USER MOD reduce.3.24.130724 H: found=0, std=0, add=1133, rem=0, adj=51 USER MOD reduce.3.24.130724 removed 1134 hydrogens (14 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 NoAdj-H: A 126 ASNHD21 : A 126 ASN ND2 : A 161 NAG C1 :(H bumps) USER MOD Set 1.1: A 16 MET CE :methyl 140:sc= -11.8! (180deg=-14.4!) USER MOD Set 1.2: A 111 SER OG : rot 94:sc= -9.14! USER MOD Set 1.3: A 144 THR OG1 : rot -73:sc= -5.49! USER MOD Set 2.1: A 88 TYR OH : rot 137:sc= 0.16 USER MOD Set 2.2: A 92 GLN : amide:sc= -4.36! C(o=-4.2!,f=-4!) USER MOD Set 3.1: A 86 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 87 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 4.1: A 47 TYR OH : rot 60:sc= -1.66! USER MOD Set 4.2: A 79 HIS : no HE2:sc= -6.98! C(o=-8.6!,f=-13!) USER MOD Single : A 1 TYR N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 TYR OH : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HE2:sc= -9.31! C(o=-9.3!,f=-5.9!) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0.447 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 23:sc= -1.59! USER MOD Single : A 13 SER OG : rot -150:sc= 0 USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 LYS NZ :NH3+ -137:sc= 0.245 (180deg=0) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 GLN : amide:sc= -5.74! C(o=-5.7!,f=-4.6!) USER MOD Single : A 24 ASN : amide:sc=-0.00515 K(o=-0.0052,f=-0.95) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 GLN : amide:sc= -1.53 K(o=-1.5,f=-3.6!) USER MOD Single : A 27 MET CE :methyl 145:sc= -6.72! (180deg=-9.48!) USER MOD Single : A 30 THR OG1 : rot 146:sc= -7.43! USER MOD Single : A 34 ASN : amide:sc= -0.204 K(o=-0.2,f=-2.6!) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 39 GLN : amide:sc= -0.31 X(o=-0.31,f=-0.025) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 163:sc= 0.582 USER MOD Single : A 45 GLN : amide:sc= -0.504 X(o=-0.5,f=-0.15) USER MOD Single : A 46 THR OG1 : rot 159:sc= 0.216 USER MOD Single : A 50 ASN : amide:sc= -4.13! C(o=-4.1!,f=-18!) USER MOD Single : A 51 SER OG : rot 66:sc= -3.13! USER MOD Single : A 52 ASN : amide:sc= -1.06! C(o=-1.1!,f=-1.1!) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0.038 USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 ASN : amide:sc= -6.42! C(o=-6.4!,f=-5.6!) USER MOD Single : A 66 THR OG1 : rot 180:sc= -3.39! USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot -144:sc= -1.85! USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 GLN : amide:sc= -1.46 K(o=-1.5,f=0) USER MOD Single : A 83 SER OG : rot -101:sc= -1.19! USER MOD Single : A 84 THR OG1 : rot -165:sc= -8.03! USER MOD Single : A 85 THR OG1 : rot 70:sc= -2.46! USER MOD Single : A 90 GLN : amide:sc= -0.329 X(o=-0.33,f=-0.54) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 SER OG : rot -63:sc= -4.29! USER MOD Single : A 98 THR OG1 : rot 180:sc= -2.65! USER MOD Single : A 100 HIS : no HD1:sc= -0.0959 X(o=-0.096,f=-0.082) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 THR OG1 : rot -25:sc= 0.913 USER MOD Single : A 110 ASN : amide:sc= -3.86! C(o=-3.9!,f=-3.6!) USER MOD Single : A 112 ASN : amide:sc= -0.0117 K(o=-0.012,f=-1.3) USER MOD Single : A 117 HIS : no HE2:sc= -6.13! C(o=-6.1!,f=-4!) USER MOD Single : A 122 TYR OH : rot 180:sc= -0.194 USER MOD Single : A 123 ASN : amide:sc= 0 X(o=0,f=0.13) USER MOD Single : A 124 ASN : amide:sc= -4.55! C(o=-4.6!,f=-5.1!) USER MOD Single : A 125 HIS : no HD1:sc= -0.475 X(o=-0.48,f=-0.22) USER MOD Single : A 127 TYR OH : rot -107:sc= 0.834 USER MOD Single : A 128 THR OG1 : rot 69:sc= 0.993 USER MOD Single : A 131 THR OG1 : rot 157:sc= -0.296! USER MOD Single : A 132 SER OG : rot 60:sc= 0.0548 USER MOD Single : A 138 ASN : amide:sc= -1.06 X(o=-1.1,f=-0.96) USER MOD Single : A 139 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 140 LYS NZ :NH3+ 153:sc= -0.227 (180deg=-0.854) USER MOD Single : A 145 THR OG1 : rot -68:sc= -2.51! USER MOD Single : A 146 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 147 ASN : amide:sc= -12! C(o=-12!,f=-12!) USER MOD Single : A 148 TYR OH : rot 180:sc= 0 USER MOD Single : A 152 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 153 LYS NZ :NH3+ -100:sc= -4.82! (180deg=-8.22!) USER MOD Single : A 159 MET CE :methyl 166:sc= -0.0207 (180deg=-0.253) USER MOD Single : A 161 NAG O3 : rot 147:sc= 0.03 USER MOD Single : A 161 NAG O4 : rot 180:sc= 0.0226 USER MOD Single : A 161 NAG O6 : rot -31:sc= 0.102 USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 1 13.093 -4.128 20.233 1.00 0.00 N ATOM 2 CA TYR A 1 12.995 -3.628 18.838 1.00 0.00 C ATOM 3 C TYR A 1 11.952 -2.520 18.721 1.00 0.00 C ATOM 4 O TYR A 1 12.215 -1.465 18.144 1.00 0.00 O ATOM 5 CB TYR A 1 12.627 -4.798 17.925 1.00 0.00 C ATOM 6 CG TYR A 1 13.508 -4.916 16.702 1.00 0.00 C ATOM 7 CD1 TYR A 1 14.680 -5.660 16.738 1.00 0.00 C ATOM 8 CD2 TYR A 1 13.168 -4.282 15.513 1.00 0.00 C ATOM 9 CE1 TYR A 1 15.489 -5.770 15.622 1.00 0.00 C ATOM 10 CE2 TYR A 1 13.971 -4.387 14.395 1.00 0.00 C ATOM 11 CZ TYR A 1 15.130 -5.131 14.453 1.00 0.00 C ATOM 12 OH TYR A 1 15.934 -5.239 13.341 1.00 0.00 O ATOM 0 H1 TYR A 1 13.809 -4.880 20.283 1.00 0.00 H new ATOM 0 H2 TYR A 1 13.367 -3.347 20.863 1.00 0.00 H new ATOM 0 H3 TYR A 1 12.172 -4.507 20.531 1.00 0.00 H new ATOM 0 HA TYR A 1 13.956 -3.207 18.541 1.00 0.00 H new ATOM 0 HB2 TYR A 1 12.687 -5.725 18.495 1.00 0.00 H new ATOM 0 HB3 TYR A 1 11.591 -4.686 17.606 1.00 0.00 H new ATOM 0 HD1 TYR A 1 14.964 -6.161 17.652 1.00 0.00 H new ATOM 0 HD2 TYR A 1 12.261 -3.698 15.463 1.00 0.00 H new ATOM 0 HE1 TYR A 1 16.397 -6.353 15.665 1.00 0.00 H new ATOM 0 HE2 TYR A 1 13.692 -3.888 13.479 1.00 0.00 H new ATOM 0 HH TYR A 1 15.539 -4.731 12.601 1.00 0.00 H new ATOM 24 N GLY A 2 10.768 -2.768 19.272 1.00 0.00 N ATOM 25 CA GLY A 2 9.705 -1.783 19.218 1.00 0.00 C ATOM 26 C GLY A 2 8.475 -2.296 18.495 1.00 0.00 C ATOM 27 O GLY A 2 7.484 -1.579 18.359 1.00 0.00 O ATOM 0 H GLY A 2 10.526 -3.633 19.755 1.00 0.00 H new ATOM 0 HA2 GLY A 2 9.432 -1.492 20.232 1.00 0.00 H new ATOM 0 HA3 GLY A 2 10.070 -0.886 18.717 1.00 0.00 H new ATOM 31 N HIS A 3 8.540 -3.539 18.031 1.00 0.00 N ATOM 32 CA HIS A 3 7.423 -4.148 17.317 1.00 0.00 C ATOM 33 C HIS A 3 6.091 -3.718 17.923 1.00 0.00 C ATOM 34 O HIS A 3 6.036 -3.268 19.068 1.00 0.00 O ATOM 35 CB HIS A 3 7.544 -5.673 17.348 1.00 0.00 C ATOM 36 CG HIS A 3 7.000 -6.291 18.598 1.00 0.00 C ATOM 37 ND1 HIS A 3 7.792 -6.923 19.533 1.00 0.00 N ATOM 38 CD2 HIS A 3 5.732 -6.369 19.066 1.00 0.00 C ATOM 39 CE1 HIS A 3 7.035 -7.364 20.522 1.00 0.00 C ATOM 40 NE2 HIS A 3 5.782 -7.040 20.263 1.00 0.00 N ATOM 0 H HIS A 3 9.354 -4.145 18.136 1.00 0.00 H new ATOM 0 HA HIS A 3 7.456 -3.809 16.282 1.00 0.00 H new ATOM 0 HB2 HIS A 3 7.018 -6.089 16.488 1.00 0.00 H new ATOM 0 HB3 HIS A 3 8.593 -5.948 17.243 1.00 0.00 H new ATOM 0 HD1 HIS A 3 8.804 -7.033 19.471 1.00 0.00 H new ATOM 0 HD2 HIS A 3 4.847 -5.977 18.587 1.00 0.00 H new ATOM 0 HE1 HIS A 3 7.382 -7.899 21.394 1.00 0.00 H new ATOM 49 N CYS A 4 5.019 -3.858 17.149 1.00 0.00 N ATOM 50 CA CYS A 4 3.688 -3.482 17.611 1.00 0.00 C ATOM 51 C CYS A 4 2.763 -4.695 17.659 1.00 0.00 C ATOM 52 O CYS A 4 2.808 -5.557 16.782 1.00 0.00 O ATOM 53 CB CYS A 4 3.093 -2.410 16.695 1.00 0.00 C ATOM 54 SG CYS A 4 3.889 -0.777 16.845 1.00 0.00 S ATOM 0 H CYS A 4 5.047 -4.229 16.199 1.00 0.00 H new ATOM 0 HA CYS A 4 3.782 -3.080 18.620 1.00 0.00 H new ATOM 0 HB2 CYS A 4 3.171 -2.747 15.661 1.00 0.00 H new ATOM 0 HB3 CYS A 4 2.031 -2.306 16.917 1.00 0.00 H new ATOM 59 N VAL A 5 1.925 -4.753 18.689 1.00 0.00 N ATOM 60 CA VAL A 5 0.987 -5.858 18.851 1.00 0.00 C ATOM 61 C VAL A 5 -0.454 -5.378 18.729 1.00 0.00 C ATOM 62 O VAL A 5 -0.891 -4.497 19.469 1.00 0.00 O ATOM 63 CB VAL A 5 1.172 -6.561 20.209 1.00 0.00 C ATOM 64 CG1 VAL A 5 0.832 -8.040 20.097 1.00 0.00 C ATOM 65 CG2 VAL A 5 2.590 -6.369 20.722 1.00 0.00 C ATOM 0 H VAL A 5 1.876 -4.048 19.424 1.00 0.00 H new ATOM 0 HA VAL A 5 1.198 -6.570 18.053 1.00 0.00 H new ATOM 0 HB VAL A 5 0.487 -6.109 20.927 1.00 0.00 H new ATOM 0 HG11 VAL A 5 0.969 -8.519 21.066 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -0.205 -8.152 19.780 1.00 0.00 H new ATOM 0 HG13 VAL A 5 1.488 -8.510 19.364 1.00 0.00 H new ATOM 0 HG21 VAL A 5 2.701 -6.873 21.682 1.00 0.00 H new ATOM 0 HG22 VAL A 5 3.296 -6.791 20.007 1.00 0.00 H new ATOM 0 HG23 VAL A 5 2.791 -5.305 20.845 1.00 0.00 H new ATOM 75 N THR A 6 -1.189 -5.961 17.786 1.00 0.00 N ATOM 76 CA THR A 6 -2.582 -5.591 17.565 1.00 0.00 C ATOM 77 C THR A 6 -3.408 -6.789 17.109 1.00 0.00 C ATOM 78 O THR A 6 -2.957 -7.931 17.182 1.00 0.00 O ATOM 79 CB THR A 6 -2.702 -4.474 16.511 1.00 0.00 C ATOM 80 OG1 THR A 6 -3.987 -3.847 16.606 1.00 0.00 O ATOM 81 CG2 THR A 6 -2.506 -5.030 15.108 1.00 0.00 C ATOM 0 H THR A 6 -0.843 -6.691 17.163 1.00 0.00 H new ATOM 0 HA THR A 6 -2.967 -5.231 18.519 1.00 0.00 H new ATOM 0 HB THR A 6 -1.923 -3.737 16.705 1.00 0.00 H new ATOM 0 HG1 THR A 6 -4.055 -3.137 15.934 1.00 0.00 H new ATOM 0 HG21 THR A 6 -2.595 -4.223 14.381 1.00 0.00 H new ATOM 0 HG22 THR A 6 -1.517 -5.481 15.030 1.00 0.00 H new ATOM 0 HG23 THR A 6 -3.266 -5.785 14.907 1.00 0.00 H new ATOM 89 N ASP A 7 -4.621 -6.517 16.639 1.00 0.00 N ATOM 90 CA ASP A 7 -5.515 -7.570 16.170 1.00 0.00 C ATOM 91 C ASP A 7 -5.844 -8.548 17.293 1.00 0.00 C ATOM 92 O ASP A 7 -6.381 -9.629 17.049 1.00 0.00 O ATOM 93 CB ASP A 7 -4.882 -8.318 14.995 1.00 0.00 C ATOM 94 CG ASP A 7 -5.196 -7.671 13.661 1.00 0.00 C ATOM 95 OD1 ASP A 7 -6.363 -7.749 13.223 1.00 0.00 O ATOM 96 OD2 ASP A 7 -4.274 -7.086 13.052 1.00 0.00 O ATOM 0 H ASP A 7 -5.008 -5.576 16.573 1.00 0.00 H new ATOM 0 HA ASP A 7 -6.442 -7.103 15.838 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -3.801 -8.356 15.132 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -5.239 -9.348 14.989 1.00 0.00 H new ATOM 101 N SER A 8 -5.522 -8.161 18.522 1.00 0.00 N ATOM 102 CA SER A 8 -5.785 -9.001 19.684 1.00 0.00 C ATOM 103 C SER A 8 -4.654 -10.000 19.909 1.00 0.00 C ATOM 104 O SER A 8 -4.546 -10.598 20.979 1.00 0.00 O ATOM 105 CB SER A 8 -7.110 -9.746 19.511 1.00 0.00 C ATOM 106 OG SER A 8 -7.764 -9.922 20.756 1.00 0.00 O ATOM 0 H SER A 8 -5.078 -7.269 18.739 1.00 0.00 H new ATOM 0 HA SER A 8 -5.849 -8.353 20.558 1.00 0.00 H new ATOM 0 HB2 SER A 8 -7.757 -9.190 18.832 1.00 0.00 H new ATOM 0 HB3 SER A 8 -6.927 -10.718 19.053 1.00 0.00 H new ATOM 0 HG SER A 8 -8.609 -10.399 20.617 1.00 0.00 H new ATOM 112 N GLY A 9 -3.812 -10.176 18.895 1.00 0.00 N ATOM 113 CA GLY A 9 -2.702 -11.105 19.009 1.00 0.00 C ATOM 114 C GLY A 9 -1.900 -11.220 17.728 1.00 0.00 C ATOM 115 O GLY A 9 -1.430 -12.304 17.379 1.00 0.00 O ATOM 0 H GLY A 9 -3.878 -9.693 17.999 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -2.045 -10.782 19.816 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -3.084 -12.089 19.283 1.00 0.00 H new ATOM 119 N VAL A 10 -1.738 -10.103 17.027 1.00 0.00 N ATOM 120 CA VAL A 10 -0.984 -10.087 15.780 1.00 0.00 C ATOM 121 C VAL A 10 0.099 -9.015 15.808 1.00 0.00 C ATOM 122 O VAL A 10 -0.126 -7.879 15.391 1.00 0.00 O ATOM 123 CB VAL A 10 -1.901 -9.845 14.568 1.00 0.00 C ATOM 124 CG1 VAL A 10 -1.213 -10.280 13.283 1.00 0.00 C ATOM 125 CG2 VAL A 10 -3.225 -10.573 14.745 1.00 0.00 C ATOM 0 H VAL A 10 -2.119 -9.197 17.301 1.00 0.00 H new ATOM 0 HA VAL A 10 -0.519 -11.068 15.680 1.00 0.00 H new ATOM 0 HB VAL A 10 -2.107 -8.777 14.499 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -1.876 -10.101 12.437 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -0.294 -9.709 13.151 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -0.975 -11.342 13.339 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -3.860 -10.390 13.878 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -3.042 -11.643 14.841 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -3.723 -10.208 15.643 1.00 0.00 H new ATOM 135 N VAL A 11 1.273 -9.385 16.306 1.00 0.00 N ATOM 136 CA VAL A 11 2.394 -8.459 16.393 1.00 0.00 C ATOM 137 C VAL A 11 3.067 -8.281 15.035 1.00 0.00 C ATOM 138 O VAL A 11 3.334 -9.252 14.328 1.00 0.00 O ATOM 139 CB VAL A 11 3.435 -8.933 17.430 1.00 0.00 C ATOM 140 CG1 VAL A 11 3.581 -10.447 17.387 1.00 0.00 C ATOM 141 CG2 VAL A 11 4.780 -8.253 17.213 1.00 0.00 C ATOM 0 H VAL A 11 1.473 -10.322 16.656 1.00 0.00 H new ATOM 0 HA VAL A 11 1.992 -7.499 16.716 1.00 0.00 H new ATOM 0 HB VAL A 11 3.077 -8.649 18.420 1.00 0.00 H new ATOM 0 HG11 VAL A 11 4.319 -10.762 18.125 1.00 0.00 H new ATOM 0 HG12 VAL A 11 2.621 -10.912 17.612 1.00 0.00 H new ATOM 0 HG13 VAL A 11 3.908 -10.753 16.393 1.00 0.00 H new ATOM 0 HG21 VAL A 11 5.492 -8.608 17.959 1.00 0.00 H new ATOM 0 HG22 VAL A 11 5.151 -8.490 16.216 1.00 0.00 H new ATOM 0 HG23 VAL A 11 4.662 -7.174 17.309 1.00 0.00 H new ATOM 151 N TYR A 12 3.336 -7.028 14.682 1.00 0.00 N ATOM 152 CA TYR A 12 3.978 -6.709 13.413 1.00 0.00 C ATOM 153 C TYR A 12 5.261 -5.919 13.639 1.00 0.00 C ATOM 154 O TYR A 12 5.216 -4.744 14.004 1.00 0.00 O ATOM 155 CB TYR A 12 3.031 -5.896 12.529 1.00 0.00 C ATOM 156 CG TYR A 12 1.760 -6.622 12.159 1.00 0.00 C ATOM 157 CD1 TYR A 12 1.753 -7.581 11.155 1.00 0.00 C ATOM 158 CD2 TYR A 12 0.565 -6.342 12.809 1.00 0.00 C ATOM 159 CE1 TYR A 12 0.591 -8.242 10.809 1.00 0.00 C ATOM 160 CE2 TYR A 12 -0.602 -7.000 12.470 1.00 0.00 C ATOM 161 CZ TYR A 12 -0.584 -7.949 11.470 1.00 0.00 C ATOM 162 OH TYR A 12 -1.744 -8.606 11.127 1.00 0.00 O ATOM 0 H TYR A 12 3.118 -6.216 15.259 1.00 0.00 H new ATOM 0 HA TYR A 12 4.224 -7.647 12.915 1.00 0.00 H new ATOM 0 HB2 TYR A 12 2.772 -4.972 13.046 1.00 0.00 H new ATOM 0 HB3 TYR A 12 3.555 -5.614 11.616 1.00 0.00 H new ATOM 0 HD1 TYR A 12 2.671 -7.814 10.636 1.00 0.00 H new ATOM 0 HD2 TYR A 12 0.547 -5.598 13.592 1.00 0.00 H new ATOM 0 HE1 TYR A 12 0.602 -8.985 10.025 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -1.523 -6.772 12.986 1.00 0.00 H new ATOM 0 HH TYR A 12 -1.522 -9.458 10.695 1.00 0.00 H new ATOM 172 N SER A 13 6.403 -6.560 13.411 1.00 0.00 N ATOM 173 CA SER A 13 7.689 -5.896 13.581 1.00 0.00 C ATOM 174 C SER A 13 7.598 -4.455 13.103 1.00 0.00 C ATOM 175 O SER A 13 6.990 -4.171 12.070 1.00 0.00 O ATOM 176 CB SER A 13 8.783 -6.638 12.811 1.00 0.00 C ATOM 177 OG SER A 13 9.451 -7.569 13.644 1.00 0.00 O ATOM 0 H SER A 13 6.464 -7.533 13.110 1.00 0.00 H new ATOM 0 HA SER A 13 7.947 -5.904 14.640 1.00 0.00 H new ATOM 0 HB2 SER A 13 8.344 -7.157 11.959 1.00 0.00 H new ATOM 0 HB3 SER A 13 9.501 -5.922 12.412 1.00 0.00 H new ATOM 0 HG SER A 13 10.377 -7.673 13.342 1.00 0.00 H new ATOM 183 N VAL A 14 8.190 -3.547 13.864 1.00 0.00 N ATOM 184 CA VAL A 14 8.165 -2.137 13.526 1.00 0.00 C ATOM 185 C VAL A 14 8.572 -1.906 12.076 1.00 0.00 C ATOM 186 O VAL A 14 8.740 -2.855 11.309 1.00 0.00 O ATOM 187 CB VAL A 14 9.081 -1.336 14.455 1.00 0.00 C ATOM 188 CG1 VAL A 14 8.419 -1.158 15.813 1.00 0.00 C ATOM 189 CG2 VAL A 14 10.427 -2.017 14.593 1.00 0.00 C ATOM 0 H VAL A 14 8.695 -3.766 14.723 1.00 0.00 H new ATOM 0 HA VAL A 14 7.139 -1.791 13.656 1.00 0.00 H new ATOM 0 HB VAL A 14 9.248 -0.350 14.021 1.00 0.00 H new ATOM 0 HG11 VAL A 14 9.078 -0.587 16.467 1.00 0.00 H new ATOM 0 HG12 VAL A 14 7.477 -0.624 15.691 1.00 0.00 H new ATOM 0 HG13 VAL A 14 8.227 -2.136 16.255 1.00 0.00 H new ATOM 0 HG21 VAL A 14 11.064 -1.433 15.257 1.00 0.00 H new ATOM 0 HG22 VAL A 14 10.289 -3.015 15.008 1.00 0.00 H new ATOM 0 HG23 VAL A 14 10.898 -2.094 13.613 1.00 0.00 H new ATOM 199 N GLY A 15 8.709 -0.642 11.695 1.00 0.00 N ATOM 200 CA GLY A 15 9.067 -0.327 10.329 1.00 0.00 C ATOM 201 C GLY A 15 8.351 -1.232 9.350 1.00 0.00 C ATOM 202 O GLY A 15 8.971 -1.800 8.451 1.00 0.00 O ATOM 0 H GLY A 15 8.579 0.165 12.305 1.00 0.00 H new ATOM 0 HA2 GLY A 15 8.817 0.712 10.116 1.00 0.00 H new ATOM 0 HA3 GLY A 15 10.145 -0.429 10.201 1.00 0.00 H new ATOM 206 N MET A 16 7.039 -1.382 9.534 1.00 0.00 N ATOM 207 CA MET A 16 6.248 -2.245 8.662 1.00 0.00 C ATOM 208 C MET A 16 4.765 -1.889 8.709 1.00 0.00 C ATOM 209 O MET A 16 4.207 -1.643 9.778 1.00 0.00 O ATOM 210 CB MET A 16 6.439 -3.710 9.061 1.00 0.00 C ATOM 211 CG MET A 16 5.500 -4.664 8.345 1.00 0.00 C ATOM 212 SD MET A 16 5.006 -6.060 9.375 1.00 0.00 S ATOM 213 CE MET A 16 6.276 -7.253 8.964 1.00 0.00 C ATOM 0 H MET A 16 6.507 -0.921 10.272 1.00 0.00 H new ATOM 0 HA MET A 16 6.599 -2.093 7.641 1.00 0.00 H new ATOM 0 HB2 MET A 16 7.468 -4.003 8.853 1.00 0.00 H new ATOM 0 HB3 MET A 16 6.291 -3.807 10.137 1.00 0.00 H new ATOM 0 HG2 MET A 16 4.611 -4.121 8.026 1.00 0.00 H new ATOM 0 HG3 MET A 16 5.986 -5.037 7.443 1.00 0.00 H new ATOM 0 HE1 MET A 16 6.582 -7.784 9.865 1.00 0.00 H new ATOM 0 HE2 MET A 16 5.884 -7.966 8.238 1.00 0.00 H new ATOM 0 HE3 MET A 16 7.136 -6.737 8.538 1.00 0.00 H new ATOM 223 N GLN A 17 4.133 -1.869 7.537 1.00 0.00 N ATOM 224 CA GLN A 17 2.714 -1.547 7.432 1.00 0.00 C ATOM 225 C GLN A 17 1.860 -2.810 7.465 1.00 0.00 C ATOM 226 O GLN A 17 2.378 -3.925 7.381 1.00 0.00 O ATOM 227 CB GLN A 17 2.443 -0.776 6.138 1.00 0.00 C ATOM 228 CG GLN A 17 3.601 0.107 5.702 1.00 0.00 C ATOM 229 CD GLN A 17 3.315 0.849 4.412 1.00 0.00 C ATOM 230 OE1 GLN A 17 2.532 1.799 4.389 1.00 0.00 O ATOM 231 NE2 GLN A 17 3.951 0.419 3.329 1.00 0.00 N ATOM 0 H GLN A 17 4.584 -2.073 6.645 1.00 0.00 H new ATOM 0 HA GLN A 17 2.446 -0.927 8.287 1.00 0.00 H new ATOM 0 HB2 GLN A 17 2.219 -1.486 5.342 1.00 0.00 H new ATOM 0 HB3 GLN A 17 1.556 -0.157 6.273 1.00 0.00 H new ATOM 0 HG2 GLN A 17 3.820 0.827 6.490 1.00 0.00 H new ATOM 0 HG3 GLN A 17 4.493 -0.507 5.574 1.00 0.00 H new ATOM 0 HE21 GLN A 17 4.591 -0.372 3.394 1.00 0.00 H new ATOM 0 HE22 GLN A 17 3.799 0.880 2.432 1.00 0.00 H new ATOM 240 N TRP A 18 0.549 -2.629 7.582 1.00 0.00 N ATOM 241 CA TRP A 18 -0.380 -3.753 7.618 1.00 0.00 C ATOM 242 C TRP A 18 -1.825 -3.271 7.524 1.00 0.00 C ATOM 243 O TRP A 18 -2.312 -2.557 8.400 1.00 0.00 O ATOM 244 CB TRP A 18 -0.174 -4.578 8.891 1.00 0.00 C ATOM 245 CG TRP A 18 -0.757 -3.955 10.124 1.00 0.00 C ATOM 246 CD1 TRP A 18 -2.062 -3.988 10.521 1.00 0.00 C ATOM 247 CD2 TRP A 18 -0.049 -3.217 11.128 1.00 0.00 C ATOM 248 NE1 TRP A 18 -2.210 -3.315 11.711 1.00 0.00 N ATOM 249 CE2 TRP A 18 -0.989 -2.834 12.103 1.00 0.00 C ATOM 250 CE3 TRP A 18 1.286 -2.843 11.297 1.00 0.00 C ATOM 251 CZ2 TRP A 18 -0.634 -2.096 13.231 1.00 0.00 C ATOM 252 CZ3 TRP A 18 1.637 -2.112 12.416 1.00 0.00 C ATOM 253 CH2 TRP A 18 0.681 -1.746 13.371 1.00 0.00 C ATOM 0 H TRP A 18 0.105 -1.713 7.654 1.00 0.00 H new ATOM 0 HA TRP A 18 -0.177 -4.387 6.755 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -0.619 -5.563 8.749 1.00 0.00 H new ATOM 0 HB3 TRP A 18 0.894 -4.730 9.044 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -2.862 -4.472 9.980 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -3.086 -3.194 12.219 1.00 0.00 H new ATOM 0 HE3 TRP A 18 2.031 -3.120 10.566 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -1.370 -1.811 13.968 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 2.667 -1.818 12.556 1.00 0.00 H new ATOM 0 HH2 TRP A 18 0.988 -1.176 14.235 1.00 0.00 H new ATOM 264 N LEU A 19 -2.500 -3.665 6.448 1.00 0.00 N ATOM 265 CA LEU A 19 -3.888 -3.274 6.224 1.00 0.00 C ATOM 266 C LEU A 19 -4.802 -3.849 7.300 1.00 0.00 C ATOM 267 O LEU A 19 -4.433 -4.786 8.008 1.00 0.00 O ATOM 268 CB LEU A 19 -4.353 -3.745 4.844 1.00 0.00 C ATOM 269 CG LEU A 19 -4.603 -2.629 3.827 1.00 0.00 C ATOM 270 CD1 LEU A 19 -5.624 -1.637 4.363 1.00 0.00 C ATOM 271 CD2 LEU A 19 -3.300 -1.926 3.478 1.00 0.00 C ATOM 0 H LEU A 19 -2.107 -4.256 5.716 1.00 0.00 H new ATOM 0 HA LEU A 19 -3.942 -2.186 6.272 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -3.604 -4.424 4.438 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -5.272 -4.319 4.964 1.00 0.00 H new ATOM 0 HG LEU A 19 -5.006 -3.074 2.917 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -5.789 -0.851 3.626 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -6.564 -2.153 4.560 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -5.252 -1.196 5.288 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -3.496 -1.135 2.754 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -2.867 -1.493 4.380 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -2.602 -2.645 3.050 1.00 0.00 H new ATOM 283 N LYS A 20 -5.999 -3.281 7.414 1.00 0.00 N ATOM 284 CA LYS A 20 -6.972 -3.737 8.401 1.00 0.00 C ATOM 285 C LYS A 20 -8.360 -3.190 8.087 1.00 0.00 C ATOM 286 O LYS A 20 -8.581 -2.601 7.029 1.00 0.00 O ATOM 287 CB LYS A 20 -6.550 -3.309 9.809 1.00 0.00 C ATOM 288 CG LYS A 20 -5.317 -2.419 9.838 1.00 0.00 C ATOM 289 CD LYS A 20 -5.360 -1.444 11.002 1.00 0.00 C ATOM 290 CE LYS A 20 -5.901 -2.102 12.262 1.00 0.00 C ATOM 291 NZ LYS A 20 -5.939 -1.156 13.411 1.00 0.00 N ATOM 0 H LYS A 20 -6.318 -2.504 6.835 1.00 0.00 H new ATOM 0 HA LYS A 20 -7.009 -4.826 8.358 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -7.378 -2.781 10.281 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -6.357 -4.200 10.407 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -4.423 -3.037 9.913 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -5.244 -1.866 8.902 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -4.358 -1.059 11.193 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -5.985 -0.590 10.740 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -6.905 -2.481 12.071 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -5.280 -2.960 12.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -5.595 -1.636 14.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -5.332 -0.337 13.206 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -6.916 -0.834 13.563 1.00 0.00 H new ATOM 305 N THR A 21 -9.292 -3.388 9.013 1.00 0.00 N ATOM 306 CA THR A 21 -10.659 -2.913 8.834 1.00 0.00 C ATOM 307 C THR A 21 -11.059 -1.955 9.950 1.00 0.00 C ATOM 308 O THR A 21 -11.150 -2.345 11.114 1.00 0.00 O ATOM 309 CB THR A 21 -11.660 -4.083 8.795 1.00 0.00 C ATOM 310 OG1 THR A 21 -12.981 -3.591 8.540 1.00 0.00 O ATOM 311 CG2 THR A 21 -11.645 -4.851 10.108 1.00 0.00 C ATOM 0 H THR A 21 -9.126 -3.874 9.894 1.00 0.00 H new ATOM 0 HA THR A 21 -10.688 -2.387 7.880 1.00 0.00 H new ATOM 0 HB THR A 21 -11.364 -4.759 7.993 1.00 0.00 H new ATOM 0 HG1 THR A 21 -13.611 -4.342 8.515 1.00 0.00 H new ATOM 0 HG21 THR A 21 -12.360 -5.672 10.057 1.00 0.00 H new ATOM 0 HG22 THR A 21 -10.646 -5.249 10.285 1.00 0.00 H new ATOM 0 HG23 THR A 21 -11.919 -4.182 10.924 1.00 0.00 H new ATOM 319 N GLN A 22 -11.298 -0.699 9.588 1.00 0.00 N ATOM 320 CA GLN A 22 -11.689 0.316 10.558 1.00 0.00 C ATOM 321 C GLN A 22 -13.179 0.225 10.870 1.00 0.00 C ATOM 322 O GLN A 22 -13.896 1.225 10.821 1.00 0.00 O ATOM 323 CB GLN A 22 -11.351 1.712 10.033 1.00 0.00 C ATOM 324 CG GLN A 22 -12.136 2.103 8.791 1.00 0.00 C ATOM 325 CD GLN A 22 -12.405 3.593 8.716 1.00 0.00 C ATOM 326 OE1 GLN A 22 -13.001 4.175 9.622 1.00 0.00 O ATOM 327 NE2 GLN A 22 -11.965 4.218 7.629 1.00 0.00 N ATOM 0 H GLN A 22 -11.228 -0.360 8.629 1.00 0.00 H new ATOM 0 HA GLN A 22 -11.132 0.137 11.477 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -11.543 2.443 10.819 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -10.285 1.758 9.808 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -11.584 1.792 7.904 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -13.084 1.565 8.781 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -11.476 3.695 6.903 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -12.117 5.221 7.521 1.00 0.00 H new ATOM 336 N GLY A 23 -13.639 -0.980 11.191 1.00 0.00 N ATOM 337 CA GLY A 23 -15.041 -1.179 11.506 1.00 0.00 C ATOM 338 C GLY A 23 -15.864 -1.539 10.286 1.00 0.00 C ATOM 339 O GLY A 23 -16.634 -2.498 10.307 1.00 0.00 O ATOM 0 H GLY A 23 -13.065 -1.822 11.239 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -15.134 -1.970 12.250 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -15.442 -0.270 11.955 1.00 0.00 H new ATOM 343 N ASN A 24 -15.698 -0.765 9.222 1.00 0.00 N ATOM 344 CA ASN A 24 -16.430 -1.001 7.982 1.00 0.00 C ATOM 345 C ASN A 24 -15.804 -0.228 6.826 1.00 0.00 C ATOM 346 O ASN A 24 -16.505 0.247 5.932 1.00 0.00 O ATOM 347 CB ASN A 24 -17.896 -0.597 8.146 1.00 0.00 C ATOM 348 CG ASN A 24 -18.828 -1.454 7.312 1.00 0.00 C ATOM 349 OD1 ASN A 24 -18.410 -2.085 6.342 1.00 0.00 O ATOM 350 ND2 ASN A 24 -20.102 -1.480 7.687 1.00 0.00 N ATOM 0 H ASN A 24 -15.063 0.033 9.191 1.00 0.00 H new ATOM 0 HA ASN A 24 -16.377 -2.066 7.755 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -18.177 -0.676 9.196 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -18.016 0.448 7.862 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -20.776 -2.039 7.164 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -20.406 -0.941 8.498 1.00 0.00 H new ATOM 357 N LYS A 25 -14.482 -0.105 6.849 1.00 0.00 N ATOM 358 CA LYS A 25 -13.761 0.610 5.802 1.00 0.00 C ATOM 359 C LYS A 25 -12.349 0.056 5.636 1.00 0.00 C ATOM 360 O LYS A 25 -11.923 -0.817 6.389 1.00 0.00 O ATOM 361 CB LYS A 25 -13.700 2.104 6.126 1.00 0.00 C ATOM 362 CG LYS A 25 -14.754 2.554 7.124 1.00 0.00 C ATOM 363 CD LYS A 25 -16.106 2.747 6.458 1.00 0.00 C ATOM 364 CE LYS A 25 -16.458 4.220 6.324 1.00 0.00 C ATOM 365 NZ LYS A 25 -17.833 4.418 5.788 1.00 0.00 N ATOM 0 H LYS A 25 -13.887 -0.491 7.582 1.00 0.00 H new ATOM 0 HA LYS A 25 -14.299 0.469 4.864 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -12.712 2.341 6.522 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -13.819 2.672 5.204 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -14.842 1.815 7.920 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -14.440 3.488 7.590 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -16.096 2.283 5.472 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -16.875 2.240 7.041 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -16.375 4.703 7.298 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -15.738 4.706 5.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -18.033 5.436 5.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -17.905 3.980 4.847 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -18.523 3.977 6.429 1.00 0.00 H new ATOM 379 N GLN A 26 -11.632 0.571 4.643 1.00 0.00 N ATOM 380 CA GLN A 26 -10.267 0.127 4.377 1.00 0.00 C ATOM 381 C GLN A 26 -9.256 1.034 5.071 1.00 0.00 C ATOM 382 O GLN A 26 -9.054 2.179 4.666 1.00 0.00 O ATOM 383 CB GLN A 26 -10.002 0.106 2.871 1.00 0.00 C ATOM 384 CG GLN A 26 -8.741 -0.654 2.487 1.00 0.00 C ATOM 385 CD GLN A 26 -8.826 -2.130 2.817 1.00 0.00 C ATOM 386 OE1 GLN A 26 -8.654 -2.533 3.967 1.00 0.00 O ATOM 387 NE2 GLN A 26 -9.094 -2.948 1.805 1.00 0.00 N ATOM 0 H GLN A 26 -11.972 1.295 4.010 1.00 0.00 H new ATOM 0 HA GLN A 26 -10.154 -0.882 4.773 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -10.856 -0.345 2.366 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -9.923 1.131 2.510 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -8.560 -0.534 1.419 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -7.887 -0.218 3.005 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -9.230 -2.571 0.867 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -9.164 -3.953 1.966 1.00 0.00 H new ATOM 396 N MET A 27 -8.623 0.514 6.117 1.00 0.00 N ATOM 397 CA MET A 27 -7.632 1.276 6.867 1.00 0.00 C ATOM 398 C MET A 27 -6.433 0.404 7.223 1.00 0.00 C ATOM 399 O MET A 27 -6.589 -0.686 7.773 1.00 0.00 O ATOM 400 CB MET A 27 -8.256 1.848 8.141 1.00 0.00 C ATOM 401 CG MET A 27 -8.731 3.285 7.994 1.00 0.00 C ATOM 402 SD MET A 27 -7.690 4.455 8.887 1.00 0.00 S ATOM 403 CE MET A 27 -6.121 4.214 8.056 1.00 0.00 C ATOM 0 H MET A 27 -8.779 -0.432 6.465 1.00 0.00 H new ATOM 0 HA MET A 27 -7.289 2.097 6.238 1.00 0.00 H new ATOM 0 HB2 MET A 27 -9.100 1.223 8.434 1.00 0.00 H new ATOM 0 HB3 MET A 27 -7.525 1.796 8.948 1.00 0.00 H new ATOM 0 HG2 MET A 27 -8.747 3.552 6.937 1.00 0.00 H new ATOM 0 HG3 MET A 27 -9.755 3.364 8.358 1.00 0.00 H new ATOM 0 HE1 MET A 27 -5.590 5.164 7.999 1.00 0.00 H new ATOM 0 HE2 MET A 27 -5.521 3.495 8.614 1.00 0.00 H new ATOM 0 HE3 MET A 27 -6.297 3.836 7.049 1.00 0.00 H new ATOM 413 N LEU A 28 -5.238 0.891 6.910 1.00 0.00 N ATOM 414 CA LEU A 28 -4.014 0.153 7.200 1.00 0.00 C ATOM 415 C LEU A 28 -3.199 0.856 8.278 1.00 0.00 C ATOM 416 O LEU A 28 -3.216 2.083 8.383 1.00 0.00 O ATOM 417 CB LEU A 28 -3.175 -0.006 5.932 1.00 0.00 C ATOM 418 CG LEU A 28 -2.489 1.271 5.444 1.00 0.00 C ATOM 419 CD1 LEU A 28 -0.999 1.225 5.743 1.00 0.00 C ATOM 420 CD2 LEU A 28 -2.732 1.468 3.955 1.00 0.00 C ATOM 0 H LEU A 28 -5.090 1.792 6.456 1.00 0.00 H new ATOM 0 HA LEU A 28 -4.294 -0.835 7.567 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -2.412 -0.764 6.112 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -3.816 -0.383 5.135 1.00 0.00 H new ATOM 0 HG LEU A 28 -2.918 2.119 5.978 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -0.528 2.142 5.388 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -0.846 1.131 6.818 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -0.553 0.369 5.237 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -2.237 2.381 3.623 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -2.330 0.617 3.405 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -3.803 1.547 3.768 1.00 0.00 H new ATOM 432 N CYS A 29 -2.487 0.072 9.079 1.00 0.00 N ATOM 433 CA CYS A 29 -1.665 0.620 10.151 1.00 0.00 C ATOM 434 C CYS A 29 -0.230 0.116 10.045 1.00 0.00 C ATOM 435 O CYS A 29 0.007 -1.053 9.744 1.00 0.00 O ATOM 436 CB CYS A 29 -2.249 0.241 11.514 1.00 0.00 C ATOM 437 SG CYS A 29 -3.721 1.206 11.988 1.00 0.00 S ATOM 0 H CYS A 29 -2.462 -0.945 9.006 1.00 0.00 H new ATOM 0 HA CYS A 29 -1.660 1.706 10.054 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -2.510 -0.817 11.504 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -1.481 0.373 12.276 1.00 0.00 H new ATOM 442 N THR A 30 0.725 1.005 10.297 1.00 0.00 N ATOM 443 CA THR A 30 2.135 0.647 10.233 1.00 0.00 C ATOM 444 C THR A 30 2.845 0.983 11.531 1.00 0.00 C ATOM 445 O THR A 30 2.678 2.072 12.080 1.00 0.00 O ATOM 446 CB THR A 30 2.863 1.382 9.092 1.00 0.00 C ATOM 447 OG1 THR A 30 2.221 1.120 7.840 1.00 0.00 O ATOM 448 CG2 THR A 30 4.325 0.965 9.023 1.00 0.00 C ATOM 0 H THR A 30 0.547 1.978 10.547 1.00 0.00 H new ATOM 0 HA THR A 30 2.166 -0.427 10.053 1.00 0.00 H new ATOM 0 HB THR A 30 2.818 2.452 9.297 1.00 0.00 H new ATOM 0 HG1 THR A 30 2.282 1.914 7.269 1.00 0.00 H new ATOM 0 HG21 THR A 30 4.817 1.498 8.209 1.00 0.00 H new ATOM 0 HG22 THR A 30 4.817 1.207 9.965 1.00 0.00 H new ATOM 0 HG23 THR A 30 4.389 -0.108 8.845 1.00 0.00 H new ATOM 456 N CYS A 31 3.661 0.055 12.001 1.00 0.00 N ATOM 457 CA CYS A 31 4.425 0.269 13.215 1.00 0.00 C ATOM 458 C CYS A 31 5.736 0.948 12.856 1.00 0.00 C ATOM 459 O CYS A 31 6.638 0.316 12.314 1.00 0.00 O ATOM 460 CB CYS A 31 4.684 -1.058 13.930 1.00 0.00 C ATOM 461 SG CYS A 31 5.462 -0.885 15.567 1.00 0.00 S ATOM 0 H CYS A 31 3.810 -0.852 11.560 1.00 0.00 H new ATOM 0 HA CYS A 31 3.858 0.906 13.894 1.00 0.00 H new ATOM 0 HB2 CYS A 31 3.738 -1.587 14.044 1.00 0.00 H new ATOM 0 HB3 CYS A 31 5.322 -1.678 13.301 1.00 0.00 H new ATOM 466 N LEU A 32 5.822 2.246 13.123 1.00 0.00 N ATOM 467 CA LEU A 32 7.016 3.014 12.795 1.00 0.00 C ATOM 468 C LEU A 32 8.016 3.015 13.946 1.00 0.00 C ATOM 469 O LEU A 32 8.401 4.071 14.450 1.00 0.00 O ATOM 470 CB LEU A 32 6.630 4.447 12.426 1.00 0.00 C ATOM 471 CG LEU A 32 6.290 4.662 10.950 1.00 0.00 C ATOM 472 CD1 LEU A 32 4.842 5.098 10.796 1.00 0.00 C ATOM 473 CD2 LEU A 32 7.227 5.690 10.332 1.00 0.00 C ATOM 0 H LEU A 32 5.080 2.788 13.565 1.00 0.00 H new ATOM 0 HA LEU A 32 7.497 2.539 11.940 1.00 0.00 H new ATOM 0 HB2 LEU A 32 5.771 4.743 13.029 1.00 0.00 H new ATOM 0 HB3 LEU A 32 7.452 5.110 12.695 1.00 0.00 H new ATOM 0 HG LEU A 32 6.422 3.717 10.424 1.00 0.00 H new ATOM 0 HD11 LEU A 32 4.617 5.246 9.740 1.00 0.00 H new ATOM 0 HD12 LEU A 32 4.185 4.329 11.202 1.00 0.00 H new ATOM 0 HD13 LEU A 32 4.684 6.032 11.335 1.00 0.00 H new ATOM 0 HD21 LEU A 32 6.971 5.831 9.282 1.00 0.00 H new ATOM 0 HD22 LEU A 32 7.126 6.638 10.860 1.00 0.00 H new ATOM 0 HD23 LEU A 32 8.256 5.338 10.411 1.00 0.00 H new ATOM 485 N GLY A 33 8.437 1.823 14.351 1.00 0.00 N ATOM 486 CA GLY A 33 9.396 1.697 15.436 1.00 0.00 C ATOM 487 C GLY A 33 8.806 2.065 16.783 1.00 0.00 C ATOM 488 O GLY A 33 8.838 1.267 17.719 1.00 0.00 O ATOM 0 H GLY A 33 8.131 0.938 13.947 1.00 0.00 H new ATOM 0 HA2 GLY A 33 9.764 0.672 15.473 1.00 0.00 H new ATOM 0 HA3 GLY A 33 10.255 2.337 15.233 1.00 0.00 H new ATOM 492 N ASN A 34 8.267 3.276 16.884 1.00 0.00 N ATOM 493 CA ASN A 34 7.669 3.743 18.129 1.00 0.00 C ATOM 494 C ASN A 34 6.328 4.425 17.873 1.00 0.00 C ATOM 495 O ASN A 34 6.091 5.541 18.333 1.00 0.00 O ATOM 496 CB ASN A 34 8.616 4.711 18.842 1.00 0.00 C ATOM 497 CG ASN A 34 8.548 4.580 20.351 1.00 0.00 C ATOM 498 OD1 ASN A 34 7.958 3.638 20.878 1.00 0.00 O ATOM 499 ND2 ASN A 34 9.155 5.530 21.055 1.00 0.00 N ATOM 0 H ASN A 34 8.232 3.951 16.120 1.00 0.00 H new ATOM 0 HA ASN A 34 7.497 2.875 18.765 1.00 0.00 H new ATOM 0 HB2 ASN A 34 9.638 4.526 18.510 1.00 0.00 H new ATOM 0 HB3 ASN A 34 8.368 5.734 18.557 1.00 0.00 H new ATOM 0 HD21 ASN A 34 9.143 5.496 22.074 1.00 0.00 H new ATOM 0 HD22 ASN A 34 9.633 6.293 20.576 1.00 0.00 H new ATOM 506 N GLY A 35 5.453 3.746 17.136 1.00 0.00 N ATOM 507 CA GLY A 35 4.147 4.304 16.836 1.00 0.00 C ATOM 508 C GLY A 35 3.480 3.624 15.656 1.00 0.00 C ATOM 509 O GLY A 35 4.145 3.244 14.693 1.00 0.00 O ATOM 0 H GLY A 35 5.625 2.821 16.742 1.00 0.00 H new ATOM 0 HA2 GLY A 35 3.507 4.212 17.713 1.00 0.00 H new ATOM 0 HA3 GLY A 35 4.250 5.369 16.626 1.00 0.00 H new ATOM 513 N VAL A 36 2.162 3.472 15.731 1.00 0.00 N ATOM 514 CA VAL A 36 1.403 2.836 14.660 1.00 0.00 C ATOM 515 C VAL A 36 0.781 3.878 13.734 1.00 0.00 C ATOM 516 O VAL A 36 -0.404 4.191 13.846 1.00 0.00 O ATOM 517 CB VAL A 36 0.288 1.927 15.222 1.00 0.00 C ATOM 518 CG1 VAL A 36 -0.724 1.575 14.141 1.00 0.00 C ATOM 519 CG2 VAL A 36 0.880 0.664 15.830 1.00 0.00 C ATOM 0 H VAL A 36 1.597 3.781 16.522 1.00 0.00 H new ATOM 0 HA VAL A 36 2.105 2.225 14.093 1.00 0.00 H new ATOM 0 HB VAL A 36 -0.231 2.477 16.007 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -1.499 0.934 14.562 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -1.178 2.488 13.756 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -0.221 1.050 13.329 1.00 0.00 H new ATOM 0 HG21 VAL A 36 0.078 0.037 16.220 1.00 0.00 H new ATOM 0 HG22 VAL A 36 1.430 0.115 15.065 1.00 0.00 H new ATOM 0 HG23 VAL A 36 1.557 0.933 16.641 1.00 0.00 H new ATOM 529 N SER A 37 1.583 4.408 12.816 1.00 0.00 N ATOM 530 CA SER A 37 1.099 5.410 11.872 1.00 0.00 C ATOM 531 C SER A 37 0.235 4.759 10.797 1.00 0.00 C ATOM 532 O SER A 37 0.746 4.114 9.880 1.00 0.00 O ATOM 533 CB SER A 37 2.273 6.146 11.225 1.00 0.00 C ATOM 534 OG SER A 37 1.902 7.457 10.837 1.00 0.00 O ATOM 0 H SER A 37 2.567 4.162 12.706 1.00 0.00 H new ATOM 0 HA SER A 37 0.492 6.130 12.420 1.00 0.00 H new ATOM 0 HB2 SER A 37 3.107 6.193 11.925 1.00 0.00 H new ATOM 0 HB3 SER A 37 2.619 5.590 10.354 1.00 0.00 H new ATOM 0 HG SER A 37 2.670 7.907 10.428 1.00 0.00 H new ATOM 540 N CYS A 38 -1.078 4.926 10.920 1.00 0.00 N ATOM 541 CA CYS A 38 -2.015 4.348 9.963 1.00 0.00 C ATOM 542 C CYS A 38 -2.358 5.340 8.858 1.00 0.00 C ATOM 543 O CYS A 38 -2.001 6.516 8.930 1.00 0.00 O ATOM 544 CB CYS A 38 -3.293 3.906 10.678 1.00 0.00 C ATOM 545 SG CYS A 38 -3.001 3.081 12.276 1.00 0.00 S ATOM 0 H CYS A 38 -1.517 5.457 11.672 1.00 0.00 H new ATOM 0 HA CYS A 38 -1.537 3.481 9.507 1.00 0.00 H new ATOM 0 HB2 CYS A 38 -3.926 4.778 10.841 1.00 0.00 H new ATOM 0 HB3 CYS A 38 -3.846 3.229 10.027 1.00 0.00 H new ATOM 550 N GLN A 39 -3.055 4.854 7.835 1.00 0.00 N ATOM 551 CA GLN A 39 -3.452 5.692 6.709 1.00 0.00 C ATOM 552 C GLN A 39 -4.530 5.004 5.877 1.00 0.00 C ATOM 553 O GLN A 39 -4.468 3.798 5.636 1.00 0.00 O ATOM 554 CB GLN A 39 -2.240 6.012 5.833 1.00 0.00 C ATOM 555 CG GLN A 39 -1.533 7.302 6.219 1.00 0.00 C ATOM 556 CD GLN A 39 -0.683 7.861 5.095 1.00 0.00 C ATOM 557 OE1 GLN A 39 0.506 8.123 5.272 1.00 0.00 O ATOM 558 NE2 GLN A 39 -1.293 8.048 3.930 1.00 0.00 N ATOM 0 H GLN A 39 -3.357 3.882 7.763 1.00 0.00 H new ATOM 0 HA GLN A 39 -3.860 6.622 7.104 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -1.531 5.187 5.893 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -2.561 6.081 4.794 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -2.275 8.045 6.512 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -0.903 7.120 7.090 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -2.281 7.816 3.829 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -0.773 8.423 3.137 1.00 0.00 H new ATOM 567 N GLU A 40 -5.517 5.779 5.439 1.00 0.00 N ATOM 568 CA GLU A 40 -6.608 5.244 4.634 1.00 0.00 C ATOM 569 C GLU A 40 -6.373 5.516 3.152 1.00 0.00 C ATOM 570 O GLU A 40 -6.652 6.609 2.659 1.00 0.00 O ATOM 571 CB GLU A 40 -7.940 5.856 5.073 1.00 0.00 C ATOM 572 CG GLU A 40 -7.802 7.240 5.685 1.00 0.00 C ATOM 573 CD GLU A 40 -9.126 7.798 6.170 1.00 0.00 C ATOM 574 OE1 GLU A 40 -10.156 7.535 5.515 1.00 0.00 O ATOM 575 OE2 GLU A 40 -9.132 8.499 7.203 1.00 0.00 O ATOM 0 H GLU A 40 -5.583 6.779 5.628 1.00 0.00 H new ATOM 0 HA GLU A 40 -6.645 4.165 4.785 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -8.605 5.914 4.211 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -8.413 5.193 5.797 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -7.103 7.196 6.520 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -7.374 7.919 4.947 1.00 0.00 H new ATOM 582 N THR A 41 -5.862 4.513 2.445 1.00 0.00 N ATOM 583 CA THR A 41 -5.590 4.644 1.019 1.00 0.00 C ATOM 584 C THR A 41 -6.874 4.546 0.203 1.00 0.00 C ATOM 585 O THR A 41 -6.925 4.979 -0.948 1.00 0.00 O ATOM 586 CB THR A 41 -4.604 3.566 0.533 1.00 0.00 C ATOM 587 OG1 THR A 41 -5.322 2.473 -0.053 1.00 0.00 O ATOM 588 CG2 THR A 41 -3.750 3.056 1.684 1.00 0.00 C ATOM 0 H THR A 41 -5.628 3.601 2.837 1.00 0.00 H new ATOM 0 HA THR A 41 -5.143 5.627 0.872 1.00 0.00 H new ATOM 0 HB THR A 41 -3.950 4.014 -0.215 1.00 0.00 H new ATOM 0 HG1 THR A 41 -4.688 1.793 -0.361 1.00 0.00 H new ATOM 0 HG21 THR A 41 -3.061 2.295 1.317 1.00 0.00 H new ATOM 0 HG22 THR A 41 -3.183 3.883 2.111 1.00 0.00 H new ATOM 0 HG23 THR A 41 -4.393 2.623 2.450 1.00 0.00 H new ATOM 596 N ALA A 42 -7.911 3.974 0.808 1.00 0.00 N ATOM 597 CA ALA A 42 -9.196 3.819 0.138 1.00 0.00 C ATOM 598 C ALA A 42 -9.011 3.356 -1.304 1.00 0.00 C ATOM 599 O ALA A 42 -7.906 3.002 -1.716 1.00 0.00 O ATOM 600 CB ALA A 42 -9.973 5.126 0.178 1.00 0.00 C ATOM 0 H ALA A 42 -7.886 3.611 1.761 1.00 0.00 H new ATOM 0 HA ALA A 42 -9.764 3.055 0.668 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -10.931 4.996 -0.326 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -10.145 5.415 1.215 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -9.401 5.905 -0.326 1.00 0.00 H new ATOM 606 N VAL A 43 -10.099 3.362 -2.066 1.00 0.00 N ATOM 607 CA VAL A 43 -10.057 2.944 -3.462 1.00 0.00 C ATOM 608 C VAL A 43 -9.150 3.854 -4.281 1.00 0.00 C ATOM 609 O VAL A 43 -8.948 5.019 -3.938 1.00 0.00 O ATOM 610 CB VAL A 43 -11.463 2.939 -4.091 1.00 0.00 C ATOM 611 CG1 VAL A 43 -11.393 2.525 -5.553 1.00 0.00 C ATOM 612 CG2 VAL A 43 -12.394 2.023 -3.312 1.00 0.00 C ATOM 0 H VAL A 43 -11.021 3.652 -1.740 1.00 0.00 H new ATOM 0 HA VAL A 43 -9.658 1.930 -3.475 1.00 0.00 H new ATOM 0 HB VAL A 43 -11.866 3.951 -4.044 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -12.396 2.527 -5.980 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -10.764 3.227 -6.100 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -10.969 1.524 -5.628 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -13.382 2.033 -3.771 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -11.999 1.007 -3.323 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -12.469 2.371 -2.282 1.00 0.00 H new ATOM 622 N THR A 44 -8.604 3.316 -5.367 1.00 0.00 N ATOM 623 CA THR A 44 -7.717 4.081 -6.237 1.00 0.00 C ATOM 624 C THR A 44 -8.207 5.517 -6.393 1.00 0.00 C ATOM 625 O THR A 44 -9.358 5.827 -6.092 1.00 0.00 O ATOM 626 CB THR A 44 -7.602 3.435 -7.629 1.00 0.00 C ATOM 627 OG1 THR A 44 -8.326 2.200 -7.660 1.00 0.00 O ATOM 628 CG2 THR A 44 -6.145 3.183 -7.990 1.00 0.00 C ATOM 0 H THR A 44 -8.760 2.353 -5.666 1.00 0.00 H new ATOM 0 HA THR A 44 -6.735 4.084 -5.765 1.00 0.00 H new ATOM 0 HB THR A 44 -8.028 4.123 -8.359 1.00 0.00 H new ATOM 0 HG1 THR A 44 -8.478 1.933 -8.591 1.00 0.00 H new ATOM 0 HG21 THR A 44 -6.089 2.726 -8.978 1.00 0.00 H new ATOM 0 HG22 THR A 44 -5.603 4.129 -7.996 1.00 0.00 H new ATOM 0 HG23 THR A 44 -5.698 2.514 -7.255 1.00 0.00 H new ATOM 636 N GLN A 45 -7.323 6.389 -6.867 1.00 0.00 N ATOM 637 CA GLN A 45 -7.664 7.793 -7.064 1.00 0.00 C ATOM 638 C GLN A 45 -7.873 8.099 -8.544 1.00 0.00 C ATOM 639 O GLN A 45 -6.936 8.476 -9.248 1.00 0.00 O ATOM 640 CB GLN A 45 -6.565 8.691 -6.495 1.00 0.00 C ATOM 641 CG GLN A 45 -7.091 9.964 -5.852 1.00 0.00 C ATOM 642 CD GLN A 45 -6.359 10.316 -4.571 1.00 0.00 C ATOM 643 OE1 GLN A 45 -5.968 11.464 -4.361 1.00 0.00 O ATOM 644 NE2 GLN A 45 -6.171 9.325 -3.706 1.00 0.00 N ATOM 0 H GLN A 45 -6.365 6.148 -7.122 1.00 0.00 H new ATOM 0 HA GLN A 45 -8.596 7.993 -6.535 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -5.995 8.129 -5.755 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -5.874 8.957 -7.295 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -6.997 10.789 -6.558 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -8.153 9.847 -5.638 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -6.512 8.388 -3.922 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -5.685 9.501 -2.826 1.00 0.00 H new ATOM 653 N THR A 46 -9.107 7.935 -9.008 1.00 0.00 N ATOM 654 CA THR A 46 -9.439 8.195 -10.404 1.00 0.00 C ATOM 655 C THR A 46 -8.999 9.593 -10.823 1.00 0.00 C ATOM 656 O THR A 46 -8.895 10.497 -9.993 1.00 0.00 O ATOM 657 CB THR A 46 -10.951 8.048 -10.658 1.00 0.00 C ATOM 658 OG1 THR A 46 -11.689 8.740 -9.643 1.00 0.00 O ATOM 659 CG2 THR A 46 -11.358 6.582 -10.676 1.00 0.00 C ATOM 0 H THR A 46 -9.894 7.623 -8.438 1.00 0.00 H new ATOM 0 HA THR A 46 -8.904 7.455 -10.999 1.00 0.00 H new ATOM 0 HB THR A 46 -11.176 8.483 -11.632 1.00 0.00 H new ATOM 0 HG1 THR A 46 -12.590 8.939 -9.972 1.00 0.00 H new ATOM 0 HG21 THR A 46 -12.430 6.504 -10.857 1.00 0.00 H new ATOM 0 HG22 THR A 46 -10.818 6.064 -11.468 1.00 0.00 H new ATOM 0 HG23 THR A 46 -11.118 6.126 -9.715 1.00 0.00 H new ATOM 667 N TYR A 47 -8.739 9.763 -12.115 1.00 0.00 N ATOM 668 CA TYR A 47 -8.308 11.052 -12.644 1.00 0.00 C ATOM 669 C TYR A 47 -8.078 10.972 -14.150 1.00 0.00 C ATOM 670 O TYR A 47 -7.853 9.893 -14.698 1.00 0.00 O ATOM 671 CB TYR A 47 -7.027 11.512 -11.944 1.00 0.00 C ATOM 672 CG TYR A 47 -5.828 10.641 -12.241 1.00 0.00 C ATOM 673 CD1 TYR A 47 -5.293 10.574 -13.521 1.00 0.00 C ATOM 674 CD2 TYR A 47 -5.230 9.887 -11.239 1.00 0.00 C ATOM 675 CE1 TYR A 47 -4.197 9.779 -13.795 1.00 0.00 C ATOM 676 CE2 TYR A 47 -4.132 9.090 -11.505 1.00 0.00 C ATOM 677 CZ TYR A 47 -3.620 9.040 -12.785 1.00 0.00 C ATOM 678 OH TYR A 47 -2.528 8.247 -13.053 1.00 0.00 O ATOM 0 H TYR A 47 -8.819 9.025 -12.815 1.00 0.00 H new ATOM 0 HA TYR A 47 -9.098 11.778 -12.453 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -6.806 12.536 -12.246 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -7.197 11.527 -10.867 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -5.741 11.153 -14.315 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -5.629 9.924 -10.236 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -3.794 9.737 -14.796 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -3.678 8.510 -10.715 1.00 0.00 H new ATOM 0 HH TYR A 47 -1.796 8.802 -13.395 1.00 0.00 H new ATOM 688 N GLY A 48 -8.136 12.123 -14.813 1.00 0.00 N ATOM 689 CA GLY A 48 -7.932 12.161 -16.250 1.00 0.00 C ATOM 690 C GLY A 48 -8.987 11.380 -17.006 1.00 0.00 C ATOM 691 O GLY A 48 -9.938 10.870 -16.413 1.00 0.00 O ATOM 0 H GLY A 48 -8.320 13.029 -14.382 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -7.940 13.197 -16.588 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -6.947 11.757 -16.485 1.00 0.00 H new ATOM 695 N GLY A 49 -8.820 11.284 -18.322 1.00 0.00 N ATOM 696 CA GLY A 49 -9.773 10.557 -19.140 1.00 0.00 C ATOM 697 C GLY A 49 -10.966 11.406 -19.532 1.00 0.00 C ATOM 698 O GLY A 49 -10.913 12.633 -19.462 1.00 0.00 O ATOM 0 H GLY A 49 -8.042 11.697 -18.836 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -9.275 10.198 -20.041 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -10.119 9.679 -18.595 1.00 0.00 H new ATOM 702 N ASN A 50 -12.047 10.750 -19.945 1.00 0.00 N ATOM 703 CA ASN A 50 -13.259 11.452 -20.349 1.00 0.00 C ATOM 704 C ASN A 50 -14.176 11.687 -19.153 1.00 0.00 C ATOM 705 O ASN A 50 -15.378 11.905 -19.313 1.00 0.00 O ATOM 706 CB ASN A 50 -13.999 10.656 -21.425 1.00 0.00 C ATOM 707 CG ASN A 50 -14.232 9.213 -21.021 1.00 0.00 C ATOM 708 OD1 ASN A 50 -14.882 8.936 -20.013 1.00 0.00 O ATOM 709 ND2 ASN A 50 -13.701 8.284 -21.808 1.00 0.00 N ATOM 0 H ASN A 50 -12.107 9.734 -20.008 1.00 0.00 H new ATOM 0 HA ASN A 50 -12.969 12.420 -20.757 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -14.958 11.132 -21.630 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -13.425 10.683 -22.351 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -13.825 7.296 -21.586 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -13.169 8.558 -22.634 1.00 0.00 H new ATOM 716 N SER A 51 -13.603 11.641 -17.955 1.00 0.00 N ATOM 717 CA SER A 51 -14.368 11.850 -16.733 1.00 0.00 C ATOM 718 C SER A 51 -13.918 13.119 -16.017 1.00 0.00 C ATOM 719 O SER A 51 -14.663 13.697 -15.228 1.00 0.00 O ATOM 720 CB SER A 51 -14.219 10.646 -15.801 1.00 0.00 C ATOM 721 OG SER A 51 -15.456 10.312 -15.194 1.00 0.00 O ATOM 0 H SER A 51 -12.610 11.461 -17.805 1.00 0.00 H new ATOM 0 HA SER A 51 -15.417 11.962 -17.007 1.00 0.00 H new ATOM 0 HB2 SER A 51 -13.844 9.791 -16.364 1.00 0.00 H new ATOM 0 HB3 SER A 51 -13.481 10.868 -15.030 1.00 0.00 H new ATOM 0 HG SER A 51 -16.083 10.001 -15.880 1.00 0.00 H new ATOM 727 N ASN A 52 -12.692 13.548 -16.302 1.00 0.00 N ATOM 728 CA ASN A 52 -12.141 14.750 -15.686 1.00 0.00 C ATOM 729 C ASN A 52 -11.930 14.547 -14.189 1.00 0.00 C ATOM 730 O ASN A 52 -11.684 15.502 -13.452 1.00 0.00 O ATOM 731 CB ASN A 52 -13.069 15.942 -15.925 1.00 0.00 C ATOM 732 CG ASN A 52 -12.637 17.176 -15.159 1.00 0.00 C ATOM 733 OD1 ASN A 52 -11.476 17.584 -15.221 1.00 0.00 O ATOM 734 ND2 ASN A 52 -13.569 17.777 -14.430 1.00 0.00 N ATOM 0 H ASN A 52 -12.062 13.082 -16.955 1.00 0.00 H new ATOM 0 HA ASN A 52 -11.174 14.953 -16.146 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -13.095 16.170 -16.991 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -14.084 15.673 -15.632 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -13.336 18.612 -13.892 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -14.518 17.404 -14.408 1.00 0.00 H new ATOM 741 N GLY A 53 -12.029 13.298 -13.746 1.00 0.00 N ATOM 742 CA GLY A 53 -11.848 12.993 -12.339 1.00 0.00 C ATOM 743 C GLY A 53 -13.146 12.617 -11.653 1.00 0.00 C ATOM 744 O GLY A 53 -13.666 13.375 -10.836 1.00 0.00 O ATOM 0 H GLY A 53 -12.231 12.491 -14.337 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -11.137 12.173 -12.237 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -11.413 13.857 -11.837 1.00 0.00 H new ATOM 748 N GLU A 54 -13.670 11.442 -11.987 1.00 0.00 N ATOM 749 CA GLU A 54 -14.916 10.966 -11.399 1.00 0.00 C ATOM 750 C GLU A 54 -14.838 9.473 -11.092 1.00 0.00 C ATOM 751 O GLU A 54 -13.937 8.778 -11.562 1.00 0.00 O ATOM 752 CB GLU A 54 -16.089 11.244 -12.342 1.00 0.00 C ATOM 753 CG GLU A 54 -16.827 12.536 -12.030 1.00 0.00 C ATOM 754 CD GLU A 54 -15.912 13.745 -12.039 1.00 0.00 C ATOM 755 OE1 GLU A 54 -15.034 13.820 -12.924 1.00 0.00 O ATOM 756 OE2 GLU A 54 -16.076 14.618 -11.161 1.00 0.00 O ATOM 0 H GLU A 54 -13.251 10.802 -12.662 1.00 0.00 H new ATOM 0 HA GLU A 54 -15.075 11.503 -10.464 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -15.719 11.285 -13.366 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -16.792 10.412 -12.290 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -17.623 12.681 -12.761 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -17.303 12.452 -11.053 1.00 0.00 H new ATOM 763 N PRO A 55 -15.789 8.964 -10.297 1.00 0.00 N ATOM 764 CA PRO A 55 -15.834 7.547 -9.923 1.00 0.00 C ATOM 765 C PRO A 55 -16.195 6.649 -11.102 1.00 0.00 C ATOM 766 O PRO A 55 -16.909 7.063 -12.015 1.00 0.00 O ATOM 767 CB PRO A 55 -16.931 7.495 -8.857 1.00 0.00 C ATOM 768 CG PRO A 55 -17.805 8.665 -9.154 1.00 0.00 C ATOM 769 CD PRO A 55 -16.896 9.731 -9.701 1.00 0.00 C ATOM 0 HA PRO A 55 -14.866 7.186 -9.575 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -17.490 6.560 -8.909 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -16.511 7.560 -7.853 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -18.577 8.402 -9.877 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -18.314 9.010 -8.254 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -17.402 10.348 -10.443 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -16.544 10.400 -8.916 1.00 0.00 H new ATOM 777 N CYS A 56 -15.695 5.418 -11.077 1.00 0.00 N ATOM 778 CA CYS A 56 -15.964 4.463 -12.145 1.00 0.00 C ATOM 779 C CYS A 56 -17.346 3.842 -11.986 1.00 0.00 C ATOM 780 O CYS A 56 -18.137 4.264 -11.141 1.00 0.00 O ATOM 781 CB CYS A 56 -14.898 3.365 -12.160 1.00 0.00 C ATOM 782 SG CYS A 56 -13.205 3.966 -11.857 1.00 0.00 S ATOM 0 H CYS A 56 -15.102 5.059 -10.329 1.00 0.00 H new ATOM 0 HA CYS A 56 -15.934 5.001 -13.092 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -15.148 2.621 -11.404 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -14.925 2.860 -13.126 1.00 0.00 H new ATOM 787 N VAL A 57 -17.630 2.839 -12.807 1.00 0.00 N ATOM 788 CA VAL A 57 -18.916 2.157 -12.766 1.00 0.00 C ATOM 789 C VAL A 57 -18.756 0.677 -13.090 1.00 0.00 C ATOM 790 O VAL A 57 -19.372 0.162 -14.023 1.00 0.00 O ATOM 791 CB VAL A 57 -19.911 2.789 -13.756 1.00 0.00 C ATOM 792 CG1 VAL A 57 -21.342 2.463 -13.360 1.00 0.00 C ATOM 793 CG2 VAL A 57 -19.697 4.293 -13.835 1.00 0.00 C ATOM 0 H VAL A 57 -16.985 2.480 -13.511 1.00 0.00 H new ATOM 0 HA VAL A 57 -19.307 2.263 -11.754 1.00 0.00 H new ATOM 0 HB VAL A 57 -19.732 2.367 -14.745 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -22.030 2.919 -14.072 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -21.483 1.382 -13.361 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -21.541 2.854 -12.362 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -20.408 4.725 -14.539 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -19.848 4.734 -12.850 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -18.681 4.499 -14.173 1.00 0.00 H new ATOM 803 N LEU A 58 -17.918 -0.002 -12.313 1.00 0.00 N ATOM 804 CA LEU A 58 -17.666 -1.423 -12.514 1.00 0.00 C ATOM 805 C LEU A 58 -18.842 -2.264 -12.024 1.00 0.00 C ATOM 806 O LEU A 58 -19.660 -1.802 -11.229 1.00 0.00 O ATOM 807 CB LEU A 58 -16.388 -1.840 -11.785 1.00 0.00 C ATOM 808 CG LEU A 58 -15.086 -1.463 -12.495 1.00 0.00 C ATOM 809 CD1 LEU A 58 -14.021 -1.071 -11.483 1.00 0.00 C ATOM 810 CD2 LEU A 58 -14.600 -2.613 -13.363 1.00 0.00 C ATOM 0 H LEU A 58 -17.401 0.411 -11.537 1.00 0.00 H new ATOM 0 HA LEU A 58 -17.543 -1.596 -13.583 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -16.388 -1.386 -10.794 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -16.406 -2.920 -11.641 1.00 0.00 H new ATOM 0 HG LEU A 58 -15.281 -0.605 -13.139 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -13.102 -0.806 -12.006 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -14.368 -0.216 -10.903 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -13.829 -1.910 -10.814 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -13.673 -2.327 -13.860 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -14.422 -3.489 -12.740 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -15.356 -2.848 -14.112 1.00 0.00 H new ATOM 822 N PRO A 59 -18.936 -3.514 -12.499 1.00 0.00 N ATOM 823 CA PRO A 59 -17.974 -4.084 -13.446 1.00 0.00 C ATOM 824 C PRO A 59 -18.090 -3.467 -14.834 1.00 0.00 C ATOM 825 O PRO A 59 -19.035 -2.733 -15.123 1.00 0.00 O ATOM 826 CB PRO A 59 -18.344 -5.573 -13.504 1.00 0.00 C ATOM 827 CG PRO A 59 -19.307 -5.795 -12.384 1.00 0.00 C ATOM 828 CD PRO A 59 -19.986 -4.477 -12.151 1.00 0.00 C ATOM 0 HA PRO A 59 -16.948 -3.899 -13.127 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -18.794 -5.827 -14.464 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -17.460 -6.201 -13.390 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -20.032 -6.567 -12.641 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -18.789 -6.131 -11.486 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -20.869 -4.359 -12.779 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -20.312 -4.366 -11.117 1.00 0.00 H new ATOM 836 N PHE A 60 -17.126 -3.780 -15.690 1.00 0.00 N ATOM 837 CA PHE A 60 -17.115 -3.271 -17.055 1.00 0.00 C ATOM 838 C PHE A 60 -16.232 -4.140 -17.941 1.00 0.00 C ATOM 839 O PHE A 60 -15.057 -4.355 -17.646 1.00 0.00 O ATOM 840 CB PHE A 60 -16.632 -1.817 -17.084 1.00 0.00 C ATOM 841 CG PHE A 60 -15.137 -1.670 -17.061 1.00 0.00 C ATOM 842 CD1 PHE A 60 -14.382 -1.944 -18.190 1.00 0.00 C ATOM 843 CD2 PHE A 60 -14.488 -1.256 -15.909 1.00 0.00 C ATOM 844 CE1 PHE A 60 -13.007 -1.808 -18.170 1.00 0.00 C ATOM 845 CE2 PHE A 60 -13.114 -1.118 -15.883 1.00 0.00 C ATOM 846 CZ PHE A 60 -12.372 -1.395 -17.016 1.00 0.00 C ATOM 0 H PHE A 60 -16.338 -4.387 -15.462 1.00 0.00 H new ATOM 0 HA PHE A 60 -18.134 -3.304 -17.441 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -17.021 -1.333 -17.980 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -17.052 -1.288 -16.229 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -14.874 -2.267 -19.096 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -15.063 -1.039 -15.021 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -12.430 -2.025 -19.057 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -12.620 -0.794 -14.979 1.00 0.00 H new ATOM 0 HZ PHE A 60 -11.297 -1.288 -16.998 1.00 0.00 H new ATOM 856 N THR A 61 -16.809 -4.650 -19.023 1.00 0.00 N ATOM 857 CA THR A 61 -16.081 -5.505 -19.945 1.00 0.00 C ATOM 858 C THR A 61 -15.386 -4.686 -21.028 1.00 0.00 C ATOM 859 O THR A 61 -15.889 -3.646 -21.453 1.00 0.00 O ATOM 860 CB THR A 61 -17.019 -6.525 -20.612 1.00 0.00 C ATOM 861 OG1 THR A 61 -18.251 -5.892 -20.978 1.00 0.00 O ATOM 862 CG2 THR A 61 -17.301 -7.694 -19.681 1.00 0.00 C ATOM 0 H THR A 61 -17.782 -4.484 -19.281 1.00 0.00 H new ATOM 0 HA THR A 61 -15.329 -6.035 -19.361 1.00 0.00 H new ATOM 0 HB THR A 61 -16.526 -6.906 -21.507 1.00 0.00 H new ATOM 0 HG1 THR A 61 -18.842 -6.548 -21.404 1.00 0.00 H new ATOM 0 HG21 THR A 61 -17.967 -8.401 -20.176 1.00 0.00 H new ATOM 0 HG22 THR A 61 -16.365 -8.192 -19.429 1.00 0.00 H new ATOM 0 HG23 THR A 61 -17.774 -7.328 -18.770 1.00 0.00 H new ATOM 870 N TYR A 62 -14.231 -5.169 -21.476 1.00 0.00 N ATOM 871 CA TYR A 62 -13.469 -4.486 -22.515 1.00 0.00 C ATOM 872 C TYR A 62 -12.556 -5.464 -23.247 1.00 0.00 C ATOM 873 O TYR A 62 -11.782 -6.192 -22.626 1.00 0.00 O ATOM 874 CB TYR A 62 -12.648 -3.342 -21.918 1.00 0.00 C ATOM 875 CG TYR A 62 -11.517 -2.879 -22.807 1.00 0.00 C ATOM 876 CD1 TYR A 62 -10.319 -3.580 -22.862 1.00 0.00 C ATOM 877 CD2 TYR A 62 -11.648 -1.742 -23.593 1.00 0.00 C ATOM 878 CE1 TYR A 62 -9.283 -3.160 -23.675 1.00 0.00 C ATOM 879 CE2 TYR A 62 -10.618 -1.315 -24.408 1.00 0.00 C ATOM 880 CZ TYR A 62 -9.437 -2.027 -24.446 1.00 0.00 C ATOM 881 OH TYR A 62 -8.408 -1.606 -25.256 1.00 0.00 O ATOM 0 H TYR A 62 -13.803 -6.030 -21.136 1.00 0.00 H new ATOM 0 HA TYR A 62 -14.175 -4.069 -23.233 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -13.309 -2.499 -21.716 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -12.238 -3.662 -20.960 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -10.195 -4.468 -22.260 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -12.571 -1.182 -23.567 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -8.358 -3.716 -23.706 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -10.737 -0.428 -25.013 1.00 0.00 H new ATOM 0 HH TYR A 62 -8.679 -0.794 -25.733 1.00 0.00 H new ATOM 891 N ASN A 63 -12.663 -5.483 -24.574 1.00 0.00 N ATOM 892 CA ASN A 63 -11.855 -6.373 -25.405 1.00 0.00 C ATOM 893 C ASN A 63 -12.385 -7.808 -25.374 1.00 0.00 C ATOM 894 O ASN A 63 -11.968 -8.648 -26.172 1.00 0.00 O ATOM 895 CB ASN A 63 -10.385 -6.331 -24.958 1.00 0.00 C ATOM 896 CG ASN A 63 -10.019 -7.444 -23.991 1.00 0.00 C ATOM 897 OD1 ASN A 63 -10.197 -8.625 -24.290 1.00 0.00 O ATOM 898 ND2 ASN A 63 -9.505 -7.069 -22.825 1.00 0.00 N ATOM 0 H ASN A 63 -13.305 -4.889 -25.099 1.00 0.00 H new ATOM 0 HA ASN A 63 -11.922 -6.020 -26.434 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -9.743 -6.397 -25.837 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -10.183 -5.369 -24.487 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -9.240 -7.772 -22.135 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -9.375 -6.078 -22.620 1.00 0.00 H new ATOM 905 N GLY A 64 -13.296 -8.088 -24.446 1.00 0.00 N ATOM 906 CA GLY A 64 -13.852 -9.421 -24.330 1.00 0.00 C ATOM 907 C GLY A 64 -13.736 -9.959 -22.920 1.00 0.00 C ATOM 908 O GLY A 64 -14.172 -11.073 -22.632 1.00 0.00 O ATOM 0 H GLY A 64 -13.658 -7.413 -23.772 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -14.901 -9.404 -24.627 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -13.336 -10.091 -25.018 1.00 0.00 H new ATOM 912 N ARG A 65 -13.143 -9.160 -22.036 1.00 0.00 N ATOM 913 CA ARG A 65 -12.965 -9.556 -20.646 1.00 0.00 C ATOM 914 C ARG A 65 -13.767 -8.641 -19.720 1.00 0.00 C ATOM 915 O ARG A 65 -13.878 -7.440 -19.966 1.00 0.00 O ATOM 916 CB ARG A 65 -11.467 -9.537 -20.290 1.00 0.00 C ATOM 917 CG ARG A 65 -11.099 -8.651 -19.107 1.00 0.00 C ATOM 918 CD ARG A 65 -11.306 -9.360 -17.775 1.00 0.00 C ATOM 919 NE ARG A 65 -11.862 -10.704 -17.930 1.00 0.00 N ATOM 920 CZ ARG A 65 -11.597 -11.715 -17.106 1.00 0.00 C ATOM 921 NH1 ARG A 65 -10.798 -11.538 -16.061 1.00 0.00 N ATOM 922 NH2 ARG A 65 -12.140 -12.906 -17.323 1.00 0.00 N ATOM 0 H ARG A 65 -12.778 -8.234 -22.260 1.00 0.00 H new ATOM 0 HA ARG A 65 -13.340 -10.571 -20.511 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -11.147 -10.556 -20.075 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -10.905 -9.204 -21.163 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -10.057 -8.343 -19.195 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -11.703 -7.744 -19.132 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -10.353 -9.424 -17.251 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -11.973 -8.765 -17.152 1.00 0.00 H new ATOM 0 HE ARG A 65 -12.489 -10.876 -18.715 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -10.383 -10.623 -15.886 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -10.599 -12.317 -15.433 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -12.760 -13.046 -18.121 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -11.937 -13.681 -16.692 1.00 0.00 H new ATOM 936 N THR A 66 -14.316 -9.213 -18.653 1.00 0.00 N ATOM 937 CA THR A 66 -15.098 -8.442 -17.692 1.00 0.00 C ATOM 938 C THR A 66 -14.224 -7.975 -16.533 1.00 0.00 C ATOM 939 O THR A 66 -13.900 -8.751 -15.635 1.00 0.00 O ATOM 940 CB THR A 66 -16.276 -9.260 -17.133 1.00 0.00 C ATOM 941 OG1 THR A 66 -17.061 -9.790 -18.208 1.00 0.00 O ATOM 942 CG2 THR A 66 -17.153 -8.399 -16.236 1.00 0.00 C ATOM 0 H THR A 66 -14.234 -10.205 -18.432 1.00 0.00 H new ATOM 0 HA THR A 66 -15.493 -7.577 -18.225 1.00 0.00 H new ATOM 0 HB THR A 66 -15.871 -10.081 -16.542 1.00 0.00 H new ATOM 0 HG1 THR A 66 -17.807 -10.310 -17.843 1.00 0.00 H new ATOM 0 HG21 THR A 66 -17.979 -8.997 -15.852 1.00 0.00 H new ATOM 0 HG22 THR A 66 -16.561 -8.021 -15.403 1.00 0.00 H new ATOM 0 HG23 THR A 66 -17.548 -7.561 -16.810 1.00 0.00 H new ATOM 950 N PHE A 67 -13.844 -6.703 -16.562 1.00 0.00 N ATOM 951 CA PHE A 67 -13.004 -6.132 -15.516 1.00 0.00 C ATOM 952 C PHE A 67 -13.845 -5.646 -14.340 1.00 0.00 C ATOM 953 O PHE A 67 -14.810 -4.903 -14.519 1.00 0.00 O ATOM 954 CB PHE A 67 -12.173 -4.979 -16.080 1.00 0.00 C ATOM 955 CG PHE A 67 -11.499 -5.311 -17.380 1.00 0.00 C ATOM 956 CD1 PHE A 67 -12.198 -5.239 -18.575 1.00 0.00 C ATOM 957 CD2 PHE A 67 -10.169 -5.700 -17.409 1.00 0.00 C ATOM 958 CE1 PHE A 67 -11.583 -5.548 -19.773 1.00 0.00 C ATOM 959 CE2 PHE A 67 -9.549 -6.010 -18.605 1.00 0.00 C ATOM 960 CZ PHE A 67 -10.257 -5.934 -19.788 1.00 0.00 C ATOM 0 H PHE A 67 -14.104 -6.047 -17.299 1.00 0.00 H new ATOM 0 HA PHE A 67 -12.335 -6.913 -15.155 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -12.818 -4.112 -16.225 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -11.416 -4.695 -15.349 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -13.235 -4.938 -18.569 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -9.611 -5.762 -16.487 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -12.139 -5.488 -20.697 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -8.512 -6.311 -18.614 1.00 0.00 H new ATOM 0 HZ PHE A 67 -9.775 -6.176 -20.724 1.00 0.00 H new ATOM 970 N TYR A 68 -13.471 -6.072 -13.138 1.00 0.00 N ATOM 971 CA TYR A 68 -14.188 -5.682 -11.930 1.00 0.00 C ATOM 972 C TYR A 68 -13.391 -4.653 -11.135 1.00 0.00 C ATOM 973 O TYR A 68 -13.695 -4.380 -9.972 1.00 0.00 O ATOM 974 CB TYR A 68 -14.471 -6.909 -11.061 1.00 0.00 C ATOM 975 CG TYR A 68 -15.249 -7.991 -11.775 1.00 0.00 C ATOM 976 CD1 TYR A 68 -16.613 -7.859 -11.998 1.00 0.00 C ATOM 977 CD2 TYR A 68 -14.619 -9.143 -12.228 1.00 0.00 C ATOM 978 CE1 TYR A 68 -17.329 -8.845 -12.651 1.00 0.00 C ATOM 979 CE2 TYR A 68 -15.327 -10.134 -12.882 1.00 0.00 C ATOM 980 CZ TYR A 68 -16.680 -9.980 -13.091 1.00 0.00 C ATOM 981 OH TYR A 68 -17.389 -10.964 -13.742 1.00 0.00 O ATOM 0 H TYR A 68 -12.675 -6.688 -12.975 1.00 0.00 H new ATOM 0 HA TYR A 68 -15.135 -5.231 -12.228 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -13.525 -7.323 -10.713 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -15.027 -6.597 -10.177 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -17.123 -6.971 -11.656 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -13.558 -9.267 -12.067 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -18.390 -8.727 -12.816 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -14.822 -11.024 -13.227 1.00 0.00 H new ATOM 0 HH TYR A 68 -16.784 -11.695 -13.987 1.00 0.00 H new ATOM 991 N SER A 69 -12.370 -4.086 -11.769 1.00 0.00 N ATOM 992 CA SER A 69 -11.528 -3.086 -11.122 1.00 0.00 C ATOM 993 C SER A 69 -10.546 -2.478 -12.118 1.00 0.00 C ATOM 994 O SER A 69 -10.405 -2.963 -13.241 1.00 0.00 O ATOM 995 CB SER A 69 -10.766 -3.711 -9.952 1.00 0.00 C ATOM 996 OG SER A 69 -10.448 -5.067 -10.216 1.00 0.00 O ATOM 0 H SER A 69 -12.106 -4.302 -12.730 1.00 0.00 H new ATOM 0 HA SER A 69 -12.172 -2.293 -10.743 1.00 0.00 H new ATOM 0 HB2 SER A 69 -9.850 -3.149 -9.768 1.00 0.00 H new ATOM 0 HB3 SER A 69 -11.368 -3.645 -9.045 1.00 0.00 H new ATOM 0 HG SER A 69 -9.960 -5.443 -9.454 1.00 0.00 H new ATOM 1002 N CYS A 70 -9.869 -1.415 -11.699 1.00 0.00 N ATOM 1003 CA CYS A 70 -8.899 -0.740 -12.556 1.00 0.00 C ATOM 1004 C CYS A 70 -8.128 -1.749 -13.402 1.00 0.00 C ATOM 1005 O CYS A 70 -8.076 -2.935 -13.078 1.00 0.00 O ATOM 1006 CB CYS A 70 -7.927 0.084 -11.712 1.00 0.00 C ATOM 1007 SG CYS A 70 -8.655 1.597 -11.005 1.00 0.00 S ATOM 0 H CYS A 70 -9.973 -1.002 -10.772 1.00 0.00 H new ATOM 0 HA CYS A 70 -9.443 -0.072 -13.224 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -7.549 -0.538 -10.901 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -7.071 0.359 -12.328 1.00 0.00 H new ATOM 1012 N THR A 71 -7.531 -1.268 -14.488 1.00 0.00 N ATOM 1013 CA THR A 71 -6.762 -2.127 -15.380 1.00 0.00 C ATOM 1014 C THR A 71 -5.882 -1.302 -16.314 1.00 0.00 C ATOM 1015 O THR A 71 -6.098 -0.102 -16.487 1.00 0.00 O ATOM 1016 CB THR A 71 -7.683 -3.027 -16.226 1.00 0.00 C ATOM 1017 OG1 THR A 71 -6.904 -4.000 -16.932 1.00 0.00 O ATOM 1018 CG2 THR A 71 -8.489 -2.200 -17.215 1.00 0.00 C ATOM 0 H THR A 71 -7.565 -0.289 -14.771 1.00 0.00 H new ATOM 0 HA THR A 71 -6.132 -2.754 -14.749 1.00 0.00 H new ATOM 0 HB THR A 71 -8.375 -3.535 -15.554 1.00 0.00 H new ATOM 0 HG1 THR A 71 -7.305 -4.166 -17.811 1.00 0.00 H new ATOM 0 HG21 THR A 71 -9.131 -2.858 -17.801 1.00 0.00 H new ATOM 0 HG22 THR A 71 -9.103 -1.481 -16.673 1.00 0.00 H new ATOM 0 HG23 THR A 71 -7.811 -1.667 -17.882 1.00 0.00 H new ATOM 1026 N THR A 72 -4.892 -1.953 -16.914 1.00 0.00 N ATOM 1027 CA THR A 72 -3.980 -1.280 -17.830 1.00 0.00 C ATOM 1028 C THR A 72 -4.234 -1.708 -19.272 1.00 0.00 C ATOM 1029 O THR A 72 -3.719 -1.100 -20.210 1.00 0.00 O ATOM 1030 CB THR A 72 -2.510 -1.569 -17.474 1.00 0.00 C ATOM 1031 OG1 THR A 72 -2.262 -2.980 -17.517 1.00 0.00 O ATOM 1032 CG2 THR A 72 -2.174 -1.033 -16.090 1.00 0.00 C ATOM 0 H THR A 72 -4.701 -2.946 -16.782 1.00 0.00 H new ATOM 0 HA THR A 72 -4.167 -0.211 -17.732 1.00 0.00 H new ATOM 0 HB THR A 72 -1.877 -1.067 -18.206 1.00 0.00 H new ATOM 0 HG1 THR A 72 -1.324 -3.154 -17.291 1.00 0.00 H new ATOM 0 HG21 THR A 72 -1.131 -1.249 -15.860 1.00 0.00 H new ATOM 0 HG22 THR A 72 -2.335 0.045 -16.068 1.00 0.00 H new ATOM 0 HG23 THR A 72 -2.815 -1.511 -15.349 1.00 0.00 H new ATOM 1040 N GLU A 73 -5.032 -2.757 -19.441 1.00 0.00 N ATOM 1041 CA GLU A 73 -5.354 -3.266 -20.769 1.00 0.00 C ATOM 1042 C GLU A 73 -5.521 -2.122 -21.764 1.00 0.00 C ATOM 1043 O GLU A 73 -6.613 -1.573 -21.916 1.00 0.00 O ATOM 1044 CB GLU A 73 -6.632 -4.105 -20.719 1.00 0.00 C ATOM 1045 CG GLU A 73 -6.375 -5.603 -20.664 1.00 0.00 C ATOM 1046 CD GLU A 73 -6.240 -6.119 -19.245 1.00 0.00 C ATOM 1047 OE1 GLU A 73 -5.705 -5.380 -18.392 1.00 0.00 O ATOM 1048 OE2 GLU A 73 -6.670 -7.263 -18.986 1.00 0.00 O ATOM 0 H GLU A 73 -5.467 -3.271 -18.675 1.00 0.00 H new ATOM 0 HA GLU A 73 -4.528 -3.894 -21.101 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -7.215 -3.812 -19.846 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -7.238 -3.881 -21.597 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -7.192 -6.127 -21.161 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -5.465 -5.832 -21.218 1.00 0.00 H new ATOM 1055 N GLY A 74 -4.433 -1.768 -22.439 1.00 0.00 N ATOM 1056 CA GLY A 74 -4.481 -0.691 -23.411 1.00 0.00 C ATOM 1057 C GLY A 74 -3.585 0.471 -23.032 1.00 0.00 C ATOM 1058 O GLY A 74 -2.946 1.078 -23.892 1.00 0.00 O ATOM 0 H GLY A 74 -3.519 -2.207 -22.331 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -4.182 -1.073 -24.387 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -5.508 -0.338 -23.507 1.00 0.00 H new ATOM 1062 N ARG A 75 -3.538 0.784 -21.741 1.00 0.00 N ATOM 1063 CA ARG A 75 -2.714 1.882 -21.249 1.00 0.00 C ATOM 1064 C ARG A 75 -1.240 1.493 -21.238 1.00 0.00 C ATOM 1065 O ARG A 75 -0.778 0.796 -20.335 1.00 0.00 O ATOM 1066 CB ARG A 75 -3.157 2.289 -19.842 1.00 0.00 C ATOM 1067 CG ARG A 75 -4.530 2.940 -19.801 1.00 0.00 C ATOM 1068 CD ARG A 75 -4.429 4.448 -19.634 1.00 0.00 C ATOM 1069 NE ARG A 75 -3.700 5.073 -20.733 1.00 0.00 N ATOM 1070 CZ ARG A 75 -4.260 5.408 -21.891 1.00 0.00 C ATOM 1071 NH1 ARG A 75 -5.550 5.177 -22.098 1.00 0.00 N ATOM 1072 NH2 ARG A 75 -3.532 5.973 -22.844 1.00 0.00 N ATOM 0 H ARG A 75 -4.061 0.292 -21.016 1.00 0.00 H new ATOM 0 HA ARG A 75 -2.842 2.730 -21.922 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -3.163 1.406 -19.203 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -2.424 2.980 -19.425 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -5.070 2.710 -20.720 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -5.108 2.520 -18.978 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -5.431 4.874 -19.575 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -3.930 4.676 -18.692 1.00 0.00 H new ATOM 0 HE ARG A 75 -2.706 5.263 -20.605 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -6.114 4.742 -21.368 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -5.978 5.435 -22.987 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -2.540 6.152 -22.690 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -3.964 6.229 -23.732 1.00 0.00 H new ATOM 1086 N GLN A 76 -0.505 1.950 -22.248 1.00 0.00 N ATOM 1087 CA GLN A 76 0.918 1.649 -22.354 1.00 0.00 C ATOM 1088 C GLN A 76 1.749 2.675 -21.591 1.00 0.00 C ATOM 1089 O GLN A 76 2.956 2.791 -21.801 1.00 0.00 O ATOM 1090 CB GLN A 76 1.347 1.620 -23.822 1.00 0.00 C ATOM 1091 CG GLN A 76 2.106 0.362 -24.210 1.00 0.00 C ATOM 1092 CD GLN A 76 1.186 -0.778 -24.602 1.00 0.00 C ATOM 1093 OE1 GLN A 76 1.408 -1.451 -25.608 1.00 0.00 O ATOM 1094 NE2 GLN A 76 0.146 -0.999 -23.807 1.00 0.00 N ATOM 0 H GLN A 76 -0.871 2.529 -23.003 1.00 0.00 H new ATOM 0 HA GLN A 76 1.090 0.667 -21.913 1.00 0.00 H new ATOM 0 HB2 GLN A 76 0.462 1.709 -24.452 1.00 0.00 H new ATOM 0 HB3 GLN A 76 1.972 2.489 -24.026 1.00 0.00 H new ATOM 0 HG2 GLN A 76 2.774 0.587 -25.042 1.00 0.00 H new ATOM 0 HG3 GLN A 76 2.732 0.048 -23.375 1.00 0.00 H new ATOM 0 HE21 GLN A 76 0.001 -0.416 -22.983 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -0.508 -1.752 -24.020 1.00 0.00 H new ATOM 1103 N ASP A 77 1.094 3.416 -20.702 1.00 0.00 N ATOM 1104 CA ASP A 77 1.773 4.432 -19.907 1.00 0.00 C ATOM 1105 C ASP A 77 1.880 3.999 -18.448 1.00 0.00 C ATOM 1106 O ASP A 77 2.053 4.829 -17.555 1.00 0.00 O ATOM 1107 CB ASP A 77 1.030 5.765 -20.002 1.00 0.00 C ATOM 1108 CG ASP A 77 -0.472 5.584 -20.108 1.00 0.00 C ATOM 1109 OD1 ASP A 77 -1.028 4.768 -19.342 1.00 0.00 O ATOM 1110 OD2 ASP A 77 -1.093 6.257 -20.957 1.00 0.00 O ATOM 0 H ASP A 77 0.095 3.331 -20.515 1.00 0.00 H new ATOM 0 HA ASP A 77 2.780 4.556 -20.305 1.00 0.00 H new ATOM 0 HB2 ASP A 77 1.259 6.369 -19.124 1.00 0.00 H new ATOM 0 HB3 ASP A 77 1.389 6.317 -20.871 1.00 0.00 H new ATOM 1115 N GLY A 78 1.777 2.695 -18.214 1.00 0.00 N ATOM 1116 CA GLY A 78 1.865 2.175 -16.862 1.00 0.00 C ATOM 1117 C GLY A 78 0.712 2.630 -15.990 1.00 0.00 C ATOM 1118 O GLY A 78 0.713 2.402 -14.780 1.00 0.00 O ATOM 0 H GLY A 78 1.634 1.989 -18.936 1.00 0.00 H new ATOM 0 HA2 GLY A 78 1.883 1.086 -16.895 1.00 0.00 H new ATOM 0 HA3 GLY A 78 2.805 2.496 -16.413 1.00 0.00 H new ATOM 1122 N HIS A 79 -0.273 3.276 -16.604 1.00 0.00 N ATOM 1123 CA HIS A 79 -1.438 3.766 -15.875 1.00 0.00 C ATOM 1124 C HIS A 79 -2.638 2.849 -16.088 1.00 0.00 C ATOM 1125 O HIS A 79 -2.787 2.241 -17.148 1.00 0.00 O ATOM 1126 CB HIS A 79 -1.783 5.188 -16.321 1.00 0.00 C ATOM 1127 CG HIS A 79 -1.146 6.250 -15.480 1.00 0.00 C ATOM 1128 ND1 HIS A 79 -0.079 6.008 -14.641 1.00 0.00 N ATOM 1129 CD2 HIS A 79 -1.430 7.569 -15.352 1.00 0.00 C ATOM 1130 CE1 HIS A 79 0.265 7.130 -14.033 1.00 0.00 C ATOM 1131 NE2 HIS A 79 -0.539 8.090 -14.447 1.00 0.00 N ATOM 0 H HIS A 79 -0.288 3.473 -17.605 1.00 0.00 H new ATOM 0 HA HIS A 79 -1.194 3.775 -14.813 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -1.471 5.321 -17.357 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -2.865 5.316 -16.295 1.00 0.00 H new ATOM 0 HD1 HIS A 79 0.374 5.104 -14.510 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -2.211 8.109 -15.866 1.00 0.00 H new ATOM 0 HE1 HIS A 79 1.068 7.242 -13.319 1.00 0.00 H new ATOM 1140 N LEU A 80 -3.491 2.755 -15.073 1.00 0.00 N ATOM 1141 CA LEU A 80 -4.678 1.911 -15.149 1.00 0.00 C ATOM 1142 C LEU A 80 -5.929 2.753 -15.384 1.00 0.00 C ATOM 1143 O LEU A 80 -6.074 3.838 -14.820 1.00 0.00 O ATOM 1144 CB LEU A 80 -4.833 1.095 -13.865 1.00 0.00 C ATOM 1145 CG LEU A 80 -3.542 0.465 -13.339 1.00 0.00 C ATOM 1146 CD1 LEU A 80 -2.589 1.541 -12.843 1.00 0.00 C ATOM 1147 CD2 LEU A 80 -3.848 -0.533 -12.232 1.00 0.00 C ATOM 0 H LEU A 80 -3.383 3.252 -14.189 1.00 0.00 H new ATOM 0 HA LEU A 80 -4.556 1.230 -15.991 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -5.246 1.740 -13.090 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -5.560 0.303 -14.042 1.00 0.00 H new ATOM 0 HG LEU A 80 -3.060 -0.069 -14.157 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -1.676 1.075 -12.472 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -2.345 2.217 -13.663 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -3.062 2.103 -12.038 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -2.918 -0.971 -11.870 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -4.352 -0.023 -11.411 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -4.493 -1.321 -12.621 1.00 0.00 H new ATOM 1159 N TRP A 81 -6.829 2.246 -16.220 1.00 0.00 N ATOM 1160 CA TRP A 81 -8.067 2.951 -16.528 1.00 0.00 C ATOM 1161 C TRP A 81 -9.280 2.150 -16.065 1.00 0.00 C ATOM 1162 O TRP A 81 -9.170 0.966 -15.750 1.00 0.00 O ATOM 1163 CB TRP A 81 -8.163 3.222 -18.031 1.00 0.00 C ATOM 1164 CG TRP A 81 -8.284 1.975 -18.853 1.00 0.00 C ATOM 1165 CD1 TRP A 81 -7.308 1.047 -19.082 1.00 0.00 C ATOM 1166 CD2 TRP A 81 -9.444 1.520 -19.557 1.00 0.00 C ATOM 1167 NE1 TRP A 81 -7.793 0.042 -19.885 1.00 0.00 N ATOM 1168 CE2 TRP A 81 -9.102 0.310 -20.189 1.00 0.00 C ATOM 1169 CE3 TRP A 81 -10.742 2.018 -19.712 1.00 0.00 C ATOM 1170 CZ2 TRP A 81 -10.009 -0.407 -20.964 1.00 0.00 C ATOM 1171 CZ3 TRP A 81 -11.641 1.304 -20.482 1.00 0.00 C ATOM 1172 CH2 TRP A 81 -11.271 0.103 -21.100 1.00 0.00 C ATOM 0 H TRP A 81 -6.724 1.350 -16.696 1.00 0.00 H new ATOM 0 HA TRP A 81 -8.057 3.901 -15.994 1.00 0.00 H new ATOM 0 HB2 TRP A 81 -9.025 3.860 -18.223 1.00 0.00 H new ATOM 0 HB3 TRP A 81 -7.280 3.775 -18.350 1.00 0.00 H new ATOM 0 HD1 TRP A 81 -6.303 1.096 -18.690 1.00 0.00 H new ATOM 0 HE1 TRP A 81 -7.265 -0.771 -20.203 1.00 0.00 H new ATOM 0 HE3 TRP A 81 -11.036 2.943 -19.239 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 -9.726 -1.334 -21.441 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 -12.646 1.679 -20.609 1.00 0.00 H new ATOM 0 HH2 TRP A 81 -11.996 -0.431 -21.696 1.00 0.00 H new ATOM 1183 N CYS A 82 -10.435 2.804 -16.027 1.00 0.00 N ATOM 1184 CA CYS A 82 -11.669 2.153 -15.603 1.00 0.00 C ATOM 1185 C CYS A 82 -12.858 2.654 -16.417 1.00 0.00 C ATOM 1186 O CYS A 82 -12.787 3.703 -17.056 1.00 0.00 O ATOM 1187 CB CYS A 82 -11.915 2.401 -14.114 1.00 0.00 C ATOM 1188 SG CYS A 82 -12.403 4.112 -13.716 1.00 0.00 S ATOM 0 H CYS A 82 -10.543 3.785 -16.285 1.00 0.00 H new ATOM 0 HA CYS A 82 -11.562 1.082 -15.774 1.00 0.00 H new ATOM 0 HB2 CYS A 82 -12.694 1.722 -13.767 1.00 0.00 H new ATOM 0 HB3 CYS A 82 -11.009 2.155 -13.561 1.00 0.00 H new ATOM 1193 N SER A 83 -13.950 1.897 -16.386 1.00 0.00 N ATOM 1194 CA SER A 83 -15.155 2.265 -17.120 1.00 0.00 C ATOM 1195 C SER A 83 -16.062 3.146 -16.268 1.00 0.00 C ATOM 1196 O SER A 83 -16.568 2.714 -15.232 1.00 0.00 O ATOM 1197 CB SER A 83 -15.911 1.011 -17.562 1.00 0.00 C ATOM 1198 OG SER A 83 -17.055 1.347 -18.328 1.00 0.00 O ATOM 0 H SER A 83 -14.025 1.026 -15.861 1.00 0.00 H new ATOM 0 HA SER A 83 -14.855 2.830 -18.003 1.00 0.00 H new ATOM 0 HB2 SER A 83 -15.251 0.373 -18.150 1.00 0.00 H new ATOM 0 HB3 SER A 83 -16.212 0.437 -16.686 1.00 0.00 H new ATOM 0 HG SER A 83 -17.855 1.282 -17.766 1.00 0.00 H new ATOM 1204 N THR A 84 -16.264 4.383 -16.711 1.00 0.00 N ATOM 1205 CA THR A 84 -17.110 5.324 -15.989 1.00 0.00 C ATOM 1206 C THR A 84 -18.569 5.190 -16.413 1.00 0.00 C ATOM 1207 O THR A 84 -19.280 6.187 -16.547 1.00 0.00 O ATOM 1208 CB THR A 84 -16.653 6.778 -16.213 1.00 0.00 C ATOM 1209 OG1 THR A 84 -16.258 6.962 -17.577 1.00 0.00 O ATOM 1210 CG2 THR A 84 -15.495 7.128 -15.292 1.00 0.00 C ATOM 0 H THR A 84 -15.853 4.756 -17.567 1.00 0.00 H new ATOM 0 HA THR A 84 -17.019 5.082 -14.930 1.00 0.00 H new ATOM 0 HB THR A 84 -17.490 7.439 -15.986 1.00 0.00 H new ATOM 0 HG1 THR A 84 -15.753 7.798 -17.661 1.00 0.00 H new ATOM 0 HG21 THR A 84 -15.189 8.159 -15.468 1.00 0.00 H new ATOM 0 HG22 THR A 84 -15.808 7.014 -14.254 1.00 0.00 H new ATOM 0 HG23 THR A 84 -14.656 6.462 -15.493 1.00 0.00 H new ATOM 1218 N THR A 85 -19.009 3.954 -16.623 1.00 0.00 N ATOM 1219 CA THR A 85 -20.383 3.691 -17.032 1.00 0.00 C ATOM 1220 C THR A 85 -20.627 2.197 -17.212 1.00 0.00 C ATOM 1221 O THR A 85 -19.884 1.517 -17.919 1.00 0.00 O ATOM 1222 CB THR A 85 -20.728 4.419 -18.344 1.00 0.00 C ATOM 1223 OG1 THR A 85 -19.552 4.561 -19.150 1.00 0.00 O ATOM 1224 CG2 THR A 85 -21.323 5.789 -18.061 1.00 0.00 C ATOM 0 H THR A 85 -18.434 3.119 -16.517 1.00 0.00 H new ATOM 0 HA THR A 85 -21.027 4.068 -16.237 1.00 0.00 H new ATOM 0 HB THR A 85 -21.466 3.823 -18.881 1.00 0.00 H new ATOM 0 HG1 THR A 85 -19.281 3.683 -19.490 1.00 0.00 H new ATOM 0 HG21 THR A 85 -21.559 6.285 -19.003 1.00 0.00 H new ATOM 0 HG22 THR A 85 -22.233 5.676 -17.472 1.00 0.00 H new ATOM 0 HG23 THR A 85 -20.604 6.390 -17.505 1.00 0.00 H new ATOM 1232 N SER A 86 -21.674 1.692 -16.566 1.00 0.00 N ATOM 1233 CA SER A 86 -22.017 0.278 -16.654 1.00 0.00 C ATOM 1234 C SER A 86 -21.736 -0.265 -18.051 1.00 0.00 C ATOM 1235 O SER A 86 -20.878 -1.130 -18.231 1.00 0.00 O ATOM 1236 CB SER A 86 -23.490 0.067 -16.298 1.00 0.00 C ATOM 1237 OG SER A 86 -23.972 -1.157 -16.825 1.00 0.00 O ATOM 0 H SER A 86 -22.299 2.242 -15.976 1.00 0.00 H new ATOM 0 HA SER A 86 -21.396 -0.266 -15.942 1.00 0.00 H new ATOM 0 HB2 SER A 86 -23.610 0.072 -15.215 1.00 0.00 H new ATOM 0 HB3 SER A 86 -24.084 0.894 -16.688 1.00 0.00 H new ATOM 0 HG SER A 86 -24.915 -1.269 -16.583 1.00 0.00 H new ATOM 1243 N ASN A 87 -22.464 0.248 -19.037 1.00 0.00 N ATOM 1244 CA ASN A 87 -22.292 -0.184 -20.419 1.00 0.00 C ATOM 1245 C ASN A 87 -21.145 0.568 -21.087 1.00 0.00 C ATOM 1246 O ASN A 87 -21.369 1.497 -21.863 1.00 0.00 O ATOM 1247 CB ASN A 87 -23.585 0.030 -21.207 1.00 0.00 C ATOM 1248 CG ASN A 87 -24.808 -0.465 -20.458 1.00 0.00 C ATOM 1249 OD1 ASN A 87 -24.820 -1.577 -19.932 1.00 0.00 O ATOM 1250 ND2 ASN A 87 -25.845 0.363 -20.407 1.00 0.00 N ATOM 0 H ASN A 87 -23.179 0.963 -18.905 1.00 0.00 H new ATOM 0 HA ASN A 87 -22.050 -1.247 -20.413 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -23.702 1.091 -21.427 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -23.514 -0.488 -22.164 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -26.696 0.086 -19.917 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -25.791 1.276 -20.858 1.00 0.00 H new ATOM 1257 N TYR A 88 -19.919 0.161 -20.779 1.00 0.00 N ATOM 1258 CA TYR A 88 -18.736 0.798 -21.349 1.00 0.00 C ATOM 1259 C TYR A 88 -18.894 0.991 -22.852 1.00 0.00 C ATOM 1260 O TYR A 88 -18.916 2.120 -23.344 1.00 0.00 O ATOM 1261 CB TYR A 88 -17.490 -0.042 -21.057 1.00 0.00 C ATOM 1262 CG TYR A 88 -16.277 0.379 -21.855 1.00 0.00 C ATOM 1263 CD1 TYR A 88 -15.670 1.609 -21.634 1.00 0.00 C ATOM 1264 CD2 TYR A 88 -15.739 -0.454 -22.828 1.00 0.00 C ATOM 1265 CE1 TYR A 88 -14.560 1.996 -22.362 1.00 0.00 C ATOM 1266 CE2 TYR A 88 -14.630 -0.074 -23.559 1.00 0.00 C ATOM 1267 CZ TYR A 88 -14.044 1.152 -23.322 1.00 0.00 C ATOM 1268 OH TYR A 88 -12.939 1.535 -24.048 1.00 0.00 O ATOM 0 H TYR A 88 -19.717 -0.607 -20.138 1.00 0.00 H new ATOM 0 HA TYR A 88 -18.621 1.778 -20.886 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -17.257 0.026 -19.994 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -17.709 -1.088 -21.269 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -16.071 2.273 -20.882 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -16.195 -1.415 -23.016 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -14.099 2.956 -22.179 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -14.224 -0.733 -24.312 1.00 0.00 H new ATOM 0 HH TYR A 88 -12.320 0.779 -24.125 1.00 0.00 H new ATOM 1278 N GLU A 89 -19.001 -0.117 -23.579 1.00 0.00 N ATOM 1279 CA GLU A 89 -19.155 -0.069 -25.028 1.00 0.00 C ATOM 1280 C GLU A 89 -20.183 0.983 -25.432 1.00 0.00 C ATOM 1281 O GLU A 89 -20.026 1.662 -26.446 1.00 0.00 O ATOM 1282 CB GLU A 89 -19.572 -1.439 -25.563 1.00 0.00 C ATOM 1283 CG GLU A 89 -18.527 -2.521 -25.347 1.00 0.00 C ATOM 1284 CD GLU A 89 -17.524 -2.597 -26.482 1.00 0.00 C ATOM 1285 OE1 GLU A 89 -17.426 -1.621 -27.254 1.00 0.00 O ATOM 1286 OE2 GLU A 89 -16.836 -3.634 -26.597 1.00 0.00 O ATOM 0 H GLU A 89 -18.984 -1.059 -23.188 1.00 0.00 H new ATOM 0 HA GLU A 89 -18.193 0.205 -25.461 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -20.501 -1.741 -25.079 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -19.781 -1.355 -26.630 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -17.999 -2.330 -24.413 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -19.024 -3.485 -25.241 1.00 0.00 H new ATOM 1293 N GLN A 90 -21.236 1.111 -24.631 1.00 0.00 N ATOM 1294 CA GLN A 90 -22.291 2.081 -24.904 1.00 0.00 C ATOM 1295 C GLN A 90 -21.824 3.497 -24.588 1.00 0.00 C ATOM 1296 O GLN A 90 -21.634 4.316 -25.487 1.00 0.00 O ATOM 1297 CB GLN A 90 -23.541 1.748 -24.090 1.00 0.00 C ATOM 1298 CG GLN A 90 -24.594 0.982 -24.876 1.00 0.00 C ATOM 1299 CD GLN A 90 -23.989 0.080 -25.933 1.00 0.00 C ATOM 1300 OE1 GLN A 90 -23.232 -0.839 -25.623 1.00 0.00 O ATOM 1301 NE2 GLN A 90 -24.321 0.339 -27.192 1.00 0.00 N ATOM 0 H GLN A 90 -21.382 0.556 -23.788 1.00 0.00 H new ATOM 0 HA GLN A 90 -22.533 2.028 -25.965 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -23.251 1.160 -23.219 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -23.980 2.674 -23.718 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -25.190 0.382 -24.189 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -25.273 1.689 -25.352 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -24.952 1.111 -27.404 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -23.945 -0.234 -27.947 1.00 0.00 H new ATOM 1310 N ASP A 91 -21.641 3.781 -23.301 1.00 0.00 N ATOM 1311 CA ASP A 91 -21.197 5.099 -22.864 1.00 0.00 C ATOM 1312 C ASP A 91 -19.850 5.453 -23.488 1.00 0.00 C ATOM 1313 O ASP A 91 -19.711 6.486 -24.142 1.00 0.00 O ATOM 1314 CB ASP A 91 -21.093 5.145 -21.338 1.00 0.00 C ATOM 1315 CG ASP A 91 -22.451 5.123 -20.666 1.00 0.00 C ATOM 1316 OD1 ASP A 91 -22.951 4.016 -20.376 1.00 0.00 O ATOM 1317 OD2 ASP A 91 -23.014 6.212 -20.429 1.00 0.00 O ATOM 0 H ASP A 91 -21.794 3.115 -22.544 1.00 0.00 H new ATOM 0 HA ASP A 91 -21.934 5.831 -23.193 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -20.505 4.295 -20.991 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -20.558 6.046 -21.040 1.00 0.00 H new ATOM 1322 N GLN A 92 -18.863 4.589 -23.281 1.00 0.00 N ATOM 1323 CA GLN A 92 -17.527 4.811 -23.823 1.00 0.00 C ATOM 1324 C GLN A 92 -16.705 5.703 -22.898 1.00 0.00 C ATOM 1325 O GLN A 92 -15.651 6.209 -23.284 1.00 0.00 O ATOM 1326 CB GLN A 92 -17.616 5.442 -25.213 1.00 0.00 C ATOM 1327 CG GLN A 92 -16.513 4.993 -26.158 1.00 0.00 C ATOM 1328 CD GLN A 92 -15.226 4.655 -25.433 1.00 0.00 C ATOM 1329 OE1 GLN A 92 -14.329 5.490 -25.314 1.00 0.00 O ATOM 1330 NE2 GLN A 92 -15.128 3.424 -24.945 1.00 0.00 N ATOM 0 H GLN A 92 -18.962 3.729 -22.742 1.00 0.00 H new ATOM 0 HA GLN A 92 -17.029 3.844 -23.902 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -18.582 5.196 -25.653 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -17.578 6.527 -25.113 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -16.851 4.120 -26.716 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -16.320 5.781 -26.885 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -15.896 2.764 -25.067 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -14.284 3.138 -24.448 1.00 0.00 H new ATOM 1339 N LYS A 93 -17.195 5.892 -21.678 1.00 0.00 N ATOM 1340 CA LYS A 93 -16.506 6.723 -20.697 1.00 0.00 C ATOM 1341 C LYS A 93 -15.530 5.892 -19.869 1.00 0.00 C ATOM 1342 O LYS A 93 -15.672 4.674 -19.763 1.00 0.00 O ATOM 1343 CB LYS A 93 -17.517 7.409 -19.777 1.00 0.00 C ATOM 1344 CG LYS A 93 -18.629 8.126 -20.524 1.00 0.00 C ATOM 1345 CD LYS A 93 -18.349 9.616 -20.646 1.00 0.00 C ATOM 1346 CE LYS A 93 -19.542 10.446 -20.204 1.00 0.00 C ATOM 1347 NZ LYS A 93 -19.427 10.874 -18.783 1.00 0.00 N ATOM 0 H LYS A 93 -18.067 5.481 -21.344 1.00 0.00 H new ATOM 0 HA LYS A 93 -15.942 7.484 -21.236 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -17.957 6.664 -19.115 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -16.993 8.127 -19.146 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -18.739 7.693 -21.518 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -19.575 7.974 -20.004 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -17.480 9.875 -20.040 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -18.100 9.857 -21.680 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -19.628 11.326 -20.842 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -20.456 9.866 -20.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -20.261 11.438 -18.522 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -19.371 10.035 -18.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -18.569 11.449 -18.662 1.00 0.00 H new ATOM 1361 N TYR A 94 -14.539 6.559 -19.287 1.00 0.00 N ATOM 1362 CA TYR A 94 -13.539 5.882 -18.469 1.00 0.00 C ATOM 1363 C TYR A 94 -12.752 6.883 -17.630 1.00 0.00 C ATOM 1364 O TYR A 94 -12.983 8.090 -17.707 1.00 0.00 O ATOM 1365 CB TYR A 94 -12.585 5.079 -19.355 1.00 0.00 C ATOM 1366 CG TYR A 94 -11.833 5.924 -20.358 1.00 0.00 C ATOM 1367 CD1 TYR A 94 -10.934 6.898 -19.939 1.00 0.00 C ATOM 1368 CD2 TYR A 94 -12.021 5.748 -21.722 1.00 0.00 C ATOM 1369 CE1 TYR A 94 -10.246 7.672 -20.853 1.00 0.00 C ATOM 1370 CE2 TYR A 94 -11.335 6.519 -22.642 1.00 0.00 C ATOM 1371 CZ TYR A 94 -10.449 7.479 -22.203 1.00 0.00 C ATOM 1372 OH TYR A 94 -9.765 8.249 -23.115 1.00 0.00 O ATOM 0 H TYR A 94 -14.407 7.567 -19.366 1.00 0.00 H new ATOM 0 HA TYR A 94 -14.058 5.201 -17.795 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -11.867 4.557 -18.722 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -13.153 4.317 -19.888 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -10.771 7.052 -18.883 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -12.714 4.997 -22.070 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -9.552 8.425 -20.511 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -11.493 6.370 -23.700 1.00 0.00 H new ATOM 0 HH TYR A 94 -10.022 7.986 -24.023 1.00 0.00 H new ATOM 1382 N SER A 95 -11.821 6.374 -16.830 1.00 0.00 N ATOM 1383 CA SER A 95 -10.998 7.223 -15.976 1.00 0.00 C ATOM 1384 C SER A 95 -9.737 6.489 -15.533 1.00 0.00 C ATOM 1385 O SER A 95 -9.792 5.324 -15.140 1.00 0.00 O ATOM 1386 CB SER A 95 -11.796 7.676 -14.752 1.00 0.00 C ATOM 1387 OG SER A 95 -12.545 8.846 -15.035 1.00 0.00 O ATOM 0 H SER A 95 -11.617 5.377 -16.755 1.00 0.00 H new ATOM 0 HA SER A 95 -10.702 8.099 -16.553 1.00 0.00 H new ATOM 0 HB2 SER A 95 -12.468 6.878 -14.436 1.00 0.00 H new ATOM 0 HB3 SER A 95 -11.116 7.868 -13.922 1.00 0.00 H new ATOM 0 HG SER A 95 -11.934 9.582 -15.249 1.00 0.00 H new ATOM 1393 N PHE A 96 -8.603 7.178 -15.599 1.00 0.00 N ATOM 1394 CA PHE A 96 -7.328 6.591 -15.204 1.00 0.00 C ATOM 1395 C PHE A 96 -7.142 6.656 -13.691 1.00 0.00 C ATOM 1396 O PHE A 96 -7.325 7.707 -13.078 1.00 0.00 O ATOM 1397 CB PHE A 96 -6.173 7.312 -15.901 1.00 0.00 C ATOM 1398 CG PHE A 96 -6.556 7.927 -17.217 1.00 0.00 C ATOM 1399 CD1 PHE A 96 -7.211 7.180 -18.182 1.00 0.00 C ATOM 1400 CD2 PHE A 96 -6.262 9.254 -17.487 1.00 0.00 C ATOM 1401 CE1 PHE A 96 -7.566 7.745 -19.393 1.00 0.00 C ATOM 1402 CE2 PHE A 96 -6.613 9.825 -18.696 1.00 0.00 C ATOM 1403 CZ PHE A 96 -7.266 9.068 -19.650 1.00 0.00 C ATOM 0 H PHE A 96 -8.541 8.143 -15.922 1.00 0.00 H new ATOM 0 HA PHE A 96 -7.331 5.544 -15.507 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -5.792 8.092 -15.242 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -5.359 6.605 -16.063 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -7.447 6.144 -17.986 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -5.752 9.849 -16.744 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -8.077 7.152 -20.137 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -6.377 10.860 -18.894 1.00 0.00 H new ATOM 0 HZ PHE A 96 -7.541 9.511 -20.596 1.00 0.00 H new ATOM 1413 N CYS A 97 -6.779 5.524 -13.096 1.00 0.00 N ATOM 1414 CA CYS A 97 -6.569 5.452 -11.655 1.00 0.00 C ATOM 1415 C CYS A 97 -5.142 5.848 -11.293 1.00 0.00 C ATOM 1416 O CYS A 97 -4.388 6.334 -12.137 1.00 0.00 O ATOM 1417 CB CYS A 97 -6.860 4.039 -11.146 1.00 0.00 C ATOM 1418 SG CYS A 97 -7.974 3.075 -12.218 1.00 0.00 S ATOM 0 H CYS A 97 -6.624 4.645 -13.589 1.00 0.00 H new ATOM 0 HA CYS A 97 -7.255 6.152 -11.178 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -5.918 3.501 -11.042 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -7.300 4.107 -10.151 1.00 0.00 H new ATOM 1423 N THR A 98 -4.775 5.632 -10.034 1.00 0.00 N ATOM 1424 CA THR A 98 -3.438 5.963 -9.562 1.00 0.00 C ATOM 1425 C THR A 98 -2.465 4.818 -9.821 1.00 0.00 C ATOM 1426 O THR A 98 -2.660 3.703 -9.336 1.00 0.00 O ATOM 1427 CB THR A 98 -3.436 6.289 -8.058 1.00 0.00 C ATOM 1428 OG1 THR A 98 -4.509 5.600 -7.404 1.00 0.00 O ATOM 1429 CG2 THR A 98 -3.574 7.786 -7.828 1.00 0.00 C ATOM 0 H THR A 98 -5.386 5.229 -9.323 1.00 0.00 H new ATOM 0 HA THR A 98 -3.117 6.844 -10.118 1.00 0.00 H new ATOM 0 HB THR A 98 -2.485 5.959 -7.640 1.00 0.00 H new ATOM 0 HG1 THR A 98 -4.499 5.812 -6.447 1.00 0.00 H new ATOM 0 HG21 THR A 98 -3.570 7.992 -6.758 1.00 0.00 H new ATOM 0 HG22 THR A 98 -2.740 8.305 -8.300 1.00 0.00 H new ATOM 0 HG23 THR A 98 -4.511 8.136 -8.261 1.00 0.00 H new ATOM 1437 N ASP A 99 -1.419 5.102 -10.588 1.00 0.00 N ATOM 1438 CA ASP A 99 -0.414 4.097 -10.913 1.00 0.00 C ATOM 1439 C ASP A 99 0.742 4.142 -9.919 1.00 0.00 C ATOM 1440 O ASP A 99 1.809 4.679 -10.217 1.00 0.00 O ATOM 1441 CB ASP A 99 0.111 4.311 -12.334 1.00 0.00 C ATOM 1442 CG ASP A 99 1.406 3.566 -12.590 1.00 0.00 C ATOM 1443 OD1 ASP A 99 1.578 2.463 -12.030 1.00 0.00 O ATOM 1444 OD2 ASP A 99 2.249 4.085 -13.352 1.00 0.00 O ATOM 0 H ASP A 99 -1.245 6.020 -10.997 1.00 0.00 H new ATOM 0 HA ASP A 99 -0.885 3.116 -10.851 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -0.642 3.982 -13.050 1.00 0.00 H new ATOM 0 HB3 ASP A 99 0.268 5.376 -12.504 1.00 0.00 H new ATOM 1449 N HIS A 100 0.522 3.573 -8.738 1.00 0.00 N ATOM 1450 CA HIS A 100 1.543 3.545 -7.700 1.00 0.00 C ATOM 1451 C HIS A 100 1.007 2.899 -6.427 1.00 0.00 C ATOM 1452 O HIS A 100 0.925 3.540 -5.379 1.00 0.00 O ATOM 1453 CB HIS A 100 2.036 4.962 -7.398 1.00 0.00 C ATOM 1454 CG HIS A 100 3.240 4.999 -6.509 1.00 0.00 C ATOM 1455 ND1 HIS A 100 3.554 6.080 -5.712 1.00 0.00 N ATOM 1456 CD2 HIS A 100 4.211 4.080 -6.292 1.00 0.00 C ATOM 1457 CE1 HIS A 100 4.665 5.825 -5.044 1.00 0.00 C ATOM 1458 NE2 HIS A 100 5.083 4.618 -5.378 1.00 0.00 N ATOM 0 H HIS A 100 -0.356 3.125 -8.477 1.00 0.00 H new ATOM 0 HA HIS A 100 2.379 2.948 -8.065 1.00 0.00 H new ATOM 0 HB2 HIS A 100 2.272 5.464 -8.336 1.00 0.00 H new ATOM 0 HB3 HIS A 100 1.230 5.526 -6.929 1.00 0.00 H new ATOM 0 HD2 HIS A 100 4.285 3.106 -6.752 1.00 0.00 H new ATOM 0 HE1 HIS A 100 5.149 6.490 -4.344 1.00 0.00 H new ATOM 0 HE2 HIS A 100 5.919 4.159 -5.016 1.00 0.00 H new ATOM 1467 N THR A 101 0.643 1.624 -6.525 1.00 0.00 N ATOM 1468 CA THR A 101 0.116 0.889 -5.387 1.00 0.00 C ATOM 1469 C THR A 101 1.223 0.089 -4.702 1.00 0.00 C ATOM 1470 O THR A 101 1.666 -0.939 -5.214 1.00 0.00 O ATOM 1471 CB THR A 101 -1.025 -0.055 -5.828 1.00 0.00 C ATOM 1472 OG1 THR A 101 -2.260 0.669 -5.892 1.00 0.00 O ATOM 1473 CG2 THR A 101 -1.177 -1.232 -4.876 1.00 0.00 C ATOM 0 H THR A 101 0.705 1.079 -7.385 1.00 0.00 H new ATOM 0 HA THR A 101 -0.284 1.611 -4.675 1.00 0.00 H new ATOM 0 HB THR A 101 -0.771 -0.445 -6.814 1.00 0.00 H new ATOM 0 HG1 THR A 101 -2.979 0.065 -6.174 1.00 0.00 H new ATOM 0 HG21 THR A 101 -1.989 -1.874 -5.218 1.00 0.00 H new ATOM 0 HG22 THR A 101 -0.249 -1.803 -4.852 1.00 0.00 H new ATOM 0 HG23 THR A 101 -1.403 -0.864 -3.875 1.00 0.00 H new ATOM 1481 N VAL A 102 1.664 0.569 -3.543 1.00 0.00 N ATOM 1482 CA VAL A 102 2.717 -0.100 -2.790 1.00 0.00 C ATOM 1483 C VAL A 102 2.174 -0.698 -1.497 1.00 0.00 C ATOM 1484 O VAL A 102 2.607 -0.334 -0.404 1.00 0.00 O ATOM 1485 CB VAL A 102 3.867 0.866 -2.452 1.00 0.00 C ATOM 1486 CG1 VAL A 102 3.328 2.133 -1.805 1.00 0.00 C ATOM 1487 CG2 VAL A 102 4.887 0.188 -1.549 1.00 0.00 C ATOM 0 H VAL A 102 1.308 1.419 -3.106 1.00 0.00 H new ATOM 0 HA VAL A 102 3.099 -0.900 -3.424 1.00 0.00 H new ATOM 0 HB VAL A 102 4.367 1.145 -3.379 1.00 0.00 H new ATOM 0 HG11 VAL A 102 4.155 2.804 -1.573 1.00 0.00 H new ATOM 0 HG12 VAL A 102 2.641 2.628 -2.491 1.00 0.00 H new ATOM 0 HG13 VAL A 102 2.801 1.876 -0.886 1.00 0.00 H new ATOM 0 HG21 VAL A 102 5.692 0.886 -1.321 1.00 0.00 H new ATOM 0 HG22 VAL A 102 4.403 -0.123 -0.623 1.00 0.00 H new ATOM 0 HG23 VAL A 102 5.297 -0.686 -2.055 1.00 0.00 H new ATOM 1497 N LEU A 103 1.223 -1.617 -1.630 1.00 0.00 N ATOM 1498 CA LEU A 103 0.621 -2.266 -0.471 1.00 0.00 C ATOM 1499 C LEU A 103 0.253 -3.712 -0.787 1.00 0.00 C ATOM 1500 O LEU A 103 -0.780 -3.981 -1.400 1.00 0.00 O ATOM 1501 CB LEU A 103 -0.623 -1.498 -0.020 1.00 0.00 C ATOM 1502 CG LEU A 103 -0.652 -0.022 -0.420 1.00 0.00 C ATOM 1503 CD1 LEU A 103 -1.261 0.143 -1.803 1.00 0.00 C ATOM 1504 CD2 LEU A 103 -1.423 0.793 0.607 1.00 0.00 C ATOM 0 H LEU A 103 0.853 -1.929 -2.528 1.00 0.00 H new ATOM 0 HA LEU A 103 1.353 -2.265 0.336 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -1.504 -1.988 -0.434 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -0.700 -1.566 1.065 1.00 0.00 H new ATOM 0 HG LEU A 103 0.373 0.348 -0.451 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -1.274 1.199 -2.071 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -0.666 -0.409 -2.531 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -2.280 -0.243 -1.800 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -1.434 1.841 0.307 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -2.446 0.423 0.671 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -0.942 0.700 1.581 1.00 0.00 H new ATOM 1516 N VAL A 104 1.105 -4.641 -0.365 1.00 0.00 N ATOM 1517 CA VAL A 104 0.870 -6.060 -0.603 1.00 0.00 C ATOM 1518 C VAL A 104 0.368 -6.747 0.665 1.00 0.00 C ATOM 1519 O VAL A 104 1.003 -6.671 1.713 1.00 0.00 O ATOM 1520 CB VAL A 104 2.156 -6.760 -1.102 1.00 0.00 C ATOM 1521 CG1 VAL A 104 2.113 -8.261 -0.838 1.00 0.00 C ATOM 1522 CG2 VAL A 104 2.367 -6.483 -2.583 1.00 0.00 C ATOM 0 H VAL A 104 1.965 -4.436 0.144 1.00 0.00 H new ATOM 0 HA VAL A 104 0.106 -6.142 -1.376 1.00 0.00 H new ATOM 0 HB VAL A 104 2.998 -6.351 -0.544 1.00 0.00 H new ATOM 0 HG11 VAL A 104 3.032 -8.721 -1.201 1.00 0.00 H new ATOM 0 HG12 VAL A 104 2.017 -8.439 0.233 1.00 0.00 H new ATOM 0 HG13 VAL A 104 1.259 -8.697 -1.357 1.00 0.00 H new ATOM 0 HG21 VAL A 104 3.276 -6.982 -2.921 1.00 0.00 H new ATOM 0 HG22 VAL A 104 1.515 -6.860 -3.149 1.00 0.00 H new ATOM 0 HG23 VAL A 104 2.462 -5.409 -2.742 1.00 0.00 H new ATOM 1532 N GLN A 105 -0.772 -7.421 0.558 1.00 0.00 N ATOM 1533 CA GLN A 105 -1.353 -8.122 1.697 1.00 0.00 C ATOM 1534 C GLN A 105 -0.839 -9.557 1.768 1.00 0.00 C ATOM 1535 O GLN A 105 -1.342 -10.442 1.076 1.00 0.00 O ATOM 1536 CB GLN A 105 -2.880 -8.119 1.602 1.00 0.00 C ATOM 1537 CG GLN A 105 -3.535 -6.989 2.379 1.00 0.00 C ATOM 1538 CD GLN A 105 -4.953 -7.321 2.805 1.00 0.00 C ATOM 1539 OE1 GLN A 105 -5.805 -7.637 1.976 1.00 0.00 O ATOM 1540 NE2 GLN A 105 -5.210 -7.250 4.106 1.00 0.00 N ATOM 0 H GLN A 105 -1.311 -7.497 -0.304 1.00 0.00 H new ATOM 0 HA GLN A 105 -1.053 -7.600 2.606 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -3.170 -8.044 0.554 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -3.261 -9.071 1.971 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -2.937 -6.766 3.262 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -3.545 -6.089 1.765 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -4.472 -6.983 4.758 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -6.145 -7.462 4.453 1.00 0.00 H new ATOM 1549 N THR A 106 0.170 -9.779 2.606 1.00 0.00 N ATOM 1550 CA THR A 106 0.753 -11.106 2.763 1.00 0.00 C ATOM 1551 C THR A 106 0.383 -11.719 4.108 1.00 0.00 C ATOM 1552 O THR A 106 -0.029 -11.017 5.031 1.00 0.00 O ATOM 1553 CB THR A 106 2.288 -11.062 2.640 1.00 0.00 C ATOM 1554 OG1 THR A 106 2.837 -10.212 3.655 1.00 0.00 O ATOM 1555 CG2 THR A 106 2.707 -10.558 1.269 1.00 0.00 C ATOM 0 H THR A 106 0.600 -9.058 3.185 1.00 0.00 H new ATOM 0 HA THR A 106 0.346 -11.724 1.963 1.00 0.00 H new ATOM 0 HB THR A 106 2.670 -12.075 2.769 1.00 0.00 H new ATOM 0 HG1 THR A 106 2.162 -9.560 3.936 1.00 0.00 H new ATOM 0 HG21 THR A 106 3.795 -10.536 1.206 1.00 0.00 H new ATOM 0 HG22 THR A 106 2.313 -11.223 0.501 1.00 0.00 H new ATOM 0 HG23 THR A 106 2.314 -9.553 1.115 1.00 0.00 H new ATOM 1563 N ARG A 107 0.536 -13.036 4.211 1.00 0.00 N ATOM 1564 CA ARG A 107 0.220 -13.749 5.443 1.00 0.00 C ATOM 1565 C ARG A 107 1.039 -15.031 5.554 1.00 0.00 C ATOM 1566 O ARG A 107 1.154 -15.791 4.593 1.00 0.00 O ATOM 1567 CB ARG A 107 -1.273 -14.076 5.500 1.00 0.00 C ATOM 1568 CG ARG A 107 -1.683 -14.829 6.754 1.00 0.00 C ATOM 1569 CD ARG A 107 -3.195 -14.915 6.884 1.00 0.00 C ATOM 1570 NE ARG A 107 -3.750 -16.023 6.114 1.00 0.00 N ATOM 1571 CZ ARG A 107 -3.510 -17.302 6.387 1.00 0.00 C ATOM 1572 NH1 ARG A 107 -2.730 -17.629 7.408 1.00 0.00 N ATOM 1573 NH2 ARG A 107 -4.051 -18.254 5.639 1.00 0.00 N ATOM 0 H ARG A 107 0.877 -13.631 3.456 1.00 0.00 H new ATOM 0 HA ARG A 107 0.474 -13.103 6.283 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -1.842 -13.148 5.441 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -1.540 -14.670 4.626 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -1.261 -15.834 6.730 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -1.269 -14.330 7.631 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -3.462 -15.034 7.934 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -3.641 -13.980 6.546 1.00 0.00 H new ATOM 0 HE ARG A 107 -4.355 -15.804 5.323 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -2.313 -16.899 7.985 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -2.547 -18.611 7.616 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -4.652 -18.005 4.853 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -3.866 -19.235 5.849 1.00 0.00 H new ATOM 1587 N GLY A 108 1.606 -15.266 6.733 1.00 0.00 N ATOM 1588 CA GLY A 108 2.405 -16.457 6.948 1.00 0.00 C ATOM 1589 C GLY A 108 3.870 -16.141 7.177 1.00 0.00 C ATOM 1590 O GLY A 108 4.356 -15.087 6.769 1.00 0.00 O ATOM 0 H GLY A 108 1.526 -14.652 7.544 1.00 0.00 H new ATOM 0 HA2 GLY A 108 2.015 -17.001 7.808 1.00 0.00 H new ATOM 0 HA3 GLY A 108 2.309 -17.115 6.084 1.00 0.00 H new ATOM 1594 N GLY A 109 4.575 -17.058 7.832 1.00 0.00 N ATOM 1595 CA GLY A 109 5.985 -16.854 8.105 1.00 0.00 C ATOM 1596 C GLY A 109 6.226 -16.138 9.419 1.00 0.00 C ATOM 1597 O GLY A 109 6.250 -16.763 10.479 1.00 0.00 O ATOM 0 H GLY A 109 4.195 -17.939 8.178 1.00 0.00 H new ATOM 0 HA2 GLY A 109 6.491 -17.819 8.123 1.00 0.00 H new ATOM 0 HA3 GLY A 109 6.429 -16.276 7.294 1.00 0.00 H new ATOM 1601 N ASN A 110 6.405 -14.823 9.349 1.00 0.00 N ATOM 1602 CA ASN A 110 6.645 -14.019 10.542 1.00 0.00 C ATOM 1603 C ASN A 110 6.000 -12.644 10.408 1.00 0.00 C ATOM 1604 O ASN A 110 6.304 -11.728 11.173 1.00 0.00 O ATOM 1605 CB ASN A 110 8.147 -13.870 10.789 1.00 0.00 C ATOM 1606 CG ASN A 110 8.869 -15.203 10.784 1.00 0.00 C ATOM 1607 OD1 ASN A 110 8.371 -16.195 11.314 1.00 0.00 O ATOM 1608 ND2 ASN A 110 10.053 -15.232 10.181 1.00 0.00 N ATOM 0 H ASN A 110 6.388 -14.291 8.479 1.00 0.00 H new ATOM 0 HA ASN A 110 6.194 -14.531 11.392 1.00 0.00 H new ATOM 0 HB2 ASN A 110 8.576 -13.225 10.023 1.00 0.00 H new ATOM 0 HB3 ASN A 110 8.308 -13.377 11.748 1.00 0.00 H new ATOM 0 HD21 ASN A 110 10.586 -16.101 10.145 1.00 0.00 H new ATOM 0 HD22 ASN A 110 10.429 -14.385 9.754 1.00 0.00 H new ATOM 1615 N SER A 111 5.110 -12.507 9.431 1.00 0.00 N ATOM 1616 CA SER A 111 4.421 -11.245 9.194 1.00 0.00 C ATOM 1617 C SER A 111 2.989 -11.302 9.714 1.00 0.00 C ATOM 1618 O SER A 111 2.348 -10.270 9.914 1.00 0.00 O ATOM 1619 CB SER A 111 4.419 -10.916 7.701 1.00 0.00 C ATOM 1620 OG SER A 111 5.278 -9.825 7.418 1.00 0.00 O ATOM 0 H SER A 111 4.849 -13.256 8.790 1.00 0.00 H new ATOM 0 HA SER A 111 4.954 -10.461 9.733 1.00 0.00 H new ATOM 0 HB2 SER A 111 4.737 -11.790 7.132 1.00 0.00 H new ATOM 0 HB3 SER A 111 3.405 -10.678 7.379 1.00 0.00 H new ATOM 0 HG SER A 111 6.160 -10.162 7.155 1.00 0.00 H new ATOM 1626 N ASN A 112 2.491 -12.516 9.931 1.00 0.00 N ATOM 1627 CA ASN A 112 1.134 -12.709 10.426 1.00 0.00 C ATOM 1628 C ASN A 112 0.189 -11.669 9.837 1.00 0.00 C ATOM 1629 O ASN A 112 -0.316 -10.800 10.547 1.00 0.00 O ATOM 1630 CB ASN A 112 1.108 -12.632 11.954 1.00 0.00 C ATOM 1631 CG ASN A 112 1.999 -13.675 12.601 1.00 0.00 C ATOM 1632 OD1 ASN A 112 2.484 -14.592 11.937 1.00 0.00 O ATOM 1633 ND2 ASN A 112 2.220 -13.540 13.903 1.00 0.00 N ATOM 0 H ASN A 112 3.008 -13.381 9.771 1.00 0.00 H new ATOM 0 HA ASN A 112 0.798 -13.698 10.115 1.00 0.00 H new ATOM 0 HB2 ASN A 112 1.427 -11.639 12.270 1.00 0.00 H new ATOM 0 HB3 ASN A 112 0.084 -12.765 12.304 1.00 0.00 H new ATOM 0 HD21 ASN A 112 2.812 -14.211 14.392 1.00 0.00 H new ATOM 0 HD22 ASN A 112 1.798 -12.765 14.414 1.00 0.00 H new ATOM 1640 N GLY A 113 -0.044 -11.763 8.533 1.00 0.00 N ATOM 1641 CA GLY A 113 -0.924 -10.822 7.866 1.00 0.00 C ATOM 1642 C GLY A 113 -0.355 -9.419 7.849 1.00 0.00 C ATOM 1643 O GLY A 113 -0.926 -8.502 8.441 1.00 0.00 O ATOM 0 H GLY A 113 0.361 -12.475 7.925 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -1.099 -11.154 6.842 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -1.892 -10.814 8.368 1.00 0.00 H new ATOM 1647 N ALA A 114 0.776 -9.248 7.171 1.00 0.00 N ATOM 1648 CA ALA A 114 1.423 -7.946 7.084 1.00 0.00 C ATOM 1649 C ALA A 114 1.350 -7.385 5.670 1.00 0.00 C ATOM 1650 O ALA A 114 1.368 -8.131 4.691 1.00 0.00 O ATOM 1651 CB ALA A 114 2.870 -8.047 7.541 1.00 0.00 C ATOM 0 H ALA A 114 1.262 -9.995 6.675 1.00 0.00 H new ATOM 0 HA ALA A 114 0.891 -7.260 7.743 1.00 0.00 H new ATOM 0 HB1 ALA A 114 3.343 -7.067 7.471 1.00 0.00 H new ATOM 0 HB2 ALA A 114 2.902 -8.393 8.574 1.00 0.00 H new ATOM 0 HB3 ALA A 114 3.404 -8.754 6.905 1.00 0.00 H new ATOM 1657 N LEU A 115 1.266 -6.063 5.572 1.00 0.00 N ATOM 1658 CA LEU A 115 1.189 -5.395 4.279 1.00 0.00 C ATOM 1659 C LEU A 115 2.571 -5.269 3.651 1.00 0.00 C ATOM 1660 O LEU A 115 3.215 -4.225 3.754 1.00 0.00 O ATOM 1661 CB LEU A 115 0.557 -4.011 4.433 1.00 0.00 C ATOM 1662 CG LEU A 115 0.335 -3.253 3.122 1.00 0.00 C ATOM 1663 CD1 LEU A 115 -0.685 -3.977 2.255 1.00 0.00 C ATOM 1664 CD2 LEU A 115 -0.113 -1.827 3.400 1.00 0.00 C ATOM 0 H LEU A 115 1.250 -5.432 6.374 1.00 0.00 H new ATOM 0 HA LEU A 115 0.564 -6.000 3.622 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -0.402 -4.120 4.939 1.00 0.00 H new ATOM 0 HB3 LEU A 115 1.193 -3.408 5.081 1.00 0.00 H new ATOM 0 HG LEU A 115 1.280 -3.215 2.580 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -0.831 -3.425 1.327 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -0.323 -4.980 2.027 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -1.633 -4.046 2.789 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -0.266 -1.303 2.456 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -1.047 -1.842 3.962 1.00 0.00 H new ATOM 0 HD23 LEU A 115 0.652 -1.312 3.981 1.00 0.00 H new ATOM 1676 N CYS A 116 3.023 -6.340 3.003 1.00 0.00 N ATOM 1677 CA CYS A 116 4.331 -6.351 2.357 1.00 0.00 C ATOM 1678 C CYS A 116 4.677 -4.975 1.801 1.00 0.00 C ATOM 1679 O CYS A 116 3.791 -4.178 1.490 1.00 0.00 O ATOM 1680 CB CYS A 116 4.370 -7.389 1.234 1.00 0.00 C ATOM 1681 SG CYS A 116 5.662 -8.661 1.439 1.00 0.00 S ATOM 0 H CYS A 116 2.501 -7.212 2.912 1.00 0.00 H new ATOM 0 HA CYS A 116 5.071 -6.618 3.111 1.00 0.00 H new ATOM 0 HB2 CYS A 116 3.399 -7.880 1.174 1.00 0.00 H new ATOM 0 HB3 CYS A 116 4.528 -6.876 0.285 1.00 0.00 H new ATOM 1686 N HIS A 117 5.971 -4.706 1.682 1.00 0.00 N ATOM 1687 CA HIS A 117 6.444 -3.426 1.170 1.00 0.00 C ATOM 1688 C HIS A 117 7.268 -3.620 -0.099 1.00 0.00 C ATOM 1689 O HIS A 117 8.335 -4.234 -0.072 1.00 0.00 O ATOM 1690 CB HIS A 117 7.274 -2.706 2.241 1.00 0.00 C ATOM 1691 CG HIS A 117 8.284 -1.745 1.693 1.00 0.00 C ATOM 1692 ND1 HIS A 117 7.951 -0.503 1.194 1.00 0.00 N ATOM 1693 CD2 HIS A 117 9.629 -1.848 1.572 1.00 0.00 C ATOM 1694 CE1 HIS A 117 9.048 0.115 0.790 1.00 0.00 C ATOM 1695 NE2 HIS A 117 10.077 -0.679 1.010 1.00 0.00 N ATOM 0 H HIS A 117 6.713 -5.359 1.934 1.00 0.00 H new ATOM 0 HA HIS A 117 5.578 -2.812 0.921 1.00 0.00 H new ATOM 0 HB2 HIS A 117 6.599 -2.166 2.906 1.00 0.00 H new ATOM 0 HB3 HIS A 117 7.790 -3.451 2.847 1.00 0.00 H new ATOM 0 HD1 HIS A 117 7.007 -0.121 1.144 1.00 0.00 H new ATOM 0 HD2 HIS A 117 10.236 -2.693 1.863 1.00 0.00 H new ATOM 0 HE1 HIS A 117 9.093 1.102 0.354 1.00 0.00 H new ATOM 1704 N PHE A 118 6.765 -3.092 -1.209 1.00 0.00 N ATOM 1705 CA PHE A 118 7.451 -3.203 -2.490 1.00 0.00 C ATOM 1706 C PHE A 118 7.868 -1.829 -3.003 1.00 0.00 C ATOM 1707 O PHE A 118 7.120 -0.859 -2.887 1.00 0.00 O ATOM 1708 CB PHE A 118 6.547 -3.887 -3.518 1.00 0.00 C ATOM 1709 CG PHE A 118 6.419 -5.372 -3.322 1.00 0.00 C ATOM 1710 CD1 PHE A 118 7.350 -6.239 -3.873 1.00 0.00 C ATOM 1711 CD2 PHE A 118 5.364 -5.900 -2.595 1.00 0.00 C ATOM 1712 CE1 PHE A 118 7.231 -7.604 -3.700 1.00 0.00 C ATOM 1713 CE2 PHE A 118 5.239 -7.266 -2.422 1.00 0.00 C ATOM 1714 CZ PHE A 118 6.175 -8.118 -2.975 1.00 0.00 C ATOM 0 H PHE A 118 5.883 -2.582 -1.247 1.00 0.00 H new ATOM 0 HA PHE A 118 8.347 -3.806 -2.343 1.00 0.00 H new ATOM 0 HB2 PHE A 118 5.555 -3.437 -3.472 1.00 0.00 H new ATOM 0 HB3 PHE A 118 6.938 -3.694 -4.517 1.00 0.00 H new ATOM 0 HD1 PHE A 118 8.177 -5.843 -4.444 1.00 0.00 H new ATOM 0 HD2 PHE A 118 4.631 -5.237 -2.159 1.00 0.00 H new ATOM 0 HE1 PHE A 118 7.964 -8.269 -4.132 1.00 0.00 H new ATOM 0 HE2 PHE A 118 4.411 -7.666 -1.856 1.00 0.00 H new ATOM 0 HZ PHE A 118 6.081 -9.185 -2.840 1.00 0.00 H new ATOM 1724 N PRO A 119 9.075 -1.731 -3.579 1.00 0.00 N ATOM 1725 CA PRO A 119 9.980 -2.866 -3.729 1.00 0.00 C ATOM 1726 C PRO A 119 10.862 -3.074 -2.501 1.00 0.00 C ATOM 1727 O PRO A 119 11.436 -2.123 -1.970 1.00 0.00 O ATOM 1728 CB PRO A 119 10.824 -2.452 -4.928 1.00 0.00 C ATOM 1729 CG PRO A 119 10.919 -0.965 -4.821 1.00 0.00 C ATOM 1730 CD PRO A 119 9.655 -0.496 -4.136 1.00 0.00 C ATOM 0 HA PRO A 119 9.451 -3.811 -3.854 1.00 0.00 H new ATOM 0 HB2 PRO A 119 11.810 -2.916 -4.899 1.00 0.00 H new ATOM 0 HB3 PRO A 119 10.357 -2.754 -5.866 1.00 0.00 H new ATOM 0 HG2 PRO A 119 11.800 -0.674 -4.249 1.00 0.00 H new ATOM 0 HG3 PRO A 119 11.015 -0.512 -5.807 1.00 0.00 H new ATOM 0 HD2 PRO A 119 9.871 0.232 -3.354 1.00 0.00 H new ATOM 0 HD3 PRO A 119 8.974 -0.016 -4.839 1.00 0.00 H new ATOM 1738 N PHE A 120 10.968 -4.322 -2.057 1.00 0.00 N ATOM 1739 CA PHE A 120 11.783 -4.651 -0.893 1.00 0.00 C ATOM 1740 C PHE A 120 13.160 -5.147 -1.324 1.00 0.00 C ATOM 1741 O PHE A 120 13.445 -5.256 -2.517 1.00 0.00 O ATOM 1742 CB PHE A 120 11.089 -5.714 -0.040 1.00 0.00 C ATOM 1743 CG PHE A 120 11.056 -7.072 -0.681 1.00 0.00 C ATOM 1744 CD1 PHE A 120 10.160 -7.349 -1.701 1.00 0.00 C ATOM 1745 CD2 PHE A 120 11.920 -8.071 -0.262 1.00 0.00 C ATOM 1746 CE1 PHE A 120 10.127 -8.597 -2.292 1.00 0.00 C ATOM 1747 CE2 PHE A 120 11.892 -9.322 -0.851 1.00 0.00 C ATOM 1748 CZ PHE A 120 10.994 -9.585 -1.867 1.00 0.00 C ATOM 0 H PHE A 120 10.501 -5.121 -2.485 1.00 0.00 H new ATOM 0 HA PHE A 120 11.908 -3.746 -0.298 1.00 0.00 H new ATOM 0 HB2 PHE A 120 11.599 -5.787 0.920 1.00 0.00 H new ATOM 0 HB3 PHE A 120 10.068 -5.393 0.165 1.00 0.00 H new ATOM 0 HD1 PHE A 120 9.480 -6.581 -2.038 1.00 0.00 H new ATOM 0 HD2 PHE A 120 12.623 -7.871 0.533 1.00 0.00 H new ATOM 0 HE1 PHE A 120 9.424 -8.800 -3.086 1.00 0.00 H new ATOM 0 HE2 PHE A 120 12.571 -10.092 -0.517 1.00 0.00 H new ATOM 0 HZ PHE A 120 10.970 -10.561 -2.328 1.00 0.00 H new ATOM 1758 N LEU A 121 14.012 -5.445 -0.349 1.00 0.00 N ATOM 1759 CA LEU A 121 15.358 -5.928 -0.637 1.00 0.00 C ATOM 1760 C LEU A 121 15.657 -7.215 0.126 1.00 0.00 C ATOM 1761 O LEU A 121 15.340 -7.337 1.307 1.00 0.00 O ATOM 1762 CB LEU A 121 16.399 -4.862 -0.285 1.00 0.00 C ATOM 1763 CG LEU A 121 17.839 -5.372 -0.225 1.00 0.00 C ATOM 1764 CD1 LEU A 121 18.079 -6.152 1.059 1.00 0.00 C ATOM 1765 CD2 LEU A 121 18.132 -6.233 -1.438 1.00 0.00 C ATOM 0 H LEU A 121 13.796 -5.361 0.644 1.00 0.00 H new ATOM 0 HA LEU A 121 15.412 -6.140 -1.705 1.00 0.00 H new ATOM 0 HB2 LEU A 121 16.342 -4.061 -1.022 1.00 0.00 H new ATOM 0 HB3 LEU A 121 16.141 -4.427 0.680 1.00 0.00 H new ATOM 0 HG LEU A 121 18.515 -4.517 -0.230 1.00 0.00 H new ATOM 0 HD11 LEU A 121 19.110 -6.506 1.082 1.00 0.00 H new ATOM 0 HD12 LEU A 121 17.898 -5.505 1.917 1.00 0.00 H new ATOM 0 HD13 LEU A 121 17.401 -7.005 1.099 1.00 0.00 H new ATOM 0 HD21 LEU A 121 19.160 -6.593 -1.389 1.00 0.00 H new ATOM 0 HD22 LEU A 121 17.450 -7.083 -1.454 1.00 0.00 H new ATOM 0 HD23 LEU A 121 17.997 -5.643 -2.344 1.00 0.00 H new ATOM 1777 N TYR A 122 16.277 -8.169 -0.559 1.00 0.00 N ATOM 1778 CA TYR A 122 16.632 -9.446 0.053 1.00 0.00 C ATOM 1779 C TYR A 122 18.118 -9.733 -0.134 1.00 0.00 C ATOM 1780 O TYR A 122 18.640 -9.638 -1.245 1.00 0.00 O ATOM 1781 CB TYR A 122 15.799 -10.577 -0.554 1.00 0.00 C ATOM 1782 CG TYR A 122 16.346 -11.957 -0.264 1.00 0.00 C ATOM 1783 CD1 TYR A 122 17.466 -12.435 -0.933 1.00 0.00 C ATOM 1784 CD2 TYR A 122 15.744 -12.780 0.678 1.00 0.00 C ATOM 1785 CE1 TYR A 122 17.968 -13.696 -0.672 1.00 0.00 C ATOM 1786 CE2 TYR A 122 16.239 -14.041 0.946 1.00 0.00 C ATOM 1787 CZ TYR A 122 17.351 -14.495 0.268 1.00 0.00 C ATOM 1788 OH TYR A 122 17.849 -15.750 0.532 1.00 0.00 O ATOM 0 H TYR A 122 16.545 -8.083 -1.539 1.00 0.00 H new ATOM 0 HA TYR A 122 16.419 -9.386 1.120 1.00 0.00 H new ATOM 0 HB2 TYR A 122 14.780 -10.512 -0.172 1.00 0.00 H new ATOM 0 HB3 TYR A 122 15.744 -10.437 -1.634 1.00 0.00 H new ATOM 0 HD1 TYR A 122 17.952 -11.811 -1.669 1.00 0.00 H new ATOM 0 HD2 TYR A 122 14.873 -12.428 1.211 1.00 0.00 H new ATOM 0 HE1 TYR A 122 18.839 -14.054 -1.201 1.00 0.00 H new ATOM 0 HE2 TYR A 122 15.758 -14.668 1.682 1.00 0.00 H new ATOM 0 HH TYR A 122 17.300 -16.182 1.220 1.00 0.00 H new ATOM 1798 N ASN A 123 18.799 -10.075 0.955 1.00 0.00 N ATOM 1799 CA ASN A 123 20.227 -10.363 0.896 1.00 0.00 C ATOM 1800 C ASN A 123 20.932 -9.342 0.011 1.00 0.00 C ATOM 1801 O ASN A 123 21.621 -9.701 -0.945 1.00 0.00 O ATOM 1802 CB ASN A 123 20.465 -11.776 0.360 1.00 0.00 C ATOM 1803 CG ASN A 123 21.741 -12.391 0.899 1.00 0.00 C ATOM 1804 OD1 ASN A 123 22.832 -11.850 0.715 1.00 0.00 O ATOM 1805 ND2 ASN A 123 21.612 -13.530 1.570 1.00 0.00 N ATOM 0 H ASN A 123 18.387 -10.159 1.884 1.00 0.00 H new ATOM 0 HA ASN A 123 20.636 -10.299 1.904 1.00 0.00 H new ATOM 0 HB2 ASN A 123 19.619 -12.410 0.626 1.00 0.00 H new ATOM 0 HB3 ASN A 123 20.511 -11.746 -0.729 1.00 0.00 H new ATOM 0 HD21 ASN A 123 22.436 -13.991 1.956 1.00 0.00 H new ATOM 0 HD22 ASN A 123 20.689 -13.944 1.699 1.00 0.00 H new ATOM 1812 N ASN A 124 20.737 -8.064 0.331 1.00 0.00 N ATOM 1813 CA ASN A 124 21.331 -6.969 -0.432 1.00 0.00 C ATOM 1814 C ASN A 124 21.055 -7.125 -1.925 1.00 0.00 C ATOM 1815 O ASN A 124 21.726 -6.514 -2.757 1.00 0.00 O ATOM 1816 CB ASN A 124 22.841 -6.876 -0.177 1.00 0.00 C ATOM 1817 CG ASN A 124 23.495 -8.232 0.003 1.00 0.00 C ATOM 1818 OD1 ASN A 124 23.878 -8.883 -0.970 1.00 0.00 O ATOM 1819 ND2 ASN A 124 23.625 -8.665 1.250 1.00 0.00 N ATOM 0 H ASN A 124 20.167 -7.760 1.121 1.00 0.00 H new ATOM 0 HA ASN A 124 20.867 -6.043 -0.093 1.00 0.00 H new ATOM 0 HB2 ASN A 124 23.314 -6.358 -1.012 1.00 0.00 H new ATOM 0 HB3 ASN A 124 23.017 -6.272 0.713 1.00 0.00 H new ATOM 0 HD21 ASN A 124 24.057 -9.571 1.433 1.00 0.00 H new ATOM 0 HD22 ASN A 124 23.293 -8.092 2.026 1.00 0.00 H new ATOM 1826 N HIS A 125 20.050 -7.930 -2.254 1.00 0.00 N ATOM 1827 CA HIS A 125 19.663 -8.153 -3.639 1.00 0.00 C ATOM 1828 C HIS A 125 18.266 -7.592 -3.887 1.00 0.00 C ATOM 1829 O HIS A 125 17.265 -8.281 -3.685 1.00 0.00 O ATOM 1830 CB HIS A 125 19.698 -9.646 -3.972 1.00 0.00 C ATOM 1831 CG HIS A 125 20.416 -9.959 -5.247 1.00 0.00 C ATOM 1832 ND1 HIS A 125 20.381 -11.201 -5.846 1.00 0.00 N ATOM 1833 CD2 HIS A 125 21.192 -9.183 -6.041 1.00 0.00 C ATOM 1834 CE1 HIS A 125 21.106 -11.175 -6.951 1.00 0.00 C ATOM 1835 NE2 HIS A 125 21.607 -9.962 -7.091 1.00 0.00 N ATOM 0 H HIS A 125 19.487 -8.441 -1.574 1.00 0.00 H new ATOM 0 HA HIS A 125 20.373 -7.638 -4.286 1.00 0.00 H new ATOM 0 HB2 HIS A 125 20.179 -10.181 -3.153 1.00 0.00 H new ATOM 0 HB3 HIS A 125 18.676 -10.019 -4.039 1.00 0.00 H new ATOM 0 HD2 HIS A 125 21.438 -8.144 -5.878 1.00 0.00 H new ATOM 0 HE1 HIS A 125 21.262 -12.005 -7.624 1.00 0.00 H new ATOM 0 HE2 HIS A 125 22.206 -9.654 -7.857 1.00 0.00 H new ATOM 1844 N ASN A 126 18.207 -6.332 -4.309 1.00 0.00 N ATOM 1845 CA ASN A 126 16.934 -5.664 -4.572 1.00 0.00 C ATOM 1846 C ASN A 126 15.893 -6.647 -5.102 1.00 0.00 C ATOM 1847 O ASN A 126 16.209 -7.538 -5.890 1.00 0.00 O ATOM 1848 CB ASN A 126 17.131 -4.526 -5.574 1.00 0.00 C ATOM 1849 CG ASN A 126 17.095 -3.162 -4.914 1.00 0.00 C ATOM 1850 OD1 ASN A 126 16.112 -2.430 -5.033 1.00 0.00 O ATOM 1851 ND2 ASN A 126 18.171 -2.817 -4.214 1.00 0.00 N ATOM 0 H ASN A 126 19.028 -5.751 -4.477 1.00 0.00 H new ATOM 0 HA ASN A 126 16.570 -5.255 -3.630 1.00 0.00 H new ATOM 0 HB2 ASN A 126 18.086 -4.655 -6.083 1.00 0.00 H new ATOM 0 HB3 ASN A 126 16.354 -4.578 -6.336 1.00 0.00 H new ATOM 0 HD22 ASN A 126 18.961 -3.458 -4.144 1.00 0.00 H new ATOM 1857 N TYR A 127 14.650 -6.474 -4.662 1.00 0.00 N ATOM 1858 CA TYR A 127 13.557 -7.340 -5.090 1.00 0.00 C ATOM 1859 C TYR A 127 12.237 -6.576 -5.101 1.00 0.00 C ATOM 1860 O TYR A 127 11.887 -5.909 -4.128 1.00 0.00 O ATOM 1861 CB TYR A 127 13.447 -8.554 -4.165 1.00 0.00 C ATOM 1862 CG TYR A 127 14.127 -9.793 -4.704 1.00 0.00 C ATOM 1863 CD1 TYR A 127 13.576 -10.507 -5.759 1.00 0.00 C ATOM 1864 CD2 TYR A 127 15.320 -10.245 -4.156 1.00 0.00 C ATOM 1865 CE1 TYR A 127 14.196 -11.640 -6.254 1.00 0.00 C ATOM 1866 CE2 TYR A 127 15.947 -11.376 -4.645 1.00 0.00 C ATOM 1867 CZ TYR A 127 15.380 -12.069 -5.694 1.00 0.00 C ATOM 1868 OH TYR A 127 15.999 -13.196 -6.184 1.00 0.00 O ATOM 0 H TYR A 127 14.375 -5.741 -4.008 1.00 0.00 H new ATOM 0 HA TYR A 127 13.771 -7.682 -6.102 1.00 0.00 H new ATOM 0 HB2 TYR A 127 13.882 -8.303 -3.198 1.00 0.00 H new ATOM 0 HB3 TYR A 127 12.393 -8.774 -3.993 1.00 0.00 H new ATOM 0 HD1 TYR A 127 12.649 -10.173 -6.200 1.00 0.00 H new ATOM 0 HD2 TYR A 127 15.766 -9.704 -3.334 1.00 0.00 H new ATOM 0 HE1 TYR A 127 13.755 -12.186 -7.075 1.00 0.00 H new ATOM 0 HE2 TYR A 127 16.875 -11.715 -4.208 1.00 0.00 H new ATOM 0 HH TYR A 127 15.886 -13.934 -5.549 1.00 0.00 H new ATOM 1878 N THR A 128 11.508 -6.675 -6.208 1.00 0.00 N ATOM 1879 CA THR A 128 10.229 -5.988 -6.340 1.00 0.00 C ATOM 1880 C THR A 128 9.136 -6.937 -6.815 1.00 0.00 C ATOM 1881 O THR A 128 8.496 -6.701 -7.840 1.00 0.00 O ATOM 1882 CB THR A 128 10.325 -4.802 -7.317 1.00 0.00 C ATOM 1883 OG1 THR A 128 10.136 -5.258 -8.662 1.00 0.00 O ATOM 1884 CG2 THR A 128 11.675 -4.110 -7.198 1.00 0.00 C ATOM 0 H THR A 128 11.780 -7.223 -7.024 1.00 0.00 H new ATOM 0 HA THR A 128 9.972 -5.613 -5.349 1.00 0.00 H new ATOM 0 HB THR A 128 9.543 -4.087 -7.062 1.00 0.00 H new ATOM 0 HG1 THR A 128 9.206 -5.543 -8.783 1.00 0.00 H new ATOM 0 HG21 THR A 128 11.719 -3.276 -7.898 1.00 0.00 H new ATOM 0 HG22 THR A 128 11.805 -3.738 -6.182 1.00 0.00 H new ATOM 0 HG23 THR A 128 12.469 -4.820 -7.429 1.00 0.00 H new ATOM 1892 N ASP A 129 8.921 -8.006 -6.058 1.00 0.00 N ATOM 1893 CA ASP A 129 7.898 -8.988 -6.393 1.00 0.00 C ATOM 1894 C ASP A 129 8.001 -10.212 -5.494 1.00 0.00 C ATOM 1895 O ASP A 129 9.092 -10.598 -5.073 1.00 0.00 O ATOM 1896 CB ASP A 129 8.015 -9.403 -7.860 1.00 0.00 C ATOM 1897 CG ASP A 129 6.682 -9.359 -8.582 1.00 0.00 C ATOM 1898 OD1 ASP A 129 5.708 -9.946 -8.065 1.00 0.00 O ATOM 1899 OD2 ASP A 129 6.613 -8.738 -9.663 1.00 0.00 O ATOM 0 H ASP A 129 9.443 -8.215 -5.207 1.00 0.00 H new ATOM 0 HA ASP A 129 6.924 -8.526 -6.233 1.00 0.00 H new ATOM 0 HB2 ASP A 129 8.721 -8.744 -8.366 1.00 0.00 H new ATOM 0 HB3 ASP A 129 8.423 -10.412 -7.918 1.00 0.00 H new ATOM 1904 N CYS A 130 6.854 -10.812 -5.201 1.00 0.00 N ATOM 1905 CA CYS A 130 6.803 -11.991 -4.347 1.00 0.00 C ATOM 1906 C CYS A 130 7.937 -12.955 -4.675 1.00 0.00 C ATOM 1907 O CYS A 130 7.788 -13.843 -5.515 1.00 0.00 O ATOM 1908 CB CYS A 130 5.456 -12.699 -4.503 1.00 0.00 C ATOM 1909 SG CYS A 130 4.991 -13.733 -3.077 1.00 0.00 S ATOM 0 H CYS A 130 5.945 -10.500 -5.543 1.00 0.00 H new ATOM 0 HA CYS A 130 6.919 -11.664 -3.314 1.00 0.00 H new ATOM 0 HB2 CYS A 130 4.680 -11.950 -4.664 1.00 0.00 H new ATOM 0 HB3 CYS A 130 5.487 -13.323 -5.396 1.00 0.00 H new ATOM 1914 N THR A 131 9.070 -12.772 -4.008 1.00 0.00 N ATOM 1915 CA THR A 131 10.231 -13.625 -4.228 1.00 0.00 C ATOM 1916 C THR A 131 10.182 -14.861 -3.337 1.00 0.00 C ATOM 1917 O THR A 131 9.627 -14.825 -2.239 1.00 0.00 O ATOM 1918 CB THR A 131 11.546 -12.866 -3.965 1.00 0.00 C ATOM 1919 OG1 THR A 131 12.640 -13.549 -4.591 1.00 0.00 O ATOM 1920 CG2 THR A 131 11.811 -12.741 -2.471 1.00 0.00 C ATOM 0 H THR A 131 9.209 -12.041 -3.311 1.00 0.00 H new ATOM 0 HA THR A 131 10.203 -13.933 -5.273 1.00 0.00 H new ATOM 0 HB THR A 131 11.451 -11.865 -4.387 1.00 0.00 H new ATOM 0 HG1 THR A 131 13.374 -12.918 -4.745 1.00 0.00 H new ATOM 0 HG21 THR A 131 12.745 -12.202 -2.311 1.00 0.00 H new ATOM 0 HG22 THR A 131 10.992 -12.197 -2.001 1.00 0.00 H new ATOM 0 HG23 THR A 131 11.886 -13.735 -2.030 1.00 0.00 H new ATOM 1928 N SER A 132 10.765 -15.955 -3.817 1.00 0.00 N ATOM 1929 CA SER A 132 10.788 -17.203 -3.063 1.00 0.00 C ATOM 1930 C SER A 132 12.220 -17.649 -2.791 1.00 0.00 C ATOM 1931 O SER A 132 12.662 -18.686 -3.286 1.00 0.00 O ATOM 1932 CB SER A 132 10.036 -18.296 -3.825 1.00 0.00 C ATOM 1933 OG SER A 132 10.470 -18.371 -5.172 1.00 0.00 O ATOM 0 H SER A 132 11.228 -16.002 -4.725 1.00 0.00 H new ATOM 0 HA SER A 132 10.294 -17.030 -2.107 1.00 0.00 H new ATOM 0 HB2 SER A 132 10.192 -19.257 -3.336 1.00 0.00 H new ATOM 0 HB3 SER A 132 8.965 -18.093 -3.796 1.00 0.00 H new ATOM 0 HG SER A 132 11.428 -18.578 -5.196 1.00 0.00 H new ATOM 1939 N GLU A 133 12.941 -16.861 -2.001 1.00 0.00 N ATOM 1940 CA GLU A 133 14.324 -17.176 -1.663 1.00 0.00 C ATOM 1941 C GLU A 133 14.397 -17.997 -0.380 1.00 0.00 C ATOM 1942 O GLU A 133 14.083 -17.504 0.704 1.00 0.00 O ATOM 1943 CB GLU A 133 15.137 -15.890 -1.506 1.00 0.00 C ATOM 1944 CG GLU A 133 15.790 -15.422 -2.797 1.00 0.00 C ATOM 1945 CD GLU A 133 14.864 -15.536 -3.993 1.00 0.00 C ATOM 1946 OE1 GLU A 133 14.258 -16.613 -4.174 1.00 0.00 O ATOM 1947 OE2 GLU A 133 14.746 -14.549 -4.748 1.00 0.00 O ATOM 0 H GLU A 133 12.591 -15.999 -1.583 1.00 0.00 H new ATOM 0 HA GLU A 133 14.745 -17.768 -2.476 1.00 0.00 H new ATOM 0 HB2 GLU A 133 14.485 -15.101 -1.132 1.00 0.00 H new ATOM 0 HB3 GLU A 133 15.910 -16.048 -0.754 1.00 0.00 H new ATOM 0 HG2 GLU A 133 16.107 -14.385 -2.685 1.00 0.00 H new ATOM 0 HG3 GLU A 133 16.688 -16.012 -2.980 1.00 0.00 H new ATOM 1954 N GLY A 134 14.814 -19.253 -0.510 1.00 0.00 N ATOM 1955 CA GLY A 134 14.920 -20.122 0.647 1.00 0.00 C ATOM 1956 C GLY A 134 13.634 -20.874 0.927 1.00 0.00 C ATOM 1957 O GLY A 134 13.467 -21.454 2.000 1.00 0.00 O ATOM 0 H GLY A 134 15.080 -19.684 -1.396 1.00 0.00 H new ATOM 0 HA2 GLY A 134 15.728 -20.836 0.488 1.00 0.00 H new ATOM 0 HA3 GLY A 134 15.187 -19.528 1.521 1.00 0.00 H new ATOM 1961 N ARG A 135 12.722 -20.864 -0.040 1.00 0.00 N ATOM 1962 CA ARG A 135 11.444 -21.551 0.107 1.00 0.00 C ATOM 1963 C ARG A 135 11.521 -22.969 -0.447 1.00 0.00 C ATOM 1964 O ARG A 135 11.792 -23.919 0.287 1.00 0.00 O ATOM 1965 CB ARG A 135 10.338 -20.771 -0.607 1.00 0.00 C ATOM 1966 CG ARG A 135 9.857 -19.553 0.164 1.00 0.00 C ATOM 1967 CD ARG A 135 9.743 -19.844 1.652 1.00 0.00 C ATOM 1968 NE ARG A 135 9.177 -21.165 1.909 1.00 0.00 N ATOM 1969 CZ ARG A 135 8.939 -21.638 3.128 1.00 0.00 C ATOM 1970 NH1 ARG A 135 9.217 -20.901 4.195 1.00 0.00 N ATOM 1971 NH2 ARG A 135 8.423 -22.850 3.281 1.00 0.00 N ATOM 0 H ARG A 135 12.844 -20.388 -0.934 1.00 0.00 H new ATOM 0 HA ARG A 135 11.211 -21.609 1.170 1.00 0.00 H new ATOM 0 HB2 ARG A 135 10.702 -20.452 -1.583 1.00 0.00 H new ATOM 0 HB3 ARG A 135 9.492 -21.436 -0.784 1.00 0.00 H new ATOM 0 HG2 ARG A 135 10.548 -18.725 0.006 1.00 0.00 H new ATOM 0 HG3 ARG A 135 8.888 -19.237 -0.221 1.00 0.00 H new ATOM 0 HD2 ARG A 135 10.729 -19.777 2.111 1.00 0.00 H new ATOM 0 HD3 ARG A 135 9.119 -19.084 2.123 1.00 0.00 H new ATOM 0 HE ARG A 135 8.952 -21.757 1.110 1.00 0.00 H new ATOM 0 HH11 ARG A 135 9.615 -19.969 4.081 1.00 0.00 H new ATOM 0 HH12 ARG A 135 9.033 -21.267 5.129 1.00 0.00 H new ATOM 0 HH21 ARG A 135 8.208 -23.420 2.463 1.00 0.00 H new ATOM 0 HH22 ARG A 135 8.241 -23.212 4.217 1.00 0.00 H new ATOM 1985 N ARG A 136 11.278 -23.104 -1.746 1.00 0.00 N ATOM 1986 CA ARG A 136 11.318 -24.406 -2.401 1.00 0.00 C ATOM 1987 C ARG A 136 9.980 -25.126 -2.263 1.00 0.00 C ATOM 1988 O ARG A 136 9.928 -26.354 -2.205 1.00 0.00 O ATOM 1989 CB ARG A 136 12.437 -25.265 -1.808 1.00 0.00 C ATOM 1990 CG ARG A 136 12.840 -26.434 -2.693 1.00 0.00 C ATOM 1991 CD ARG A 136 14.330 -26.420 -2.990 1.00 0.00 C ATOM 1992 NE ARG A 136 15.002 -27.611 -2.478 1.00 0.00 N ATOM 1993 CZ ARG A 136 16.150 -28.074 -2.960 1.00 0.00 C ATOM 1994 NH1 ARG A 136 16.750 -27.448 -3.963 1.00 0.00 N ATOM 1995 NH2 ARG A 136 16.699 -29.163 -2.441 1.00 0.00 N ATOM 0 H ARG A 136 11.051 -22.327 -2.367 1.00 0.00 H new ATOM 0 HA ARG A 136 11.516 -24.246 -3.461 1.00 0.00 H new ATOM 0 HB2 ARG A 136 13.310 -24.637 -1.630 1.00 0.00 H new ATOM 0 HB3 ARG A 136 12.116 -25.647 -0.839 1.00 0.00 H new ATOM 0 HG2 ARG A 136 12.574 -27.371 -2.203 1.00 0.00 H new ATOM 0 HG3 ARG A 136 12.281 -26.393 -3.628 1.00 0.00 H new ATOM 0 HD2 ARG A 136 14.484 -26.352 -4.067 1.00 0.00 H new ATOM 0 HD3 ARG A 136 14.780 -25.531 -2.547 1.00 0.00 H new ATOM 0 HE ARG A 136 14.565 -28.116 -1.707 1.00 0.00 H new ATOM 0 HH11 ARG A 136 16.330 -26.610 -4.365 1.00 0.00 H new ATOM 0 HH12 ARG A 136 17.631 -27.804 -4.332 1.00 0.00 H new ATOM 0 HH21 ARG A 136 16.240 -29.648 -1.670 1.00 0.00 H new ATOM 0 HH22 ARG A 136 17.581 -29.517 -2.813 1.00 0.00 H new ATOM 2009 N ASP A 137 8.901 -24.352 -2.211 1.00 0.00 N ATOM 2010 CA ASP A 137 7.562 -24.915 -2.081 1.00 0.00 C ATOM 2011 C ASP A 137 6.500 -23.878 -2.428 1.00 0.00 C ATOM 2012 O ASP A 137 6.582 -22.724 -2.007 1.00 0.00 O ATOM 2013 CB ASP A 137 7.340 -25.431 -0.657 1.00 0.00 C ATOM 2014 CG ASP A 137 8.263 -24.770 0.348 1.00 0.00 C ATOM 2015 OD1 ASP A 137 8.685 -23.622 0.101 1.00 0.00 O ATOM 2016 OD2 ASP A 137 8.560 -25.401 1.385 1.00 0.00 O ATOM 0 H ASP A 137 8.928 -23.333 -2.257 1.00 0.00 H new ATOM 0 HA ASP A 137 7.475 -25.746 -2.780 1.00 0.00 H new ATOM 0 HB2 ASP A 137 6.304 -25.254 -0.367 1.00 0.00 H new ATOM 0 HB3 ASP A 137 7.497 -26.509 -0.636 1.00 0.00 H new ATOM 2021 N ASN A 138 5.502 -24.296 -3.201 1.00 0.00 N ATOM 2022 CA ASN A 138 4.423 -23.404 -3.606 1.00 0.00 C ATOM 2023 C ASN A 138 3.988 -22.513 -2.446 1.00 0.00 C ATOM 2024 O ASN A 138 3.112 -22.880 -1.664 1.00 0.00 O ATOM 2025 CB ASN A 138 3.229 -24.212 -4.119 1.00 0.00 C ATOM 2026 CG ASN A 138 2.866 -25.355 -3.193 1.00 0.00 C ATOM 2027 OD1 ASN A 138 3.366 -26.470 -3.337 1.00 0.00 O ATOM 2028 ND2 ASN A 138 1.987 -25.084 -2.234 1.00 0.00 N ATOM 0 H ASN A 138 5.419 -25.247 -3.559 1.00 0.00 H new ATOM 0 HA ASN A 138 4.795 -22.768 -4.410 1.00 0.00 H new ATOM 0 HB2 ASN A 138 2.369 -23.552 -4.232 1.00 0.00 H new ATOM 0 HB3 ASN A 138 3.459 -24.608 -5.108 1.00 0.00 H new ATOM 0 HD21 ASN A 138 1.703 -25.815 -1.582 1.00 0.00 H new ATOM 0 HD22 ASN A 138 1.597 -24.145 -2.150 1.00 0.00 H new ATOM 2035 N MET A 139 4.608 -21.342 -2.342 1.00 0.00 N ATOM 2036 CA MET A 139 4.285 -20.398 -1.277 1.00 0.00 C ATOM 2037 C MET A 139 5.130 -19.135 -1.396 1.00 0.00 C ATOM 2038 O MET A 139 5.794 -18.729 -0.442 1.00 0.00 O ATOM 2039 CB MET A 139 4.505 -21.047 0.091 1.00 0.00 C ATOM 2040 CG MET A 139 3.242 -21.138 0.931 1.00 0.00 C ATOM 2041 SD MET A 139 3.430 -22.227 2.355 1.00 0.00 S ATOM 2042 CE MET A 139 2.370 -23.590 1.882 1.00 0.00 C ATOM 0 H MET A 139 5.336 -21.024 -2.981 1.00 0.00 H new ATOM 0 HA MET A 139 3.235 -20.121 -1.375 1.00 0.00 H new ATOM 0 HB2 MET A 139 4.909 -22.049 -0.052 1.00 0.00 H new ATOM 0 HB3 MET A 139 5.255 -20.476 0.638 1.00 0.00 H new ATOM 0 HG2 MET A 139 2.967 -20.141 1.275 1.00 0.00 H new ATOM 0 HG3 MET A 139 2.422 -21.498 0.309 1.00 0.00 H new ATOM 0 HE1 MET A 139 2.381 -24.348 2.665 1.00 0.00 H new ATOM 0 HE2 MET A 139 1.352 -23.227 1.742 1.00 0.00 H new ATOM 0 HE3 MET A 139 2.731 -24.025 0.950 1.00 0.00 H new ATOM 2052 N LYS A 140 5.099 -18.516 -2.571 1.00 0.00 N ATOM 2053 CA LYS A 140 5.862 -17.297 -2.814 1.00 0.00 C ATOM 2054 C LYS A 140 5.646 -16.288 -1.691 1.00 0.00 C ATOM 2055 O LYS A 140 4.539 -16.149 -1.171 1.00 0.00 O ATOM 2056 CB LYS A 140 5.462 -16.678 -4.154 1.00 0.00 C ATOM 2057 CG LYS A 140 3.971 -16.413 -4.281 1.00 0.00 C ATOM 2058 CD LYS A 140 3.651 -15.619 -5.537 1.00 0.00 C ATOM 2059 CE LYS A 140 3.577 -16.518 -6.761 1.00 0.00 C ATOM 2060 NZ LYS A 140 2.535 -17.572 -6.615 1.00 0.00 N ATOM 0 H LYS A 140 4.554 -18.838 -3.370 1.00 0.00 H new ATOM 0 HA LYS A 140 6.919 -17.560 -2.845 1.00 0.00 H new ATOM 0 HB2 LYS A 140 6.002 -15.740 -4.287 1.00 0.00 H new ATOM 0 HB3 LYS A 140 5.774 -17.343 -4.959 1.00 0.00 H new ATOM 0 HG2 LYS A 140 3.433 -17.360 -4.301 1.00 0.00 H new ATOM 0 HG3 LYS A 140 3.622 -15.866 -3.405 1.00 0.00 H new ATOM 0 HD2 LYS A 140 2.702 -15.099 -5.408 1.00 0.00 H new ATOM 0 HD3 LYS A 140 4.414 -14.856 -5.690 1.00 0.00 H new ATOM 0 HE2 LYS A 140 3.361 -15.914 -7.642 1.00 0.00 H new ATOM 0 HE3 LYS A 140 4.547 -16.987 -6.926 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 2.191 -17.853 -7.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 2.943 -18.399 -6.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 1.742 -17.201 -6.053 1.00 0.00 H new ATOM 2074 N TRP A 141 6.713 -15.585 -1.320 1.00 0.00 N ATOM 2075 CA TRP A 141 6.638 -14.589 -0.258 1.00 0.00 C ATOM 2076 C TRP A 141 7.372 -13.312 -0.656 1.00 0.00 C ATOM 2077 O TRP A 141 7.986 -13.240 -1.721 1.00 0.00 O ATOM 2078 CB TRP A 141 7.230 -15.149 1.036 1.00 0.00 C ATOM 2079 CG TRP A 141 8.706 -15.397 0.958 1.00 0.00 C ATOM 2080 CD1 TRP A 141 9.323 -16.561 0.600 1.00 0.00 C ATOM 2081 CD2 TRP A 141 9.749 -14.460 1.246 1.00 0.00 C ATOM 2082 NE1 TRP A 141 10.688 -16.405 0.647 1.00 0.00 N ATOM 2083 CE2 TRP A 141 10.974 -15.124 1.041 1.00 0.00 C ATOM 2084 CE3 TRP A 141 9.766 -13.124 1.656 1.00 0.00 C ATOM 2085 CZ2 TRP A 141 12.202 -14.495 1.234 1.00 0.00 C ATOM 2086 CZ3 TRP A 141 10.986 -12.502 1.846 1.00 0.00 C ATOM 2087 CH2 TRP A 141 12.187 -13.188 1.635 1.00 0.00 C ATOM 0 H TRP A 141 7.637 -15.687 -1.739 1.00 0.00 H new ATOM 0 HA TRP A 141 5.588 -14.346 -0.095 1.00 0.00 H new ATOM 0 HB2 TRP A 141 7.029 -14.452 1.850 1.00 0.00 H new ATOM 0 HB3 TRP A 141 6.725 -16.083 1.283 1.00 0.00 H new ATOM 0 HD1 TRP A 141 8.813 -17.471 0.321 1.00 0.00 H new ATOM 0 HE1 TRP A 141 11.376 -17.125 0.425 1.00 0.00 H new ATOM 0 HE3 TRP A 141 8.843 -12.588 1.821 1.00 0.00 H new ATOM 0 HZ2 TRP A 141 13.132 -15.021 1.073 1.00 0.00 H new ATOM 0 HZ3 TRP A 141 11.012 -11.470 2.162 1.00 0.00 H new ATOM 0 HH2 TRP A 141 13.123 -12.673 1.792 1.00 0.00 H new ATOM 2098 N CYS A 142 7.303 -12.305 0.210 1.00 0.00 N ATOM 2099 CA CYS A 142 7.961 -11.029 -0.051 1.00 0.00 C ATOM 2100 C CYS A 142 8.365 -10.349 1.252 1.00 0.00 C ATOM 2101 O CYS A 142 7.849 -10.676 2.322 1.00 0.00 O ATOM 2102 CB CYS A 142 7.040 -10.109 -0.853 1.00 0.00 C ATOM 2103 SG CYS A 142 5.374 -9.908 -0.138 1.00 0.00 S ATOM 0 H CYS A 142 6.800 -12.348 1.096 1.00 0.00 H new ATOM 0 HA CYS A 142 8.861 -11.227 -0.633 1.00 0.00 H new ATOM 0 HB2 CYS A 142 7.508 -9.128 -0.936 1.00 0.00 H new ATOM 0 HB3 CYS A 142 6.944 -10.503 -1.865 1.00 0.00 H new ATOM 2108 N GLY A 143 9.287 -9.398 1.152 1.00 0.00 N ATOM 2109 CA GLY A 143 9.745 -8.681 2.326 1.00 0.00 C ATOM 2110 C GLY A 143 8.748 -7.636 2.783 1.00 0.00 C ATOM 2111 O GLY A 143 8.279 -6.826 1.984 1.00 0.00 O ATOM 0 H GLY A 143 9.726 -9.111 0.277 1.00 0.00 H new ATOM 0 HA2 GLY A 143 9.924 -9.389 3.135 1.00 0.00 H new ATOM 0 HA3 GLY A 143 10.698 -8.200 2.107 1.00 0.00 H new ATOM 2115 N THR A 144 8.421 -7.655 4.069 1.00 0.00 N ATOM 2116 CA THR A 144 7.471 -6.703 4.630 1.00 0.00 C ATOM 2117 C THR A 144 8.171 -5.428 5.088 1.00 0.00 C ATOM 2118 O THR A 144 7.651 -4.690 5.926 1.00 0.00 O ATOM 2119 CB THR A 144 6.704 -7.313 5.816 1.00 0.00 C ATOM 2120 OG1 THR A 144 7.625 -7.877 6.756 1.00 0.00 O ATOM 2121 CG2 THR A 144 5.740 -8.388 5.337 1.00 0.00 C ATOM 0 H THR A 144 8.800 -8.320 4.743 1.00 0.00 H new ATOM 0 HA THR A 144 6.764 -6.456 3.838 1.00 0.00 H new ATOM 0 HB THR A 144 6.132 -6.521 6.299 1.00 0.00 H new ATOM 0 HG1 THR A 144 7.997 -8.707 6.392 1.00 0.00 H new ATOM 0 HG21 THR A 144 5.208 -8.806 6.191 1.00 0.00 H new ATOM 0 HG22 THR A 144 5.023 -7.951 4.642 1.00 0.00 H new ATOM 0 HG23 THR A 144 6.297 -9.178 4.834 1.00 0.00 H new ATOM 2129 N THR A 145 9.348 -5.174 4.530 1.00 0.00 N ATOM 2130 CA THR A 145 10.119 -3.986 4.875 1.00 0.00 C ATOM 2131 C THR A 145 11.142 -3.667 3.789 1.00 0.00 C ATOM 2132 O THR A 145 11.568 -4.551 3.046 1.00 0.00 O ATOM 2133 CB THR A 145 10.844 -4.155 6.223 1.00 0.00 C ATOM 2134 OG1 THR A 145 12.175 -4.638 6.006 1.00 0.00 O ATOM 2135 CG2 THR A 145 10.088 -5.119 7.130 1.00 0.00 C ATOM 0 H THR A 145 9.790 -5.776 3.835 1.00 0.00 H new ATOM 0 HA THR A 145 9.412 -3.160 4.959 1.00 0.00 H new ATOM 0 HB THR A 145 10.887 -3.182 6.712 1.00 0.00 H new ATOM 0 HG1 THR A 145 12.139 -5.559 5.674 1.00 0.00 H new ATOM 0 HG21 THR A 145 10.620 -5.222 8.076 1.00 0.00 H new ATOM 0 HG22 THR A 145 9.086 -4.732 7.317 1.00 0.00 H new ATOM 0 HG23 THR A 145 10.016 -6.093 6.646 1.00 0.00 H new ATOM 2143 N GLN A 146 11.522 -2.396 3.699 1.00 0.00 N ATOM 2144 CA GLN A 146 12.488 -1.948 2.699 1.00 0.00 C ATOM 2145 C GLN A 146 13.523 -3.029 2.392 1.00 0.00 C ATOM 2146 O GLN A 146 13.748 -3.370 1.231 1.00 0.00 O ATOM 2147 CB GLN A 146 13.188 -0.674 3.175 1.00 0.00 C ATOM 2148 CG GLN A 146 14.362 -0.937 4.101 1.00 0.00 C ATOM 2149 CD GLN A 146 15.018 0.340 4.590 1.00 0.00 C ATOM 2150 OE1 GLN A 146 14.465 1.055 5.426 1.00 0.00 O ATOM 2151 NE2 GLN A 146 16.204 0.633 4.069 1.00 0.00 N ATOM 0 H GLN A 146 11.175 -1.655 4.308 1.00 0.00 H new ATOM 0 HA GLN A 146 11.940 -1.738 1.780 1.00 0.00 H new ATOM 0 HB2 GLN A 146 13.538 -0.116 2.307 1.00 0.00 H new ATOM 0 HB3 GLN A 146 12.464 -0.042 3.690 1.00 0.00 H new ATOM 0 HG2 GLN A 146 14.021 -1.517 4.959 1.00 0.00 H new ATOM 0 HG3 GLN A 146 15.102 -1.544 3.580 1.00 0.00 H new ATOM 0 HE21 GLN A 146 16.625 0.012 3.379 1.00 0.00 H new ATOM 0 HE22 GLN A 146 16.693 1.479 4.359 1.00 0.00 H new ATOM 2160 N ASN A 147 14.150 -3.565 3.434 1.00 0.00 N ATOM 2161 CA ASN A 147 15.159 -4.605 3.263 1.00 0.00 C ATOM 2162 C ASN A 147 14.816 -5.847 4.079 1.00 0.00 C ATOM 2163 O ASN A 147 15.056 -5.900 5.285 1.00 0.00 O ATOM 2164 CB ASN A 147 16.539 -4.078 3.658 1.00 0.00 C ATOM 2165 CG ASN A 147 17.295 -3.492 2.482 1.00 0.00 C ATOM 2166 OD1 ASN A 147 18.445 -3.849 2.229 1.00 0.00 O ATOM 2167 ND2 ASN A 147 16.649 -2.588 1.754 1.00 0.00 N ATOM 0 H ASN A 147 13.978 -3.298 4.403 1.00 0.00 H new ATOM 0 HA ASN A 147 15.175 -4.886 2.210 1.00 0.00 H new ATOM 0 HB2 ASN A 147 16.426 -3.316 4.429 1.00 0.00 H new ATOM 0 HB3 ASN A 147 17.123 -4.889 4.094 1.00 0.00 H new ATOM 0 HD21 ASN A 147 17.106 -2.160 0.949 1.00 0.00 H new ATOM 0 HD22 ASN A 147 15.696 -2.322 2.000 1.00 0.00 H new ATOM 2174 N TYR A 148 14.255 -6.847 3.408 1.00 0.00 N ATOM 2175 CA TYR A 148 13.881 -8.094 4.063 1.00 0.00 C ATOM 2176 C TYR A 148 14.965 -8.540 5.039 1.00 0.00 C ATOM 2177 O TYR A 148 14.704 -8.737 6.226 1.00 0.00 O ATOM 2178 CB TYR A 148 13.637 -9.187 3.021 1.00 0.00 C ATOM 2179 CG TYR A 148 13.514 -10.572 3.611 1.00 0.00 C ATOM 2180 CD1 TYR A 148 12.447 -10.902 4.437 1.00 0.00 C ATOM 2181 CD2 TYR A 148 14.463 -11.549 3.342 1.00 0.00 C ATOM 2182 CE1 TYR A 148 12.330 -12.169 4.977 1.00 0.00 C ATOM 2183 CE2 TYR A 148 14.354 -12.818 3.878 1.00 0.00 C ATOM 2184 CZ TYR A 148 13.285 -13.123 4.695 1.00 0.00 C ATOM 2185 OH TYR A 148 13.172 -14.385 5.232 1.00 0.00 O ATOM 0 H TYR A 148 14.049 -6.818 2.409 1.00 0.00 H new ATOM 0 HA TYR A 148 12.961 -7.922 4.622 1.00 0.00 H new ATOM 0 HB2 TYR A 148 12.726 -8.954 2.470 1.00 0.00 H new ATOM 0 HB3 TYR A 148 14.456 -9.180 2.301 1.00 0.00 H new ATOM 0 HD1 TYR A 148 11.697 -10.157 4.661 1.00 0.00 H new ATOM 0 HD2 TYR A 148 15.301 -11.313 2.703 1.00 0.00 H new ATOM 0 HE1 TYR A 148 11.494 -12.411 5.617 1.00 0.00 H new ATOM 0 HE2 TYR A 148 15.101 -13.566 3.659 1.00 0.00 H new ATOM 0 HH TYR A 148 13.926 -14.936 4.934 1.00 0.00 H new ATOM 2195 N ASP A 149 16.184 -8.694 4.530 1.00 0.00 N ATOM 2196 CA ASP A 149 17.309 -9.114 5.356 1.00 0.00 C ATOM 2197 C ASP A 149 17.637 -8.053 6.402 1.00 0.00 C ATOM 2198 O ASP A 149 18.363 -8.314 7.361 1.00 0.00 O ATOM 2199 CB ASP A 149 18.536 -9.386 4.485 1.00 0.00 C ATOM 2200 CG ASP A 149 18.728 -10.862 4.200 1.00 0.00 C ATOM 2201 OD1 ASP A 149 17.790 -11.644 4.463 1.00 0.00 O ATOM 2202 OD2 ASP A 149 19.816 -11.236 3.713 1.00 0.00 O ATOM 0 H ASP A 149 16.417 -8.534 3.550 1.00 0.00 H new ATOM 0 HA ASP A 149 17.029 -10.033 5.870 1.00 0.00 H new ATOM 0 HB2 ASP A 149 18.436 -8.847 3.543 1.00 0.00 H new ATOM 0 HB3 ASP A 149 19.424 -8.996 4.982 1.00 0.00 H new ATOM 2207 N ALA A 150 17.094 -6.856 6.208 1.00 0.00 N ATOM 2208 CA ALA A 150 17.323 -5.752 7.132 1.00 0.00 C ATOM 2209 C ALA A 150 16.323 -5.789 8.281 1.00 0.00 C ATOM 2210 O ALA A 150 16.504 -5.121 9.298 1.00 0.00 O ATOM 2211 CB ALA A 150 17.232 -4.424 6.395 1.00 0.00 C ATOM 0 H ALA A 150 16.491 -6.626 5.418 1.00 0.00 H new ATOM 0 HA ALA A 150 18.324 -5.857 7.550 1.00 0.00 H new ATOM 0 HB1 ALA A 150 17.405 -3.607 7.095 1.00 0.00 H new ATOM 0 HB2 ALA A 150 17.985 -4.393 5.608 1.00 0.00 H new ATOM 0 HB3 ALA A 150 16.241 -4.320 5.953 1.00 0.00 H new ATOM 2217 N ASP A 151 15.265 -6.572 8.106 1.00 0.00 N ATOM 2218 CA ASP A 151 14.229 -6.697 9.124 1.00 0.00 C ATOM 2219 C ASP A 151 13.996 -8.159 9.493 1.00 0.00 C ATOM 2220 O ASP A 151 13.975 -8.516 10.671 1.00 0.00 O ATOM 2221 CB ASP A 151 12.926 -6.076 8.623 1.00 0.00 C ATOM 2222 CG ASP A 151 12.389 -6.786 7.397 1.00 0.00 C ATOM 2223 OD1 ASP A 151 13.073 -6.763 6.353 1.00 0.00 O ATOM 2224 OD2 ASP A 151 11.287 -7.367 7.479 1.00 0.00 O ATOM 0 H ASP A 151 15.102 -7.130 7.268 1.00 0.00 H new ATOM 0 HA ASP A 151 14.564 -6.167 10.016 1.00 0.00 H new ATOM 0 HB2 ASP A 151 12.180 -6.111 9.417 1.00 0.00 H new ATOM 0 HB3 ASP A 151 13.093 -5.025 8.388 1.00 0.00 H new ATOM 2229 N GLN A 152 13.820 -8.998 8.476 1.00 0.00 N ATOM 2230 CA GLN A 152 13.584 -10.423 8.686 1.00 0.00 C ATOM 2231 C GLN A 152 12.099 -10.708 8.881 1.00 0.00 C ATOM 2232 O GLN A 152 11.695 -11.302 9.881 1.00 0.00 O ATOM 2233 CB GLN A 152 14.376 -10.925 9.896 1.00 0.00 C ATOM 2234 CG GLN A 152 15.014 -12.288 9.684 1.00 0.00 C ATOM 2235 CD GLN A 152 16.272 -12.218 8.841 1.00 0.00 C ATOM 2236 OE1 GLN A 152 16.228 -12.394 7.623 1.00 0.00 O ATOM 2237 NE2 GLN A 152 17.403 -11.963 9.487 1.00 0.00 N ATOM 0 H GLN A 152 13.836 -8.715 7.496 1.00 0.00 H new ATOM 0 HA GLN A 152 13.923 -10.953 7.796 1.00 0.00 H new ATOM 0 HB2 GLN A 152 15.156 -10.202 10.135 1.00 0.00 H new ATOM 0 HB3 GLN A 152 13.712 -10.974 10.759 1.00 0.00 H new ATOM 0 HG2 GLN A 152 15.254 -12.727 10.652 1.00 0.00 H new ATOM 0 HG3 GLN A 152 14.295 -12.951 9.203 1.00 0.00 H new ATOM 0 HE21 GLN A 152 17.393 -11.824 10.497 1.00 0.00 H new ATOM 0 HE22 GLN A 152 18.282 -11.906 8.973 1.00 0.00 H new ATOM 2246 N LYS A 153 11.290 -10.281 7.917 1.00 0.00 N ATOM 2247 CA LYS A 153 9.847 -10.490 7.977 1.00 0.00 C ATOM 2248 C LYS A 153 9.302 -10.880 6.607 1.00 0.00 C ATOM 2249 O LYS A 153 9.090 -10.026 5.746 1.00 0.00 O ATOM 2250 CB LYS A 153 9.146 -9.224 8.473 1.00 0.00 C ATOM 2251 CG LYS A 153 9.402 -8.919 9.939 1.00 0.00 C ATOM 2252 CD LYS A 153 10.029 -7.546 10.118 1.00 0.00 C ATOM 2253 CE LYS A 153 9.094 -6.440 9.659 1.00 0.00 C ATOM 2254 NZ LYS A 153 9.647 -5.088 9.947 1.00 0.00 N ATOM 0 H LYS A 153 11.609 -9.787 7.083 1.00 0.00 H new ATOM 0 HA LYS A 153 9.650 -11.303 8.676 1.00 0.00 H new ATOM 0 HB2 LYS A 153 9.476 -8.377 7.872 1.00 0.00 H new ATOM 0 HB3 LYS A 153 8.073 -9.328 8.315 1.00 0.00 H new ATOM 0 HG2 LYS A 153 8.464 -8.967 10.492 1.00 0.00 H new ATOM 0 HG3 LYS A 153 10.060 -9.679 10.361 1.00 0.00 H new ATOM 0 HD2 LYS A 153 10.284 -7.396 11.167 1.00 0.00 H new ATOM 0 HD3 LYS A 153 10.960 -7.494 9.553 1.00 0.00 H new ATOM 0 HE2 LYS A 153 8.914 -6.538 8.588 1.00 0.00 H new ATOM 0 HE3 LYS A 153 8.130 -6.551 10.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 153 9.205 -4.709 10.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 153 10.675 -5.156 10.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 153 9.447 -4.454 9.147 1.00 0.00 H new ATOM 2268 N PHE A 154 9.078 -12.175 6.410 1.00 0.00 N ATOM 2269 CA PHE A 154 8.561 -12.677 5.142 1.00 0.00 C ATOM 2270 C PHE A 154 7.089 -13.057 5.262 1.00 0.00 C ATOM 2271 O PHE A 154 6.651 -13.565 6.294 1.00 0.00 O ATOM 2272 CB PHE A 154 9.374 -13.885 4.676 1.00 0.00 C ATOM 2273 CG PHE A 154 9.154 -15.114 5.512 1.00 0.00 C ATOM 2274 CD1 PHE A 154 9.868 -15.307 6.685 1.00 0.00 C ATOM 2275 CD2 PHE A 154 8.235 -16.075 5.125 1.00 0.00 C ATOM 2276 CE1 PHE A 154 9.668 -16.437 7.455 1.00 0.00 C ATOM 2277 CE2 PHE A 154 8.031 -17.208 5.891 1.00 0.00 C ATOM 2278 CZ PHE A 154 8.748 -17.388 7.058 1.00 0.00 C ATOM 0 H PHE A 154 9.246 -12.896 7.112 1.00 0.00 H new ATOM 0 HA PHE A 154 8.652 -11.880 4.404 1.00 0.00 H new ATOM 0 HB2 PHE A 154 9.117 -14.109 3.641 1.00 0.00 H new ATOM 0 HB3 PHE A 154 10.433 -13.629 4.693 1.00 0.00 H new ATOM 0 HD1 PHE A 154 10.588 -14.566 7.000 1.00 0.00 H new ATOM 0 HD2 PHE A 154 7.671 -15.938 4.214 1.00 0.00 H new ATOM 0 HE1 PHE A 154 10.230 -16.577 8.366 1.00 0.00 H new ATOM 0 HE2 PHE A 154 7.312 -17.951 5.578 1.00 0.00 H new ATOM 0 HZ PHE A 154 8.590 -18.271 7.659 1.00 0.00 H new ATOM 2288 N GLY A 155 6.331 -12.810 4.198 1.00 0.00 N ATOM 2289 CA GLY A 155 4.917 -13.134 4.202 1.00 0.00 C ATOM 2290 C GLY A 155 4.444 -13.683 2.871 1.00 0.00 C ATOM 2291 O GLY A 155 4.959 -13.305 1.818 1.00 0.00 O ATOM 0 H GLY A 155 6.672 -12.391 3.333 1.00 0.00 H new ATOM 0 HA2 GLY A 155 4.717 -13.866 4.985 1.00 0.00 H new ATOM 0 HA3 GLY A 155 4.343 -12.240 4.447 1.00 0.00 H new ATOM 2295 N PHE A 156 3.461 -14.577 2.915 1.00 0.00 N ATOM 2296 CA PHE A 156 2.919 -15.176 1.700 1.00 0.00 C ATOM 2297 C PHE A 156 2.032 -14.181 0.961 1.00 0.00 C ATOM 2298 O PHE A 156 1.075 -13.653 1.524 1.00 0.00 O ATOM 2299 CB PHE A 156 2.122 -16.437 2.038 1.00 0.00 C ATOM 2300 CG PHE A 156 2.849 -17.380 2.953 1.00 0.00 C ATOM 2301 CD1 PHE A 156 4.220 -17.550 2.846 1.00 0.00 C ATOM 2302 CD2 PHE A 156 2.162 -18.097 3.920 1.00 0.00 C ATOM 2303 CE1 PHE A 156 4.892 -18.418 3.686 1.00 0.00 C ATOM 2304 CE2 PHE A 156 2.828 -18.966 4.763 1.00 0.00 C ATOM 2305 CZ PHE A 156 4.195 -19.127 4.645 1.00 0.00 C ATOM 0 H PHE A 156 3.024 -14.902 3.777 1.00 0.00 H new ATOM 0 HA PHE A 156 3.752 -15.448 1.052 1.00 0.00 H new ATOM 0 HB2 PHE A 156 1.179 -16.147 2.503 1.00 0.00 H new ATOM 0 HB3 PHE A 156 1.875 -16.959 1.114 1.00 0.00 H new ATOM 0 HD1 PHE A 156 4.770 -16.998 2.098 1.00 0.00 H new ATOM 0 HD2 PHE A 156 1.093 -17.975 4.016 1.00 0.00 H new ATOM 0 HE1 PHE A 156 5.961 -18.542 3.593 1.00 0.00 H new ATOM 0 HE2 PHE A 156 2.281 -19.518 5.513 1.00 0.00 H new ATOM 0 HZ PHE A 156 4.718 -19.806 5.302 1.00 0.00 H new ATOM 2315 N CYS A 157 2.359 -13.927 -0.302 1.00 0.00 N ATOM 2316 CA CYS A 157 1.592 -12.989 -1.114 1.00 0.00 C ATOM 2317 C CYS A 157 0.460 -13.698 -1.850 1.00 0.00 C ATOM 2318 O CYS A 157 0.557 -14.882 -2.170 1.00 0.00 O ATOM 2319 CB CYS A 157 2.505 -12.285 -2.120 1.00 0.00 C ATOM 2320 SG CYS A 157 4.280 -12.398 -1.725 1.00 0.00 S ATOM 0 H CYS A 157 3.148 -14.357 -0.785 1.00 0.00 H new ATOM 0 HA CYS A 157 1.156 -12.247 -0.445 1.00 0.00 H new ATOM 0 HB2 CYS A 157 2.336 -12.713 -3.108 1.00 0.00 H new ATOM 0 HB3 CYS A 157 2.223 -11.234 -2.176 1.00 0.00 H new ATOM 2325 N PRO A 158 -0.632 -12.971 -2.128 1.00 0.00 N ATOM 2326 CA PRO A 158 -1.792 -13.521 -2.831 1.00 0.00 C ATOM 2327 C PRO A 158 -1.397 -14.308 -4.076 1.00 0.00 C ATOM 2328 O PRO A 158 -0.213 -14.509 -4.346 1.00 0.00 O ATOM 2329 CB PRO A 158 -2.590 -12.274 -3.215 1.00 0.00 C ATOM 2330 CG PRO A 158 -2.240 -11.269 -2.173 1.00 0.00 C ATOM 2331 CD PRO A 158 -0.815 -11.550 -1.777 1.00 0.00 C ATOM 0 HA PRO A 158 -2.347 -14.229 -2.215 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -2.321 -11.922 -4.211 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -3.661 -12.477 -3.227 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -2.343 -10.255 -2.560 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -2.906 -11.352 -1.314 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -0.116 -10.911 -2.316 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -0.652 -11.375 -0.713 1.00 0.00 H new ATOM 2339 N MET A 159 -2.397 -14.751 -4.831 1.00 0.00 N ATOM 2340 CA MET A 159 -2.154 -15.517 -6.048 1.00 0.00 C ATOM 2341 C MET A 159 -2.007 -14.592 -7.252 1.00 0.00 C ATOM 2342 O MET A 159 -1.998 -13.370 -7.111 1.00 0.00 O ATOM 2343 CB MET A 159 -3.295 -16.507 -6.289 1.00 0.00 C ATOM 2344 CG MET A 159 -4.610 -15.842 -6.660 1.00 0.00 C ATOM 2345 SD MET A 159 -5.758 -16.976 -7.466 1.00 0.00 S ATOM 2346 CE MET A 159 -5.815 -18.308 -6.271 1.00 0.00 C ATOM 0 H MET A 159 -3.383 -14.593 -4.622 1.00 0.00 H new ATOM 0 HA MET A 159 -1.223 -16.070 -5.920 1.00 0.00 H new ATOM 0 HB2 MET A 159 -3.007 -17.193 -7.086 1.00 0.00 H new ATOM 0 HB3 MET A 159 -3.441 -17.106 -5.390 1.00 0.00 H new ATOM 0 HG2 MET A 159 -5.075 -15.438 -5.761 1.00 0.00 H new ATOM 0 HG3 MET A 159 -4.412 -14.999 -7.322 1.00 0.00 H new ATOM 0 HE1 MET A 159 -6.657 -18.963 -6.496 1.00 0.00 H new ATOM 0 HE2 MET A 159 -4.888 -18.880 -6.319 1.00 0.00 H new ATOM 0 HE3 MET A 159 -5.934 -17.894 -5.270 1.00 0.00 H new ATOM 2356 N ALA A 160 -1.890 -15.185 -8.436 1.00 0.00 N ATOM 2357 CA ALA A 160 -1.742 -14.414 -9.665 1.00 0.00 C ATOM 2358 C ALA A 160 -3.096 -14.161 -10.320 1.00 0.00 C ATOM 2359 O ALA A 160 -3.248 -14.503 -11.511 1.00 0.00 O ATOM 2360 CB ALA A 160 -0.813 -15.134 -10.630 1.00 0.00 C ATOM 2361 OXT ALA A 160 -3.992 -13.623 -9.636 1.00 0.00 O ATOM 0 H ALA A 160 -1.895 -16.196 -8.570 1.00 0.00 H new ATOM 0 HA ALA A 160 -1.305 -13.449 -9.410 1.00 0.00 H new ATOM 0 HB1 ALA A 160 -0.711 -14.548 -11.543 1.00 0.00 H new ATOM 0 HB2 ALA A 160 0.166 -15.258 -10.168 1.00 0.00 H new ATOM 0 HB3 ALA A 160 -1.227 -16.113 -10.872 1.00 0.00 H new TER 2367 ALA A 160 HETATM 2368 C1 NAG A 161 18.227 -1.526 -3.545 1.00 0.00 C HETATM 2369 C2 NAG A 161 19.674 -1.166 -3.260 1.00 0.00 C HETATM 2370 C3 NAG A 161 19.725 0.217 -2.620 1.00 0.00 C HETATM 2371 C4 NAG A 161 19.107 1.269 -3.571 1.00 0.00 C HETATM 2372 C5 NAG A 161 17.621 0.831 -3.846 1.00 0.00 C HETATM 2373 C6 NAG A 161 16.914 1.772 -4.835 1.00 0.00 C HETATM 2374 C7 NAG A 161 21.448 -2.741 -2.701 1.00 0.00 C HETATM 2375 C8 NAG A 161 21.984 -3.742 -1.682 1.00 0.00 C HETATM 2376 N2 NAG A 161 20.303 -2.145 -2.383 1.00 0.00 N HETATM 2377 O3 NAG A 161 21.073 0.564 -2.348 1.00 0.00 O HETATM 2378 O4 NAG A 161 19.188 2.533 -2.924 1.00 0.00 O HETATM 2379 O5 NAG A 161 17.634 -0.520 -4.390 1.00 0.00 O HETATM 2380 O6 NAG A 161 15.672 1.183 -5.219 1.00 0.00 O HETATM 2381 O7 NAG A 161 22.050 -2.510 -3.749 1.00 0.00 O HETATM 0 HO6 NAG A 161 15.757 0.207 -5.211 1.00 0.00 H new HETATM 0 HO4 NAG A 161 18.804 3.223 -3.505 1.00 0.00 H new HETATM 0 HO3 NAG A 161 21.189 1.532 -2.451 1.00 0.00 H new HETATM 0 HN2 NAG A 161 19.852 -2.380 -1.499 1.00 0.00 H new HETATM 0 H83 NAG A 161 22.159 -3.236 -0.732 1.00 0.00 H new HETATM 0 H82 NAG A 161 21.256 -4.541 -1.539 1.00 0.00 H new HETATM 0 H81 NAG A 161 22.920 -4.165 -2.046 1.00 0.00 H new HETATM 0 H62 NAG A 161 16.744 2.745 -4.375 1.00 0.00 H new HETATM 0 H61 NAG A 161 17.540 1.939 -5.711 1.00 0.00 H new HETATM 0 H5 NAG A 161 17.070 0.872 -2.906 1.00 0.00 H new HETATM 0 H4 NAG A 161 19.628 1.343 -4.526 1.00 0.00 H new HETATM 0 H3 NAG A 161 19.155 0.198 -1.691 1.00 0.00 H new HETATM 0 H2 NAG A 161 20.225 -1.164 -4.201 1.00 0.00 H new