 0.00 H new ATOM 1375 N ILE A 90 8.323 66.978 2.587 1.00 0.00 N ATOM 1376 CA ILE A 90 7.443 68.136 2.560 1.00 0.00 C ATOM 1377 C ILE A 90 8.082 69.258 1.750 1.00 0.00 C ATOM 1378 O ILE A 90 7.405 69.967 1.015 1.00 0.00 O ATOM 1379 CB ILE A 90 7.154 68.609 3.985 1.00 0.00 C ATOM 1380 CG1 ILE A 90 8.466 68.975 4.678 1.00 0.00 C ATOM 1381 CG2 ILE A 90 6.465 67.488 4.766 1.00 0.00 C ATOM 1382 CD1 ILE A 90 8.194 69.343 6.135 1.00 0.00 C ATOM 0 H ILE A 90 8.731 66.776 3.500 1.00 0.00 H new ATOM 0 HA ILE A 90 6.502 67.855 2.088 1.00 0.00 H new ATOM 0 HB ILE A 90 6.504 69.483 3.950 1.00 0.00 H new ATOM 0 HG12 ILE A 90 9.161 68.137 4.628 1.00 0.00 H new ATOM 0 HG13 ILE A 90 8.939 69.812 4.164 1.00 0.00 H new ATOM 0 HG21 ILE A 90 6.259 67.826 5.782 1.00 0.00 H new ATOM 0 HG22 ILE A 90 5.529 67.224 4.274 1.00 0.00 H new ATOM 0 HG23 ILE A 90 7.116 66.614 4.799 1.00 0.00 H new ATOM 0 HD11 ILE A 90 9.132 69.603 6.626 1.00 0.00 H new ATOM 0 HD12 ILE A 90 7.515 70.195 6.174 1.00 0.00 H new ATOM 0 HD13 ILE A 90 7.741 68.494 6.646 1.00 0.00 H new ATOM 1394 N ALA A 91 9.391 69.417 1.901 1.00 0.00 N ATOM 1395 CA ALA A 91 10.106 70.462 1.183 1.00 0.00 C ATOM 1396 C ALA A 91 9.773 70.399 -0.302 1.00 0.00 C ATOM 1397 O ALA A 91 9.477 71.420 -0.926 1.00 0.00 O ATOM 1398 CB ALA A 91 11.616 70.295 1.378 1.00 0.00 C ATOM 0 H ALA A 91 9.974 68.841 2.509 1.00 0.00 H new ATOM 0 HA ALA A 91 9.798 71.430 1.578 1.00 0.00 H new ATOM 0 HB1 ALA A 91 12.142 71.082 0.837 1.00 0.00 H new ATOM 0 HB2 ALA A 91 11.855 70.362 2.439 1.00 0.00 H new ATOM 0 HB3 ALA A 91 11.927 69.322 0.997 1.00 0.00 H new ATOM 1404 N GLN A 92 9.817 69.196 -0.866 1.00 0.00 N ATOM 1405 CA GLN A 92 9.508 69.015 -2.280 1.00 0.00 C ATOM 1406 C GLN A 92 8.027 69.268 -2.548 1.00 0.00 C ATOM 1407 O GLN A 92 7.670 69.909 -3.537 1.00 0.00 O ATOM 1408 CB GLN A 92 9.867 67.591 -2.710 1.00 0.00 C ATOM 1409 CG GLN A 92 9.740 67.454 -4.231 1.00 0.00 C ATOM 1410 CD GLN A 92 10.828 68.272 -4.918 1.00 0.00 C ATOM 1411 OE1 GLN A 92 11.959 68.330 -4.434 1.00 0.00 O ATOM 1412 NE2 GLN A 92 10.555 68.906 -6.025 1.00 0.00 N ATOM 0 H GLN A 92 10.061 68.339 -0.371 1.00 0.00 H new ATOM 0 HA GLN A 92 10.095 69.732 -2.854 1.00 0.00 H new ATOM 0 HB2 GLN A 92 10.885 67.354 -2.399 1.00 0.00 H new ATOM 0 HB3 GLN A 92 9.208 66.876 -2.216 1.00 0.00 H new ATOM 0 HG2 GLN A 92 9.824 66.406 -4.519 1.00 0.00 H new ATOM 0 HG3 GLN A 92 8.757 67.795 -4.555 1.00 0.00 H new ATOM 0 HE21 GLN A 92 9.617 68.856 -6.423 1.00 0.00 H new ATOM 0 HE22 GLN A 92 11.279 69.452 -6.492 1.00 0.00 H new ATOM 1421 N LYS A 93 7.168 68.759 -1.670 1.00 0.00 N ATOM 1422 CA LYS A 93 5.728 68.934 -1.840 1.00 0.00 C ATOM 1423 C LYS A 93 5.367 70.415 -1.815 1.00 0.00 C ATOM 1424 O LYS A 93 4.681 70.914 -2.706 1.00 0.00 O ATOM 1425 CB LYS A 93 4.983 68.207 -0.719 1.00 0.00 C ATOM 1426 CG LYS A 93 3.472 68.328 -0.935 1.00 0.00 C ATOM 1427 CD LYS A 93 2.734 67.609 0.193 1.00 0.00 C ATOM 1428 CE LYS A 93 1.227 67.739 -0.026 1.00 0.00 C ATOM 1429 NZ LYS A 93 0.502 67.079 1.096 1.00 0.00 N1+ ATOM 0 H LYS A 93 7.439 68.228 -0.842 1.00 0.00 H new ATOM 0 HA LYS A 93 5.436 68.515 -2.803 1.00 0.00 H new ATOM 0 HB2 LYS A 93 5.273 67.157 -0.699 1.00 0.00 H new ATOM 0 HB3 LYS A 93 5.256 68.632 0.247 1.00 0.00 H new ATOM 0 HG2 LYS A 93 3.181 69.378 -0.962 1.00 0.00 H new ATOM 0 HG3 LYS A 93 3.196 67.896 -1.897 1.00 0.00 H new ATOM 0 HD2 LYS A 93 3.020 66.558 0.218 1.00 0.00 H new ATOM 0 HD3 LYS A 93 3.011 68.038 1.156 1.00 0.00 H new ATOM 0 HE2 LYS A 93 0.947 68.791 -0.085 1.00 0.00 H new ATOM 0 HE3 LYS A 93 0.946 67.281 -0.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -0.523 67.168 0.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 0.761 66.072 1.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 0.762 67.536 1.994 1.00 0.00 H new ATOM 1443 N GLU A 94 5.838 71.110 -0.789 1.00 0.00 N ATOM 1444 CA GLU A 94 5.565 72.539 -0.657 1.00 0.00 C ATOM 1445 C GLU A 94 6.455 73.340 -1.601 1.00 0.00 C ATOM 1446 O GLU A 94 6.584 74.556 -1.464 1.00 0.00 O ATOM 1447 CB GLU A 94 5.815 72.990 0.784 1.00 0.00 C ATOM 1448 CG GLU A 94 4.768 72.362 1.705 1.00 0.00 C ATOM 1449 CD GLU A 94 5.084 72.699 3.160 1.00 0.00 C ATOM 1450 OE1 GLU A 94 6.068 73.384 3.387 1.00 0.00 O ATOM 1451 OE2 GLU A 94 4.339 72.267 4.024 1.00 0.00 O1- ATOM 0 H GLU A 94 6.407 70.714 -0.040 1.00 0.00 H new ATOM 0 HA GLU A 94 4.521 72.716 -0.916 1.00 0.00 H new ATOM 0 HB2 GLU A 94 6.816 72.696 1.100 1.00 0.00 H new ATOM 0 HB3 GLU A 94 5.767 74.077 0.849 1.00 0.00 H new ATOM 0 HG2 GLU A 94 3.775 72.730 1.445 1.00 0.00 H new ATOM 0 HG3 GLU A 94 4.753 71.281 1.568 1.00 0.00 H new ATOM 1458 N SER A 95 7.066 72.648 -2.558 1.00 0.00 N ATOM 1459 CA SER A 95 7.944 73.305 -3.521 1.00 0.00 C ATOM 1460 C SER A 95 9.010 74.129 -2.805 1.00 0.00 C ATOM 1461 O SER A 95 9.759 74.876 -3.435 1.00 0.00 O ATOM 1462 CB SER A 95 7.123 74.210 -4.439 1.00 0.00 C ATOM 1463 OG SER A 95 7.998 75.072 -5.156 1.00 0.00 O ATOM 0 H SER A 95 6.971 71.641 -2.687 1.00 0.00 H new ATOM 0 HA SER A 95 8.439 72.537 -4.116 1.00 0.00 H new ATOM 0 HB2 SER A 95 6.538 73.608 -5.134 1.00 0.00 H new ATOM 0 HB3 SER A 95 6.416 74.797 -3.852 1.00 0.00 H new ATOM 0 HG SER A 95 8.928 74.834 -4.956 1.00 0.00 H new ATOM 1469 N SER A 96 9.073 73.987 -1.484 1.00 0.00 N ATOM 1470 CA SER A 96 10.053 74.719 -0.688 1.00 0.00 C ATOM 1471 C SER A 96 11.443 74.114 -0.866 1.00 0.00 C ATOM 1472 O SER A 96 11.579 72.935 -1.189 1.00 0.00 O ATOM 1473 CB SER A 96 9.657 74.683 0.790 1.00 0.00 C ATOM 1474 OG SER A 96 8.576 75.579 1.004 1.00 0.00 O ATOM 0 H SER A 96 8.461 73.375 -0.945 1.00 0.00 H new ATOM 0 HA SER A 96 10.075 75.754 -1.029 1.00 0.00 H new ATOM 0 HB2 SER A 96 9.370 73.672 1.078 1.00 0.00 H new ATOM 0 HB3 SER A 96 10.506 74.963 1.414 1.00 0.00 H new ATOM 0 HG SER A 96 7.883 75.422 0.329 1.00 0.00 H new ATOM 1480 N LEU A 97 12.470 74.931 -0.657 1.00 0.00 N ATOM 1481 CA LEU A 97 13.843 74.461 -0.799 1.00 0.00 C ATOM 1482 C LEU A 97 14.192 73.516 0.344 1.00 0.00 C ATOM 1483 O LEU A 97 13.801 73.743 1.489 1.00 0.00 O ATOM 1484 CB LEU A 97 14.805 75.656 -0.796 1.00 0.00 C ATOM 1485 CG LEU A 97 14.807 76.319 -2.175 1.00 0.00 C ATOM 1486 CD1 LEU A 97 13.402 76.824 -2.506 1.00 0.00 C ATOM 1487 CD2 LEU A 97 15.786 77.495 -2.170 1.00 0.00 C ATOM 0 H LEU A 97 12.380 75.912 -0.391 1.00 0.00 H new ATOM 0 HA LEU A 97 13.938 73.926 -1.744 1.00 0.00 H new ATOM 0 HB2 LEU A 97 14.503 76.376 -0.036 1.00 0.00 H new ATOM 0 HB3 LEU A 97 15.811 75.325 -0.540 1.00 0.00 H new ATOM 0 HG LEU A 97 15.113 75.592 -2.927 1.00 0.00 H new ATOM 0 HD11 LEU A 97 13.407 77.296 -3.489 1.00 0.00 H new ATOM 0 HD12 LEU A 97 12.705 75.986 -2.509 1.00 0.00 H new ATOM 0 HD13 LEU A 97 13.091 77.551 -1.756 1.00 0.00 H new ATOM 0 HD21 LEU A 97 15.790 77.970 -3.151 1.00 0.00 H new ATOM 0 HD22 LEU A 97 15.479 78.221 -1.417 1.00 0.00 H new ATOM 0 HD23 LEU A 97 16.788 77.133 -1.938 1.00 0.00 H new ATOM 1499 N LEU A 98 14.917 72.452 0.027 1.00 0.00 N ATOM 1500 CA LEU A 98 15.296 71.473 1.033 1.00 0.00 C ATOM 1501 C LEU A 98 15.787 72.168 2.308 1.00 0.00 C ATOM 1502 O LEU A 98 16.300 73.287 2.257 1.00 0.00 O ATOM 1503 CB LEU A 98 16.404 70.563 0.472 1.00 0.00 C ATOM 1504 CG LEU A 98 15.782 69.419 -0.335 1.00 0.00 C ATOM 1505 CD1 LEU A 98 14.879 69.997 -1.424 1.00 0.00 C ATOM 1506 CD2 LEU A 98 16.894 68.589 -0.980 1.00 0.00 C ATOM 0 H LEU A 98 15.252 72.246 -0.914 1.00 0.00 H new ATOM 0 HA LEU A 98 14.422 70.872 1.285 1.00 0.00 H new ATOM 0 HB2 LEU A 98 17.076 71.142 -0.161 1.00 0.00 H new ATOM 0 HB3 LEU A 98 17.003 70.160 1.288 1.00 0.00 H new ATOM 0 HG LEU A 98 15.192 68.785 0.326 1.00 0.00 H new ATOM 0 HD11 LEU A 98 14.436 69.184 -1.999 1.00 0.00 H new ATOM 0 HD12 LEU A 98 14.088 70.589 -0.964 1.00 0.00 H new ATOM 0 HD13 LEU A 98 15.468 70.631 -2.087 1.00 0.00 H new ATOM 0 HD21 LEU A 98 16.453 67.774 -1.555 1.00 0.00 H new ATOM 0 HD22 LEU A 98 17.484 69.223 -1.642 1.00 0.00 H new ATOM 0 HD23 LEU A 98 17.538 68.178 -0.203 1.00 0.00 H new ATOM 1518 N PRO A 99 15.644 71.520 3.439 1.00 0.00 N ATOM 1519 CA PRO A 99 16.082 72.073 4.753 1.00 0.00 C ATOM 1520 C PRO A 99 17.598 72.211 4.827 1.00 0.00 C ATOM 1521 O PRO A 99 18.319 71.751 3.941 1.00 0.00 O ATOM 1522 CB PRO A 99 15.557 71.058 5.780 1.00 0.00 C ATOM 1523 CG PRO A 99 15.406 69.780 5.021 1.00 0.00 C ATOM 1524 CD PRO A 99 15.044 70.182 3.594 1.00 0.00 C ATOM 0 HA PRO A 99 15.698 73.078 4.928 1.00 0.00 H new ATOM 0 HB2 PRO A 99 16.252 70.943 6.612 1.00 0.00 H new ATOM 0 HB3 PRO A 99 14.605 71.381 6.202 1.00 0.00 H new ATOM 0 HG2 PRO A 99 16.330 69.202 5.042 1.00 0.00 H new ATOM 0 HG3 PRO A 99 14.629 69.154 5.460 1.00 0.00 H new ATOM 0 HD2 PRO A 99 15.446 69.477 2.866 1.00 0.00 H new ATOM 0 HD3 PRO A 99 13.964 70.209 3.448 1.00 0.00 H new ATOM 1532 N PHE A 100 18.077 72.834 5.897 1.00 0.00 N ATOM 1533 CA PHE A 100 19.516 73.005 6.097 1.00 0.00 C ATOM 1534 C PHE A 100 19.866 72.769 7.559 1.00 0.00 C ATOM 1535 O PHE A 100 19.472 73.543 8.429 1.00 0.00 O ATOM 1536 CB PHE A 100 19.935 74.417 5.692 1.00 0.00 C ATOM 1537 CG PHE A 100 21.438 74.481 5.574 1.00 0.00 C ATOM 1538 CD1 PHE A 100 22.062 74.063 4.394 1.00 0.00 C ATOM 1539 CD2 PHE A 100 22.205 74.956 6.644 1.00 0.00 C ATOM 1540 CE1 PHE A 100 23.454 74.119 4.283 1.00 0.00 C ATOM 1541 CE2 PHE A 100 23.598 75.013 6.532 1.00 0.00 C ATOM 1542 CZ PHE A 100 24.223 74.594 5.351 1.00 0.00 C ATOM 0 H PHE A 100 17.496 73.228 6.637 1.00 0.00 H new ATOM 0 HA PHE A 100 20.047 72.282 5.478 1.00 0.00 H new ATOM 0 HB2 PHE A 100 19.473 74.687 4.742 1.00 0.00 H new ATOM 0 HB3 PHE A 100 19.587 75.138 6.432 1.00 0.00 H new ATOM 0 HD1 PHE A 100 21.468 73.697 3.569 1.00 0.00 H new ATOM 0 HD2 PHE A 100 21.722 75.278 7.555 1.00 0.00 H new ATOM 0 HE1 PHE A 100 23.936 73.795 3.372 1.00 0.00 H new ATOM 0 HE2 PHE A 100 24.192 75.380 7.356 1.00 0.00 H new ATOM 0 HZ PHE A 100 25.299 74.638 5.265 1.00 0.00 H new ATOM 1552 N TYR A 101 20.598 71.691 7.830 1.00 0.00 N ATOM 1553 CA TYR A 101 20.979 71.355 9.201 1.00 0.00 C ATOM 1554 C TYR A 101 22.377 71.875 9.512 1.00 0.00 C ATOM 1555 O TYR A 101 23.315 71.655 8.745 1.00 0.00 O ATOM 1556 CB TYR A 101 20.959 69.838 9.390 1.00 0.00 C ATOM 1557 CG TYR A 101 19.663 69.281 8.853 1.00 0.00 C ATOM 1558 CD1 TYR A 101 18.463 69.518 9.534 1.00 0.00 C ATOM 1559 CD2 TYR A 101 19.658 68.534 7.668 1.00 0.00 C ATOM 1560 CE1 TYR A 101 17.261 69.005 9.033 1.00 0.00 C ATOM 1561 CE2 TYR A 101 18.454 68.023 7.167 1.00 0.00 C ATOM 1562 CZ TYR A 101 17.257 68.259 7.849 1.00 0.00 C ATOM 1563 OH TYR A 101 16.074 67.756 7.352 1.00 0.00 O ATOM 0 H TYR A 101 20.938 71.038 7.124 1.00 0.00 H new ATOM 0 HA TYR A 101 20.264 71.823 9.878 1.00 0.00 H new ATOM 0 HB2 TYR A 101 21.804 69.385 8.872 1.00 0.00 H new ATOM 0 HB3 TYR A 101 21.063 69.591 10.447 1.00 0.00 H new ATOM 0 HD1 TYR A 101 18.465 70.097 10.446 1.00 0.00 H new ATOM 0 HD2 TYR A 101 20.583 68.352 7.141 1.00 0.00 H new ATOM 0 HE1 TYR A 101 16.336 69.185 9.561 1.00 0.00 H new ATOM 0 HE2 TYR A 101 18.451 67.447 6.254 1.00 0.00 H new ATOM 0 HH TYR A 101 16.250 67.264 6.523 1.00 0.00 H new ATOM 1573 N ALA A 102 22.511 72.559 10.644 1.00 0.00 N ATOM 1574 CA ALA A 102 23.802 73.103 11.062 1.00 0.00 C ATOM 1575 C ALA A 102 24.003 72.878 12.554 1.00 0.00 C ATOM 1576 O ALA A 102 23.091 73.095 13.352 1.00 0.00 O ATOM 1577 CB ALA A 102 23.862 74.600 10.755 1.00 0.00 C ATOM 0 H ALA A 102 21.744 72.750 11.288 1.00 0.00 H new ATOM 0 HA ALA A 102 24.594 72.593 10.513 1.00 0.00 H new ATOM 0 HB1 ALA A 102 24.827 74.998 11.069 1.00 0.00 H new ATOM 0 HB2 ALA A 102 23.737 74.757 9.684 1.00 0.00 H new ATOM 0 HB3 ALA A 102 23.065 75.114 11.293 1.00 0.00 H new ATOM 1583 N THR A 103 25.206 72.443 12.925 1.00 0.00 N ATOM 1584 CA THR A 103 25.533 72.185 14.328 1.00 0.00 C ATOM 1585 C THR A 103 26.736 73.015 14.756 1.00 0.00 C ATOM 1586 O THR A 103 27.745 73.068 14.052 1.00 0.00 O ATOM 1587 CB THR A 103 25.836 70.701 14.537 1.00 0.00 C ATOM 1588 OG1 THR A 103 24.717 69.929 14.128 1.00 0.00 O ATOM 1589 CG2 THR A 103 26.124 70.438 16.020 1.00 0.00 C ATOM 0 H THR A 103 25.971 72.262 12.275 1.00 0.00 H new ATOM 0 HA THR A 103 24.673 72.465 14.936 1.00 0.00 H new ATOM 0 HB THR A 103 26.708 70.422 13.945 1.00 0.00 H new ATOM 0 HG1 THR A 103 24.306 69.509 14.912 1.00 0.00 H new ATOM 0 HG21 THR A 103 26.340 69.380 16.167 1.00 0.00 H new ATOM 0 HG22 THR A 103 26.983 71.030 16.334 1.00 0.00 H new ATOM 0 HG23 THR A 103 25.254 70.717 16.615 1.00 0.00 H new ATOM 1597 N ALA A 104 26.624 73.665 15.916 1.00 0.00 N ATOM 1598 CA ALA A 104 27.715 74.494 16.440 1.00 0.00 C ATOM 1599 C ALA A 104 28.157 73.985 17.810 1.00 0.00 C ATOM 1600 O ALA A 104 27.333 73.558 18.618 1.00 0.00 O ATOM 1601 CB ALA A 104 27.247 75.946 16.558 1.00 0.00 C ATOM 0 H ALA A 104 25.794 73.635 16.509 1.00 0.00 H new ATOM 0 HA ALA A 104 28.560 74.438 15.754 1.00 0.00 H new ATOM 0 HB1 ALA A 104 28.059 76.560 16.947 1.00 0.00 H new ATOM 0 HB2 ALA A 104 26.953 76.315 15.575 1.00 0.00 H new ATOM 0 HB3 ALA A 104 26.395 76.000 17.235 1.00 0.00 H new ATOM 1607 N THR A 105 29.466 74.035 18.067 1.00 0.00 N ATOM 1608 CA THR A 105 30.017 73.586 19.335 1.00 0.00 C ATOM 1609 C THR A 105 30.362 74.782 20.214 1.00 0.00 C ATOM 1610 O THR A 105 30.975 75.747 19.754 1.00 0.00 O ATOM 1611 CB THR A 105 31.277 72.770 19.072 1.00 0.00 C ATOM 1612 OG1 THR A 105 32.329 73.631 18.659 1.00 0.00 O ATOM 1613 CG2 THR A 105 31.003 71.732 17.982 1.00 0.00 C ATOM 0 H THR A 105 30.161 74.384 17.407 1.00 0.00 H new ATOM 0 HA THR A 105 29.277 72.973 19.849 1.00 0.00 H new ATOM 0 HB THR A 105 31.570 72.259 19.989 1.00 0.00 H new ATOM 0 HG1 THR A 105 32.068 74.563 18.812 1.00 0.00 H new ATOM 0 HG21 THR A 105 31.907 71.151 17.797 1.00 0.00 H new ATOM 0 HG22 THR A 105 30.203 71.066 18.306 1.00 0.00 H new ATOM 0 HG23 THR A 105 30.703 72.238 17.064 1.00 0.00 H new ATOM 1621 N SER A 106 29.965 74.713 21.477 1.00 0.00 N ATOM 1622 CA SER A 106 30.243 75.795 22.409 1.00 0.00 C ATOM 1623 C SER A 106 30.058 75.315 23.840 1.00 0.00 C ATOM 1624 O SER A 106 29.425 74.285 24.076 1.00 0.00 O ATOM 1625 CB SER A 106 29.307 76.973 22.142 1.00 0.00 C ATOM 1626 OG SER A 106 27.971 76.586 22.436 1.00 0.00 O ATOM 0 H SER A 106 29.454 73.926 21.877 1.00 0.00 H new ATOM 0 HA SER A 106 31.275 76.117 22.269 1.00 0.00 H new ATOM 0 HB2 SER A 106 29.594 77.827 22.756 1.00 0.00 H new ATOM 0 HB3 SER A 106 29.386 77.287 21.101 1.00 0.00 H new ATOM 0 HG SER A 106 27.368 77.340 22.268 1.00 0.00 H new ATOM 1632 N GLY A 107 30.603 76.068 24.791 1.00 0.00 N ATOM 1633 CA GLY A 107 30.484 75.716 26.206 1.00 0.00 C ATOM 1634 C GLY A 107 31.858 75.557 26.855 1.00 0.00 C ATOM 1635 O GLY A 107 32.885 75.729 26.199 1.00 0.00 O ATOM 0 H GLY A 107 31.130 76.923 24.611 1.00 0.00 H new ATOM 0 HA2 GLY A 107 29.919 76.488 26.729 1.00 0.00 H new ATOM 0 HA3 GLY A 107 29.922 74.787 26.306 1.00 0.00 H new ATOM 1639 N PRO A 108 31.890 75.229 28.124 1.00 0.00 N ATOM 1640 CA PRO A 108 33.165 75.040 28.881 1.00 0.00 C ATOM 1641 C PRO A 108 34.009 73.904 28.315 1.00 0.00 C ATOM 1642 O PRO A 108 33.485 72.950 27.742 1.00 0.00 O ATOM 1643 CB PRO A 108 32.703 74.716 30.317 1.00 0.00 C ATOM 1644 CG PRO A 108 31.290 74.267 30.182 1.00 0.00 C ATOM 1645 CD PRO A 108 30.713 75.007 28.983 1.00 0.00 C ATOM 0 HA PRO A 108 33.802 75.922 28.825 1.00 0.00 H new ATOM 0 HB2 PRO A 108 33.322 73.938 30.763 1.00 0.00 H new ATOM 0 HB3 PRO A 108 32.778 75.592 30.961 1.00 0.00 H new ATOM 0 HG2 PRO A 108 31.238 73.188 30.034 1.00 0.00 H new ATOM 0 HG3 PRO A 108 30.724 74.492 31.086 1.00 0.00 H new ATOM 0 HD2 PRO A 108 29.950 74.417 28.475 1.00 0.00 H new ATOM 0 HD3 PRO A 108 30.246 75.947 29.277 1.00 0.00 H new ATOM 1653 N SER A 109 35.320 74.012 28.499 1.00 0.00 N ATOM 1654 CA SER A 109 36.228 72.982 28.024 1.00 0.00 C ATOM 1655 C SER A 109 36.002 71.690 28.800 1.00 0.00 C ATOM 1656 O SER A 109 36.418 70.614 28.367 1.00 0.00 O ATOM 1657 CB SER A 109 37.678 73.435 28.205 1.00 0.00 C ATOM 1658 OG SER A 109 37.935 73.651 29.587 1.00 0.00 O ATOM 0 H SER A 109 35.772 74.796 28.970 1.00 0.00 H new ATOM 0 HA SER A 109 36.034 72.808 26.966 1.00 0.00 H new ATOM 0 HB2 SER A 109 38.359 72.680 27.811 1.00 0.00 H new ATOM 0 HB3 SER A 109 37.858 74.351 27.643 1.00 0.00 H new ATOM 0 HG SER A 109 38.864 73.940 29.706 1.00 0.00 H new ATOM 1664 N HIS A 110 35.335 71.801 29.952 1.00 0.00 N ATOM 1665 CA HIS A 110 35.055 70.629 30.781 1.00 0.00 C ATOM 1666 C HIS A 110 33.731 70.005 30.379 1.00 0.00 C ATOM 1667 O HIS A 110 33.619 68.785 30.263 1.00 0.00 O ATOM 1668 CB HIS A 110 35.008 71.023 32.255 1.00 0.00 C ATOM 1669 CG HIS A 110 36.397 71.354 32.728 1.00 0.00 C ATOM 1670 ND1 HIS A 110 37.286 70.380 33.156 1.00 0.00 N ATOM 1671 CD2 HIS A 110 37.066 72.548 32.842 1.00 0.00 C ATOM 1672 CE1 HIS A 110 38.429 70.998 33.503 1.00 0.00 C ATOM 1673 NE2 HIS A 110 38.349 72.320 33.332 1.00 0.00 N ATOM 0 H HIS A 110 34.983 72.681 30.328 1.00 0.00 H new ATOM 0 HA HIS A 110 35.853 69.902 30.631 1.00 0.00 H new ATOM 0 HB2 HIS A 110 34.351 71.882 32.393 1.00 0.00 H new ATOM 0 HB3 HIS A 110 34.595 70.207 32.848 1.00 0.00 H new ATOM 0 HD2 HIS A 110 36.659 73.516 32.590 1.00 0.00 H new ATOM 0 HE1 HIS A 110 39.305 70.487 33.875 1.00 0.00 H new ATOM 0 HE2 HIS A 110 39.073 73.014 33.520 1.00 0.00 H new ATOM 1681 N ALA A 111 32.728 70.855 30.152 1.00 0.00 N ATOM 1682 CA ALA A 111 31.408 70.382 29.742 1.00 0.00 C ATOM 1683 C ALA A 111 30.981 71.054 28.433 1.00 0.00 C ATOM 1684 O ALA A 111 30.165 71.973 28.431 1.00 0.00 O ATOM 1685 CB ALA A 111 30.377 70.662 30.858 1.00 0.00 C ATOM 0 H ALA A 111 32.805 71.868 30.245 1.00 0.00 H new ATOM 0 HA ALA A 111 31.456 69.306 29.573 1.00 0.00 H new ATOM 0 HB1 ALA A 111 29.396 70.306 30.544 1.00 0.00 H new ATOM 0 HB2 ALA A 111 30.677 70.144 31.769 1.00 0.00 H new ATOM 0 HB3 ALA A 111 30.330 71.734 31.049 1.00 0.00 H new ATOM 1691 N PRO A 112 31.510 70.603 27.321 1.00 0.00 N ATOM 1692 CA PRO A 112 31.174 71.173 25.985 1.00 0.00 C ATOM 1693 C PRO A 112 29.855 70.634 25.439 1.00 0.00 C ATOM 1694 O PRO A 112 29.612 69.429 25.449 1.00 0.00 O ATOM 1695 CB PRO A 112 32.358 70.745 25.110 1.00 0.00 C ATOM 1696 CG PRO A 112 32.854 69.466 25.713 1.00 0.00 C ATOM 1697 CD PRO A 112 32.489 69.503 27.212 1.00 0.00 C ATOM 0 HA PRO A 112 31.032 72.253 26.019 1.00 0.00 H new ATOM 0 HB2 PRO A 112 32.049 70.598 24.075 1.00 0.00 H new ATOM 0 HB3 PRO A 112 33.138 71.506 25.105 1.00 0.00 H new ATOM 0 HG2 PRO A 112 32.395 68.606 25.225 1.00 0.00 H new ATOM 0 HG3 PRO A 112 33.932 69.370 25.581 1.00 0.00 H new ATOM 0 HD2 PRO A 112 32.062 68.556 27.541 1.00 0.00 H new ATOM 0 HD3 PRO A 112 33.367 69.689 27.831 1.00 0.00 H new ATOM 1705 N THR A 113 29.004 71.542 24.962 1.00 0.00 N ATOM 1706 CA THR A 113 27.705 71.171 24.408 1.00 0.00 C ATOM 1707 C THR A 113 27.637 71.553 22.942 1.00 0.00 C ATOM 1708 O THR A 113 28.546 72.194 22.416 1.00 0.00 O ATOM 1709 CB THR A 113 26.582 71.873 25.182 1.00 0.00 C ATOM 1710 OG1 THR A 113 26.634 73.270 24.924 1.00 0.00 O ATOM 1711 CG2 THR A 113 26.762 71.624 26.681 1.00 0.00 C ATOM 0 H THR A 113 29.194 72.544 24.949 1.00 0.00 H new ATOM 0 HA THR A 113 27.579 70.092 24.501 1.00 0.00 H new ATOM 0 HB THR A 113 25.617 71.479 24.862 1.00 0.00 H new ATOM 0 HG1 THR A 113 27.545 73.521 24.663 1.00 0.00 H new ATOM 0 HG21 THR A 113 25.964 72.123 27.231 1.00 0.00 H new ATOM 0 HG22 THR A 113 26.725 70.553 26.879 1.00 0.00 H new ATOM 0 HG23 THR A 113 27.726 72.019 27.002 1.00 0.00 H new ATOM 1719 N PHE A 114 26.556 71.153 22.285 1.00 0.00 N ATOM 1720 CA PHE A 114 26.376 71.454 20.867 1.00 0.00 C ATOM 1721 C PHE A 114 24.975 72.002 20.620 1.00 0.00 C ATOM 1722 O PHE A 114 24.014 71.592 21.271 1.00 0.00 O ATOM 1723 CB PHE A 114 26.586 70.171 20.047 1.00 0.00 C ATOM 1724 CG PHE A 114 27.579 69.287 20.762 1.00 0.00 C ATOM 1725 CD1 PHE A 114 28.938 69.608 20.753 1.00 0.00 C ATOM 1726 CD2 PHE A 114 27.135 68.148 21.439 1.00 0.00 C ATOM 1727 CE1 PHE A 114 29.858 68.788 21.415 1.00 0.00 C ATOM 1728 CE2 PHE A 114 28.050 67.328 22.102 1.00 0.00 C ATOM 1729 CZ PHE A 114 29.412 67.644 22.089 1.00 0.00 C ATOM 0 H PHE A 114 25.794 70.622 22.706 1.00 0.00 H new ATOM 0 HA PHE A 114 27.104 72.206 20.563 1.00 0.00 H new ATOM 0 HB2 PHE A 114 25.639 69.647 19.919 1.00 0.00 H new ATOM 0 HB3 PHE A 114 26.951 70.417 19.050 1.00 0.00 H new ATOM 0 HD1 PHE A 114 29.280 70.491 20.234 1.00 0.00 H new ATOM 0 HD2 PHE A 114 26.083 67.902 21.449 1.00 0.00 H new ATOM 0 HE1 PHE A 114 30.909 69.036 21.406 1.00 0.00 H new ATOM 0 HE2 PHE A 114 27.705 66.449 22.626 1.00 0.00 H new ATOM 0 HZ PHE A 114 30.120 67.006 22.598 1.00 0.00 H new ATOM 1739 N THR A 115 24.865 72.921 19.664 1.00 0.00 N ATOM 1740 CA THR A 115 23.577 73.516 19.316 1.00 0.00 C ATOM 1741 C THR A 115 23.256 73.226 17.860 1.00 0.00 C ATOM 1742 O THR A 115 24.036 73.553 16.965 1.00 0.00 O ATOM 1743 CB THR A 115 23.619 75.029 19.538 1.00 0.00 C ATOM 1744 OG1 THR A 115 23.874 75.298 20.911 1.00 0.00 O ATOM 1745 CG2 THR A 115 22.278 75.639 19.136 1.00 0.00 C ATOM 0 H THR A 115 25.652 73.270 19.117 1.00 0.00 H new ATOM 0 HA THR A 115 22.805 73.084 19.952 1.00 0.00 H new ATOM 0 HB THR A 115 24.411 75.466 18.930 1.00 0.00 H new ATOM 0 HG1 THR A 115 23.903 76.267 21.055 1.00 0.00 H new ATOM 0 HG21 THR A 115 22.307 76.717 19.294 1.00 0.00 H new ATOM 0 HG22 THR A 115 22.085 75.431 18.084 1.00 0.00 H new ATOM 0 HG23 THR A 115 21.484 75.205 19.743 1.00 0.00 H new ATOM 1753 N SER A 116 22.101 72.606 17.626 1.00 0.00 N ATOM 1754 CA SER A 116 21.679 72.262 16.269 1.00 0.00 C ATOM 1755 C SER A 116 20.453 73.074 15.876 1.00 0.00 C ATOM 1756 O SER A 116 19.531 73.250 16.673 1.00 0.00 O ATOM 1757 CB SER A 116 21.338 70.775 16.192 1.00 0.00 C ATOM 1758 OG SER A 116 21.038 70.431 14.846 1.00 0.00 O ATOM 0 H SER A 116 21.443 72.332 18.355 1.00 0.00 H new ATOM 0 HA SER A 116 22.497 72.488 15.585 1.00 0.00 H new ATOM 0 HB2 SER A 116 22.176 70.179 16.554 1.00 0.00 H new ATOM 0 HB3 SER A 116 20.487 70.552 16.835 1.00 0.00 H new ATOM 0 HG SER A 116 20.081 70.236 14.764 1.00 0.00 H new ATOM 1764 N THR A 117 20.449 73.568 14.642 1.00 0.00 N ATOM 1765 CA THR A 117 19.331 74.368 14.144 1.00 0.00 C ATOM 1766 C THR A 117 19.021 74.002 12.699 1.00 0.00 C ATOM 1767 O THR A 117 19.900 73.556 11.961 1.00 0.00 O ATOM 1768 CB THR A 117 19.682 75.852 14.230 1.00 0.00 C ATOM 1769 OG1 THR A 117 19.884 76.211 15.590 1.00 0.00 O ATOM 1770 CG2 THR A 117 18.544 76.683 13.643 1.00 0.00 C ATOM 0 H THR A 117 21.203 73.430 13.969 1.00 0.00 H new ATOM 0 HA THR A 117 18.453 74.164 14.757 1.00 0.00 H new ATOM 0 HB THR A 117 20.594 76.043 13.665 1.00 0.00 H new ATOM 0 HG1 THR A 117 20.111 77.163 15.647 1.00 0.00 H new ATOM 0 HG21 THR A 117 18.797 77.741 13.705 1.00 0.00 H new ATOM 0 HG22 THR A 117 18.393 76.407 12.599 1.00 0.00 H new ATOM 0 HG23 THR A 117 17.629 76.495 14.204 1.00 0.00 H new ATOM 1778 N VAL A 118 17.763 74.190 12.303 1.00 0.00 N ATOM 1779 CA VAL A 118 17.336 73.873 10.937 1.00 0.00 C ATOM 1780 C VAL A 118 16.738 75.107 10.272 1.00 0.00 C ATOM 1781 O VAL A 118 16.213 75.993 10.946 1.00 0.00 O ATOM 1782 CB VAL A 118 16.306 72.744 10.957 1.00 0.00 C ATOM 1783 CG1 VAL A 118 15.030 73.226 11.646 1.00 0.00 C ATOM 1784 CG2 VAL A 118 15.990 72.321 9.520 1.00 0.00 C ATOM 0 H VAL A 118 17.024 74.558 12.903 1.00 0.00 H new ATOM 0 HA VAL A 118 18.206 73.550 10.366 1.00 0.00 H new ATOM 0 HB VAL A 118 16.708 71.892 11.505 1.00 0.00 H new ATOM 0 HG11 VAL A 118 14.297 72.420 11.659 1.00 0.00 H new ATOM 0 HG12 VAL A 118 15.259 73.525 12.669 1.00 0.00 H new ATOM 0 HG13 VAL A 118 14.622 74.078 11.102 1.00 0.00 H new ATOM 0 HG21 VAL A 118 15.256 71.516 9.531 1.00 0.00 H new ATOM 0 HG22 VAL A 118 15.587 73.172 8.970 1.00 0.00 H new ATOM 0 HG23 VAL A 118 16.902 71.974 9.034 1.00 0.00 H new ATOM 1794 N GLU A 119 16.819 75.156 8.942 1.00 0.00 N ATOM 1795 CA GLU A 119 16.280 76.286 8.184 1.00 0.00 C ATOM 1796 C GLU A 119 15.522 75.803 6.958 1.00 0.00 C ATOM 1797 O GLU A 119 16.118 75.309 5.999 1.00 0.00 O ATOM 1798 CB GLU A 119 17.414 77.215 7.753 1.00 0.00 C ATOM 1799 CG GLU A 119 16.827 78.464 7.092 1.00 0.00 C ATOM 1800 CD GLU A 119 17.951 79.424 6.717 1.00 0.00 C ATOM 1801 OE1 GLU A 119 19.047 79.248 7.220 1.00 0.00 O ATOM 1802 OE2 GLU A 119 17.697 80.319 5.927 1.00 0.00 O1- ATOM 0 H GLU A 119 17.250 74.430 8.369 1.00 0.00 H new ATOM 0 HA GLU A 119 15.589 76.830 8.828 1.00 0.00 H new ATOM 0 HB2 GLU A 119 18.016 77.497 8.617 1.00 0.00 H new ATOM 0 HB3 GLU A 119 18.076 76.700 7.057 1.00 0.00 H new ATOM 0 HG2 GLU A 119 16.262 78.185 6.202 1.00 0.00 H new ATOM 0 HG3 GLU A 119 16.130 78.953 7.772 1.00 0.00 H new ATOM 1809 N PHE A 120 14.199 75.946 7.005 1.00 0.00 N ATOM 1810 CA PHE A 120 13.346 75.525 5.890 1.00 0.00 C ATOM 1811 C PHE A 120 12.178 76.494 5.723 1.00 0.00 C ATOM 1812 O PHE A 120 11.862 77.251 6.640 1.00 0.00 O ATOM 1813 CB PHE A 120 12.812 74.112 6.129 1.00 0.00 C ATOM 1814 CG PHE A 120 11.814 74.122 7.263 1.00 0.00 C ATOM 1815 CD1 PHE A 120 10.462 74.365 6.997 1.00 0.00 C ATOM 1816 CD2 PHE A 120 12.239 73.886 8.573 1.00 0.00 C ATOM 1817 CE1 PHE A 120 9.534 74.370 8.045 1.00 0.00 C ATOM 1818 CE2 PHE A 120 11.313 73.891 9.621 1.00 0.00 C ATOM 1819 CZ PHE A 120 9.960 74.133 9.357 1.00 0.00 C ATOM 0 H PHE A 120 13.695 76.347 7.796 1.00 0.00 H new ATOM 0 HA PHE A 120 13.946 75.527 4.980 1.00 0.00 H new ATOM 0 HB2 PHE A 120 12.340 73.734 5.222 1.00 0.00 H new ATOM 0 HB3 PHE A 120 13.636 73.438 6.364 1.00 0.00 H new ATOM 0 HD1 PHE A 120 10.135 74.549 5.984 1.00 0.00 H new ATOM 0 HD2 PHE A 120 13.283 73.700 8.776 1.00 0.00 H new ATOM 0 HE1 PHE A 120 8.490 74.557 7.841 1.00 0.00 H new ATOM 0 HE2 PHE A 120 11.642 73.708 10.633 1.00 0.00 H new ATOM 0 HZ PHE A 120 9.244 74.137 10.166 1.00 0.00 H new ATOM 1829 N ALA A 121 11.528 76.458 4.562 1.00 0.00 N ATOM 1830 CA ALA A 121 10.391 77.337 4.302 1.00 0.00 C ATOM 1831 C ALA A 121 10.778 78.801 4.496 1.00 0.00 C ATOM 1832 O ALA A 121 9.918 79.678 4.543 1.00 0.00 O ATOM 1833 CB ALA A 121 9.224 76.976 5.228 1.00 0.00 C ATOM 0 H ALA A 121 11.767 75.834 3.791 1.00 0.00 H new ATOM 0 HA ALA A 121 10.082 77.198 3.266 1.00 0.00 H new ATOM 0 HB1 ALA A 121 8.381 77.637 5.026 1.00 0.00 H new ATOM 0 HB2 ALA A 121 8.925 75.943 5.051 1.00 0.00 H new ATOM 0 HB3 ALA A 121 9.535 77.091 6.266 1.00 0.00 H new ATOM 1839 N GLY A 122 12.078 79.055 4.604 1.00 0.00 N ATOM 1840 CA GLY A 122 12.572 80.417 4.786 1.00 0.00 C ATOM 1841 C GLY A 122 12.540 80.822 6.256 1.00 0.00 C ATOM 1842 O GLY A 122 12.737 81.990 6.594 1.00 0.00 O ATOM 0 H GLY A 122 12.806 78.341 4.569 1.00 0.00 H new ATOM 0 HA2 GLY A 122 13.592 80.491 4.408 1.00 0.00 H new ATOM 0 HA3 GLY A 122 11.964 81.108 4.202 1.00 0.00 H new ATOM 1846 N LYS A 123 12.294 79.848 7.128 1.00 0.00 N ATOM 1847 CA LYS A 123 12.237 80.095 8.570 1.00 0.00 C ATOM 1848 C LYS A 123 13.218 79.187 9.299 1.00 0.00 C ATOM 1849 O LYS A 123 13.479 78.062 8.867 1.00 0.00 O ATOM 1850 CB LYS A 123 10.822 79.841 9.086 1.00 0.00 C ATOM 1851 CG LYS A 123 9.879 80.918 8.560 1.00 0.00 C ATOM 1852 CD LYS A 123 8.472 80.658 9.096 1.00 0.00 C ATOM 1853 CE LYS A 123 7.522 81.729 8.556 1.00 0.00 C ATOM 1854 NZ LYS A 123 6.145 81.485 9.073 1.00 0.00 N1+ ATOM 0 H LYS A 123 12.130 78.877 6.862 1.00 0.00 H new ATOM 0 HA LYS A 123 12.508 81.134 8.758 1.00 0.00 H new ATOM 0 HB2 LYS A 123 10.480 78.857 8.766 1.00 0.00 H new ATOM 0 HB3 LYS A 123 10.817 79.841 10.176 1.00 0.00 H new ATOM 0 HG2 LYS A 123 10.224 81.904 8.872 1.00 0.00 H new ATOM 0 HG3 LYS A 123 9.873 80.912 7.470 1.00 0.00 H new ATOM 0 HD2 LYS A 123 8.132 79.667 8.794 1.00 0.00 H new ATOM 0 HD3 LYS A 123 8.476 80.675 10.186 1.00 0.00 H new ATOM 0 HE2 LYS A 123 7.864 82.719 8.858 1.00 0.00 H new ATOM 0 HE3 LYS A 123 7.520 81.711 7.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 5.689 82.394 9.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 5.589 80.980 8.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 6.196 80.911 9.938 1.00 0.00 H new ATOM 1868 N VAL A 124 13.768 79.688 10.405 1.00 0.00 N ATOM 1869 CA VAL A 124 14.737 78.925 11.192 1.00 0.00 C ATOM 1870 C VAL A 124 14.125 78.437 12.499 1.00 0.00 C ATOM 1871 O VAL A 124 13.686 79.231 13.329 1.00 0.00 O ATOM 1872 CB VAL A 124 15.952 79.810 11.500 1.00 0.00 C ATOM 1873 CG1 VAL A 124 15.556 80.923 12.488 1.00 0.00 C ATOM 1874 CG2 VAL A 124 17.061 78.948 12.109 1.00 0.00 C ATOM 0 H VAL A 124 13.560 80.615 10.775 1.00 0.00 H new ATOM 0 HA VAL A 124 15.041 78.055 10.610 1.00 0.00 H new ATOM 0 HB VAL A 124 16.309 80.269 10.578 1.00 0.00 H new ATOM 0 HG11 VAL A 124 16.424 81.546 12.701 1.00 0.00 H new ATOM 0 HG12 VAL A 124 14.768 81.536 12.049 1.00 0.00 H new ATOM 0 HG13 VAL A 124 15.194 80.476 13.414 1.00 0.00 H new ATOM 0 HG21 VAL A 124 17.927 79.572 12.330 1.00 0.00 H new ATOM 0 HG22 VAL A 124 16.701 78.488 13.029 1.00 0.00 H new ATOM 0 HG23 VAL A 124 17.346 78.169 11.402 1.00 0.00 H new ATOM 1884 N PHE A 125 14.096 77.117 12.671 1.00 0.00 N ATOM 1885 CA PHE A 125 13.540 76.519 13.885 1.00 0.00 C ATOM 1886 C PHE A 125 14.665 76.038 14.794 1.00 0.00 C ATOM 1887 O PHE A 125 15.344 75.053 14.494 1.00 0.00 O ATOM 1888 CB PHE A 125 12.638 75.338 13.516 1.00 0.00 C ATOM 1889 CG PHE A 125 11.424 75.849 12.781 1.00 0.00 C ATOM 1890 CD1 PHE A 125 11.509 76.148 11.417 1.00 0.00 C ATOM 1891 CD2 PHE A 125 10.210 76.022 13.459 1.00 0.00 C ATOM 1892 CE1 PHE A 125 10.386 76.624 10.731 1.00 0.00 C ATOM 1893 CE2 PHE A 125 9.091 76.499 12.770 1.00 0.00 C ATOM 1894 CZ PHE A 125 9.178 76.802 11.409 1.00 0.00 C ATOM 0 H PHE A 125 14.448 76.444 11.990 1.00 0.00 H new ATOM 0 HA PHE A 125 12.953 77.272 14.411 1.00 0.00 H new ATOM 0 HB2 PHE A 125 13.184 74.630 12.892 1.00 0.00 H new ATOM 0 HB3 PHE A 125 12.334 74.803 14.416 1.00 0.00 H new ATOM 0 HD1 PHE A 125 12.443 76.011 10.892 1.00 0.00 H new ATOM 0 HD2 PHE A 125 10.139 75.788 14.511 1.00 0.00 H new ATOM 0 HE1 PHE A 125 10.453 76.854 9.678 1.00 0.00 H new ATOM 0 HE2 PHE A 125 8.155 76.634 13.292 1.00 0.00 H new ATOM 0 HZ PHE A 125 8.312 77.174 10.882 1.00 0.00 H new ATOM 1904 N SER A 126 14.865 76.746 15.900 1.00 0.00 N ATOM 1905 CA SER A 126 15.916 76.390 16.844 1.00 0.00 C ATOM 1906 C SER A 126 15.462 75.236 17.734 1.00 0.00 C ATOM 1907 O SER A 126 14.345 75.246 18.255 1.00 0.00 O ATOM 1908 CB SER A 126 16.272 77.603 17.709 1.00 0.00 C ATOM 1909 OG SER A 126 17.067 78.504 16.949 1.00 0.00 O ATOM 0 H SER A 126 14.317 77.565 16.163 1.00 0.00 H new ATOM 0 HA SER A 126 16.797 76.076 16.284 1.00 0.00 H new ATOM 0 HB2 SER A 126 15.364 78.100 18.050 1.00 0.00 H new ATOM 0 HB3 SER A 126 16.814 77.283 18.599 1.00 0.00 H new ATOM 0 HG SER A 126 17.295 79.282 17.499 1.00 0.00 H new ATOM 1915 N GLY A 127 16.336 74.249 17.910 1.00 0.00 N ATOM 1916 CA GLY A 127 16.025 73.090 18.746 1.00 0.00 C ATOM 1917 C GLY A 127 16.588 73.276 20.149 1.00 0.00 C ATOM 1918 O GLY A 127 17.075 74.353 20.493 1.00 0.00 O ATOM 0 H GLY A 127 17.264 74.227 17.487 1.00 0.00 H new ATOM 0 HA2 GLY A 127 14.945 72.951 18.797 1.00 0.00 H new ATOM 0 HA3 GLY A 127 16.442 72.188 18.297 1.00 0.00 H new ATOM 1922 N GLU A 128 16.526 72.219 20.958 1.00 0.00 N ATOM 1923 CA GLU A 128 17.033 72.267 22.313 1.00 0.00 C ATOM 1924 C GLU A 128 18.479 71.814 22.368 1.00 0.00 C ATOM 1925 O GLU A 128 18.833 70.769 21.830 1.00 0.00 O ATOM 1926 CB GLU A 128 16.185 71.378 23.216 1.00 0.00 C ATOM 1927 CG GLU A 128 16.840 71.256 24.584 1.00 0.00 C ATOM 1928 CD GLU A 128 15.886 70.598 25.574 1.00 0.00 C ATOM 1929 OE1 GLU A 128 14.702 70.552 25.284 1.00 0.00 O ATOM 1930 OE2 GLU A 128 16.354 70.150 26.608 1.00 0.00 O1- ATOM 0 H GLU A 128 16.127 71.320 20.690 1.00 0.00 H new ATOM 0 HA GLU A 128 16.980 73.299 22.660 1.00 0.00 H new ATOM 0 HB2 GLU A 128 15.184 71.798 23.318 1.00 0.00 H new ATOM 0 HB3 GLU A 128 16.072 70.391 22.768 1.00 0.00 H new ATOM 0 HG2 GLU A 128 17.754 70.668 24.505 1.00 0.00 H new ATOM 0 HG3 GLU A 128 17.126 72.243 24.946 1.00 0.00 H new ATOM 1937 N GLU A 129 19.302 72.607 23.023 1.00 0.00 N ATOM 1938 CA GLU A 129 20.718 72.285 23.155 1.00 0.00 C ATOM 1939 C GLU A 129 20.912 71.059 24.038 1.00 0.00 C ATOM 1940 O GLU A 129 20.052 70.723 24.851 1.00 0.00 O ATOM 1941 CB GLU A 129 21.474 73.476 23.753 1.00 0.00 C ATOM 1942 CG GLU A 129 20.908 73.807 25.137 1.00 0.00 C ATOM 1943 CD GLU A 129 21.606 75.037 25.706 1.00 0.00 C ATOM 1944 OE1 GLU A 129 22.782 75.209 25.432 1.00 0.00 O ATOM 1945 OE2 GLU A 129 20.952 75.792 26.408 1.00 0.00 O1- ATOM 0 H GLU A 129 19.021 73.478 23.473 1.00 0.00 H new ATOM 0 HA GLU A 129 21.113 72.067 22.163 1.00 0.00 H new ATOM 0 HB2 GLU A 129 22.536 73.243 23.830 1.00 0.00 H new ATOM 0 HB3 GLU A 129 21.385 74.342 23.097 1.00 0.00 H new ATOM 0 HG2 GLU A 129 19.835 73.988 25.066 1.00 0.00 H new ATOM 0 HG3 GLU A 129 21.045 72.958 25.807 1.00 0.00 H new ATOM 1952 N ALA A 130 22.049 70.395 23.868 1.00 0.00 N ATOM 1953 CA ALA A 130 22.348 69.204 24.650 1.00 0.00 C ATOM 1954 C ALA A 130 23.797 68.773 24.452 1.00 0.00 C ATOM 1955 O ALA A 130 24.442 69.155 23.477 1.00 0.00 O ATOM 1956 CB ALA A 130 21.412 68.066 24.244 1.00 0.00 C ATOM 0 H ALA A 130 22.774 70.659 23.201 1.00 0.00 H new ATOM 0 HA ALA A 130 22.198 69.440 25.703 1.00 0.00 H new ATOM 0 HB1 ALA A 130 21.642 67.178 24.833 1.00 0.00 H new ATOM 0 HB2 ALA A 130 20.379 68.363 24.423 1.00 0.00 H new ATOM 0 HB3 ALA A 130 21.547 67.844 23.185 1.00 0.00 H new ATOM 1962 N LYS A 131 24.296 67.970 25.384 1.00 0.00 N ATOM 1963 CA LYS A 131 25.667 67.475 25.309 1.00 0.00 C ATOM 1964 C LYS A 131 25.751 66.310 24.334 1.00 0.00 C ATOM 1965 O LYS A 131 26.542 65.386 24.521 1.00 0.00 O ATOM 1966 CB LYS A 131 26.149 67.032 26.696 1.00 0.00 C ATOM 1967 CG LYS A 131 27.683 67.031 26.739 1.00 0.00 C ATOM 1968 CD LYS A 131 28.158 66.763 28.170 1.00 0.00 C ATOM 1969 CE LYS A 131 27.835 65.320 28.570 1.00 0.00 C ATOM 1970 NZ LYS A 131 28.640 64.950 29.765 1.00 0.00 N1+ ATOM 0 H LYS A 131 23.774 67.648 26.199 1.00 0.00 H new ATOM 0 HA LYS A 131 26.309 68.281 24.954 1.00 0.00 H new ATOM 0 HB2 LYS A 131 25.755 67.703 27.459 1.00 0.00 H new ATOM 0 HB3 LYS A 131 25.769 66.035 26.922 1.00 0.00 H new ATOM 0 HG2 LYS A 131 28.075 66.268 26.066 1.00 0.00 H new ATOM 0 HG3 LYS A 131 28.067 67.990 26.391 1.00 0.00 H new ATOM 0 HD2 LYS A 131 29.231 66.938 28.244 1.00 0.00 H new ATOM 0 HD3 LYS A 131 27.674 67.456 28.858 1.00 0.00 H new ATOM 0 HE2 LYS A 131 26.772 65.220 28.788 1.00 0.00 H new ATOM 0 HE3 LYS A 131 28.056 64.643 27.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 28.423 63.971 30.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 29.652 65.031 29.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 28.408 65.590 30.552 1.00 0.00 H new ATOM 1984 N THR A 132 24.934 66.363 23.294 1.00 0.00 N ATOM 1985 CA THR A 132 24.920 65.306 22.290 1.00 0.00 C ATOM 1986 C THR A 132 24.348 65.819 20.975 1.00 0.00 C ATOM 1987 O THR A 132 23.535 66.746 20.959 1.00 0.00 O ATOM 1988 CB THR A 132 24.087 64.125 22.791 1.00 0.00 C ATOM 1989 OG1 THR A 132 23.966 63.161 21.755 1.00 0.00 O ATOM 1990 CG2 THR A 132 22.699 64.617 23.200 1.00 0.00 C ATOM 0 H THR A 132 24.274 67.122 23.122 1.00 0.00 H new ATOM 0 HA THR A 132 25.946 64.980 22.118 1.00 0.00 H new ATOM 0 HB THR A 132 24.577 63.672 23.653 1.00 0.00 H new ATOM 0 HG1 THR A 132 23.434 62.402 22.074 1.00 0.00 H new ATOM 0 HG21 THR A 132 22.105 63.775 23.557 1.00 0.00 H new ATOM 0 HG22 THR A 132 22.795 65.357 23.995 1.00 0.00 H new ATOM 0 HG23 THR A 132 22.206 65.070 22.340 1.00 0.00 H new ATOM 1998 N LYS A 133 24.765 65.204 19.874 1.00 0.00 N ATOM 1999 CA LYS A 133 24.281 65.595 18.554 1.00 0.00 C ATOM 2000 C LYS A 133 22.931 64.940 18.271 1.00 0.00 C ATOM 2001 O LYS A 133 22.186 65.387 17.403 1.00 0.00 O ATOM 2002 CB LYS A 133 25.313 65.191 17.478 1.00 0.00 C ATOM 2003 CG LYS A 133 26.153 66.405 17.071 1.00 0.00 C ATOM 2004 CD LYS A 133 27.269 65.962 16.130 1.00 0.00 C ATOM 2005 CE LYS A 133 28.100 67.178 15.723 1.00 0.00 C ATOM 2006 NZ LYS A 133 29.198 66.746 14.815 1.00 0.00 N1+ ATOM 0 H LYS A 133 25.435 64.435 19.868 1.00 0.00 H new ATOM 0 HA LYS A 133 24.150 66.677 18.528 1.00 0.00 H new ATOM 0 HB2 LYS A 133 25.961 64.403 17.862 1.00 0.00 H new ATOM 0 HB3 LYS A 133 24.800 64.785 16.606 1.00 0.00 H new ATOM 0 HG2 LYS A 133 25.524 67.148 16.581 1.00 0.00 H new ATOM 0 HG3 LYS A 133 26.577 66.880 17.956 1.00 0.00 H new ATOM 0 HD2 LYS A 133 27.902 65.223 16.621 1.00 0.00 H new ATOM 0 HD3 LYS A 133 26.847 65.484 15.246 1.00 0.00 H new ATOM 0 HE2 LYS A 133 27.469 67.913 15.224 1.00 0.00 H new ATOM 0 HE3 LYS A 133 28.514 67.662 16.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 29.764 67.573 14.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 29.805 66.060 15.307 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 28.792 66.303 13.966 1.00 0.00 H new ATOM 2020 N LYS A 134 22.631 63.868 18.992 1.00 0.00 N ATOM 2021 CA LYS A 134 21.373 63.170 18.777 1.00 0.00 C ATOM 2022 C LYS A 134 20.197 63.979 19.309 1.00 0.00 C ATOM 2023 O LYS A 134 19.254 64.269 18.574 1.00 0.00 O ATOM 2024 CB LYS A 134 21.408 61.817 19.481 1.00 0.00 C ATOM 2025 CG LYS A 134 22.419 60.904 18.784 1.00 0.00 C ATOM 2026 CD LYS A 134 22.325 59.490 19.364 1.00 0.00 C ATOM 2027 CE LYS A 134 22.819 59.480 20.813 1.00 0.00 C ATOM 2028 NZ LYS A 134 23.079 58.074 21.237 1.00 0.00 N1+ ATOM 0 H LYS A 134 23.228 63.470 19.716 1.00 0.00 H new ATOM 0 HA LYS A 134 21.243 63.031 17.704 1.00 0.00 H new ATOM 0 HB2 LYS A 134 21.681 61.947 20.528 1.00 0.00 H new ATOM 0 HB3 LYS A 134 20.418 61.361 19.464 1.00 0.00 H new ATOM 0 HG2 LYS A 134 22.224 60.881 17.712 1.00 0.00 H new ATOM 0 HG3 LYS A 134 23.428 61.295 18.916 1.00 0.00 H new ATOM 0 HD2 LYS A 134 21.294 59.139 19.321 1.00 0.00 H new ATOM 0 HD3 LYS A 134 22.921 58.802 18.764 1.00 0.00 H new ATOM 0 HE2 LYS A 134 23.729 60.073 20.903 1.00 0.00 H new ATOM 0 HE3 LYS A 134 22.075 59.937 21.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 23.415 58.065 22.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 22.201 57.522 21.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 23.803 57.654 20.620 1.00 0.00 H new ATOM 2042 N LEU A 135 20.246 64.326 20.591 1.00 0.00 N ATOM 2043 CA LEU A 135 19.169 65.082 21.205 1.00 0.00 C ATOM 2044 C LEU A 135 19.040 66.465 20.576 1.00 0.00 C ATOM 2045 O LEU A 135 17.936 66.942 20.326 1.00 0.00 O ATOM 2046 CB LEU A 135 19.435 65.222 22.714 1.00 0.00 C ATOM 2047 CG LEU A 135 18.101 65.387 23.470 1.00 0.00 C ATOM 2048 CD1 LEU A 135 17.494 64.001 23.744 1.00 0.00 C ATOM 2049 CD2 LEU A 135 18.341 66.115 24.798 1.00 0.00 C ATOM 0 H LEU A 135 21.016 64.096 21.219 1.00 0.00 H new ATOM 0 HA LEU A 135 18.235 64.545 21.041 1.00 0.00 H new ATOM 0 HB2 LEU A 135 19.965 64.343 23.082 1.00 0.00 H new ATOM 0 HB3 LEU A 135 20.077 66.083 22.900 1.00 0.00 H new ATOM 0 HG LEU A 135 17.412 65.973 22.861 1.00 0.00 H new ATOM 0 HD11 LEU A 135 16.551 64.116 24.278 1.00 0.00 H new ATOM 0 HD12 LEU A 135 17.315 63.489 22.799 1.00 0.00 H new ATOM 0 HD13 LEU A 135 18.185 63.414 24.350 1.00 0.00 H new ATOM 0 HD21 LEU A 135 17.395 66.228 25.327 1.00 0.00 H new ATOM 0 HD22 LEU A 135 19.032 65.536 25.411 1.00 0.00 H new ATOM 0 HD23 LEU A 135 18.767 67.099 24.602 1.00 0.00 H new ATOM 2061 N ALA A 136 20.177 67.109 20.339 1.00 0.00 N ATOM 2062 CA ALA A 136 20.173 68.446 19.763 1.00 0.00 C ATOM 2063 C ALA A 136 19.414 68.470 18.440 1.00 0.00 C ATOM 2064 O ALA A 136 18.487 69.259 18.260 1.00 0.00 O ATOM 2065 CB ALA A 136 21.610 68.912 19.532 1.00 0.00 C ATOM 0 H ALA A 136 21.104 66.731 20.535 1.00 0.00 H new ATOM 0 HA ALA A 136 19.673 69.117 20.462 1.00 0.00 H new ATOM 0 HB1 ALA A 136 21.603 69.913 19.101 1.00 0.00 H new ATOM 0 HB2 ALA A 136 22.144 68.930 20.482 1.00 0.00 H new ATOM 0 HB3 ALA A 136 22.110 68.226 18.848 1.00 0.00 H new ATOM 2071 N GLU A 137 19.810 67.598 17.515 1.00 0.00 N ATOM 2072 CA GLU A 137 19.160 67.530 16.214 1.00 0.00 C ATOM 2073 C GLU A 137 17.728 67.023 16.364 1.00 0.00 C ATOM 2074 O GLU A 137 16.817 67.498 15.684 1.00 0.00 O ATOM 2075 CB GLU A 137 19.960 66.601 15.281 1.00 0.00 C ATOM 2076 CG GLU A 137 21.040 67.387 14.518 1.00 0.00 C ATOM 2077 CD GLU A 137 22.157 67.826 15.459 1.00 0.00 C ATOM 2078 OE1 GLU A 137 22.027 67.608 16.648 1.00 0.00 O ATOM 2079 OE2 GLU A 137 23.120 68.394 14.971 1.00 0.00 O1- ATOM 0 H GLU A 137 20.573 66.934 17.644 1.00 0.00 H new ATOM 0 HA GLU A 137 19.129 68.529 15.780 1.00 0.00 H new ATOM 0 HB2 GLU A 137 20.426 65.807 15.864 1.00 0.00 H new ATOM 0 HB3 GLU A 137 19.285 66.121 14.572 1.00 0.00 H new ATOM 0 HG2 GLU A 137 21.452 66.768 13.721 1.00 0.00 H new ATOM 0 HG3 GLU A 137 20.593 68.261 14.044 1.00 0.00 H new ATOM 2086 N MET A 138 17.536 66.056 17.248 1.00 0.00 N ATOM 2087 CA MET A 138 16.211 65.499 17.464 1.00 0.00 C ATOM 2088 C MET A 138 15.240 66.578 17.927 1.00 0.00 C ATOM 2089 O MET A 138 14.122 66.675 17.423 1.00 0.00 O ATOM 2090 CB MET A 138 16.281 64.392 18.513 1.00 0.00 C ATOM 2091 CG MET A 138 14.892 63.790 18.715 1.00 0.00 C ATOM 2092 SD MET A 138 15.006 62.357 19.814 1.00 0.00 S ATOM 2093 CE MET A 138 15.069 61.082 18.530 1.00 0.00 C ATOM 0 H MET A 138 18.272 65.645 17.822 1.00 0.00 H new ATOM 0 HA MET A 138 15.852 65.089 16.520 1.00 0.00 H new ATOM 0 HB2 MET A 138 16.981 63.619 18.195 1.00 0.00 H new ATOM 0 HB3 MET A 138 16.655 64.793 19.455 1.00 0.00 H new ATOM 0 HG2 MET A 138 14.220 64.535 19.141 1.00 0.00 H new ATOM 0 HG3 MET A 138 14.470 63.492 17.755 1.00 0.00 H new ATOM 0 HE1 MET A 138 15.142 60.099 18.996 1.00 0.00 H new ATOM 0 HE2 MET A 138 14.164 61.130 17.925 1.00 0.00 H new ATOM 0 HE3 MET A 138 15.939 61.248 17.895 1.00 0.00 H new ATOM 2103 N SER A 139 15.670 67.387 18.891 1.00 0.00 N ATOM 2104 CA SER A 139 14.823 68.451 19.416 1.00 0.00 C ATOM 2105 C SER A 139 14.451 69.438 18.317 1.00 0.00 C ATOM 2106 O SER A 139 13.333 69.946 18.284 1.00 0.00 O ATOM 2107 CB SER A 139 15.545 69.194 20.545 1.00 0.00 C ATOM 2108 OG SER A 139 15.728 68.309 21.644 1.00 0.00 O ATOM 0 H SER A 139 16.593 67.327 19.321 1.00 0.00 H new ATOM 0 HA SER A 139 13.912 67.997 19.805 1.00 0.00 H new ATOM 0 HB2 SER A 139 16.509 69.563 20.195 1.00 0.00 H new ATOM 0 HB3 SER A 139 14.964 70.063 20.855 1.00 0.00 H new ATOM 0 HG SER A 139 16.455 67.683 21.442 1.00 0.00 H new ATOM 2114 N ALA A 140 15.400 69.709 17.426 1.00 0.00 N ATOM 2115 CA ALA A 140 15.164 70.650 16.334 1.00 0.00 C ATOM 2116 C ALA A 140 14.097 70.117 15.384 1.00 0.00 C ATOM 2117 O ALA A 140 13.210 70.849 14.951 1.00 0.00 O ATOM 2118 CB ALA A 140 16.463 70.892 15.566 1.00 0.00 C ATOM 0 H ALA A 140 16.332 69.295 17.437 1.00 0.00 H new ATOM 0 HA ALA A 140 14.813 71.590 16.759 1.00 0.00 H new ATOM 0 HB1 ALA A 140 16.280 71.595 14.753 1.00 0.00 H new ATOM 0 HB2 ALA A 140 17.213 71.305 16.241 1.00 0.00 H new ATOM 0 HB3 ALA A 140 16.824 69.949 15.156 1.00 0.00 H new ATOM 2124 N ALA A 141 14.195 68.838 15.058 1.00 0.00 N ATOM 2125 CA ALA A 141 13.233 68.221 14.159 1.00 0.00 C ATOM 2126 C ALA A 141 11.876 68.074 14.839 1.00 0.00 C ATOM 2127 O ALA A 141 10.842 68.034 14.172 1.00 0.00 O ATOM 2128 CB ALA A 141 13.736 66.846 13.723 1.00 0.00 C ATOM 0 H ALA A 141 14.924 68.212 15.399 1.00 0.00 H new ATOM 0 HA ALA A 141 13.120 68.863 13.285 1.00 0.00 H new ATOM 0 HB1 ALA A 141 13.010 66.390 13.050 1.00 0.00 H new ATOM 0 HB2 ALA A 141 14.691 66.954 13.208 1.00 0.00 H new ATOM 0 HB3 ALA A 141 13.867 66.212 14.600 1.00 0.00 H new ATOM 2134 N LYS A 142 11.879 68.008 16.169 1.00 0.00 N ATOM 2135 CA LYS A 142 10.634 67.878 16.922 1.00 0.00 C ATOM 2136 C LYS A 142 9.837 69.181 16.906 1.00 0.00 C ATOM 2137 O LYS A 142 8.639 69.184 16.619 1.00 0.00 O ATOM 2138 CB LYS A 142 10.947 67.477 18.374 1.00 0.00 C ATOM 2139 CG LYS A 142 11.104 65.959 18.475 1.00 0.00 C ATOM 2140 CD LYS A 142 11.476 65.580 19.906 1.00 0.00 C ATOM 2141 CE LYS A 142 11.444 64.057 20.052 1.00 0.00 C ATOM 2142 NZ LYS A 142 11.818 63.686 21.445 1.00 0.00 N1+ ATOM 0 H LYS A 142 12.722 68.042 16.743 1.00 0.00 H new ATOM 0 HA LYS A 142 10.029 67.105 16.448 1.00 0.00 H new ATOM 0 HB2 LYS A 142 11.861 67.968 18.707 1.00 0.00 H new ATOM 0 HB3 LYS A 142 10.147 67.813 19.033 1.00 0.00 H new ATOM 0 HG2 LYS A 142 10.175 65.467 18.187 1.00 0.00 H new ATOM 0 HG3 LYS A 142 11.874 65.616 17.785 1.00 0.00 H new ATOM 0 HD2 LYS A 142 12.469 65.959 20.148 1.00 0.00 H new ATOM 0 HD3 LYS A 142 10.780 66.039 20.608 1.00 0.00 H new ATOM 0 HE2 LYS A 142 10.449 63.679 19.818 1.00 0.00 H new ATOM 0 HE3 LYS A 142 12.134 63.598 19.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 11.797 62.651 21.546 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 12.776 64.035 21.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 11.143 64.113 22.111 1.00 0.00 H new ATOM 2156 N VAL A 143 10.507 70.283 17.227 1.00 0.00 N ATOM 2157 CA VAL A 143 9.844 71.582 17.261 1.00 0.00 C ATOM 2158 C VAL A 143 9.379 71.982 15.868 1.00 0.00 C ATOM 2159 O VAL A 143 8.271 72.491 15.695 1.00 0.00 O ATOM 2160 CB VAL A 143 10.794 72.645 17.822 1.00 0.00 C ATOM 2161 CG1 VAL A 143 12.088 72.655 17.014 1.00 0.00 C ATOM 2162 CG2 VAL A 143 10.137 74.023 17.737 1.00 0.00 C ATOM 0 H VAL A 143 11.499 70.304 17.465 1.00 0.00 H new ATOM 0 HA VAL A 143 8.972 71.507 17.910 1.00 0.00 H new ATOM 0 HB VAL A 143 11.015 72.411 18.863 1.00 0.00 H new ATOM 0 HG11 VAL A 143 12.762 73.412 17.415 1.00 0.00 H new ATOM 0 HG12 VAL A 143 12.564 71.676 17.077 1.00 0.00 H new ATOM 0 HG13 VAL A 143 11.865 72.884 15.972 1.00 0.00 H new ATOM 0 HG21 VAL A 143 10.817 74.775 18.137 1.00 0.00 H new ATOM 0 HG22 VAL A 143 9.911 74.255 16.696 1.00 0.00 H new ATOM 0 HG23 VAL A 143 9.214 74.022 18.317 1.00 0.00 H new ATOM 2172 N ALA A 144 10.227 71.745 14.877 1.00 0.00 N ATOM 2173 CA ALA A 144 9.892 72.084 13.501 1.00 0.00 C ATOM 2174 C ALA A 144 8.721 71.241 13.006 1.00 0.00 C ATOM 2175 O ALA A 144 7.783 71.757 12.406 1.00 0.00 O ATOM 2176 CB ALA A 144 11.110 71.850 12.605 1.00 0.00 C ATOM 0 H ALA A 144 11.147 71.322 14.999 1.00 0.00 H new ATOM 0 HA ALA A 144 9.603 73.134 13.462 1.00 0.00 H new ATOM 0 HB1 ALA A 144 10.858 72.104 11.575 1.00 0.00 H new ATOM 0 HB2 ALA A 144 11.935 72.477 12.942 1.00 0.00 H new ATOM 0 HB3 ALA A 144 11.405 70.802 12.658 1.00 0.00 H new ATOM 2182 N PHE A 145 8.786 69.940 13.258 1.00 0.00 N ATOM 2183 CA PHE A 145 7.731 69.038 12.816 1.00 0.00 C ATOM 2184 C PHE A 145 6.385 69.455 13.387 1.00 0.00 C ATOM 2185 O PHE A 145 5.399 69.553 12.660 1.00 0.00 O ATOM 2186 CB PHE A 145 8.055 67.610 13.257 1.00 0.00 C ATOM 2187 CG PHE A 145 6.997 66.666 12.740 1.00 0.00 C ATOM 2188 CD1 PHE A 145 7.146 66.070 11.483 1.00 0.00 C ATOM 2189 CD2 PHE A 145 5.867 66.389 13.518 1.00 0.00 C ATOM 2190 CE1 PHE A 145 6.166 65.194 11.003 1.00 0.00 C ATOM 2191 CE2 PHE A 145 4.887 65.513 13.038 1.00 0.00 C ATOM 2192 CZ PHE A 145 5.037 64.915 11.781 1.00 0.00 C ATOM 0 H PHE A 145 9.550 69.489 13.761 1.00 0.00 H new ATOM 0 HA PHE A 145 7.674 69.083 11.728 1.00 0.00 H new ATOM 0 HB2 PHE A 145 9.034 67.316 12.880 1.00 0.00 H new ATOM 0 HB3 PHE A 145 8.103 67.557 14.345 1.00 0.00 H new ATOM 0 HD1 PHE A 145 8.018 66.286 10.883 1.00 0.00 H new ATOM 0 HD2 PHE A 145 5.752 66.851 14.487 1.00 0.00 H new ATOM 0 HE1 PHE A 145 6.281 64.734 10.033 1.00 0.00 H new ATOM 0 HE2 PHE A 145 4.015 65.298 13.637 1.00 0.00 H new ATOM 0 HZ PHE A 145 4.281 64.238 11.412 1.00 0.00 H new ATOM 2202 N MET A 146 6.346 69.707 14.686 1.00 0.00 N ATOM 2203 CA MET A 146 5.107 70.112 15.335 1.00 0.00 C ATOM 2204 C MET A 146 4.680 71.499 14.864 1.00 0.00 C ATOM 2205 O MET A 146 3.490 71.761 14.689 1.00 0.00 O ATOM 2206 CB MET A 146 5.292 70.121 16.853 1.00 0.00 C ATOM 2207 CG MET A 146 5.297 68.684 17.376 1.00 0.00 C ATOM 2208 SD MET A 146 3.592 68.117 17.597 1.00 0.00 S ATOM 2209 CE MET A 146 3.797 66.483 16.845 1.00 0.00 C ATOM 0 H MET A 146 7.151 69.639 15.309 1.00 0.00 H new ATOM 0 HA MET A 146 4.329 69.397 15.067 1.00 0.00 H new ATOM 0 HB2 MET A 146 6.227 70.617 17.113 1.00 0.00 H new ATOM 0 HB3 MET A 146 4.489 70.688 17.324 1.00 0.00 H new ATOM 0 HG2 MET A 146 5.820 68.033 16.676 1.00 0.00 H new ATOM 0 HG3 MET A 146 5.835 68.632 18.323 1.00 0.00 H new ATOM 0 HE1 MET A 146 2.874 65.914 16.953 1.00 0.00 H new ATOM 0 HE2 MET A 146 4.031 66.596 15.787 1.00 0.00 H new ATOM 0 HE3 MET A 146 4.610 65.953 17.342 1.00 0.00 H new ATOM 2219 N SER A 147 5.648 72.389 14.658 1.00 0.00 N ATOM 2220 CA SER A 147 5.330 73.734 14.204 1.00 0.00 C ATOM 2221 C SER A 147 4.704 73.701 12.814 1.00 0.00 C ATOM 2222 O SER A 147 3.761 74.440 12.528 1.00 0.00 O ATOM 2223 CB SER A 147 6.587 74.585 14.180 1.00 0.00 C ATOM 2224 OG SER A 147 7.184 74.579 15.471 1.00 0.00 O ATOM 0 H SER A 147 6.642 72.205 14.796 1.00 0.00 H new ATOM 0 HA SER A 147 4.612 74.169 14.899 1.00 0.00 H new ATOM 0 HB2 SER A 147 7.288 74.198 13.441 1.00 0.00 H new ATOM 0 HB3 SER A 147 6.343 75.605 13.884 1.00 0.00 H new ATOM 0 HG SER A 147 7.924 73.937 15.486 1.00 0.00 H new ATOM 2230 N ILE A 148 5.231 72.833 11.959 1.00 0.00 N ATOM 2231 CA ILE A 148 4.719 72.692 10.600 1.00 0.00 C ATOM 2232 C ILE A 148 3.270 72.214 10.626 1.00 0.00 C ATOM 2233 O ILE A 148 2.462 72.608 9.787 1.00 0.00 O ATOM 2234 CB ILE A 148 5.586 71.718 9.796 1.00 0.00 C ATOM 2235 CG1 ILE A 148 6.956 72.359 9.527 1.00 0.00 C ATOM 2236 CG2 ILE A 148 4.908 71.396 8.458 1.00 0.00 C ATOM 2237 CD1 ILE A 148 7.952 71.282 9.085 1.00 0.00 C ATOM 0 H ILE A 148 6.012 72.216 12.182 1.00 0.00 H new ATOM 0 HA ILE A 148 4.756 73.668 10.115 1.00 0.00 H new ATOM 0 HB ILE A 148 5.713 70.798 10.366 1.00 0.00 H new ATOM 0 HG12 ILE A 148 6.865 73.123 8.755 1.00 0.00 H new ATOM 0 HG13 ILE A 148 7.319 72.856 10.427 1.00 0.00 H new ATOM 0 HG21 ILE A 148 5.531 70.703 7.892 1.00 0.00 H new ATOM 0 HG22 ILE A 148 3.935 70.941 8.643 1.00 0.00 H new ATOM 0 HG23 ILE A 148 4.776 72.315 7.887 1.00 0.00 H new ATOM 0 HD11 ILE A 148 8.923 71.740 8.895 1.00 0.00 H new ATOM 0 HD12 ILE A 148 8.052 70.534 9.871 1.00 0.00 H new ATOM 0 HD13 ILE A 148 7.591 70.805 8.174 1.00 0.00 H new ATOM 2249 N LYS A 149 2.949 71.352 11.586 1.00 0.00 N ATOM 2250 CA LYS A 149 1.596 70.824 11.701 1.00 0.00 C ATOM 2251 C LYS A 149 0.593 71.960 11.895 1.00 0.00 C ATOM 2252 O LYS A 149 -0.501 71.934 11.335 1.00 0.00 O ATOM 2253 CB LYS A 149 1.543 69.849 12.898 1.00 0.00 C ATOM 2254 CG LYS A 149 1.662 68.406 12.421 1.00 0.00 C ATOM 2255 CD LYS A 149 3.036 68.167 11.784 1.00 0.00 C ATOM 2256 CE LYS A 149 2.958 66.982 10.836 1.00 0.00 C ATOM 2257 NZ LYS A 149 4.252 66.843 10.118 1.00 0.00 N1+ ATOM 0 H LYS A 149 3.602 71.007 12.290 1.00 0.00 H new ATOM 0 HA LYS A 149 1.331 70.296 10.785 1.00 0.00 H new ATOM 0 HB2 LYS A 149 2.351 70.075 13.594 1.00 0.00 H new ATOM 0 HB3 LYS A 149 0.607 69.982 13.441 1.00 0.00 H new ATOM 0 HG2 LYS A 149 1.520 67.726 13.261 1.00 0.00 H new ATOM 0 HG3 LYS A 149 0.876 68.189 11.698 1.00 0.00 H new ATOM 0 HD2 LYS A 149 3.358 69.057 11.244 1.00 0.00 H new ATOM 0 HD3 LYS A 149 3.779 67.978 12.558 1.00 0.00 H new ATOM 0 HE2 LYS A 149 2.737 66.071 11.392 1.00 0.00 H new ATOM 0 HE3 LYS A 149 2.146 67.125 10.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 4.072 66.627 9.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 4.786 67.732 10.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 4.804 66.072 10.544 1.00 0.00 H new ATOM 2271 N ASN A 150 0.971 72.952 12.691 1.00 0.00 N ATOM 2272 CA ASN A 150 0.091 74.087 12.947 1.00 0.00 C ATOM 2273 C ASN A 150 0.253 75.143 11.858 1.00 0.00 C ATOM 2274 O ASN A 150 1.321 75.735 11.710 1.00 0.00 O ATOM 2275 CB ASN A 150 0.411 74.699 14.311 1.00 0.00 C ATOM 2276 CG ASN A 150 -0.754 75.564 14.779 1.00 0.00 C ATOM 2277 OD1 ASN A 150 -1.621 75.921 13.980 1.00 0.00 O ATOM 2278 ND2 ASN A 150 -0.828 75.924 16.029 1.00 0.00 N ATOM 0 H ASN A 150 1.872 72.995 13.167 1.00 0.00 H new ATOM 0 HA ASN A 150 -0.940 73.734 12.944 1.00 0.00 H new ATOM 0 HB2 ASN A 150 0.603 73.909 15.037 1.00 0.00 H new ATOM 0 HB3 ASN A 150 1.318 75.300 14.246 1.00 0.00 H new ATOM 0 HD21 ASN A 150 -1.605 76.503 16.348 1.00 0.00 H new ATOM 0 HD22 ASN A 150 -0.109 75.627 16.689 1.00 0.00 H new ATOM 2285 N GLY A 151 -0.815 75.371 11.099 1.00 0.00 N ATOM 2286 CA GLY A 151 -0.780 76.358 10.026 1.00 0.00 C ATOM 2287 C GLY A 151 -0.074 77.631 10.481 1.00 0.00 C ATOM 2288 O GLY A 151 -0.703 78.546 11.008 1.00 0.00 O ATOM 0 H GLY A 151 -1.708 74.890 11.206 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -0.265 75.942 9.160 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -1.796 76.594 9.710 1.00 0.00 H new ATOM 2292 N ASN A 152 1.238 77.678 10.274 1.00 0.00 N ATOM 2293 CA ASN A 152 2.023 78.841 10.668 1.00 0.00 C ATOM 2294 C ASN A 152 1.589 80.070 9.877 1.00 0.00 C ATOM 2295 O ASN A 152 1.490 81.169 10.423 1.00 0.00 O ATOM 2296 CB ASN A 152 3.512 78.573 10.428 1.00 0.00 C ATOM 2297 CG ASN A 152 4.332 79.790 10.842 1.00 0.00 C ATOM 2298 OD1 ASN A 152 5.630 79.685 10.941 1.00 0.00 O flip ATOM 2299 ND2 ASN A 152 3.778 80.864 11.080 1.00 0.00 N flip ATOM 0 H ASN A 152 1.777 76.929 9.839 1.00 0.00 H new ATOM 0 HA ASN A 152 1.856 79.028 11.729 1.00 0.00 H new ATOM 0 HB2 ASN A 152 3.829 77.699 10.997 1.00 0.00 H new ATOM 0 HB3 ASN A 152 3.685 78.348 9.376 1.00 0.00 H new ATOM 0 HD21 ASN A 152 2.764 80.943 11.002 1.00 0.00 H new ATOM 0 HD22 ASN A 152 4.333 81.674 11.355 1.00 0.00 H new ATOM 2306 N SER A 153 1.333 79.877 8.588 1.00 0.00 N ATOM 2307 CA SER A 153 0.910 80.976 7.729 1.00 0.00 C ATOM 2308 C SER A 153 -0.401 81.575 8.228 1.00 0.00 C ATOM 2309 O SER A 153 -0.584 82.791 8.212 1.00 0.00 O ATOM 2310 CB SER A 153 0.735 80.481 6.293 1.00 0.00 C ATOM 2311 OG SER A 153 1.934 79.851 5.864 1.00 0.00 O ATOM 2312 OXT SER A 153 -1.240 80.788 8.636 1.00 0.00 O ATOM 0 H SER A 153 1.410 78.975 8.117 1.00 0.00 H new ATOM 0 HA SER A 153 1.680 81.747 7.755 1.00 0.00 H new ATOM 0 HB2 SER A 153 -0.098 79.780 6.237 1.00 0.00 H new ATOM 0 HB3 SER A 153 0.494 81.316 5.635 1.00 0.00 H new ATOM 0 HG SER A 153 1.824 79.531 4.944 1.00 0.00 H new TER 2318 SER A 153