USER MOD reduce.3.24.130724 H: found=0, std=0, add=1133, rem=0, adj=48 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 127 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 131 THR OG1 : rot 134:sc= -0.0109 USER MOD Set 2.1: A 51 SER OG : rot 120:sc= 0 USER MOD Set 2.2: A 84 THR OG1 : rot -167:sc= -4.55! USER MOD Set 3.1: A 47 TYR OH : rot 47:sc= -0.993 USER MOD Set 3.2: A 79 HIS : no HD1:sc= -0.498! C(o=-1.5!,f=-11!) USER MOD Set 4.1: A 17 GLN : amide:sc= 0 X(o=-5.8,f=-5.8) USER MOD Set 4.2: A 30 THR OG1 : rot 149:sc= -5.8! USER MOD Set 5.1: A 16 MET CE :methyl 152:sc= -10.6! (180deg=-8.03!) USER MOD Set 5.2: A 144 THR OG1 : rot 21:sc= -4.06! USER MOD Single : A 1 TYR N :NH3+ 142:sc= 0.62 (180deg=0.142) USER MOD Single : A 1 TYR OH : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HE2:sc= -9! C(o=-9!,f=-5.2!) USER MOD Single : A 6 THR OG1 : rot -101:sc= 0.556 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 55:sc= 0.834 USER MOD Single : A 13 SER OG : rot -120:sc= -1.11 USER MOD Single : A 20 LYS NZ :NH3+ -161:sc= -2.37! (180deg=-3.28!) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0.0907 USER MOD Single : A 22 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 ASN : amide:sc= 0 X(o=0,f=-0.068) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 GLN : amide:sc= -1.06 K(o=-1.1,f=-0.094) USER MOD Single : A 27 MET CE :methyl 138:sc= -7.63! (180deg=-8.61!) USER MOD Single : A 34 ASN : amide:sc=-0.00213 X(o=-0.0021,f=0) USER MOD Single : A 37 SER OG : rot 43:sc= -0.793 USER MOD Single : A 39 GLN : amide:sc= -0.114 K(o=-0.11,f=-1.3) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0.0752 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0.0165 USER MOD Single : A 45 GLN : amide:sc= -1.34 K(o=-1.3,f=0) USER MOD Single : A 46 THR OG1 : rot 95:sc= 0.977 USER MOD Single : A 50 ASN : amide:sc= -10.7! C(o=-11!,f=-23!) USER MOD Single : A 52 ASN : amide:sc= -0.118 K(o=-0.12,f=-1.2) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0.0244 USER MOD Single : A 62 TYR OH : rot -54:sc= 0.413 USER MOD Single : A 63 ASN : amide:sc= -6.83! C(o=-6.8!,f=-5.7!) USER MOD Single : A 66 THR OG1 : rot 180:sc= -2.19! USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot -28:sc= 0.0468! USER MOD Single : A 71 THR OG1 : rot 170:sc= 0 USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 83 SER OG : rot -106:sc= -1.57! USER MOD Single : A 85 THR OG1 : rot 100:sc= -0.241 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= -0.011 K(o=-0.011,f=-0.58) USER MOD Single : A 88 TYR OH : rot 134:sc= 0.598 USER MOD Single : A 90 GLN : amide:sc= -0.91 K(o=-0.91,f=-3.3!) USER MOD Single : A 92 GLN : amide:sc= -0.453 X(o=-0.45,f=-0.012) 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 15:sc= 0.496 USER MOD Single : A 98 THR OG1 : rot -27:sc= 0.237! USER MOD Single : A 100 HIS : no HD1:sc= -1.12! C(o=-1.1!,f=-1.2!) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 GLN : amide:sc= -0.956 K(o=-0.96,f=-2.5) USER MOD Single : A 106 THR OG1 : rot -44:sc= 0.853 USER MOD Single : A 110 ASN : amide:sc= -5.38! C(o=-5.4!,f=-4.9!) USER MOD Single : A 111 SER OG : rot -51:sc= -0.266 USER MOD Single : A 112 ASN : amide:sc= 0 K(o=0,f=-0.93) USER MOD Single : A 117 HIS : no HD1:sc= -2.87! C(o=-2.9!,f=-3.5!) USER MOD Single : A 122 TYR OH : rot 30:sc= 0.0606 USER MOD Single : A 123 ASN : amide:sc= -8.23! C(o=-8.2!,f=-13!) USER MOD Single : A 124 ASN : amide:sc= -7.27! C(o=-7.3!,f=-11!) USER MOD Single : A 125 HIS : no HD1:sc= -0.0492 X(o=-0.049,f=0) USER MOD Single : A 128 THR OG1 : rot 180:sc= -4.22! USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 138 ASN : amide:sc= -0.253 X(o=-0.25,f=0.05) USER MOD Single : A 139 MET CE :methyl -163:sc= -0.906! (180deg=-2.29!) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 THR OG1 : rot -90:sc= -2! USER MOD Single : A 146 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 147 ASN : amide:sc= -6.47! C(o=-6.5!,f=-8.7!) USER MOD Single : A 148 TYR OH : rot 100:sc= 1.41 USER MOD Single : A 152 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 159 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 161 NAG O3 : rot 158:sc= 0.0291 USER MOD Single : A 161 NAG O4 : rot 160:sc= 0.0297 USER MOD Single : A 161 NAG O6 : rot 4:sc= 0.623 USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 1 8.620 -3.819 22.811 1.00 0.00 N ATOM 2 CA TYR A 1 10.104 -3.774 22.795 1.00 0.00 C ATOM 3 C TYR A 1 10.660 -4.401 21.521 1.00 0.00 C ATOM 4 O TYR A 1 11.125 -5.541 21.530 1.00 0.00 O ATOM 5 CB TYR A 1 10.628 -4.520 24.023 1.00 0.00 C ATOM 6 CG TYR A 1 10.026 -4.044 25.325 1.00 0.00 C ATOM 7 CD1 TYR A 1 10.450 -2.862 25.917 1.00 0.00 C ATOM 8 CD2 TYR A 1 9.033 -4.778 25.962 1.00 0.00 C ATOM 9 CE1 TYR A 1 9.902 -2.423 27.108 1.00 0.00 C ATOM 10 CE2 TYR A 1 8.479 -4.346 27.153 1.00 0.00 C ATOM 11 CZ TYR A 1 8.917 -3.168 27.721 1.00 0.00 C ATOM 12 OH TYR A 1 8.368 -2.735 28.906 1.00 0.00 O ATOM 0 H1 TYR A 1 8.289 -4.018 23.777 1.00 0.00 H new ATOM 0 H2 TYR A 1 8.241 -2.903 22.497 1.00 0.00 H new ATOM 0 H3 TYR A 1 8.288 -4.568 22.170 1.00 0.00 H new ATOM 0 HA TYR A 1 10.431 -2.734 22.819 1.00 0.00 H new ATOM 0 HB2 TYR A 1 10.423 -5.584 23.906 1.00 0.00 H new ATOM 0 HB3 TYR A 1 11.711 -4.407 24.071 1.00 0.00 H new ATOM 0 HD1 TYR A 1 11.221 -2.276 25.439 1.00 0.00 H new ATOM 0 HD2 TYR A 1 8.688 -5.701 25.520 1.00 0.00 H new ATOM 0 HE1 TYR A 1 10.244 -1.501 27.556 1.00 0.00 H new ATOM 0 HE2 TYR A 1 7.708 -4.928 27.636 1.00 0.00 H new ATOM 0 HH TYR A 1 7.687 -3.374 29.204 1.00 0.00 H new ATOM 24 N GLY A 2 10.611 -3.650 20.426 1.00 0.00 N ATOM 25 CA GLY A 2 11.113 -4.148 19.160 1.00 0.00 C ATOM 26 C GLY A 2 10.025 -4.774 18.310 1.00 0.00 C ATOM 27 O GLY A 2 10.279 -5.715 17.558 1.00 0.00 O ATOM 0 H GLY A 2 10.232 -2.704 20.393 1.00 0.00 H new ATOM 0 HA2 GLY A 2 11.575 -3.329 18.608 1.00 0.00 H new ATOM 0 HA3 GLY A 2 11.893 -4.886 19.347 1.00 0.00 H new ATOM 31 N HIS A 3 8.810 -4.249 18.429 1.00 0.00 N ATOM 32 CA HIS A 3 7.678 -4.760 17.665 1.00 0.00 C ATOM 33 C HIS A 3 6.392 -4.033 18.044 1.00 0.00 C ATOM 34 O HIS A 3 6.427 -2.945 18.618 1.00 0.00 O ATOM 35 CB HIS A 3 7.511 -6.263 17.899 1.00 0.00 C ATOM 36 CG HIS A 3 7.046 -6.604 19.279 1.00 0.00 C ATOM 37 ND1 HIS A 3 7.859 -7.189 20.227 1.00 0.00 N ATOM 38 CD2 HIS A 3 5.841 -6.435 19.873 1.00 0.00 C ATOM 39 CE1 HIS A 3 7.173 -7.366 21.343 1.00 0.00 C ATOM 40 NE2 HIS A 3 5.946 -6.917 21.154 1.00 0.00 N ATOM 0 H HIS A 3 8.584 -3.470 19.047 1.00 0.00 H new ATOM 0 HA HIS A 3 7.879 -4.583 16.608 1.00 0.00 H new ATOM 0 HB2 HIS A 3 6.798 -6.658 17.176 1.00 0.00 H new ATOM 0 HB3 HIS A 3 8.463 -6.760 17.712 1.00 0.00 H new ATOM 0 HD1 HIS A 3 8.837 -7.445 20.089 1.00 0.00 H new ATOM 0 HD2 HIS A 3 4.960 -6.001 19.422 1.00 0.00 H new ATOM 0 HE1 HIS A 3 7.552 -7.804 22.255 1.00 0.00 H new ATOM 49 N CYS A 4 5.258 -4.647 17.721 1.00 0.00 N ATOM 50 CA CYS A 4 3.956 -4.065 18.029 1.00 0.00 C ATOM 51 C CYS A 4 2.891 -5.151 18.135 1.00 0.00 C ATOM 52 O CYS A 4 2.572 -5.819 17.151 1.00 0.00 O ATOM 53 CB CYS A 4 3.562 -3.051 16.956 1.00 0.00 C ATOM 54 SG CYS A 4 3.085 -3.800 15.365 1.00 0.00 S ATOM 0 H CYS A 4 5.214 -5.548 17.246 1.00 0.00 H new ATOM 0 HA CYS A 4 4.029 -3.555 18.990 1.00 0.00 H new ATOM 0 HB2 CYS A 4 2.731 -2.450 17.326 1.00 0.00 H new ATOM 0 HB3 CYS A 4 4.397 -2.371 16.789 1.00 0.00 H new ATOM 59 N VAL A 5 2.344 -5.323 19.334 1.00 0.00 N ATOM 60 CA VAL A 5 1.315 -6.331 19.566 1.00 0.00 C ATOM 61 C VAL A 5 -0.069 -5.794 19.218 1.00 0.00 C ATOM 62 O VAL A 5 -0.603 -4.928 19.910 1.00 0.00 O ATOM 63 CB VAL A 5 1.314 -6.809 21.031 1.00 0.00 C ATOM 64 CG1 VAL A 5 0.963 -8.288 21.109 1.00 0.00 C ATOM 65 CG2 VAL A 5 2.660 -6.538 21.686 1.00 0.00 C ATOM 0 H VAL A 5 2.595 -4.778 20.159 1.00 0.00 H new ATOM 0 HA VAL A 5 1.549 -7.175 18.917 1.00 0.00 H new ATOM 0 HB VAL A 5 0.554 -6.248 21.575 1.00 0.00 H new ATOM 0 HG11 VAL A 5 0.967 -8.608 22.151 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -0.027 -8.450 20.683 1.00 0.00 H new ATOM 0 HG13 VAL A 5 1.698 -8.866 20.549 1.00 0.00 H new ATOM 0 HG21 VAL A 5 2.638 -6.883 22.720 1.00 0.00 H new ATOM 0 HG22 VAL A 5 3.442 -7.069 21.143 1.00 0.00 H new ATOM 0 HG23 VAL A 5 2.866 -5.468 21.665 1.00 0.00 H new ATOM 75 N THR A 6 -0.644 -6.314 18.138 1.00 0.00 N ATOM 76 CA THR A 6 -1.966 -5.888 17.695 1.00 0.00 C ATOM 77 C THR A 6 -3.064 -6.630 18.451 1.00 0.00 C ATOM 78 O THR A 6 -3.112 -7.860 18.447 1.00 0.00 O ATOM 79 CB THR A 6 -2.155 -6.117 16.185 1.00 0.00 C ATOM 80 OG1 THR A 6 -2.641 -7.444 15.947 1.00 0.00 O ATOM 81 CG2 THR A 6 -0.845 -5.911 15.438 1.00 0.00 C ATOM 0 H THR A 6 -0.215 -7.031 17.554 1.00 0.00 H new ATOM 0 HA THR A 6 -2.040 -4.821 17.904 1.00 0.00 H new ATOM 0 HB THR A 6 -2.882 -5.392 15.819 1.00 0.00 H new ATOM 0 HG1 THR A 6 -1.900 -8.017 15.657 1.00 0.00 H new ATOM 0 HG21 THR A 6 -1.003 -6.078 14.373 1.00 0.00 H new ATOM 0 HG22 THR A 6 -0.492 -4.892 15.597 1.00 0.00 H new ATOM 0 HG23 THR A 6 -0.100 -6.615 15.809 1.00 0.00 H new ATOM 89 N ASP A 7 -3.945 -5.872 19.095 1.00 0.00 N ATOM 90 CA ASP A 7 -5.045 -6.456 19.854 1.00 0.00 C ATOM 91 C ASP A 7 -5.835 -7.441 18.999 1.00 0.00 C ATOM 92 O ASP A 7 -6.549 -8.298 19.521 1.00 0.00 O ATOM 93 CB ASP A 7 -5.973 -5.357 20.375 1.00 0.00 C ATOM 94 CG ASP A 7 -7.040 -5.894 21.308 1.00 0.00 C ATOM 95 OD1 ASP A 7 -6.717 -6.772 22.136 1.00 0.00 O ATOM 96 OD2 ASP A 7 -8.199 -5.438 21.211 1.00 0.00 O ATOM 0 H ASP A 7 -3.919 -4.852 19.107 1.00 0.00 H new ATOM 0 HA ASP A 7 -4.622 -6.997 20.701 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -5.383 -4.605 20.898 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -6.450 -4.858 19.531 1.00 0.00 H new ATOM 101 N SER A 8 -5.701 -7.314 17.682 1.00 0.00 N ATOM 102 CA SER A 8 -6.402 -8.195 16.756 1.00 0.00 C ATOM 103 C SER A 8 -5.975 -9.644 16.962 1.00 0.00 C ATOM 104 O SER A 8 -6.713 -10.573 16.632 1.00 0.00 O ATOM 105 CB SER A 8 -6.130 -7.771 15.312 1.00 0.00 C ATOM 106 OG SER A 8 -6.432 -6.400 15.117 1.00 0.00 O ATOM 0 H SER A 8 -5.114 -6.610 17.233 1.00 0.00 H new ATOM 0 HA SER A 8 -7.471 -8.117 16.954 1.00 0.00 H new ATOM 0 HB2 SER A 8 -5.084 -7.955 15.067 1.00 0.00 H new ATOM 0 HB3 SER A 8 -6.728 -8.378 14.633 1.00 0.00 H new ATOM 0 HG SER A 8 -6.248 -6.154 14.187 1.00 0.00 H new ATOM 112 N GLY A 9 -4.781 -9.829 17.512 1.00 0.00 N ATOM 113 CA GLY A 9 -4.274 -11.165 17.756 1.00 0.00 C ATOM 114 C GLY A 9 -2.948 -11.419 17.068 1.00 0.00 C ATOM 115 O GLY A 9 -2.542 -12.568 16.893 1.00 0.00 O ATOM 0 H GLY A 9 -4.154 -9.075 17.794 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -4.157 -11.315 18.829 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -5.005 -11.896 17.410 1.00 0.00 H new ATOM 119 N VAL A 10 -2.269 -10.345 16.678 1.00 0.00 N ATOM 120 CA VAL A 10 -0.981 -10.459 16.005 1.00 0.00 C ATOM 121 C VAL A 10 -0.044 -9.330 16.417 1.00 0.00 C ATOM 122 O VAL A 10 -0.469 -8.186 16.581 1.00 0.00 O ATOM 123 CB VAL A 10 -1.143 -10.440 14.474 1.00 0.00 C ATOM 124 CG1 VAL A 10 -0.058 -11.276 13.811 1.00 0.00 C ATOM 125 CG2 VAL A 10 -2.525 -10.934 14.076 1.00 0.00 C ATOM 0 H VAL A 10 -2.589 -9.387 16.817 1.00 0.00 H new ATOM 0 HA VAL A 10 -0.551 -11.414 16.306 1.00 0.00 H new ATOM 0 HB VAL A 10 -1.038 -9.411 14.129 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -0.189 -11.250 12.729 1.00 0.00 H new ATOM 0 HG12 VAL A 10 0.921 -10.871 14.068 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -0.128 -12.306 14.161 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -2.620 -10.913 12.990 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -2.663 -11.955 14.433 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -3.284 -10.289 14.519 1.00 0.00 H new ATOM 135 N VAL A 11 1.233 -9.657 16.584 1.00 0.00 N ATOM 136 CA VAL A 11 2.230 -8.667 16.975 1.00 0.00 C ATOM 137 C VAL A 11 3.245 -8.442 15.861 1.00 0.00 C ATOM 138 O VAL A 11 4.245 -9.153 15.765 1.00 0.00 O ATOM 139 CB VAL A 11 2.969 -9.088 18.262 1.00 0.00 C ATOM 140 CG1 VAL A 11 3.306 -10.569 18.228 1.00 0.00 C ATOM 141 CG2 VAL A 11 4.226 -8.250 18.465 1.00 0.00 C ATOM 0 H VAL A 11 1.602 -10.599 16.455 1.00 0.00 H new ATOM 0 HA VAL A 11 1.696 -7.736 17.166 1.00 0.00 H new ATOM 0 HB VAL A 11 2.305 -8.910 19.108 1.00 0.00 H new ATOM 0 HG11 VAL A 11 3.827 -10.845 19.145 1.00 0.00 H new ATOM 0 HG12 VAL A 11 2.387 -11.149 18.144 1.00 0.00 H new ATOM 0 HG13 VAL A 11 3.946 -10.777 17.371 1.00 0.00 H new ATOM 0 HG21 VAL A 11 4.730 -8.565 19.379 1.00 0.00 H new ATOM 0 HG22 VAL A 11 4.895 -8.387 17.616 1.00 0.00 H new ATOM 0 HG23 VAL A 11 3.953 -7.198 18.546 1.00 0.00 H new ATOM 151 N TYR A 12 2.983 -7.443 15.027 1.00 0.00 N ATOM 152 CA TYR A 12 3.875 -7.116 13.923 1.00 0.00 C ATOM 153 C TYR A 12 5.122 -6.403 14.437 1.00 0.00 C ATOM 154 O TYR A 12 5.397 -6.407 15.637 1.00 0.00 O ATOM 155 CB TYR A 12 3.150 -6.240 12.899 1.00 0.00 C ATOM 156 CG TYR A 12 1.903 -6.882 12.337 1.00 0.00 C ATOM 157 CD1 TYR A 12 1.985 -7.850 11.345 1.00 0.00 C ATOM 158 CD2 TYR A 12 0.644 -6.522 12.801 1.00 0.00 C ATOM 159 CE1 TYR A 12 0.847 -8.441 10.829 1.00 0.00 C ATOM 160 CE2 TYR A 12 -0.499 -7.109 12.291 1.00 0.00 C ATOM 161 CZ TYR A 12 -0.392 -8.067 11.306 1.00 0.00 C ATOM 162 OH TYR A 12 -1.527 -8.653 10.796 1.00 0.00 O ATOM 0 H TYR A 12 2.159 -6.845 15.095 1.00 0.00 H new ATOM 0 HA TYR A 12 4.181 -8.043 13.439 1.00 0.00 H new ATOM 0 HB2 TYR A 12 2.883 -5.292 13.367 1.00 0.00 H new ATOM 0 HB3 TYR A 12 3.832 -6.010 12.080 1.00 0.00 H new ATOM 0 HD1 TYR A 12 2.954 -8.146 10.970 1.00 0.00 H new ATOM 0 HD2 TYR A 12 0.557 -5.771 13.573 1.00 0.00 H new ATOM 0 HE1 TYR A 12 0.928 -9.192 10.057 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -1.471 -6.818 12.662 1.00 0.00 H new ATOM 0 HH TYR A 12 -1.461 -9.627 10.886 1.00 0.00 H new ATOM 172 N SER A 13 5.871 -5.791 13.528 1.00 0.00 N ATOM 173 CA SER A 13 7.086 -5.077 13.902 1.00 0.00 C ATOM 174 C SER A 13 7.079 -3.659 13.344 1.00 0.00 C ATOM 175 O SER A 13 6.308 -3.339 12.439 1.00 0.00 O ATOM 176 CB SER A 13 8.320 -5.829 13.401 1.00 0.00 C ATOM 177 OG SER A 13 8.823 -6.705 14.395 1.00 0.00 O ATOM 0 H SER A 13 5.660 -5.774 12.530 1.00 0.00 H new ATOM 0 HA SER A 13 7.122 -5.019 14.990 1.00 0.00 H new ATOM 0 HB2 SER A 13 8.065 -6.397 12.507 1.00 0.00 H new ATOM 0 HB3 SER A 13 9.093 -5.116 13.116 1.00 0.00 H new ATOM 0 HG SER A 13 9.745 -6.456 14.614 1.00 0.00 H new ATOM 183 N VAL A 14 7.943 -2.812 13.893 1.00 0.00 N ATOM 184 CA VAL A 14 8.042 -1.429 13.457 1.00 0.00 C ATOM 185 C VAL A 14 8.264 -1.339 11.953 1.00 0.00 C ATOM 186 O VAL A 14 8.324 -2.357 11.264 1.00 0.00 O ATOM 187 CB VAL A 14 9.186 -0.707 14.185 1.00 0.00 C ATOM 188 CG1 VAL A 14 9.035 -0.867 15.688 1.00 0.00 C ATOM 189 CG2 VAL A 14 10.535 -1.230 13.717 1.00 0.00 C ATOM 0 H VAL A 14 8.586 -3.063 14.644 1.00 0.00 H new ATOM 0 HA VAL A 14 7.097 -0.944 13.702 1.00 0.00 H new ATOM 0 HB VAL A 14 9.136 0.355 13.945 1.00 0.00 H new ATOM 0 HG11 VAL A 14 9.852 -0.351 16.193 1.00 0.00 H new ATOM 0 HG12 VAL A 14 8.084 -0.439 16.006 1.00 0.00 H new ATOM 0 HG13 VAL A 14 9.061 -1.926 15.946 1.00 0.00 H new ATOM 0 HG21 VAL A 14 11.332 -0.706 14.245 1.00 0.00 H new ATOM 0 HG22 VAL A 14 10.603 -2.298 13.925 1.00 0.00 H new ATOM 0 HG23 VAL A 14 10.638 -1.062 12.645 1.00 0.00 H new ATOM 199 N GLY A 15 8.381 -0.114 11.447 1.00 0.00 N ATOM 200 CA GLY A 15 8.587 0.081 10.026 1.00 0.00 C ATOM 201 C GLY A 15 7.820 -0.928 9.196 1.00 0.00 C ATOM 202 O GLY A 15 8.262 -1.319 8.116 1.00 0.00 O ATOM 0 H GLY A 15 8.337 0.744 11.996 1.00 0.00 H new ATOM 0 HA2 GLY A 15 8.276 1.089 9.750 1.00 0.00 H new ATOM 0 HA3 GLY A 15 9.650 0.002 9.800 1.00 0.00 H new ATOM 206 N MET A 16 6.669 -1.357 9.709 1.00 0.00 N ATOM 207 CA MET A 16 5.843 -2.336 9.009 1.00 0.00 C ATOM 208 C MET A 16 4.400 -1.857 8.894 1.00 0.00 C ATOM 209 O MET A 16 3.768 -1.516 9.893 1.00 0.00 O ATOM 210 CB MET A 16 5.888 -3.682 9.734 1.00 0.00 C ATOM 211 CG MET A 16 5.381 -4.842 8.894 1.00 0.00 C ATOM 212 SD MET A 16 5.336 -6.395 9.810 1.00 0.00 S ATOM 213 CE MET A 16 6.397 -7.418 8.793 1.00 0.00 C ATOM 0 H MET A 16 6.289 -1.044 10.602 1.00 0.00 H new ATOM 0 HA MET A 16 6.245 -2.456 8.003 1.00 0.00 H new ATOM 0 HB2 MET A 16 6.914 -3.887 10.039 1.00 0.00 H new ATOM 0 HB3 MET A 16 5.292 -3.615 10.644 1.00 0.00 H new ATOM 0 HG2 MET A 16 4.380 -4.611 8.529 1.00 0.00 H new ATOM 0 HG3 MET A 16 6.021 -4.959 8.019 1.00 0.00 H new ATOM 0 HE1 MET A 16 6.869 -8.181 9.412 1.00 0.00 H new ATOM 0 HE2 MET A 16 5.803 -7.898 8.015 1.00 0.00 H new ATOM 0 HE3 MET A 16 7.166 -6.799 8.331 1.00 0.00 H new ATOM 223 N GLN A 17 3.884 -1.838 7.668 1.00 0.00 N ATOM 224 CA GLN A 17 2.515 -1.402 7.419 1.00 0.00 C ATOM 225 C GLN A 17 1.594 -2.596 7.185 1.00 0.00 C ATOM 226 O GLN A 17 2.055 -3.725 7.016 1.00 0.00 O ATOM 227 CB GLN A 17 2.469 -0.467 6.209 1.00 0.00 C ATOM 228 CG GLN A 17 3.796 0.210 5.912 1.00 0.00 C ATOM 229 CD GLN A 17 3.763 1.023 4.633 1.00 0.00 C ATOM 230 OE1 GLN A 17 3.800 0.472 3.532 1.00 0.00 O ATOM 231 NE2 GLN A 17 3.693 2.342 4.772 1.00 0.00 N ATOM 0 H GLN A 17 4.395 -2.120 6.831 1.00 0.00 H new ATOM 0 HA GLN A 17 2.167 -0.865 8.302 1.00 0.00 H new ATOM 0 HB2 GLN A 17 2.157 -1.035 5.333 1.00 0.00 H new ATOM 0 HB3 GLN A 17 1.711 0.297 6.380 1.00 0.00 H new ATOM 0 HG2 GLN A 17 4.062 0.861 6.745 1.00 0.00 H new ATOM 0 HG3 GLN A 17 4.577 -0.547 5.837 1.00 0.00 H new ATOM 0 HE21 GLN A 17 3.664 2.756 5.704 1.00 0.00 H new ATOM 0 HE22 GLN A 17 3.668 2.941 3.947 1.00 0.00 H new ATOM 240 N TRP A 18 0.290 -2.336 7.172 1.00 0.00 N ATOM 241 CA TRP A 18 -0.699 -3.386 6.955 1.00 0.00 C ATOM 242 C TRP A 18 -2.102 -2.796 6.844 1.00 0.00 C ATOM 243 O TRP A 18 -2.450 -1.859 7.562 1.00 0.00 O ATOM 244 CB TRP A 18 -0.652 -4.409 8.091 1.00 0.00 C ATOM 245 CG TRP A 18 -1.241 -3.905 9.372 1.00 0.00 C ATOM 246 CD1 TRP A 18 -2.527 -4.063 9.804 1.00 0.00 C ATOM 247 CD2 TRP A 18 -0.565 -3.159 10.389 1.00 0.00 C ATOM 248 NE1 TRP A 18 -2.691 -3.461 11.028 1.00 0.00 N ATOM 249 CE2 TRP A 18 -1.500 -2.899 11.408 1.00 0.00 C ATOM 250 CE3 TRP A 18 0.742 -2.688 10.536 1.00 0.00 C ATOM 251 CZ2 TRP A 18 -1.167 -2.188 12.559 1.00 0.00 C ATOM 252 CZ3 TRP A 18 1.069 -1.983 11.677 1.00 0.00 C ATOM 253 CH2 TRP A 18 0.120 -1.739 12.676 1.00 0.00 C ATOM 0 H TRP A 18 -0.106 -1.406 7.309 1.00 0.00 H new ATOM 0 HA TRP A 18 -0.458 -3.887 6.018 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -1.187 -5.307 7.783 1.00 0.00 H new ATOM 0 HB3 TRP A 18 0.384 -4.699 8.266 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -3.302 -4.585 9.262 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -3.557 -3.436 11.566 1.00 0.00 H new ATOM 0 HE3 TRP A 18 1.482 -2.872 9.772 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -1.898 -1.998 13.331 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 2.076 -1.613 11.801 1.00 0.00 H new ATOM 0 HH2 TRP A 18 0.409 -1.185 13.557 1.00 0.00 H new ATOM 264 N LEU A 19 -2.902 -3.351 5.939 1.00 0.00 N ATOM 265 CA LEU A 19 -4.267 -2.880 5.733 1.00 0.00 C ATOM 266 C LEU A 19 -5.189 -3.383 6.839 1.00 0.00 C ATOM 267 O LEU A 19 -5.027 -4.496 7.336 1.00 0.00 O ATOM 268 CB LEU A 19 -4.787 -3.339 4.370 1.00 0.00 C ATOM 269 CG LEU A 19 -6.084 -2.669 3.914 1.00 0.00 C ATOM 270 CD1 LEU A 19 -5.871 -1.176 3.716 1.00 0.00 C ATOM 271 CD2 LEU A 19 -6.594 -3.313 2.633 1.00 0.00 C ATOM 0 H LEU A 19 -2.629 -4.127 5.337 1.00 0.00 H new ATOM 0 HA LEU A 19 -4.257 -1.790 5.761 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -4.017 -3.152 3.622 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -4.944 -4.417 4.402 1.00 0.00 H new ATOM 0 HG LEU A 19 -6.836 -2.808 4.690 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -6.804 -0.715 3.392 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -5.552 -0.726 4.656 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -5.104 -1.015 2.958 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -7.517 -2.824 2.323 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -5.845 -3.205 1.848 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -6.785 -4.372 2.809 1.00 0.00 H new ATOM 283 N LYS A 20 -6.157 -2.554 7.217 1.00 0.00 N ATOM 284 CA LYS A 20 -7.106 -2.915 8.263 1.00 0.00 C ATOM 285 C LYS A 20 -8.363 -2.055 8.178 1.00 0.00 C ATOM 286 O LYS A 20 -8.288 -0.853 7.924 1.00 0.00 O ATOM 287 CB LYS A 20 -6.462 -2.760 9.642 1.00 0.00 C ATOM 288 CG LYS A 20 -5.429 -1.648 9.709 1.00 0.00 C ATOM 289 CD LYS A 20 -6.075 -0.305 10.012 1.00 0.00 C ATOM 290 CE LYS A 20 -6.318 -0.125 11.501 1.00 0.00 C ATOM 291 NZ LYS A 20 -7.312 -1.101 12.024 1.00 0.00 N ATOM 0 H LYS A 20 -6.304 -1.628 6.815 1.00 0.00 H new ATOM 0 HA LYS A 20 -7.389 -3.957 8.117 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -7.242 -2.565 10.378 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -5.989 -3.702 9.921 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -4.692 -1.880 10.478 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -4.893 -1.590 8.761 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -5.434 0.498 9.648 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -7.021 -0.226 9.476 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -5.377 -0.242 12.039 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -6.670 0.889 11.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -7.690 -0.760 12.931 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -8.090 -1.204 11.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -6.852 -2.023 12.166 1.00 0.00 H new ATOM 305 N THR A 21 -9.517 -2.679 8.391 1.00 0.00 N ATOM 306 CA THR A 21 -10.790 -1.971 8.338 1.00 0.00 C ATOM 307 C THR A 21 -11.072 -1.248 9.651 1.00 0.00 C ATOM 308 O THR A 21 -11.494 -1.862 10.631 1.00 0.00 O ATOM 309 CB THR A 21 -11.954 -2.930 8.034 1.00 0.00 C ATOM 310 OG1 THR A 21 -11.554 -4.283 8.284 1.00 0.00 O ATOM 311 CG2 THR A 21 -12.409 -2.790 6.589 1.00 0.00 C ATOM 0 H THR A 21 -9.596 -3.674 8.602 1.00 0.00 H new ATOM 0 HA THR A 21 -10.712 -1.240 7.533 1.00 0.00 H new ATOM 0 HB THR A 21 -12.787 -2.671 8.687 1.00 0.00 H new ATOM 0 HG1 THR A 21 -12.301 -4.886 8.090 1.00 0.00 H new ATOM 0 HG21 THR A 21 -13.233 -3.478 6.399 1.00 0.00 H new ATOM 0 HG22 THR A 21 -12.742 -1.768 6.410 1.00 0.00 H new ATOM 0 HG23 THR A 21 -11.579 -3.024 5.922 1.00 0.00 H new ATOM 319 N GLN A 22 -10.835 0.059 9.664 1.00 0.00 N ATOM 320 CA GLN A 22 -11.063 0.867 10.856 1.00 0.00 C ATOM 321 C GLN A 22 -12.541 1.213 11.003 1.00 0.00 C ATOM 322 O GLN A 22 -12.901 2.379 11.170 1.00 0.00 O ATOM 323 CB GLN A 22 -10.230 2.148 10.799 1.00 0.00 C ATOM 324 CG GLN A 22 -9.325 2.339 12.004 1.00 0.00 C ATOM 325 CD GLN A 22 -10.029 3.025 13.159 1.00 0.00 C ATOM 326 OE1 GLN A 22 -10.010 4.250 13.274 1.00 0.00 O ATOM 327 NE2 GLN A 22 -10.655 2.234 14.023 1.00 0.00 N ATOM 0 H GLN A 22 -10.485 0.582 8.861 1.00 0.00 H new ATOM 0 HA GLN A 22 -10.756 0.283 11.724 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -9.620 2.135 9.896 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -10.900 3.004 10.719 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -8.955 1.368 12.334 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -8.456 2.928 11.711 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -10.645 1.223 13.889 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -11.146 2.638 14.821 1.00 0.00 H new ATOM 336 N GLY A 23 -13.393 0.195 10.940 1.00 0.00 N ATOM 337 CA GLY A 23 -14.822 0.413 11.068 1.00 0.00 C ATOM 338 C GLY A 23 -15.593 -0.072 9.856 1.00 0.00 C ATOM 339 O GLY A 23 -16.056 -1.211 9.823 1.00 0.00 O ATOM 0 H GLY A 23 -13.119 -0.778 10.802 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -15.187 -0.102 11.957 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -15.013 1.476 11.215 1.00 0.00 H new ATOM 343 N ASN A 24 -15.731 0.795 8.859 1.00 0.00 N ATOM 344 CA ASN A 24 -16.453 0.449 7.640 1.00 0.00 C ATOM 345 C ASN A 24 -15.739 1.001 6.410 1.00 0.00 C ATOM 346 O ASN A 24 -16.362 1.253 5.379 1.00 0.00 O ATOM 347 CB ASN A 24 -17.883 0.988 7.698 1.00 0.00 C ATOM 348 CG ASN A 24 -18.921 -0.110 7.569 1.00 0.00 C ATOM 349 OD1 ASN A 24 -18.866 -0.926 6.649 1.00 0.00 O ATOM 350 ND2 ASN A 24 -19.875 -0.135 8.492 1.00 0.00 N ATOM 0 H ASN A 24 -15.353 1.742 8.871 1.00 0.00 H new ATOM 0 HA ASN A 24 -16.485 -0.638 7.563 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -18.031 1.516 8.640 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -18.027 1.716 6.899 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -20.601 -0.851 8.456 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -19.882 0.561 9.237 1.00 0.00 H new ATOM 357 N LYS A 25 -14.428 1.186 6.527 1.00 0.00 N ATOM 358 CA LYS A 25 -13.629 1.708 5.424 1.00 0.00 C ATOM 359 C LYS A 25 -12.199 1.179 5.490 1.00 0.00 C ATOM 360 O LYS A 25 -11.765 0.663 6.519 1.00 0.00 O ATOM 361 CB LYS A 25 -13.620 3.237 5.452 1.00 0.00 C ATOM 362 CG LYS A 25 -14.048 3.825 6.787 1.00 0.00 C ATOM 363 CD LYS A 25 -13.995 5.343 6.772 1.00 0.00 C ATOM 364 CE LYS A 25 -12.906 5.873 7.689 1.00 0.00 C ATOM 365 NZ LYS A 25 -13.447 6.807 8.715 1.00 0.00 N ATOM 0 H LYS A 25 -13.897 0.982 7.374 1.00 0.00 H new ATOM 0 HA LYS A 25 -14.080 1.371 4.491 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -12.617 3.590 5.214 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -14.283 3.610 4.671 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -15.061 3.498 7.021 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -13.400 3.445 7.577 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -13.817 5.691 5.755 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -14.960 5.745 7.082 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -12.411 5.038 8.184 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -12.149 6.386 7.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -12.672 7.145 9.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -13.897 7.617 8.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -14.150 6.311 9.299 1.00 0.00 H new ATOM 379 N GLN A 26 -11.473 1.313 4.385 1.00 0.00 N ATOM 380 CA GLN A 26 -10.092 0.848 4.318 1.00 0.00 C ATOM 381 C GLN A 26 -9.142 1.879 4.920 1.00 0.00 C ATOM 382 O GLN A 26 -9.106 3.032 4.489 1.00 0.00 O ATOM 383 CB GLN A 26 -9.699 0.562 2.868 1.00 0.00 C ATOM 384 CG GLN A 26 -9.440 -0.910 2.587 1.00 0.00 C ATOM 385 CD GLN A 26 -10.615 -1.791 2.965 1.00 0.00 C ATOM 386 OE1 GLN A 26 -10.440 -2.948 3.349 1.00 0.00 O ATOM 387 NE2 GLN A 26 -11.822 -1.247 2.859 1.00 0.00 N ATOM 0 H GLN A 26 -11.817 1.739 3.525 1.00 0.00 H new ATOM 0 HA GLN A 26 -10.016 -0.073 4.897 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -10.492 0.915 2.209 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -8.803 1.133 2.624 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -9.219 -1.040 1.528 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -8.557 -1.232 3.139 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -11.921 -0.284 2.536 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -12.650 -1.792 3.100 1.00 0.00 H new ATOM 396 N MET A 27 -8.375 1.455 5.919 1.00 0.00 N ATOM 397 CA MET A 27 -7.423 2.341 6.580 1.00 0.00 C ATOM 398 C MET A 27 -6.088 1.637 6.801 1.00 0.00 C ATOM 399 O MET A 27 -6.036 0.540 7.356 1.00 0.00 O ATOM 400 CB MET A 27 -7.988 2.820 7.920 1.00 0.00 C ATOM 401 CG MET A 27 -8.642 4.190 7.849 1.00 0.00 C ATOM 402 SD MET A 27 -8.001 5.331 9.088 1.00 0.00 S ATOM 403 CE MET A 27 -6.318 5.544 8.513 1.00 0.00 C ATOM 0 H MET A 27 -8.394 0.504 6.288 1.00 0.00 H new ATOM 0 HA MET A 27 -7.256 3.203 5.934 1.00 0.00 H new ATOM 0 HB2 MET A 27 -8.720 2.095 8.276 1.00 0.00 H new ATOM 0 HB3 MET A 27 -7.184 2.848 8.655 1.00 0.00 H new ATOM 0 HG2 MET A 27 -8.485 4.612 6.856 1.00 0.00 H new ATOM 0 HG3 MET A 27 -9.718 4.082 7.983 1.00 0.00 H new ATOM 0 HE1 MET A 27 -6.037 6.594 8.591 1.00 0.00 H new ATOM 0 HE2 MET A 27 -5.646 4.942 9.124 1.00 0.00 H new ATOM 0 HE3 MET A 27 -6.246 5.225 7.473 1.00 0.00 H new ATOM 413 N LEU A 28 -5.009 2.278 6.361 1.00 0.00 N ATOM 414 CA LEU A 28 -3.672 1.714 6.511 1.00 0.00 C ATOM 415 C LEU A 28 -3.171 1.877 7.941 1.00 0.00 C ATOM 416 O LEU A 28 -3.639 2.745 8.678 1.00 0.00 O ATOM 417 CB LEU A 28 -2.699 2.386 5.541 1.00 0.00 C ATOM 418 CG LEU A 28 -2.940 2.081 4.061 1.00 0.00 C ATOM 419 CD1 LEU A 28 -2.087 0.903 3.614 1.00 0.00 C ATOM 420 CD2 LEU A 28 -4.414 1.803 3.804 1.00 0.00 C ATOM 0 H LEU A 28 -5.034 3.187 5.899 1.00 0.00 H new ATOM 0 HA LEU A 28 -3.727 0.650 6.281 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -2.753 3.465 5.687 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -1.685 2.080 5.798 1.00 0.00 H new ATOM 0 HG LEU A 28 -2.651 2.956 3.478 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -2.271 0.700 2.559 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.033 1.141 3.759 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -2.345 0.023 4.203 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -4.565 1.588 2.746 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -4.731 0.945 4.397 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -5.003 2.676 4.085 1.00 0.00 H new ATOM 432 N CYS A 29 -2.215 1.038 8.328 1.00 0.00 N ATOM 433 CA CYS A 29 -1.649 1.090 9.670 1.00 0.00 C ATOM 434 C CYS A 29 -0.244 0.498 9.689 1.00 0.00 C ATOM 435 O CYS A 29 -0.024 -0.616 9.215 1.00 0.00 O ATOM 436 CB CYS A 29 -2.547 0.340 10.655 1.00 0.00 C ATOM 437 SG CYS A 29 -3.190 1.374 12.012 1.00 0.00 S ATOM 0 H CYS A 29 -1.816 0.314 7.730 1.00 0.00 H new ATOM 0 HA CYS A 29 -1.587 2.135 9.972 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -3.388 -0.089 10.110 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -1.986 -0.492 11.081 1.00 0.00 H new ATOM 442 N THR A 30 0.704 1.251 10.237 1.00 0.00 N ATOM 443 CA THR A 30 2.088 0.797 10.313 1.00 0.00 C ATOM 444 C THR A 30 2.655 0.973 11.716 1.00 0.00 C ATOM 445 O THR A 30 2.351 1.947 12.403 1.00 0.00 O ATOM 446 CB THR A 30 2.986 1.559 9.320 1.00 0.00 C ATOM 447 OG1 THR A 30 2.460 1.443 7.993 1.00 0.00 O ATOM 448 CG2 THR A 30 4.410 1.023 9.356 1.00 0.00 C ATOM 0 H THR A 30 0.540 2.176 10.634 1.00 0.00 H new ATOM 0 HA THR A 30 2.081 -0.262 10.055 1.00 0.00 H new ATOM 0 HB THR A 30 3.002 2.609 9.612 1.00 0.00 H new ATOM 0 HG1 THR A 30 2.677 2.251 7.483 1.00 0.00 H new ATOM 0 HG21 THR A 30 5.025 1.577 8.647 1.00 0.00 H new ATOM 0 HG22 THR A 30 4.818 1.141 10.360 1.00 0.00 H new ATOM 0 HG23 THR A 30 4.408 -0.033 9.087 1.00 0.00 H new ATOM 456 N CYS A 31 3.490 0.027 12.128 1.00 0.00 N ATOM 457 CA CYS A 31 4.114 0.078 13.442 1.00 0.00 C ATOM 458 C CYS A 31 5.492 0.718 13.345 1.00 0.00 C ATOM 459 O CYS A 31 6.236 0.462 12.398 1.00 0.00 O ATOM 460 CB CYS A 31 4.232 -1.329 14.033 1.00 0.00 C ATOM 461 SG CYS A 31 2.642 -2.202 14.196 1.00 0.00 S ATOM 0 H CYS A 31 3.750 -0.786 11.569 1.00 0.00 H new ATOM 0 HA CYS A 31 3.488 0.682 14.099 1.00 0.00 H new ATOM 0 HB2 CYS A 31 4.897 -1.921 13.404 1.00 0.00 H new ATOM 0 HB3 CYS A 31 4.699 -1.261 15.015 1.00 0.00 H new ATOM 466 N LEU A 32 5.825 1.554 14.322 1.00 0.00 N ATOM 467 CA LEU A 32 7.115 2.232 14.335 1.00 0.00 C ATOM 468 C LEU A 32 7.661 2.343 15.756 1.00 0.00 C ATOM 469 O LEU A 32 8.583 3.115 16.018 1.00 0.00 O ATOM 470 CB LEU A 32 6.985 3.625 13.716 1.00 0.00 C ATOM 471 CG LEU A 32 6.535 3.641 12.253 1.00 0.00 C ATOM 472 CD1 LEU A 32 5.286 4.494 12.087 1.00 0.00 C ATOM 473 CD2 LEU A 32 7.655 4.151 11.357 1.00 0.00 C ATOM 0 H LEU A 32 5.221 1.778 15.113 1.00 0.00 H new ATOM 0 HA LEU A 32 7.814 1.640 13.744 1.00 0.00 H new ATOM 0 HB2 LEU A 32 6.274 4.204 14.306 1.00 0.00 H new ATOM 0 HB3 LEU A 32 7.948 4.131 13.790 1.00 0.00 H new ATOM 0 HG LEU A 32 6.294 2.620 11.955 1.00 0.00 H new ATOM 0 HD11 LEU A 32 4.981 4.493 11.040 1.00 0.00 H new ATOM 0 HD12 LEU A 32 4.482 4.085 12.699 1.00 0.00 H new ATOM 0 HD13 LEU A 32 5.499 5.516 12.402 1.00 0.00 H new ATOM 0 HD21 LEU A 32 7.318 4.156 10.320 1.00 0.00 H new ATOM 0 HD22 LEU A 32 7.927 5.164 11.655 1.00 0.00 H new ATOM 0 HD23 LEU A 32 8.523 3.499 11.453 1.00 0.00 H new ATOM 485 N GLY A 33 7.086 1.567 16.668 1.00 0.00 N ATOM 486 CA GLY A 33 7.529 1.594 18.049 1.00 0.00 C ATOM 487 C GLY A 33 6.844 2.678 18.859 1.00 0.00 C ATOM 488 O GLY A 33 6.526 2.478 20.031 1.00 0.00 O ATOM 0 H GLY A 33 6.321 0.920 16.476 1.00 0.00 H new ATOM 0 HA2 GLY A 33 7.335 0.625 18.508 1.00 0.00 H new ATOM 0 HA3 GLY A 33 8.607 1.750 18.078 1.00 0.00 H new ATOM 492 N ASN A 34 6.615 3.827 18.232 1.00 0.00 N ATOM 493 CA ASN A 34 5.962 4.945 18.902 1.00 0.00 C ATOM 494 C ASN A 34 4.465 4.691 19.049 1.00 0.00 C ATOM 495 O ASN A 34 3.845 5.123 20.022 1.00 0.00 O ATOM 496 CB ASN A 34 6.197 6.241 18.124 1.00 0.00 C ATOM 497 CG ASN A 34 7.559 6.845 18.404 1.00 0.00 C ATOM 498 OD1 ASN A 34 8.438 6.848 17.541 1.00 0.00 O ATOM 499 ND2 ASN A 34 7.741 7.359 19.614 1.00 0.00 N ATOM 0 H ASN A 34 6.872 4.008 17.262 1.00 0.00 H new ATOM 0 HA ASN A 34 6.396 5.043 19.897 1.00 0.00 H new ATOM 0 HB2 ASN A 34 6.103 6.043 17.056 1.00 0.00 H new ATOM 0 HB3 ASN A 34 5.422 6.963 18.383 1.00 0.00 H new ATOM 0 HD21 ASN A 34 8.638 7.779 19.860 1.00 0.00 H new ATOM 0 HD22 ASN A 34 6.984 7.335 20.298 1.00 0.00 H new ATOM 506 N GLY A 35 3.892 3.987 18.080 1.00 0.00 N ATOM 507 CA GLY A 35 2.472 3.688 18.122 1.00 0.00 C ATOM 508 C GLY A 35 1.896 3.409 16.747 1.00 0.00 C ATOM 509 O GLY A 35 1.990 4.241 15.846 1.00 0.00 O ATOM 0 H GLY A 35 4.384 3.618 17.266 1.00 0.00 H new ATOM 0 HA2 GLY A 35 2.305 2.824 18.765 1.00 0.00 H new ATOM 0 HA3 GLY A 35 1.941 4.527 18.572 1.00 0.00 H new ATOM 513 N VAL A 36 1.295 2.233 16.588 1.00 0.00 N ATOM 514 CA VAL A 36 0.700 1.846 15.316 1.00 0.00 C ATOM 515 C VAL A 36 0.004 3.032 14.653 1.00 0.00 C ATOM 516 O VAL A 36 -1.120 3.383 15.010 1.00 0.00 O ATOM 517 CB VAL A 36 -0.318 0.702 15.496 1.00 0.00 C ATOM 518 CG1 VAL A 36 -1.143 0.510 14.233 1.00 0.00 C ATOM 519 CG2 VAL A 36 0.391 -0.589 15.878 1.00 0.00 C ATOM 0 H VAL A 36 1.208 1.533 17.325 1.00 0.00 H new ATOM 0 HA VAL A 36 1.513 1.501 14.678 1.00 0.00 H new ATOM 0 HB VAL A 36 -0.996 0.973 16.305 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -1.854 -0.302 14.383 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -1.684 1.429 14.008 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -0.483 0.265 13.401 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -0.344 -1.385 16.001 1.00 0.00 H new ATOM 0 HG22 VAL A 36 1.095 -0.863 15.093 1.00 0.00 H new ATOM 0 HG23 VAL A 36 0.930 -0.445 16.815 1.00 0.00 H new ATOM 529 N SER A 37 0.680 3.644 13.686 1.00 0.00 N ATOM 530 CA SER A 37 0.126 4.790 12.973 1.00 0.00 C ATOM 531 C SER A 37 -0.786 4.335 11.839 1.00 0.00 C ATOM 532 O SER A 37 -0.401 3.504 11.017 1.00 0.00 O ATOM 533 CB SER A 37 1.251 5.666 12.420 1.00 0.00 C ATOM 534 OG SER A 37 2.411 4.898 12.151 1.00 0.00 O ATOM 0 H SER A 37 1.612 3.366 13.378 1.00 0.00 H new ATOM 0 HA SER A 37 -0.465 5.374 13.678 1.00 0.00 H new ATOM 0 HB2 SER A 37 0.917 6.158 11.507 1.00 0.00 H new ATOM 0 HB3 SER A 37 1.490 6.452 13.137 1.00 0.00 H new ATOM 0 HG SER A 37 2.154 4.059 11.714 1.00 0.00 H new ATOM 540 N CYS A 38 -1.995 4.886 11.800 1.00 0.00 N ATOM 541 CA CYS A 38 -2.962 4.535 10.765 1.00 0.00 C ATOM 542 C CYS A 38 -3.174 5.696 9.800 1.00 0.00 C ATOM 543 O CYS A 38 -3.304 6.847 10.216 1.00 0.00 O ATOM 544 CB CYS A 38 -4.295 4.133 11.400 1.00 0.00 C ATOM 545 SG CYS A 38 -4.736 2.381 11.164 1.00 0.00 S ATOM 0 H CYS A 38 -2.329 5.577 12.472 1.00 0.00 H new ATOM 0 HA CYS A 38 -2.565 3.690 10.203 1.00 0.00 H new ATOM 0 HB2 CYS A 38 -4.254 4.345 12.468 1.00 0.00 H new ATOM 0 HB3 CYS A 38 -5.086 4.755 10.981 1.00 0.00 H new ATOM 550 N GLN A 39 -3.207 5.385 8.506 1.00 0.00 N ATOM 551 CA GLN A 39 -3.403 6.404 7.481 1.00 0.00 C ATOM 552 C GLN A 39 -4.396 5.927 6.425 1.00 0.00 C ATOM 553 O GLN A 39 -4.378 4.764 6.022 1.00 0.00 O ATOM 554 CB GLN A 39 -2.069 6.757 6.821 1.00 0.00 C ATOM 555 CG GLN A 39 -1.264 7.790 7.593 1.00 0.00 C ATOM 556 CD GLN A 39 0.217 7.469 7.623 1.00 0.00 C ATOM 557 OE1 GLN A 39 0.720 6.719 6.787 1.00 0.00 O ATOM 558 NE2 GLN A 39 0.925 8.036 8.593 1.00 0.00 N ATOM 0 H GLN A 39 -3.101 4.437 8.144 1.00 0.00 H new ATOM 0 HA GLN A 39 -3.809 7.294 7.961 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -1.474 5.850 6.715 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -2.259 7.133 5.816 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -1.411 8.771 7.142 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -1.640 7.850 8.614 1.00 0.00 H new ATOM 0 HE21 GLN A 39 0.467 8.652 9.265 1.00 0.00 H new ATOM 0 HE22 GLN A 39 1.926 7.856 8.666 1.00 0.00 H new ATOM 567 N GLU A 40 -5.261 6.833 5.981 1.00 0.00 N ATOM 568 CA GLU A 40 -6.261 6.505 4.972 1.00 0.00 C ATOM 569 C GLU A 40 -5.618 5.815 3.773 1.00 0.00 C ATOM 570 O GLU A 40 -4.459 6.070 3.446 1.00 0.00 O ATOM 571 CB GLU A 40 -6.990 7.770 4.516 1.00 0.00 C ATOM 572 CG GLU A 40 -8.286 8.029 5.268 1.00 0.00 C ATOM 573 CD GLU A 40 -8.683 9.491 5.260 1.00 0.00 C ATOM 574 OE1 GLU A 40 -7.823 10.338 4.940 1.00 0.00 O ATOM 575 OE2 GLU A 40 -9.854 9.791 5.574 1.00 0.00 O ATOM 0 H GLU A 40 -5.289 7.800 6.304 1.00 0.00 H new ATOM 0 HA GLU A 40 -6.981 5.820 5.420 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -6.328 8.627 4.643 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -7.207 7.690 3.451 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -9.085 7.437 4.822 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -8.177 7.692 6.299 1.00 0.00 H new ATOM 582 N THR A 41 -6.377 4.941 3.121 1.00 0.00 N ATOM 583 CA THR A 41 -5.882 4.215 1.958 1.00 0.00 C ATOM 584 C THR A 41 -5.011 5.109 1.083 1.00 0.00 C ATOM 585 O THR A 41 -4.064 4.641 0.449 1.00 0.00 O ATOM 586 CB THR A 41 -7.039 3.657 1.110 1.00 0.00 C ATOM 587 OG1 THR A 41 -8.278 4.251 1.516 1.00 0.00 O ATOM 588 CG2 THR A 41 -7.130 2.144 1.246 1.00 0.00 C ATOM 0 H THR A 41 -7.338 4.718 3.379 1.00 0.00 H new ATOM 0 HA THR A 41 -5.284 3.385 2.334 1.00 0.00 H new ATOM 0 HB THR A 41 -6.844 3.902 0.066 1.00 0.00 H new ATOM 0 HG1 THR A 41 -9.008 3.891 0.970 1.00 0.00 H new ATOM 0 HG21 THR A 41 -7.955 1.773 0.638 1.00 0.00 H new ATOM 0 HG22 THR A 41 -6.198 1.692 0.908 1.00 0.00 H new ATOM 0 HG23 THR A 41 -7.303 1.882 2.290 1.00 0.00 H new ATOM 596 N ALA A 42 -5.337 6.397 1.050 1.00 0.00 N ATOM 597 CA ALA A 42 -4.583 7.356 0.252 1.00 0.00 C ATOM 598 C ALA A 42 -3.343 7.836 0.997 1.00 0.00 C ATOM 599 O ALA A 42 -3.443 8.553 1.993 1.00 0.00 O ATOM 600 CB ALA A 42 -5.465 8.537 -0.123 1.00 0.00 C ATOM 0 H ALA A 42 -6.118 6.800 1.567 1.00 0.00 H new ATOM 0 HA ALA A 42 -4.256 6.856 -0.659 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -4.890 9.246 -0.719 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -6.318 8.184 -0.702 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -5.820 9.028 0.783 1.00 0.00 H new ATOM 606 N VAL A 43 -2.174 7.437 0.507 1.00 0.00 N ATOM 607 CA VAL A 43 -0.913 7.826 1.127 1.00 0.00 C ATOM 608 C VAL A 43 0.235 7.757 0.127 1.00 0.00 C ATOM 609 O VAL A 43 1.288 7.188 0.414 1.00 0.00 O ATOM 610 CB VAL A 43 -0.579 6.930 2.335 1.00 0.00 C ATOM 611 CG1 VAL A 43 0.433 7.612 3.242 1.00 0.00 C ATOM 612 CG2 VAL A 43 -1.843 6.578 3.104 1.00 0.00 C ATOM 0 H VAL A 43 -2.074 6.845 -0.317 1.00 0.00 H new ATOM 0 HA VAL A 43 -1.034 8.854 1.469 1.00 0.00 H new ATOM 0 HB VAL A 43 -0.136 6.005 1.967 1.00 0.00 H new ATOM 0 HG11 VAL A 43 0.657 6.964 4.090 1.00 0.00 H new ATOM 0 HG12 VAL A 43 1.348 7.808 2.683 1.00 0.00 H new ATOM 0 HG13 VAL A 43 0.021 8.554 3.604 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -1.588 5.945 3.954 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -2.317 7.492 3.462 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -2.531 6.045 2.448 1.00 0.00 H new ATOM 622 N THR A 44 0.026 8.341 -1.048 1.00 0.00 N ATOM 623 CA THR A 44 1.044 8.347 -2.091 1.00 0.00 C ATOM 624 C THR A 44 1.772 9.685 -2.142 1.00 0.00 C ATOM 625 O THR A 44 1.147 10.746 -2.109 1.00 0.00 O ATOM 626 CB THR A 44 0.432 8.057 -3.475 1.00 0.00 C ATOM 627 OG1 THR A 44 -0.998 8.064 -3.391 1.00 0.00 O ATOM 628 CG2 THR A 44 0.907 6.711 -4.005 1.00 0.00 C ATOM 0 H THR A 44 -0.840 8.817 -1.302 1.00 0.00 H new ATOM 0 HA THR A 44 1.755 7.559 -1.843 1.00 0.00 H new ATOM 0 HB THR A 44 0.758 8.837 -4.163 1.00 0.00 H new ATOM 0 HG1 THR A 44 -1.379 7.881 -4.275 1.00 0.00 H new ATOM 0 HG21 THR A 44 0.462 6.528 -4.983 1.00 0.00 H new ATOM 0 HG22 THR A 44 1.993 6.719 -4.096 1.00 0.00 H new ATOM 0 HG23 THR A 44 0.606 5.922 -3.316 1.00 0.00 H new ATOM 636 N GLN A 45 3.097 9.630 -2.222 1.00 0.00 N ATOM 637 CA GLN A 45 3.912 10.838 -2.277 1.00 0.00 C ATOM 638 C GLN A 45 3.629 11.627 -3.551 1.00 0.00 C ATOM 639 O GLN A 45 4.504 11.784 -4.403 1.00 0.00 O ATOM 640 CB GLN A 45 5.398 10.482 -2.203 1.00 0.00 C ATOM 641 CG GLN A 45 6.169 11.299 -1.179 1.00 0.00 C ATOM 642 CD GLN A 45 6.122 10.689 0.209 1.00 0.00 C ATOM 643 OE1 GLN A 45 7.142 10.588 0.889 1.00 0.00 O ATOM 644 NE2 GLN A 45 4.933 10.279 0.635 1.00 0.00 N ATOM 0 H GLN A 45 3.630 8.761 -2.250 1.00 0.00 H new ATOM 0 HA GLN A 45 3.653 11.460 -1.420 1.00 0.00 H new ATOM 0 HB2 GLN A 45 5.498 9.424 -1.961 1.00 0.00 H new ATOM 0 HB3 GLN A 45 5.847 10.628 -3.185 1.00 0.00 H new ATOM 0 HG2 GLN A 45 7.208 11.388 -1.498 1.00 0.00 H new ATOM 0 HG3 GLN A 45 5.760 12.308 -1.142 1.00 0.00 H new ATOM 0 HE21 GLN A 45 4.113 10.383 0.037 1.00 0.00 H new ATOM 0 HE22 GLN A 45 4.839 9.860 1.560 1.00 0.00 H new ATOM 653 N THR A 46 2.402 12.121 -3.676 1.00 0.00 N ATOM 654 CA THR A 46 2.004 12.894 -4.845 1.00 0.00 C ATOM 655 C THR A 46 3.121 13.832 -5.290 1.00 0.00 C ATOM 656 O THR A 46 3.318 14.899 -4.708 1.00 0.00 O ATOM 657 CB THR A 46 0.735 13.722 -4.568 1.00 0.00 C ATOM 658 OG1 THR A 46 0.825 14.340 -3.279 1.00 0.00 O ATOM 659 CG2 THR A 46 -0.506 12.844 -4.630 1.00 0.00 C ATOM 0 H THR A 46 1.666 11.999 -2.981 1.00 0.00 H new ATOM 0 HA THR A 46 1.795 12.178 -5.640 1.00 0.00 H new ATOM 0 HB THR A 46 0.655 14.493 -5.335 1.00 0.00 H new ATOM 0 HG1 THR A 46 1.174 15.251 -3.376 1.00 0.00 H new ATOM 0 HG21 THR A 46 -1.390 13.449 -4.431 1.00 0.00 H new ATOM 0 HG22 THR A 46 -0.587 12.398 -5.621 1.00 0.00 H new ATOM 0 HG23 THR A 46 -0.431 12.055 -3.882 1.00 0.00 H new ATOM 667 N TYR A 47 3.850 13.428 -6.325 1.00 0.00 N ATOM 668 CA TYR A 47 4.947 14.233 -6.849 1.00 0.00 C ATOM 669 C TYR A 47 4.607 14.784 -8.230 1.00 0.00 C ATOM 670 O TYR A 47 3.664 14.329 -8.877 1.00 0.00 O ATOM 671 CB TYR A 47 6.228 13.400 -6.920 1.00 0.00 C ATOM 672 CG TYR A 47 6.143 12.236 -7.883 1.00 0.00 C ATOM 673 CD1 TYR A 47 6.202 12.440 -9.255 1.00 0.00 C ATOM 674 CD2 TYR A 47 6.004 10.934 -7.418 1.00 0.00 C ATOM 675 CE1 TYR A 47 6.124 11.380 -10.138 1.00 0.00 C ATOM 676 CE2 TYR A 47 5.925 9.869 -8.293 1.00 0.00 C ATOM 677 CZ TYR A 47 5.986 10.097 -9.653 1.00 0.00 C ATOM 678 OH TYR A 47 5.908 9.038 -10.528 1.00 0.00 O ATOM 0 H TYR A 47 3.701 12.547 -6.818 1.00 0.00 H new ATOM 0 HA TYR A 47 5.104 15.073 -6.172 1.00 0.00 H new ATOM 0 HB2 TYR A 47 7.055 14.046 -7.216 1.00 0.00 H new ATOM 0 HB3 TYR A 47 6.460 13.021 -5.925 1.00 0.00 H new ATOM 0 HD1 TYR A 47 6.311 13.444 -9.638 1.00 0.00 H new ATOM 0 HD2 TYR A 47 5.957 10.752 -6.354 1.00 0.00 H new ATOM 0 HE1 TYR A 47 6.171 11.556 -11.203 1.00 0.00 H new ATOM 0 HE2 TYR A 47 5.816 8.863 -7.915 1.00 0.00 H new ATOM 0 HH TYR A 47 6.614 9.119 -11.203 1.00 0.00 H new ATOM 688 N GLY A 48 5.382 15.768 -8.675 1.00 0.00 N ATOM 689 CA GLY A 48 5.146 16.366 -9.976 1.00 0.00 C ATOM 690 C GLY A 48 3.681 16.663 -10.221 1.00 0.00 C ATOM 691 O GLY A 48 2.856 16.546 -9.314 1.00 0.00 O ATOM 0 H GLY A 48 6.168 16.162 -8.158 1.00 0.00 H new ATOM 0 HA2 GLY A 48 5.719 17.290 -10.057 1.00 0.00 H new ATOM 0 HA3 GLY A 48 5.512 15.695 -10.753 1.00 0.00 H new ATOM 695 N GLY A 49 3.354 17.048 -11.450 1.00 0.00 N ATOM 696 CA GLY A 49 1.978 17.356 -11.790 1.00 0.00 C ATOM 697 C GLY A 49 1.768 18.829 -12.077 1.00 0.00 C ATOM 698 O GLY A 49 2.718 19.612 -12.068 1.00 0.00 O ATOM 0 H GLY A 49 4.018 17.152 -12.217 1.00 0.00 H new ATOM 0 HA2 GLY A 49 1.683 16.773 -12.663 1.00 0.00 H new ATOM 0 HA3 GLY A 49 1.328 17.052 -10.970 1.00 0.00 H new ATOM 702 N ASN A 50 0.519 19.208 -12.334 1.00 0.00 N ATOM 703 CA ASN A 50 0.187 20.597 -12.624 1.00 0.00 C ATOM 704 C ASN A 50 -0.146 21.355 -11.343 1.00 0.00 C ATOM 705 O ASN A 50 -0.933 22.302 -11.357 1.00 0.00 O ATOM 706 CB ASN A 50 -0.992 20.670 -13.595 1.00 0.00 C ATOM 707 CG ASN A 50 -2.201 19.905 -13.095 1.00 0.00 C ATOM 708 OD1 ASN A 50 -2.478 19.873 -11.896 1.00 0.00 O ATOM 709 ND2 ASN A 50 -2.931 19.284 -14.015 1.00 0.00 N ATOM 0 H ASN A 50 -0.278 18.572 -12.347 1.00 0.00 H new ATOM 0 HA ASN A 50 1.057 21.064 -13.085 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -1.265 21.713 -13.752 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -0.688 20.271 -14.562 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -3.758 18.754 -13.738 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -2.665 19.337 -14.998 1.00 0.00 H new ATOM 716 N SER A 51 0.459 20.932 -10.238 1.00 0.00 N ATOM 717 CA SER A 51 0.229 21.569 -8.948 1.00 0.00 C ATOM 718 C SER A 51 1.391 21.297 -8.000 1.00 0.00 C ATOM 719 O SER A 51 1.228 21.321 -6.780 1.00 0.00 O ATOM 720 CB SER A 51 -1.078 21.066 -8.332 1.00 0.00 C ATOM 721 OG SER A 51 -1.185 19.657 -8.439 1.00 0.00 O ATOM 0 H SER A 51 1.113 20.150 -10.211 1.00 0.00 H new ATOM 0 HA SER A 51 0.154 22.645 -9.107 1.00 0.00 H new ATOM 0 HB2 SER A 51 -1.125 21.358 -7.283 1.00 0.00 H new ATOM 0 HB3 SER A 51 -1.924 21.537 -8.833 1.00 0.00 H new ATOM 0 HG SER A 51 -1.253 19.265 -7.543 1.00 0.00 H new ATOM 727 N ASN A 52 2.562 21.037 -8.571 1.00 0.00 N ATOM 728 CA ASN A 52 3.756 20.757 -7.782 1.00 0.00 C ATOM 729 C ASN A 52 3.718 19.340 -7.219 1.00 0.00 C ATOM 730 O ASN A 52 4.647 18.557 -7.418 1.00 0.00 O ATOM 731 CB ASN A 52 3.887 21.768 -6.642 1.00 0.00 C ATOM 732 CG ASN A 52 5.231 21.684 -5.946 1.00 0.00 C ATOM 733 OD1 ASN A 52 5.545 20.687 -5.295 1.00 0.00 O ATOM 734 ND2 ASN A 52 6.034 22.734 -6.079 1.00 0.00 N ATOM 0 H ASN A 52 2.710 21.014 -9.580 1.00 0.00 H new ATOM 0 HA ASN A 52 4.622 20.844 -8.438 1.00 0.00 H new ATOM 0 HB2 ASN A 52 3.747 22.775 -7.035 1.00 0.00 H new ATOM 0 HB3 ASN A 52 3.093 21.596 -5.915 1.00 0.00 H new ATOM 0 HD21 ASN A 52 6.951 22.735 -5.632 1.00 0.00 H new ATOM 0 HD22 ASN A 52 5.734 23.540 -6.628 1.00 0.00 H new ATOM 741 N GLY A 53 2.637 19.018 -6.516 1.00 0.00 N ATOM 742 CA GLY A 53 2.498 17.695 -5.935 1.00 0.00 C ATOM 743 C GLY A 53 1.529 17.672 -4.769 1.00 0.00 C ATOM 744 O GLY A 53 1.748 16.965 -3.786 1.00 0.00 O ATOM 0 H GLY A 53 1.855 19.649 -6.338 1.00 0.00 H new ATOM 0 HA2 GLY A 53 2.156 16.999 -6.701 1.00 0.00 H new ATOM 0 HA3 GLY A 53 3.474 17.345 -5.599 1.00 0.00 H new ATOM 748 N GLU A 54 0.456 18.448 -4.879 1.00 0.00 N ATOM 749 CA GLU A 54 -0.551 18.514 -3.826 1.00 0.00 C ATOM 750 C GLU A 54 -1.402 17.248 -3.808 1.00 0.00 C ATOM 751 O GLU A 54 -1.133 16.295 -4.539 1.00 0.00 O ATOM 752 CB GLU A 54 -1.440 19.744 -4.018 1.00 0.00 C ATOM 753 CG GLU A 54 -1.326 20.760 -2.892 1.00 0.00 C ATOM 754 CD GLU A 54 -1.104 22.171 -3.401 1.00 0.00 C ATOM 755 OE1 GLU A 54 -2.102 22.847 -3.732 1.00 0.00 O ATOM 756 OE2 GLU A 54 0.066 22.601 -3.468 1.00 0.00 O ATOM 0 H GLU A 54 0.261 19.040 -5.687 1.00 0.00 H new ATOM 0 HA GLU A 54 -0.037 18.595 -2.868 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -1.179 20.227 -4.960 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -2.478 19.422 -4.102 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -2.234 20.733 -2.290 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -0.501 20.480 -2.237 1.00 0.00 H new ATOM 763 N PRO A 55 -2.441 17.226 -2.962 1.00 0.00 N ATOM 764 CA PRO A 55 -3.343 16.080 -2.829 1.00 0.00 C ATOM 765 C PRO A 55 -4.264 15.930 -4.034 1.00 0.00 C ATOM 766 O PRO A 55 -4.363 16.829 -4.869 1.00 0.00 O ATOM 767 CB PRO A 55 -4.159 16.400 -1.565 1.00 0.00 C ATOM 768 CG PRO A 55 -3.489 17.580 -0.938 1.00 0.00 C ATOM 769 CD PRO A 55 -2.819 18.315 -2.060 1.00 0.00 C ATOM 0 HA PRO A 55 -2.796 15.139 -2.766 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -5.196 16.626 -1.815 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -4.173 15.550 -0.883 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -4.214 18.217 -0.431 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -2.763 17.265 -0.189 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -3.492 19.026 -2.540 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -1.952 18.879 -1.717 1.00 0.00 H new ATOM 777 N CYS A 56 -4.939 14.788 -4.119 1.00 0.00 N ATOM 778 CA CYS A 56 -5.852 14.520 -5.223 1.00 0.00 C ATOM 779 C CYS A 56 -7.289 14.846 -4.834 1.00 0.00 C ATOM 780 O CYS A 56 -7.558 15.267 -3.709 1.00 0.00 O ATOM 781 CB CYS A 56 -5.748 13.056 -5.656 1.00 0.00 C ATOM 782 SG CYS A 56 -4.099 12.322 -5.404 1.00 0.00 S ATOM 0 H CYS A 56 -4.870 14.034 -3.436 1.00 0.00 H new ATOM 0 HA CYS A 56 -5.568 15.160 -6.058 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -6.483 12.471 -5.102 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -6.010 12.981 -6.711 1.00 0.00 H new ATOM 787 N VAL A 57 -8.208 14.654 -5.773 1.00 0.00 N ATOM 788 CA VAL A 57 -9.617 14.931 -5.532 1.00 0.00 C ATOM 789 C VAL A 57 -10.509 14.056 -6.407 1.00 0.00 C ATOM 790 O VAL A 57 -11.383 14.556 -7.116 1.00 0.00 O ATOM 791 CB VAL A 57 -9.947 16.411 -5.798 1.00 0.00 C ATOM 792 CG1 VAL A 57 -11.138 16.853 -4.961 1.00 0.00 C ATOM 793 CG2 VAL A 57 -8.733 17.285 -5.519 1.00 0.00 C ATOM 0 H VAL A 57 -8.001 14.307 -6.710 1.00 0.00 H new ATOM 0 HA VAL A 57 -9.811 14.704 -4.484 1.00 0.00 H new ATOM 0 HB VAL A 57 -10.213 16.523 -6.849 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -11.356 17.902 -5.163 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -12.007 16.246 -5.216 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -10.906 16.728 -3.903 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -8.984 18.328 -5.712 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -8.434 17.170 -4.477 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -7.911 16.983 -6.168 1.00 0.00 H new ATOM 803 N LEU A 58 -10.282 12.749 -6.351 1.00 0.00 N ATOM 804 CA LEU A 58 -11.064 11.801 -7.136 1.00 0.00 C ATOM 805 C LEU A 58 -12.313 11.367 -6.374 1.00 0.00 C ATOM 806 O LEU A 58 -12.548 11.812 -5.250 1.00 0.00 O ATOM 807 CB LEU A 58 -10.213 10.579 -7.488 1.00 0.00 C ATOM 808 CG LEU A 58 -8.732 10.694 -7.121 1.00 0.00 C ATOM 809 CD1 LEU A 58 -8.483 10.124 -5.733 1.00 0.00 C ATOM 810 CD2 LEU A 58 -7.870 9.987 -8.154 1.00 0.00 C ATOM 0 H LEU A 58 -9.562 12.321 -5.769 1.00 0.00 H new ATOM 0 HA LEU A 58 -11.376 12.294 -8.056 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -10.630 9.707 -6.984 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -10.293 10.396 -8.560 1.00 0.00 H new ATOM 0 HG LEU A 58 -8.459 11.749 -7.113 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -7.425 10.214 -5.487 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -9.073 10.676 -5.002 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -8.772 9.073 -5.714 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -6.820 10.079 -7.876 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -8.143 8.933 -8.195 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -8.028 10.441 -9.132 1.00 0.00 H new ATOM 822 N PRO A 59 -13.137 10.494 -6.977 1.00 0.00 N ATOM 823 CA PRO A 59 -12.887 9.945 -8.317 1.00 0.00 C ATOM 824 C PRO A 59 -12.795 11.030 -9.384 1.00 0.00 C ATOM 825 O PRO A 59 -13.384 12.103 -9.246 1.00 0.00 O ATOM 826 CB PRO A 59 -14.107 9.053 -8.577 1.00 0.00 C ATOM 827 CG PRO A 59 -14.661 8.754 -7.227 1.00 0.00 C ATOM 828 CD PRO A 59 -14.381 9.969 -6.391 1.00 0.00 C ATOM 0 HA PRO A 59 -11.935 9.416 -8.362 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -14.842 9.561 -9.201 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -13.824 8.139 -9.099 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -15.731 8.554 -7.279 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -14.191 7.868 -6.799 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -15.192 10.695 -6.449 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -14.256 9.715 -5.339 1.00 0.00 H new ATOM 836 N PHE A 60 -12.053 10.742 -10.448 1.00 0.00 N ATOM 837 CA PHE A 60 -11.884 11.689 -11.543 1.00 0.00 C ATOM 838 C PHE A 60 -11.873 10.965 -12.886 1.00 0.00 C ATOM 839 O PHE A 60 -11.006 10.129 -13.144 1.00 0.00 O ATOM 840 CB PHE A 60 -10.591 12.489 -11.363 1.00 0.00 C ATOM 841 CG PHE A 60 -9.377 11.817 -11.938 1.00 0.00 C ATOM 842 CD1 PHE A 60 -9.120 11.867 -13.299 1.00 0.00 C ATOM 843 CD2 PHE A 60 -8.493 11.135 -11.117 1.00 0.00 C ATOM 844 CE1 PHE A 60 -8.003 11.251 -13.831 1.00 0.00 C ATOM 845 CE2 PHE A 60 -7.375 10.516 -11.644 1.00 0.00 C ATOM 846 CZ PHE A 60 -7.130 10.574 -13.002 1.00 0.00 C ATOM 0 H PHE A 60 -11.559 9.859 -10.575 1.00 0.00 H new ATOM 0 HA PHE A 60 -12.728 12.379 -11.530 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -10.711 13.465 -11.832 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -10.428 12.664 -10.300 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -9.801 12.394 -13.952 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -8.680 11.087 -10.054 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -7.813 11.299 -14.893 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -6.693 9.987 -10.994 1.00 0.00 H new ATOM 0 HZ PHE A 60 -6.257 10.091 -13.415 1.00 0.00 H new ATOM 856 N THR A 61 -12.844 11.286 -13.735 1.00 0.00 N ATOM 857 CA THR A 61 -12.950 10.665 -15.046 1.00 0.00 C ATOM 858 C THR A 61 -11.887 11.197 -16.001 1.00 0.00 C ATOM 859 O THR A 61 -11.344 12.283 -15.797 1.00 0.00 O ATOM 860 CB THR A 61 -14.340 10.909 -15.659 1.00 0.00 C ATOM 861 OG1 THR A 61 -14.721 12.279 -15.480 1.00 0.00 O ATOM 862 CG2 THR A 61 -15.382 10.002 -15.021 1.00 0.00 C ATOM 0 H THR A 61 -13.569 11.975 -13.536 1.00 0.00 H new ATOM 0 HA THR A 61 -12.797 9.595 -14.905 1.00 0.00 H new ATOM 0 HB THR A 61 -14.287 10.682 -16.724 1.00 0.00 H new ATOM 0 HG1 THR A 61 -15.606 12.427 -15.874 1.00 0.00 H new ATOM 0 HG21 THR A 61 -16.356 10.194 -15.471 1.00 0.00 H new ATOM 0 HG22 THR A 61 -15.106 8.960 -15.183 1.00 0.00 H new ATOM 0 HG23 THR A 61 -15.432 10.202 -13.951 1.00 0.00 H new ATOM 870 N TYR A 62 -11.598 10.427 -17.045 1.00 0.00 N ATOM 871 CA TYR A 62 -10.603 10.825 -18.036 1.00 0.00 C ATOM 872 C TYR A 62 -10.655 9.917 -19.261 1.00 0.00 C ATOM 873 O TYR A 62 -10.683 8.693 -19.142 1.00 0.00 O ATOM 874 CB TYR A 62 -9.198 10.808 -17.428 1.00 0.00 C ATOM 875 CG TYR A 62 -8.094 10.989 -18.445 1.00 0.00 C ATOM 876 CD1 TYR A 62 -7.650 9.921 -19.214 1.00 0.00 C ATOM 877 CD2 TYR A 62 -7.493 12.227 -18.633 1.00 0.00 C ATOM 878 CE1 TYR A 62 -6.639 10.082 -20.144 1.00 0.00 C ATOM 879 CE2 TYR A 62 -6.483 12.397 -19.561 1.00 0.00 C ATOM 880 CZ TYR A 62 -6.060 11.321 -20.313 1.00 0.00 C ATOM 881 OH TYR A 62 -5.054 11.487 -21.238 1.00 0.00 O ATOM 0 H TYR A 62 -12.038 9.525 -17.227 1.00 0.00 H new ATOM 0 HA TYR A 62 -10.837 11.842 -18.352 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -9.125 11.599 -16.681 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -9.049 9.862 -16.907 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -8.102 8.949 -19.084 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -7.820 13.071 -18.044 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -6.305 9.241 -20.734 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -6.028 13.367 -19.697 1.00 0.00 H new ATOM 0 HH TYR A 62 -4.343 10.834 -21.069 1.00 0.00 H new ATOM 891 N ASN A 63 -10.677 10.533 -20.441 1.00 0.00 N ATOM 892 CA ASN A 63 -10.729 9.796 -21.701 1.00 0.00 C ATOM 893 C ASN A 63 -12.128 9.234 -21.962 1.00 0.00 C ATOM 894 O ASN A 63 -12.392 8.683 -23.031 1.00 0.00 O ATOM 895 CB ASN A 63 -9.685 8.669 -21.705 1.00 0.00 C ATOM 896 CG ASN A 63 -10.246 7.329 -21.261 1.00 0.00 C ATOM 897 OD1 ASN A 63 -11.219 6.831 -21.828 1.00 0.00 O ATOM 898 ND2 ASN A 63 -9.632 6.740 -20.242 1.00 0.00 N ATOM 0 H ASN A 63 -10.659 11.547 -20.550 1.00 0.00 H new ATOM 0 HA ASN A 63 -10.496 10.493 -22.506 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -9.273 8.568 -22.709 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -8.860 8.945 -21.049 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -9.963 5.838 -19.899 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -8.829 7.189 -19.802 1.00 0.00 H new ATOM 905 N GLY A 64 -13.019 9.375 -20.985 1.00 0.00 N ATOM 906 CA GLY A 64 -14.370 8.873 -21.138 1.00 0.00 C ATOM 907 C GLY A 64 -14.724 7.856 -20.072 1.00 0.00 C ATOM 908 O GLY A 64 -15.807 7.273 -20.095 1.00 0.00 O ATOM 0 H GLY A 64 -12.828 9.828 -20.091 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -15.073 9.705 -21.092 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -14.478 8.418 -22.123 1.00 0.00 H new ATOM 912 N ARG A 65 -13.803 7.642 -19.138 1.00 0.00 N ATOM 913 CA ARG A 65 -14.017 6.687 -18.059 1.00 0.00 C ATOM 914 C ARG A 65 -13.976 7.389 -16.701 1.00 0.00 C ATOM 915 O ARG A 65 -13.750 8.596 -16.622 1.00 0.00 O ATOM 916 CB ARG A 65 -12.963 5.570 -18.137 1.00 0.00 C ATOM 917 CG ARG A 65 -12.110 5.414 -16.888 1.00 0.00 C ATOM 918 CD ARG A 65 -10.852 4.607 -17.168 1.00 0.00 C ATOM 919 NE ARG A 65 -11.160 3.247 -17.603 1.00 0.00 N ATOM 920 CZ ARG A 65 -10.313 2.484 -18.286 1.00 0.00 C ATOM 921 NH1 ARG A 65 -9.113 2.946 -18.610 1.00 0.00 N ATOM 922 NH2 ARG A 65 -10.667 1.257 -18.646 1.00 0.00 N ATOM 0 H ARG A 65 -12.901 8.118 -19.107 1.00 0.00 H new ATOM 0 HA ARG A 65 -15.005 6.240 -18.170 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -13.469 4.625 -18.336 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -12.308 5.766 -18.986 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -11.835 6.398 -16.509 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -12.692 4.923 -16.108 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -10.263 5.109 -17.936 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -10.238 4.570 -16.268 1.00 0.00 H new ATOM 0 HE ARG A 65 -12.075 2.862 -17.370 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -8.838 3.889 -18.335 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -8.465 2.358 -19.134 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -11.590 0.899 -18.399 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -10.017 0.672 -19.170 1.00 0.00 H new ATOM 936 N THR A 66 -14.191 6.621 -15.638 1.00 0.00 N ATOM 937 CA THR A 66 -14.175 7.166 -14.285 1.00 0.00 C ATOM 938 C THR A 66 -13.122 6.472 -13.429 1.00 0.00 C ATOM 939 O THR A 66 -13.234 5.282 -13.131 1.00 0.00 O ATOM 940 CB THR A 66 -15.548 7.023 -13.604 1.00 0.00 C ATOM 941 OG1 THR A 66 -16.567 7.607 -14.425 1.00 0.00 O ATOM 942 CG2 THR A 66 -15.546 7.693 -12.237 1.00 0.00 C ATOM 0 H THR A 66 -14.378 5.620 -15.687 1.00 0.00 H new ATOM 0 HA THR A 66 -13.931 8.225 -14.373 1.00 0.00 H new ATOM 0 HB THR A 66 -15.754 5.961 -13.471 1.00 0.00 H new ATOM 0 HG1 THR A 66 -17.437 7.510 -13.985 1.00 0.00 H new ATOM 0 HG21 THR A 66 -16.526 7.579 -11.775 1.00 0.00 H new ATOM 0 HG22 THR A 66 -14.790 7.227 -11.605 1.00 0.00 H new ATOM 0 HG23 THR A 66 -15.320 8.753 -12.352 1.00 0.00 H new ATOM 950 N PHE A 67 -12.097 7.222 -13.036 1.00 0.00 N ATOM 951 CA PHE A 67 -11.023 6.677 -12.213 1.00 0.00 C ATOM 952 C PHE A 67 -11.219 7.047 -10.747 1.00 0.00 C ATOM 953 O PHE A 67 -11.833 8.066 -10.429 1.00 0.00 O ATOM 954 CB PHE A 67 -9.667 7.190 -12.703 1.00 0.00 C ATOM 955 CG PHE A 67 -9.485 7.083 -14.190 1.00 0.00 C ATOM 956 CD1 PHE A 67 -10.174 7.926 -15.047 1.00 0.00 C ATOM 957 CD2 PHE A 67 -8.625 6.140 -14.731 1.00 0.00 C ATOM 958 CE1 PHE A 67 -10.009 7.831 -16.415 1.00 0.00 C ATOM 959 CE2 PHE A 67 -8.455 6.042 -16.099 1.00 0.00 C ATOM 960 CZ PHE A 67 -9.149 6.888 -16.942 1.00 0.00 C ATOM 0 H PHE A 67 -11.988 8.208 -13.274 1.00 0.00 H new ATOM 0 HA PHE A 67 -11.047 5.591 -12.301 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -9.553 8.232 -12.406 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -8.875 6.629 -12.207 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -10.848 8.666 -14.641 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -8.082 5.475 -14.076 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -10.552 8.494 -17.072 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -7.780 5.305 -16.508 1.00 0.00 H new ATOM 0 HZ PHE A 67 -9.019 6.812 -18.011 1.00 0.00 H new ATOM 970 N TYR A 68 -10.692 6.213 -9.856 1.00 0.00 N ATOM 971 CA TYR A 68 -10.809 6.452 -8.422 1.00 0.00 C ATOM 972 C TYR A 68 -9.432 6.577 -7.778 1.00 0.00 C ATOM 973 O TYR A 68 -9.303 6.547 -6.554 1.00 0.00 O ATOM 974 CB TYR A 68 -11.595 5.321 -7.757 1.00 0.00 C ATOM 975 CG TYR A 68 -13.083 5.384 -8.015 1.00 0.00 C ATOM 976 CD1 TYR A 68 -13.589 5.281 -9.305 1.00 0.00 C ATOM 977 CD2 TYR A 68 -13.984 5.545 -6.970 1.00 0.00 C ATOM 978 CE1 TYR A 68 -14.948 5.337 -9.546 1.00 0.00 C ATOM 979 CE2 TYR A 68 -15.344 5.603 -7.202 1.00 0.00 C ATOM 980 CZ TYR A 68 -15.822 5.499 -8.491 1.00 0.00 C ATOM 981 OH TYR A 68 -17.176 5.555 -8.726 1.00 0.00 O ATOM 0 H TYR A 68 -10.180 5.366 -10.102 1.00 0.00 H new ATOM 0 HA TYR A 68 -11.345 7.390 -8.278 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -11.213 4.365 -8.115 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -11.420 5.352 -6.682 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -12.908 5.155 -10.134 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -13.614 5.626 -5.958 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -15.324 5.254 -10.555 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -16.030 5.729 -6.378 1.00 0.00 H new ATOM 0 HH TYR A 68 -17.651 5.671 -7.877 1.00 0.00 H new ATOM 991 N SER A 69 -8.406 6.716 -8.610 1.00 0.00 N ATOM 992 CA SER A 69 -7.037 6.845 -8.123 1.00 0.00 C ATOM 993 C SER A 69 -6.120 7.388 -9.214 1.00 0.00 C ATOM 994 O SER A 69 -6.570 8.074 -10.131 1.00 0.00 O ATOM 995 CB SER A 69 -6.518 5.492 -7.631 1.00 0.00 C ATOM 996 OG SER A 69 -7.459 4.866 -6.775 1.00 0.00 O ATOM 0 H SER A 69 -8.496 6.742 -9.626 1.00 0.00 H new ATOM 0 HA SER A 69 -7.039 7.550 -7.291 1.00 0.00 H new ATOM 0 HB2 SER A 69 -6.312 4.846 -8.484 1.00 0.00 H new ATOM 0 HB3 SER A 69 -5.576 5.631 -7.101 1.00 0.00 H new ATOM 0 HG SER A 69 -8.002 5.550 -6.330 1.00 0.00 H new ATOM 1002 N CYS A 70 -4.833 7.074 -9.108 1.00 0.00 N ATOM 1003 CA CYS A 70 -3.853 7.530 -10.087 1.00 0.00 C ATOM 1004 C CYS A 70 -3.928 6.692 -11.360 1.00 0.00 C ATOM 1005 O CYS A 70 -4.416 5.562 -11.341 1.00 0.00 O ATOM 1006 CB CYS A 70 -2.442 7.461 -9.500 1.00 0.00 C ATOM 1007 SG CYS A 70 -2.380 7.621 -7.686 1.00 0.00 S ATOM 0 H CYS A 70 -4.445 6.506 -8.355 1.00 0.00 H new ATOM 0 HA CYS A 70 -4.083 8.565 -10.339 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -1.988 6.512 -9.786 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -1.837 8.251 -9.944 1.00 0.00 H new ATOM 1012 N THR A 71 -3.442 7.251 -12.464 1.00 0.00 N ATOM 1013 CA THR A 71 -3.456 6.549 -13.741 1.00 0.00 C ATOM 1014 C THR A 71 -2.623 7.281 -14.789 1.00 0.00 C ATOM 1015 O THR A 71 -2.701 8.503 -14.916 1.00 0.00 O ATOM 1016 CB THR A 71 -4.894 6.373 -14.271 1.00 0.00 C ATOM 1017 OG1 THR A 71 -4.955 5.250 -15.159 1.00 0.00 O ATOM 1018 CG2 THR A 71 -5.369 7.624 -15.001 1.00 0.00 C ATOM 0 H THR A 71 -3.035 8.186 -12.499 1.00 0.00 H new ATOM 0 HA THR A 71 -3.019 5.566 -13.562 1.00 0.00 H new ATOM 0 HB THR A 71 -5.548 6.202 -13.416 1.00 0.00 H new ATOM 0 HG1 THR A 71 -5.891 5.046 -15.364 1.00 0.00 H new ATOM 0 HG21 THR A 71 -6.385 7.470 -15.363 1.00 0.00 H new ATOM 0 HG22 THR A 71 -5.352 8.473 -14.317 1.00 0.00 H new ATOM 0 HG23 THR A 71 -4.710 7.825 -15.845 1.00 0.00 H new ATOM 1026 N THR A 72 -1.834 6.524 -15.541 1.00 0.00 N ATOM 1027 CA THR A 72 -0.995 7.094 -16.586 1.00 0.00 C ATOM 1028 C THR A 72 -1.733 7.105 -17.917 1.00 0.00 C ATOM 1029 O THR A 72 -1.121 7.148 -18.983 1.00 0.00 O ATOM 1030 CB THR A 72 0.323 6.313 -16.736 1.00 0.00 C ATOM 1031 OG1 THR A 72 0.061 4.998 -17.243 1.00 0.00 O ATOM 1032 CG2 THR A 72 1.035 6.216 -15.397 1.00 0.00 C ATOM 0 H THR A 72 -1.758 5.511 -15.446 1.00 0.00 H new ATOM 0 HA THR A 72 -0.760 8.117 -16.294 1.00 0.00 H new ATOM 0 HB THR A 72 0.964 6.846 -17.438 1.00 0.00 H new ATOM 0 HG1 THR A 72 0.905 4.509 -17.337 1.00 0.00 H new ATOM 0 HG21 THR A 72 1.965 5.661 -15.519 1.00 0.00 H new ATOM 0 HG22 THR A 72 1.256 7.218 -15.029 1.00 0.00 H new ATOM 0 HG23 THR A 72 0.395 5.699 -14.681 1.00 0.00 H new ATOM 1040 N GLU A 73 -3.060 7.064 -17.840 1.00 0.00 N ATOM 1041 CA GLU A 73 -3.901 7.070 -19.029 1.00 0.00 C ATOM 1042 C GLU A 73 -3.399 8.087 -20.046 1.00 0.00 C ATOM 1043 O GLU A 73 -3.660 9.283 -19.923 1.00 0.00 O ATOM 1044 CB GLU A 73 -5.348 7.387 -18.651 1.00 0.00 C ATOM 1045 CG GLU A 73 -6.237 6.159 -18.551 1.00 0.00 C ATOM 1046 CD GLU A 73 -6.003 5.174 -19.680 1.00 0.00 C ATOM 1047 OE1 GLU A 73 -6.218 5.550 -20.851 1.00 0.00 O ATOM 1048 OE2 GLU A 73 -5.603 4.025 -19.392 1.00 0.00 O ATOM 0 H GLU A 73 -3.576 7.026 -16.961 1.00 0.00 H new ATOM 0 HA GLU A 73 -3.856 6.079 -19.480 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -5.358 7.910 -17.695 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -5.767 8.068 -19.392 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -6.057 5.662 -17.598 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -7.282 6.470 -18.556 1.00 0.00 H new ATOM 1055 N GLY A 74 -2.676 7.605 -21.049 1.00 0.00 N ATOM 1056 CA GLY A 74 -2.151 8.488 -22.071 1.00 0.00 C ATOM 1057 C GLY A 74 -0.900 9.217 -21.620 1.00 0.00 C ATOM 1058 O GLY A 74 -0.249 9.891 -22.418 1.00 0.00 O ATOM 0 H GLY A 74 -2.444 6.619 -21.172 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -1.927 7.909 -22.967 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -2.914 9.217 -22.344 1.00 0.00 H new ATOM 1062 N ARG A 75 -0.564 9.087 -20.340 1.00 0.00 N ATOM 1063 CA ARG A 75 0.616 9.747 -19.796 1.00 0.00 C ATOM 1064 C ARG A 75 1.895 9.039 -20.234 1.00 0.00 C ATOM 1065 O ARG A 75 2.186 7.927 -19.794 1.00 0.00 O ATOM 1066 CB ARG A 75 0.552 9.803 -18.271 1.00 0.00 C ATOM 1067 CG ARG A 75 1.111 11.094 -17.693 1.00 0.00 C ATOM 1068 CD ARG A 75 0.479 12.313 -18.343 1.00 0.00 C ATOM 1069 NE ARG A 75 1.459 13.136 -19.052 1.00 0.00 N ATOM 1070 CZ ARG A 75 2.119 14.144 -18.493 1.00 0.00 C ATOM 1071 NH1 ARG A 75 1.950 14.421 -17.207 1.00 0.00 N ATOM 1072 NH2 ARG A 75 2.952 14.875 -19.221 1.00 0.00 N ATOM 0 H ARG A 75 -1.090 8.533 -19.664 1.00 0.00 H new ATOM 0 HA ARG A 75 0.632 10.764 -20.187 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -0.484 9.690 -17.953 1.00 0.00 H new ATOM 0 HB3 ARG A 75 1.106 8.959 -17.860 1.00 0.00 H new ATOM 0 HG2 ARG A 75 0.933 11.120 -16.618 1.00 0.00 H new ATOM 0 HG3 ARG A 75 2.191 11.122 -17.838 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -0.294 11.990 -19.041 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -0.013 12.915 -17.579 1.00 0.00 H new ATOM 0 HE ARG A 75 1.646 12.923 -20.032 1.00 0.00 H new ATOM 0 HH11 ARG A 75 1.312 13.859 -16.644 1.00 0.00 H new ATOM 0 HH12 ARG A 75 2.459 15.196 -16.781 1.00 0.00 H new ATOM 0 HH21 ARG A 75 3.086 14.663 -20.210 1.00 0.00 H new ATOM 0 HH22 ARG A 75 3.459 15.649 -18.792 1.00 0.00 H new ATOM 1086 N GLN A 76 2.660 9.703 -21.093 1.00 0.00 N ATOM 1087 CA GLN A 76 3.919 9.159 -21.588 1.00 0.00 C ATOM 1088 C GLN A 76 5.074 10.018 -21.095 1.00 0.00 C ATOM 1089 O GLN A 76 6.038 10.270 -21.818 1.00 0.00 O ATOM 1090 CB GLN A 76 3.917 9.104 -23.116 1.00 0.00 C ATOM 1091 CG GLN A 76 3.877 7.690 -23.675 1.00 0.00 C ATOM 1092 CD GLN A 76 5.260 7.098 -23.860 1.00 0.00 C ATOM 1093 OE1 GLN A 76 5.673 6.208 -23.116 1.00 0.00 O ATOM 1094 NE2 GLN A 76 5.985 7.591 -24.858 1.00 0.00 N ATOM 0 H GLN A 76 2.428 10.625 -21.463 1.00 0.00 H new ATOM 0 HA GLN A 76 4.038 8.144 -21.210 1.00 0.00 H new ATOM 0 HB2 GLN A 76 3.056 9.658 -23.490 1.00 0.00 H new ATOM 0 HB3 GLN A 76 4.808 9.609 -23.490 1.00 0.00 H new ATOM 0 HG2 GLN A 76 3.300 7.054 -23.004 1.00 0.00 H new ATOM 0 HG3 GLN A 76 3.357 7.696 -24.633 1.00 0.00 H new ATOM 0 HE21 GLN A 76 5.603 8.328 -25.450 1.00 0.00 H new ATOM 0 HE22 GLN A 76 6.924 7.232 -25.032 1.00 0.00 H new ATOM 1103 N ASP A 77 4.950 10.474 -19.856 1.00 0.00 N ATOM 1104 CA ASP A 77 5.952 11.324 -19.233 1.00 0.00 C ATOM 1105 C ASP A 77 5.442 11.777 -17.876 1.00 0.00 C ATOM 1106 O ASP A 77 5.708 12.894 -17.431 1.00 0.00 O ATOM 1107 CB ASP A 77 6.241 12.540 -20.112 1.00 0.00 C ATOM 1108 CG ASP A 77 5.061 13.490 -20.175 1.00 0.00 C ATOM 1109 OD1 ASP A 77 3.932 13.020 -20.444 1.00 0.00 O ATOM 1110 OD2 ASP A 77 5.261 14.703 -19.951 1.00 0.00 O ATOM 0 H ASP A 77 4.152 10.265 -19.256 1.00 0.00 H new ATOM 0 HA ASP A 77 6.877 10.760 -19.111 1.00 0.00 H new ATOM 0 HB2 ASP A 77 7.112 13.069 -19.724 1.00 0.00 H new ATOM 0 HB3 ASP A 77 6.493 12.208 -21.119 1.00 0.00 H new ATOM 1115 N GLY A 78 4.692 10.893 -17.233 1.00 0.00 N ATOM 1116 CA GLY A 78 4.127 11.184 -15.946 1.00 0.00 C ATOM 1117 C GLY A 78 3.371 10.003 -15.395 1.00 0.00 C ATOM 1118 O GLY A 78 2.245 9.724 -15.807 1.00 0.00 O ATOM 0 H GLY A 78 4.466 9.966 -17.594 1.00 0.00 H new ATOM 0 HA2 GLY A 78 4.921 11.464 -15.254 1.00 0.00 H new ATOM 0 HA3 GLY A 78 3.458 12.040 -16.027 1.00 0.00 H new ATOM 1122 N HIS A 79 4.008 9.305 -14.475 1.00 0.00 N ATOM 1123 CA HIS A 79 3.418 8.129 -13.853 1.00 0.00 C ATOM 1124 C HIS A 79 1.961 8.387 -13.484 1.00 0.00 C ATOM 1125 O HIS A 79 1.441 9.485 -13.679 1.00 0.00 O ATOM 1126 CB HIS A 79 4.210 7.734 -12.605 1.00 0.00 C ATOM 1127 CG HIS A 79 5.586 7.228 -12.906 1.00 0.00 C ATOM 1128 ND1 HIS A 79 6.733 7.917 -12.568 1.00 0.00 N ATOM 1129 CD2 HIS A 79 6.000 6.091 -13.516 1.00 0.00 C ATOM 1130 CE1 HIS A 79 7.790 7.227 -12.958 1.00 0.00 C ATOM 1131 NE2 HIS A 79 7.373 6.116 -13.534 1.00 0.00 N ATOM 0 H HIS A 79 4.943 9.533 -14.137 1.00 0.00 H new ATOM 0 HA HIS A 79 3.455 7.310 -14.571 1.00 0.00 H new ATOM 0 HB2 HIS A 79 4.286 8.597 -11.944 1.00 0.00 H new ATOM 0 HB3 HIS A 79 3.659 6.965 -12.063 1.00 0.00 H new ATOM 0 HD2 HIS A 79 5.368 5.311 -13.914 1.00 0.00 H new ATOM 0 HE1 HIS A 79 8.821 7.522 -12.827 1.00 0.00 H new ATOM 0 HE2 HIS A 79 7.973 5.392 -13.929 1.00 0.00 H new ATOM 1140 N LEU A 80 1.304 7.362 -12.964 1.00 0.00 N ATOM 1141 CA LEU A 80 -0.098 7.471 -12.591 1.00 0.00 C ATOM 1142 C LEU A 80 -0.373 8.773 -11.852 1.00 0.00 C ATOM 1143 O LEU A 80 0.159 9.019 -10.768 1.00 0.00 O ATOM 1144 CB LEU A 80 -0.502 6.266 -11.747 1.00 0.00 C ATOM 1145 CG LEU A 80 -0.171 4.917 -12.390 1.00 0.00 C ATOM 1146 CD1 LEU A 80 0.867 4.171 -11.576 1.00 0.00 C ATOM 1147 CD2 LEU A 80 -1.427 4.087 -12.574 1.00 0.00 C ATOM 0 H LEU A 80 1.718 6.446 -12.791 1.00 0.00 H new ATOM 0 HA LEU A 80 -0.700 7.482 -13.500 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -0.002 6.328 -10.780 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -1.574 6.312 -11.555 1.00 0.00 H new ATOM 0 HG LEU A 80 0.253 5.104 -13.377 1.00 0.00 H new ATOM 0 HD11 LEU A 80 1.086 3.216 -12.053 1.00 0.00 H new ATOM 0 HD12 LEU A 80 1.779 4.765 -11.518 1.00 0.00 H new ATOM 0 HD13 LEU A 80 0.484 3.995 -10.571 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -1.168 3.133 -13.033 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -1.891 3.910 -11.604 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -2.125 4.622 -13.218 1.00 0.00 H new ATOM 1159 N TRP A 81 -1.203 9.609 -12.468 1.00 0.00 N ATOM 1160 CA TRP A 81 -1.559 10.904 -11.907 1.00 0.00 C ATOM 1161 C TRP A 81 -2.971 10.877 -11.329 1.00 0.00 C ATOM 1162 O TRP A 81 -3.811 10.085 -11.754 1.00 0.00 O ATOM 1163 CB TRP A 81 -1.465 11.979 -12.993 1.00 0.00 C ATOM 1164 CG TRP A 81 -2.185 11.605 -14.255 1.00 0.00 C ATOM 1165 CD1 TRP A 81 -1.703 10.846 -15.286 1.00 0.00 C ATOM 1166 CD2 TRP A 81 -3.520 11.975 -14.621 1.00 0.00 C ATOM 1167 NE1 TRP A 81 -2.661 10.715 -16.263 1.00 0.00 N ATOM 1168 CE2 TRP A 81 -3.783 11.402 -15.880 1.00 0.00 C ATOM 1169 CE3 TRP A 81 -4.519 12.733 -14.004 1.00 0.00 C ATOM 1170 CZ2 TRP A 81 -5.003 11.564 -16.532 1.00 0.00 C ATOM 1171 CZ3 TRP A 81 -5.729 12.894 -14.653 1.00 0.00 C ATOM 1172 CH2 TRP A 81 -5.962 12.311 -15.905 1.00 0.00 C ATOM 0 H TRP A 81 -1.645 9.408 -13.365 1.00 0.00 H new ATOM 0 HA TRP A 81 -0.862 11.135 -11.101 1.00 0.00 H new ATOM 0 HB2 TRP A 81 -1.878 12.912 -12.609 1.00 0.00 H new ATOM 0 HB3 TRP A 81 -0.416 12.165 -13.222 1.00 0.00 H new ATOM 0 HD1 TRP A 81 -0.714 10.413 -15.326 1.00 0.00 H new ATOM 0 HE1 TRP A 81 -2.554 10.191 -17.132 1.00 0.00 H new ATOM 0 HE3 TRP A 81 -4.349 13.185 -13.038 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 -5.185 11.116 -17.498 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 -6.508 13.479 -14.187 1.00 0.00 H new ATOM 0 HH2 TRP A 81 -6.919 12.454 -16.385 1.00 0.00 H new ATOM 1183 N CYS A 82 -3.224 11.750 -10.359 1.00 0.00 N ATOM 1184 CA CYS A 82 -4.534 11.826 -9.725 1.00 0.00 C ATOM 1185 C CYS A 82 -5.090 13.244 -9.799 1.00 0.00 C ATOM 1186 O CYS A 82 -4.481 14.188 -9.294 1.00 0.00 O ATOM 1187 CB CYS A 82 -4.445 11.377 -8.265 1.00 0.00 C ATOM 1188 SG CYS A 82 -3.273 12.342 -7.258 1.00 0.00 S ATOM 0 H CYS A 82 -2.540 12.414 -9.996 1.00 0.00 H new ATOM 0 HA CYS A 82 -5.210 11.160 -10.262 1.00 0.00 H new ATOM 0 HB2 CYS A 82 -5.435 11.445 -7.815 1.00 0.00 H new ATOM 0 HB3 CYS A 82 -4.153 10.327 -8.236 1.00 0.00 H new ATOM 1193 N SER A 83 -6.250 13.386 -10.432 1.00 0.00 N ATOM 1194 CA SER A 83 -6.889 14.689 -10.574 1.00 0.00 C ATOM 1195 C SER A 83 -6.972 15.404 -9.229 1.00 0.00 C ATOM 1196 O SER A 83 -7.626 14.929 -8.300 1.00 0.00 O ATOM 1197 CB SER A 83 -8.290 14.532 -11.167 1.00 0.00 C ATOM 1198 OG SER A 83 -8.966 15.777 -11.221 1.00 0.00 O ATOM 0 H SER A 83 -6.767 12.615 -10.855 1.00 0.00 H new ATOM 0 HA SER A 83 -6.281 15.291 -11.249 1.00 0.00 H new ATOM 0 HB2 SER A 83 -8.218 14.110 -12.170 1.00 0.00 H new ATOM 0 HB3 SER A 83 -8.866 13.828 -10.566 1.00 0.00 H new ATOM 0 HG SER A 83 -9.654 15.806 -10.524 1.00 0.00 H new ATOM 1204 N THR A 84 -6.305 16.549 -9.131 1.00 0.00 N ATOM 1205 CA THR A 84 -6.303 17.330 -7.901 1.00 0.00 C ATOM 1206 C THR A 84 -7.498 18.276 -7.849 1.00 0.00 C ATOM 1207 O THR A 84 -7.371 19.431 -7.443 1.00 0.00 O ATOM 1208 CB THR A 84 -5.008 18.151 -7.756 1.00 0.00 C ATOM 1209 OG1 THR A 84 -4.704 18.809 -8.992 1.00 0.00 O ATOM 1210 CG2 THR A 84 -3.844 17.257 -7.354 1.00 0.00 C ATOM 0 H THR A 84 -5.759 16.956 -9.890 1.00 0.00 H new ATOM 0 HA THR A 84 -6.367 16.619 -7.077 1.00 0.00 H new ATOM 0 HB THR A 84 -5.162 18.896 -6.976 1.00 0.00 H new ATOM 0 HG1 THR A 84 -3.788 19.156 -8.961 1.00 0.00 H new ATOM 0 HG21 THR A 84 -2.940 17.858 -7.257 1.00 0.00 H new ATOM 0 HG22 THR A 84 -4.065 16.779 -6.400 1.00 0.00 H new ATOM 0 HG23 THR A 84 -3.692 16.493 -8.116 1.00 0.00 H new ATOM 1218 N THR A 85 -8.659 17.778 -8.262 1.00 0.00 N ATOM 1219 CA THR A 85 -9.878 18.578 -8.264 1.00 0.00 C ATOM 1220 C THR A 85 -11.078 17.750 -8.710 1.00 0.00 C ATOM 1221 O THR A 85 -11.103 17.224 -9.823 1.00 0.00 O ATOM 1222 CB THR A 85 -9.744 19.804 -9.185 1.00 0.00 C ATOM 1223 OG1 THR A 85 -8.899 19.492 -10.299 1.00 0.00 O ATOM 1224 CG2 THR A 85 -9.169 20.990 -8.424 1.00 0.00 C ATOM 0 H THR A 85 -8.781 16.823 -8.600 1.00 0.00 H new ATOM 0 HA THR A 85 -10.035 18.918 -7.240 1.00 0.00 H new ATOM 0 HB THR A 85 -10.737 20.069 -9.547 1.00 0.00 H new ATOM 0 HG1 THR A 85 -9.452 19.292 -11.083 1.00 0.00 H new ATOM 0 HG21 THR A 85 -9.083 21.845 -9.094 1.00 0.00 H new ATOM 0 HG22 THR A 85 -9.828 21.244 -7.594 1.00 0.00 H new ATOM 0 HG23 THR A 85 -8.183 20.731 -8.038 1.00 0.00 H new ATOM 1232 N SER A 86 -12.072 17.640 -7.834 1.00 0.00 N ATOM 1233 CA SER A 86 -13.276 16.876 -8.138 1.00 0.00 C ATOM 1234 C SER A 86 -13.659 17.024 -9.606 1.00 0.00 C ATOM 1235 O SER A 86 -14.110 16.070 -10.241 1.00 0.00 O ATOM 1236 CB SER A 86 -14.433 17.335 -7.249 1.00 0.00 C ATOM 1237 OG SER A 86 -15.636 17.440 -7.990 1.00 0.00 O ATOM 0 H SER A 86 -12.067 18.070 -6.909 1.00 0.00 H new ATOM 0 HA SER A 86 -13.068 15.824 -7.940 1.00 0.00 H new ATOM 0 HB2 SER A 86 -14.568 16.629 -6.429 1.00 0.00 H new ATOM 0 HB3 SER A 86 -14.192 18.300 -6.803 1.00 0.00 H new ATOM 0 HG SER A 86 -16.360 17.733 -7.398 1.00 0.00 H new ATOM 1243 N ASN A 87 -13.476 18.227 -10.142 1.00 0.00 N ATOM 1244 CA ASN A 87 -13.803 18.499 -11.537 1.00 0.00 C ATOM 1245 C ASN A 87 -12.540 18.554 -12.391 1.00 0.00 C ATOM 1246 O ASN A 87 -12.065 19.633 -12.746 1.00 0.00 O ATOM 1247 CB ASN A 87 -14.569 19.819 -11.655 1.00 0.00 C ATOM 1248 CG ASN A 87 -15.351 20.147 -10.398 1.00 0.00 C ATOM 1249 OD1 ASN A 87 -14.788 20.610 -9.406 1.00 0.00 O ATOM 1250 ND2 ASN A 87 -16.657 19.908 -10.435 1.00 0.00 N ATOM 0 H ASN A 87 -13.103 19.028 -9.632 1.00 0.00 H new ATOM 0 HA ASN A 87 -14.432 17.687 -11.902 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -13.867 20.626 -11.864 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -15.253 19.765 -12.502 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -17.236 20.109 -9.619 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -17.081 19.523 -11.279 1.00 0.00 H new ATOM 1257 N TYR A 88 -12.001 17.384 -12.716 1.00 0.00 N ATOM 1258 CA TYR A 88 -10.793 17.297 -13.528 1.00 0.00 C ATOM 1259 C TYR A 88 -10.959 18.068 -14.834 1.00 0.00 C ATOM 1260 O TYR A 88 -10.162 18.951 -15.151 1.00 0.00 O ATOM 1261 CB TYR A 88 -10.455 15.836 -13.824 1.00 0.00 C ATOM 1262 CG TYR A 88 -9.343 15.662 -14.834 1.00 0.00 C ATOM 1263 CD1 TYR A 88 -8.026 15.957 -14.502 1.00 0.00 C ATOM 1264 CD2 TYR A 88 -9.609 15.204 -16.117 1.00 0.00 C ATOM 1265 CE1 TYR A 88 -7.007 15.801 -15.422 1.00 0.00 C ATOM 1266 CE2 TYR A 88 -8.595 15.043 -17.042 1.00 0.00 C ATOM 1267 CZ TYR A 88 -7.296 15.344 -16.690 1.00 0.00 C ATOM 1268 OH TYR A 88 -6.284 15.186 -17.609 1.00 0.00 O ATOM 0 H TYR A 88 -12.382 16.482 -12.429 1.00 0.00 H new ATOM 0 HA TYR A 88 -9.974 17.744 -12.964 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -10.170 15.343 -12.895 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -11.349 15.333 -14.191 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -7.795 16.314 -13.509 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -10.625 14.970 -16.397 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -5.989 16.036 -15.149 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -8.819 14.683 -18.035 1.00 0.00 H new ATOM 0 HH TYR A 88 -6.385 14.323 -18.061 1.00 0.00 H new ATOM 1278 N GLU A 89 -11.999 17.728 -15.587 1.00 0.00 N ATOM 1279 CA GLU A 89 -12.270 18.388 -16.860 1.00 0.00 C ATOM 1280 C GLU A 89 -12.460 19.888 -16.664 1.00 0.00 C ATOM 1281 O GLU A 89 -12.415 20.660 -17.622 1.00 0.00 O ATOM 1282 CB GLU A 89 -13.513 17.785 -17.516 1.00 0.00 C ATOM 1283 CG GLU A 89 -14.763 17.884 -16.657 1.00 0.00 C ATOM 1284 CD GLU A 89 -15.773 18.871 -17.208 1.00 0.00 C ATOM 1285 OE1 GLU A 89 -15.728 19.149 -18.425 1.00 0.00 O ATOM 1286 OE2 GLU A 89 -16.609 19.366 -16.423 1.00 0.00 O ATOM 0 H GLU A 89 -12.668 17.000 -15.339 1.00 0.00 H new ATOM 0 HA GLU A 89 -11.412 18.231 -17.513 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -13.694 18.290 -18.465 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -13.321 16.737 -17.744 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -15.226 16.900 -16.581 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -14.482 18.183 -15.647 1.00 0.00 H new ATOM 1293 N GLN A 90 -12.673 20.295 -15.417 1.00 0.00 N ATOM 1294 CA GLN A 90 -12.870 21.705 -15.096 1.00 0.00 C ATOM 1295 C GLN A 90 -11.534 22.402 -14.863 1.00 0.00 C ATOM 1296 O GLN A 90 -11.122 23.254 -15.651 1.00 0.00 O ATOM 1297 CB GLN A 90 -13.756 21.847 -13.857 1.00 0.00 C ATOM 1298 CG GLN A 90 -14.770 22.975 -13.961 1.00 0.00 C ATOM 1299 CD GLN A 90 -16.095 22.517 -14.540 1.00 0.00 C ATOM 1300 OE1 GLN A 90 -16.249 21.358 -14.928 1.00 0.00 O ATOM 1301 NE2 GLN A 90 -17.060 23.426 -14.601 1.00 0.00 N ATOM 0 H GLN A 90 -12.714 19.669 -14.612 1.00 0.00 H new ATOM 0 HA GLN A 90 -13.363 22.180 -15.944 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -14.285 20.909 -13.689 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -13.124 22.017 -12.986 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -14.938 23.400 -12.971 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -14.361 23.770 -14.584 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -16.889 24.375 -14.268 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -17.973 23.176 -14.981 1.00 0.00 H new ATOM 1310 N ASP A 91 -10.861 22.034 -13.778 1.00 0.00 N ATOM 1311 CA ASP A 91 -9.571 22.625 -13.441 1.00 0.00 C ATOM 1312 C ASP A 91 -8.448 21.965 -14.234 1.00 0.00 C ATOM 1313 O ASP A 91 -7.488 22.623 -14.634 1.00 0.00 O ATOM 1314 CB ASP A 91 -9.300 22.491 -11.942 1.00 0.00 C ATOM 1315 CG ASP A 91 -10.358 23.176 -11.099 1.00 0.00 C ATOM 1316 OD1 ASP A 91 -11.520 22.719 -11.116 1.00 0.00 O ATOM 1317 OD2 ASP A 91 -10.024 24.172 -10.423 1.00 0.00 O ATOM 0 H ASP A 91 -11.187 21.329 -13.117 1.00 0.00 H new ATOM 0 HA ASP A 91 -9.604 23.683 -13.703 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -9.256 21.435 -11.677 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -8.324 22.918 -11.713 1.00 0.00 H new ATOM 1322 N GLN A 92 -8.574 20.661 -14.457 1.00 0.00 N ATOM 1323 CA GLN A 92 -7.569 19.912 -15.202 1.00 0.00 C ATOM 1324 C GLN A 92 -6.336 19.654 -14.343 1.00 0.00 C ATOM 1325 O GLN A 92 -5.288 19.252 -14.849 1.00 0.00 O ATOM 1326 CB GLN A 92 -7.173 20.671 -16.470 1.00 0.00 C ATOM 1327 CG GLN A 92 -8.339 21.375 -17.146 1.00 0.00 C ATOM 1328 CD GLN A 92 -8.877 20.602 -18.334 1.00 0.00 C ATOM 1329 OE1 GLN A 92 -8.988 21.137 -19.437 1.00 0.00 O ATOM 1330 NE2 GLN A 92 -9.215 19.338 -18.114 1.00 0.00 N ATOM 0 H GLN A 92 -9.362 20.101 -14.132 1.00 0.00 H new ATOM 0 HA GLN A 92 -8.001 18.952 -15.483 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -6.410 21.408 -16.219 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -6.722 19.973 -17.176 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -9.139 21.523 -16.421 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -8.020 22.364 -17.475 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -9.106 18.936 -17.183 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -9.584 18.769 -18.876 1.00 0.00 H new ATOM 1339 N LYS A 93 -6.468 19.888 -13.042 1.00 0.00 N ATOM 1340 CA LYS A 93 -5.363 19.681 -12.112 1.00 0.00 C ATOM 1341 C LYS A 93 -5.132 18.194 -11.864 1.00 0.00 C ATOM 1342 O LYS A 93 -6.058 17.388 -11.959 1.00 0.00 O ATOM 1343 CB LYS A 93 -5.643 20.394 -10.788 1.00 0.00 C ATOM 1344 CG LYS A 93 -6.256 21.775 -10.958 1.00 0.00 C ATOM 1345 CD LYS A 93 -5.195 22.863 -10.931 1.00 0.00 C ATOM 1346 CE LYS A 93 -5.816 24.249 -10.990 1.00 0.00 C ATOM 1347 NZ LYS A 93 -5.324 25.029 -12.160 1.00 0.00 N ATOM 0 H LYS A 93 -7.329 20.221 -12.607 1.00 0.00 H new ATOM 0 HA LYS A 93 -4.461 20.100 -12.559 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -6.314 19.779 -10.189 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -4.711 20.485 -10.230 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -6.800 21.819 -11.902 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -6.981 21.953 -10.164 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -4.599 22.769 -10.023 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -4.516 22.731 -11.773 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -6.901 24.159 -11.044 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -5.587 24.789 -10.071 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -5.771 25.968 -12.164 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -4.292 25.137 -12.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -5.565 24.527 -13.038 1.00 0.00 H new ATOM 1361 N TYR A 94 -3.893 17.837 -11.545 1.00 0.00 N ATOM 1362 CA TYR A 94 -3.541 16.447 -11.284 1.00 0.00 C ATOM 1363 C TYR A 94 -2.185 16.348 -10.594 1.00 0.00 C ATOM 1364 O TYR A 94 -1.480 17.345 -10.443 1.00 0.00 O ATOM 1365 CB TYR A 94 -3.520 15.649 -12.589 1.00 0.00 C ATOM 1366 CG TYR A 94 -2.612 16.238 -13.645 1.00 0.00 C ATOM 1367 CD1 TYR A 94 -1.246 16.364 -13.425 1.00 0.00 C ATOM 1368 CD2 TYR A 94 -3.122 16.670 -14.863 1.00 0.00 C ATOM 1369 CE1 TYR A 94 -0.415 16.902 -14.387 1.00 0.00 C ATOM 1370 CE2 TYR A 94 -2.296 17.209 -15.832 1.00 0.00 C ATOM 1371 CZ TYR A 94 -0.944 17.323 -15.589 1.00 0.00 C ATOM 1372 OH TYR A 94 -0.119 17.859 -16.550 1.00 0.00 O ATOM 0 H TYR A 94 -3.115 18.492 -11.461 1.00 0.00 H new ATOM 0 HA TYR A 94 -4.298 16.027 -10.621 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -3.201 14.629 -12.376 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -4.534 15.590 -12.985 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -0.827 16.035 -12.485 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -4.181 16.583 -15.056 1.00 0.00 H new ATOM 0 HE1 TYR A 94 0.645 16.993 -14.199 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -2.708 17.539 -16.774 1.00 0.00 H new ATOM 0 HH TYR A 94 -0.649 18.104 -17.337 1.00 0.00 H new ATOM 1382 N SER A 95 -1.826 15.138 -10.176 1.00 0.00 N ATOM 1383 CA SER A 95 -0.553 14.907 -9.504 1.00 0.00 C ATOM 1384 C SER A 95 -0.091 13.466 -9.694 1.00 0.00 C ATOM 1385 O SER A 95 -0.872 12.528 -9.538 1.00 0.00 O ATOM 1386 CB SER A 95 -0.677 15.222 -8.012 1.00 0.00 C ATOM 1387 OG SER A 95 -0.662 16.621 -7.782 1.00 0.00 O ATOM 0 H SER A 95 -2.399 14.302 -10.291 1.00 0.00 H new ATOM 0 HA SER A 95 0.190 15.569 -9.949 1.00 0.00 H new ATOM 0 HB2 SER A 95 -1.602 14.796 -7.623 1.00 0.00 H new ATOM 0 HB3 SER A 95 0.143 14.752 -7.469 1.00 0.00 H new ATOM 0 HG SER A 95 -0.812 17.093 -8.628 1.00 0.00 H new ATOM 1393 N PHE A 96 1.184 13.298 -10.031 1.00 0.00 N ATOM 1394 CA PHE A 96 1.749 11.970 -10.243 1.00 0.00 C ATOM 1395 C PHE A 96 1.976 11.257 -8.914 1.00 0.00 C ATOM 1396 O PHE A 96 2.469 11.851 -7.955 1.00 0.00 O ATOM 1397 CB PHE A 96 3.068 12.072 -11.013 1.00 0.00 C ATOM 1398 CG PHE A 96 3.109 13.221 -11.978 1.00 0.00 C ATOM 1399 CD1 PHE A 96 1.976 13.592 -12.682 1.00 0.00 C ATOM 1400 CD2 PHE A 96 4.281 13.931 -12.179 1.00 0.00 C ATOM 1401 CE1 PHE A 96 2.010 14.650 -13.570 1.00 0.00 C ATOM 1402 CE2 PHE A 96 4.322 14.991 -13.066 1.00 0.00 C ATOM 1403 CZ PHE A 96 3.185 15.350 -13.762 1.00 0.00 C ATOM 0 H PHE A 96 1.845 14.064 -10.163 1.00 0.00 H new ATOM 0 HA PHE A 96 1.038 11.388 -10.829 1.00 0.00 H new ATOM 0 HB2 PHE A 96 3.888 12.175 -10.302 1.00 0.00 H new ATOM 0 HB3 PHE A 96 3.234 11.143 -11.559 1.00 0.00 H new ATOM 0 HD1 PHE A 96 1.055 13.048 -12.535 1.00 0.00 H new ATOM 0 HD2 PHE A 96 5.173 13.654 -11.637 1.00 0.00 H new ATOM 0 HE1 PHE A 96 1.119 14.929 -14.113 1.00 0.00 H new ATOM 0 HE2 PHE A 96 5.242 15.537 -13.214 1.00 0.00 H new ATOM 0 HZ PHE A 96 3.214 16.177 -14.456 1.00 0.00 H new ATOM 1413 N CYS A 97 1.613 9.980 -8.865 1.00 0.00 N ATOM 1414 CA CYS A 97 1.775 9.184 -7.654 1.00 0.00 C ATOM 1415 C CYS A 97 3.068 8.377 -7.702 1.00 0.00 C ATOM 1416 O CYS A 97 3.809 8.432 -8.683 1.00 0.00 O ATOM 1417 CB CYS A 97 0.580 8.246 -7.472 1.00 0.00 C ATOM 1418 SG CYS A 97 -1.026 9.101 -7.375 1.00 0.00 S ATOM 0 H CYS A 97 1.204 9.474 -9.650 1.00 0.00 H new ATOM 0 HA CYS A 97 1.826 9.866 -6.805 1.00 0.00 H new ATOM 0 HB2 CYS A 97 0.555 7.541 -8.303 1.00 0.00 H new ATOM 0 HB3 CYS A 97 0.725 7.662 -6.563 1.00 0.00 H new ATOM 1423 N THR A 98 3.331 7.628 -6.637 1.00 0.00 N ATOM 1424 CA THR A 98 4.535 6.808 -6.557 1.00 0.00 C ATOM 1425 C THR A 98 4.195 5.326 -6.646 1.00 0.00 C ATOM 1426 O THR A 98 3.414 4.811 -5.845 1.00 0.00 O ATOM 1427 CB THR A 98 5.312 7.066 -5.254 1.00 0.00 C ATOM 1428 OG1 THR A 98 5.069 6.007 -4.320 1.00 0.00 O ATOM 1429 CG2 THR A 98 4.907 8.396 -4.635 1.00 0.00 C ATOM 0 H THR A 98 2.727 7.571 -5.817 1.00 0.00 H new ATOM 0 HA THR A 98 5.162 7.089 -7.403 1.00 0.00 H new ATOM 0 HB THR A 98 6.375 7.103 -5.493 1.00 0.00 H new ATOM 0 HG1 THR A 98 4.191 5.609 -4.498 1.00 0.00 H new ATOM 0 HG21 THR A 98 5.470 8.556 -3.715 1.00 0.00 H new ATOM 0 HG22 THR A 98 5.120 9.203 -5.336 1.00 0.00 H new ATOM 0 HG23 THR A 98 3.841 8.383 -4.410 1.00 0.00 H new ATOM 1437 N ASP A 99 4.788 4.649 -7.623 1.00 0.00 N ATOM 1438 CA ASP A 99 4.553 3.223 -7.825 1.00 0.00 C ATOM 1439 C ASP A 99 3.125 2.849 -7.452 1.00 0.00 C ATOM 1440 O ASP A 99 2.879 1.800 -6.856 1.00 0.00 O ATOM 1441 CB ASP A 99 5.545 2.396 -7.005 1.00 0.00 C ATOM 1442 CG ASP A 99 6.917 3.038 -6.937 1.00 0.00 C ATOM 1443 OD1 ASP A 99 7.642 2.994 -7.953 1.00 0.00 O ATOM 1444 OD2 ASP A 99 7.265 3.582 -5.869 1.00 0.00 O ATOM 0 H ASP A 99 5.437 5.066 -8.290 1.00 0.00 H new ATOM 0 HA ASP A 99 4.701 3.003 -8.882 1.00 0.00 H new ATOM 0 HB2 ASP A 99 5.157 2.266 -5.995 1.00 0.00 H new ATOM 0 HB3 ASP A 99 5.634 1.402 -7.443 1.00 0.00 H new ATOM 1449 N HIS A 100 2.189 3.717 -7.812 1.00 0.00 N ATOM 1450 CA HIS A 100 0.778 3.489 -7.521 1.00 0.00 C ATOM 1451 C HIS A 100 0.606 2.792 -6.175 1.00 0.00 C ATOM 1452 O HIS A 100 0.018 1.713 -6.097 1.00 0.00 O ATOM 1453 CB HIS A 100 0.137 2.649 -8.628 1.00 0.00 C ATOM 1454 CG HIS A 100 -1.242 2.172 -8.295 1.00 0.00 C ATOM 1455 ND1 HIS A 100 -1.618 0.847 -8.364 1.00 0.00 N ATOM 1456 CD2 HIS A 100 -2.341 2.852 -7.887 1.00 0.00 C ATOM 1457 CE1 HIS A 100 -2.887 0.732 -8.014 1.00 0.00 C ATOM 1458 NE2 HIS A 100 -3.348 1.933 -7.720 1.00 0.00 N ATOM 0 H HIS A 100 2.381 4.588 -8.307 1.00 0.00 H new ATOM 0 HA HIS A 100 0.281 4.458 -7.475 1.00 0.00 H new ATOM 0 HB2 HIS A 100 0.097 3.239 -9.544 1.00 0.00 H new ATOM 0 HB3 HIS A 100 0.772 1.787 -8.832 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -2.412 3.917 -7.724 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -3.451 -0.188 -7.975 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -4.299 2.145 -7.418 1.00 0.00 H new ATOM 1467 N THR A 101 1.117 3.424 -5.120 1.00 0.00 N ATOM 1468 CA THR A 101 1.024 2.883 -3.770 1.00 0.00 C ATOM 1469 C THR A 101 0.986 1.356 -3.772 1.00 0.00 C ATOM 1470 O THR A 101 -0.067 0.751 -3.974 1.00 0.00 O ATOM 1471 CB THR A 101 -0.219 3.425 -3.044 1.00 0.00 C ATOM 1472 OG1 THR A 101 -0.154 3.106 -1.648 1.00 0.00 O ATOM 1473 CG2 THR A 101 -1.494 2.852 -3.644 1.00 0.00 C ATOM 0 H THR A 101 1.603 4.319 -5.178 1.00 0.00 H new ATOM 0 HA THR A 101 1.920 3.205 -3.239 1.00 0.00 H new ATOM 0 HB THR A 101 -0.236 4.508 -3.166 1.00 0.00 H new ATOM 0 HG1 THR A 101 -0.949 3.457 -1.195 1.00 0.00 H new ATOM 0 HG21 THR A 101 -2.358 3.251 -3.112 1.00 0.00 H new ATOM 0 HG22 THR A 101 -1.557 3.128 -4.697 1.00 0.00 H new ATOM 0 HG23 THR A 101 -1.483 1.766 -3.553 1.00 0.00 H new ATOM 1481 N VAL A 102 2.142 0.742 -3.545 1.00 0.00 N ATOM 1482 CA VAL A 102 2.242 -0.713 -3.521 1.00 0.00 C ATOM 1483 C VAL A 102 1.699 -1.280 -2.213 1.00 0.00 C ATOM 1484 O VAL A 102 2.101 -0.858 -1.129 1.00 0.00 O ATOM 1485 CB VAL A 102 3.698 -1.179 -3.704 1.00 0.00 C ATOM 1486 CG1 VAL A 102 3.741 -2.572 -4.313 1.00 0.00 C ATOM 1487 CG2 VAL A 102 4.473 -0.189 -4.560 1.00 0.00 C ATOM 0 H VAL A 102 3.022 1.228 -3.375 1.00 0.00 H new ATOM 0 HA VAL A 102 1.642 -1.085 -4.352 1.00 0.00 H new ATOM 0 HB VAL A 102 4.172 -1.223 -2.723 1.00 0.00 H new ATOM 0 HG11 VAL A 102 4.778 -2.884 -4.435 1.00 0.00 H new ATOM 0 HG12 VAL A 102 3.226 -3.273 -3.656 1.00 0.00 H new ATOM 0 HG13 VAL A 102 3.250 -2.559 -5.286 1.00 0.00 H new ATOM 0 HG21 VAL A 102 5.500 -0.536 -4.678 1.00 0.00 H new ATOM 0 HG22 VAL A 102 4.002 -0.109 -5.540 1.00 0.00 H new ATOM 0 HG23 VAL A 102 4.473 0.788 -4.076 1.00 0.00 H new ATOM 1497 N LEU A 103 0.784 -2.236 -2.323 1.00 0.00 N ATOM 1498 CA LEU A 103 0.186 -2.861 -1.149 1.00 0.00 C ATOM 1499 C LEU A 103 -0.075 -4.343 -1.395 1.00 0.00 C ATOM 1500 O LEU A 103 -1.065 -4.714 -2.026 1.00 0.00 O ATOM 1501 CB LEU A 103 -1.121 -2.155 -0.781 1.00 0.00 C ATOM 1502 CG LEU A 103 -1.257 -0.729 -1.315 1.00 0.00 C ATOM 1503 CD1 LEU A 103 -1.915 -0.735 -2.687 1.00 0.00 C ATOM 1504 CD2 LEU A 103 -2.050 0.132 -0.344 1.00 0.00 C ATOM 0 H LEU A 103 0.440 -2.595 -3.213 1.00 0.00 H new ATOM 0 HA LEU A 103 0.888 -2.767 -0.320 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -1.955 -2.748 -1.156 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -1.210 -2.130 0.305 1.00 0.00 H new ATOM 0 HG LEU A 103 -0.259 -0.301 -1.414 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -2.004 0.288 -3.052 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -1.306 -1.316 -3.380 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -2.907 -1.181 -2.613 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -2.136 1.143 -0.741 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -3.045 -0.292 -0.211 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -1.537 0.162 0.618 1.00 0.00 H new ATOM 1516 N VAL A 104 0.820 -5.187 -0.892 1.00 0.00 N ATOM 1517 CA VAL A 104 0.687 -6.630 -1.056 1.00 0.00 C ATOM 1518 C VAL A 104 0.259 -7.289 0.252 1.00 0.00 C ATOM 1519 O VAL A 104 0.846 -7.041 1.303 1.00 0.00 O ATOM 1520 CB VAL A 104 2.010 -7.259 -1.541 1.00 0.00 C ATOM 1521 CG1 VAL A 104 2.019 -8.765 -1.318 1.00 0.00 C ATOM 1522 CG2 VAL A 104 2.243 -6.934 -3.007 1.00 0.00 C ATOM 0 H VAL A 104 1.645 -4.897 -0.367 1.00 0.00 H new ATOM 0 HA VAL A 104 -0.081 -6.802 -1.810 1.00 0.00 H new ATOM 0 HB VAL A 104 2.823 -6.831 -0.954 1.00 0.00 H new ATOM 0 HG11 VAL A 104 2.964 -9.179 -1.670 1.00 0.00 H new ATOM 0 HG12 VAL A 104 1.904 -8.976 -0.255 1.00 0.00 H new ATOM 0 HG13 VAL A 104 1.196 -9.219 -1.870 1.00 0.00 H new ATOM 0 HG21 VAL A 104 3.180 -7.384 -3.335 1.00 0.00 H new ATOM 0 HG22 VAL A 104 1.421 -7.331 -3.603 1.00 0.00 H new ATOM 0 HG23 VAL A 104 2.295 -5.853 -3.136 1.00 0.00 H new ATOM 1532 N GLN A 105 -0.767 -8.130 0.178 1.00 0.00 N ATOM 1533 CA GLN A 105 -1.271 -8.822 1.360 1.00 0.00 C ATOM 1534 C GLN A 105 -0.557 -10.156 1.553 1.00 0.00 C ATOM 1535 O GLN A 105 -0.821 -11.122 0.839 1.00 0.00 O ATOM 1536 CB GLN A 105 -2.778 -9.051 1.238 1.00 0.00 C ATOM 1537 CG GLN A 105 -3.610 -8.057 2.033 1.00 0.00 C ATOM 1538 CD GLN A 105 -3.146 -7.927 3.471 1.00 0.00 C ATOM 1539 OE1 GLN A 105 -2.450 -8.799 3.992 1.00 0.00 O ATOM 1540 NE2 GLN A 105 -3.532 -6.835 4.120 1.00 0.00 N ATOM 0 H GLN A 105 -1.265 -8.349 -0.685 1.00 0.00 H new ATOM 0 HA GLN A 105 -1.075 -8.195 2.230 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -3.062 -8.992 0.187 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -3.012 -10.061 1.576 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -3.563 -7.081 1.550 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -4.654 -8.369 2.019 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -4.109 -6.138 3.648 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -3.252 -6.693 5.090 1.00 0.00 H new ATOM 1549 N THR A 106 0.350 -10.200 2.524 1.00 0.00 N ATOM 1550 CA THR A 106 1.103 -11.416 2.811 1.00 0.00 C ATOM 1551 C THR A 106 0.900 -11.864 4.254 1.00 0.00 C ATOM 1552 O THR A 106 0.383 -11.113 5.081 1.00 0.00 O ATOM 1553 CB THR A 106 2.608 -11.218 2.555 1.00 0.00 C ATOM 1554 OG1 THR A 106 3.181 -10.418 3.597 1.00 0.00 O ATOM 1555 CG2 THR A 106 2.845 -10.551 1.210 1.00 0.00 C ATOM 0 H THR A 106 0.581 -9.409 3.125 1.00 0.00 H new ATOM 0 HA THR A 106 0.725 -12.186 2.139 1.00 0.00 H new ATOM 0 HB THR A 106 3.084 -12.198 2.546 1.00 0.00 H new ATOM 0 HG1 THR A 106 2.592 -9.659 3.788 1.00 0.00 H new ATOM 0 HG21 THR A 106 3.916 -10.422 1.052 1.00 0.00 H new ATOM 0 HG22 THR A 106 2.434 -11.175 0.417 1.00 0.00 H new ATOM 0 HG23 THR A 106 2.356 -9.577 1.196 1.00 0.00 H new ATOM 1563 N ARG A 107 1.310 -13.093 4.549 1.00 0.00 N ATOM 1564 CA ARG A 107 1.175 -13.642 5.893 1.00 0.00 C ATOM 1565 C ARG A 107 2.036 -14.891 6.059 1.00 0.00 C ATOM 1566 O ARG A 107 2.391 -15.546 5.080 1.00 0.00 O ATOM 1567 CB ARG A 107 -0.289 -13.975 6.186 1.00 0.00 C ATOM 1568 CG ARG A 107 -0.473 -14.942 7.345 1.00 0.00 C ATOM 1569 CD ARG A 107 -1.914 -15.414 7.453 1.00 0.00 C ATOM 1570 NE ARG A 107 -2.584 -14.860 8.626 1.00 0.00 N ATOM 1571 CZ ARG A 107 -3.893 -14.953 8.838 1.00 0.00 C ATOM 1572 NH1 ARG A 107 -4.667 -15.574 7.958 1.00 0.00 N ATOM 1573 NH2 ARG A 107 -4.429 -14.424 9.929 1.00 0.00 N ATOM 0 H ARG A 107 1.739 -13.728 3.875 1.00 0.00 H new ATOM 0 HA ARG A 107 1.518 -12.889 6.603 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -0.826 -13.052 6.405 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -0.742 -14.403 5.291 1.00 0.00 H new ATOM 0 HG2 ARG A 107 0.184 -15.802 7.211 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -0.177 -14.457 8.275 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -2.459 -15.125 6.554 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -1.936 -16.503 7.503 1.00 0.00 H new ATOM 0 HE ARG A 107 -2.016 -14.375 9.321 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -4.258 -15.981 7.117 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -5.671 -15.644 8.122 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -3.837 -13.945 10.607 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -5.434 -14.496 10.090 1.00 0.00 H new ATOM 1587 N GLY A 108 2.366 -15.213 7.304 1.00 0.00 N ATOM 1588 CA GLY A 108 3.182 -16.382 7.577 1.00 0.00 C ATOM 1589 C GLY A 108 4.619 -16.023 7.903 1.00 0.00 C ATOM 1590 O GLY A 108 4.945 -14.852 8.095 1.00 0.00 O ATOM 0 H GLY A 108 2.083 -14.686 8.130 1.00 0.00 H new ATOM 0 HA2 GLY A 108 2.751 -16.935 8.411 1.00 0.00 H new ATOM 0 HA3 GLY A 108 3.164 -17.044 6.712 1.00 0.00 H new ATOM 1594 N GLY A 109 5.480 -17.033 7.965 1.00 0.00 N ATOM 1595 CA GLY A 109 6.879 -16.797 8.271 1.00 0.00 C ATOM 1596 C GLY A 109 7.066 -15.851 9.440 1.00 0.00 C ATOM 1597 O GLY A 109 7.162 -16.284 10.588 1.00 0.00 O ATOM 0 H GLY A 109 5.234 -18.011 7.809 1.00 0.00 H new ATOM 0 HA2 GLY A 109 7.364 -17.747 8.496 1.00 0.00 H new ATOM 0 HA3 GLY A 109 7.375 -16.386 7.392 1.00 0.00 H new ATOM 1601 N ASN A 110 7.119 -14.555 9.147 1.00 0.00 N ATOM 1602 CA ASN A 110 7.296 -13.545 10.183 1.00 0.00 C ATOM 1603 C ASN A 110 6.543 -12.267 9.832 1.00 0.00 C ATOM 1604 O ASN A 110 7.103 -11.171 9.878 1.00 0.00 O ATOM 1605 CB ASN A 110 8.782 -13.238 10.377 1.00 0.00 C ATOM 1606 CG ASN A 110 9.658 -14.454 10.151 1.00 0.00 C ATOM 1607 OD1 ASN A 110 9.375 -15.540 10.654 1.00 0.00 O ATOM 1608 ND2 ASN A 110 10.732 -14.277 9.388 1.00 0.00 N ATOM 0 H ASN A 110 7.042 -14.181 8.201 1.00 0.00 H new ATOM 0 HA ASN A 110 6.889 -13.941 11.114 1.00 0.00 H new ATOM 0 HB2 ASN A 110 9.079 -12.447 9.689 1.00 0.00 H new ATOM 0 HB3 ASN A 110 8.943 -12.860 11.387 1.00 0.00 H new ATOM 0 HD21 ASN A 110 11.359 -15.060 9.200 1.00 0.00 H new ATOM 0 HD22 ASN A 110 10.929 -13.359 8.990 1.00 0.00 H new ATOM 1615 N SER A 111 5.270 -12.414 9.479 1.00 0.00 N ATOM 1616 CA SER A 111 4.439 -11.271 9.118 1.00 0.00 C ATOM 1617 C SER A 111 3.071 -11.360 9.787 1.00 0.00 C ATOM 1618 O SER A 111 2.691 -10.484 10.563 1.00 0.00 O ATOM 1619 CB SER A 111 4.275 -11.192 7.600 1.00 0.00 C ATOM 1620 OG SER A 111 3.700 -12.381 7.086 1.00 0.00 O ATOM 0 H SER A 111 4.791 -13.314 9.435 1.00 0.00 H new ATOM 0 HA SER A 111 4.936 -10.367 9.469 1.00 0.00 H new ATOM 0 HB2 SER A 111 3.646 -10.340 7.343 1.00 0.00 H new ATOM 0 HB3 SER A 111 5.246 -11.023 7.135 1.00 0.00 H new ATOM 0 HG SER A 111 4.204 -13.156 7.412 1.00 0.00 H new ATOM 1626 N ASN A 112 2.336 -12.423 9.478 1.00 0.00 N ATOM 1627 CA ASN A 112 1.010 -12.627 10.049 1.00 0.00 C ATOM 1628 C ASN A 112 0.049 -11.533 9.596 1.00 0.00 C ATOM 1629 O ASN A 112 -0.442 -10.748 10.409 1.00 0.00 O ATOM 1630 CB ASN A 112 1.088 -12.655 11.576 1.00 0.00 C ATOM 1631 CG ASN A 112 1.903 -13.823 12.093 1.00 0.00 C ATOM 1632 OD1 ASN A 112 2.058 -14.837 11.413 1.00 0.00 O ATOM 1633 ND2 ASN A 112 2.431 -13.686 13.305 1.00 0.00 N ATOM 0 H ASN A 112 2.636 -13.156 8.836 1.00 0.00 H new ATOM 0 HA ASN A 112 0.632 -13.586 9.695 1.00 0.00 H new ATOM 0 HB2 ASN A 112 1.528 -11.723 11.931 1.00 0.00 H new ATOM 0 HB3 ASN A 112 0.080 -12.709 11.987 1.00 0.00 H new ATOM 0 HD21 ASN A 112 2.990 -14.439 13.706 1.00 0.00 H new ATOM 0 HD22 ASN A 112 2.277 -12.828 13.834 1.00 0.00 H new ATOM 1640 N GLY A 113 -0.216 -11.486 8.294 1.00 0.00 N ATOM 1641 CA GLY A 113 -1.117 -10.484 7.756 1.00 0.00 C ATOM 1642 C GLY A 113 -0.469 -9.118 7.649 1.00 0.00 C ATOM 1643 O GLY A 113 -1.005 -8.129 8.150 1.00 0.00 O ATOM 0 H GLY A 113 0.177 -12.124 7.602 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -1.458 -10.799 6.770 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -2.000 -10.415 8.392 1.00 0.00 H new ATOM 1647 N ALA A 114 0.687 -9.061 6.996 1.00 0.00 N ATOM 1648 CA ALA A 114 1.407 -7.806 6.826 1.00 0.00 C ATOM 1649 C ALA A 114 1.392 -7.358 5.369 1.00 0.00 C ATOM 1650 O ALA A 114 1.796 -8.103 4.476 1.00 0.00 O ATOM 1651 CB ALA A 114 2.838 -7.947 7.322 1.00 0.00 C ATOM 0 H ALA A 114 1.145 -9.870 6.576 1.00 0.00 H new ATOM 0 HA ALA A 114 0.902 -7.043 7.419 1.00 0.00 H new ATOM 0 HB1 ALA A 114 3.364 -7.002 7.189 1.00 0.00 H new ATOM 0 HB2 ALA A 114 2.832 -8.213 8.379 1.00 0.00 H new ATOM 0 HB3 ALA A 114 3.345 -8.727 6.754 1.00 0.00 H new ATOM 1657 N LEU A 115 0.925 -6.135 5.136 1.00 0.00 N ATOM 1658 CA LEU A 115 0.860 -5.589 3.787 1.00 0.00 C ATOM 1659 C LEU A 115 2.259 -5.419 3.206 1.00 0.00 C ATOM 1660 O LEU A 115 2.846 -4.340 3.279 1.00 0.00 O ATOM 1661 CB LEU A 115 0.128 -4.246 3.790 1.00 0.00 C ATOM 1662 CG LEU A 115 -0.110 -3.636 2.408 1.00 0.00 C ATOM 1663 CD1 LEU A 115 -1.183 -4.413 1.661 1.00 0.00 C ATOM 1664 CD2 LEU A 115 -0.496 -2.170 2.532 1.00 0.00 C ATOM 0 H LEU A 115 0.587 -5.505 5.864 1.00 0.00 H new ATOM 0 HA LEU A 115 0.308 -6.291 3.163 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -0.835 -4.375 4.284 1.00 0.00 H new ATOM 0 HB3 LEU A 115 0.701 -3.538 4.389 1.00 0.00 H new ATOM 0 HG LEU A 115 0.817 -3.698 1.838 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -1.340 -3.965 0.680 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -0.865 -5.449 1.541 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -2.114 -4.383 2.226 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -0.662 -1.752 1.539 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -1.410 -2.083 3.119 1.00 0.00 H new ATOM 0 HD23 LEU A 115 0.307 -1.623 3.027 1.00 0.00 H new ATOM 1676 N CYS A 116 2.789 -6.493 2.630 1.00 0.00 N ATOM 1677 CA CYS A 116 4.120 -6.464 2.039 1.00 0.00 C ATOM 1678 C CYS A 116 4.364 -5.148 1.310 1.00 0.00 C ATOM 1679 O CYS A 116 3.422 -4.426 0.978 1.00 0.00 O ATOM 1680 CB CYS A 116 4.301 -7.635 1.073 1.00 0.00 C ATOM 1681 SG CYS A 116 5.789 -8.636 1.395 1.00 0.00 S ATOM 0 H CYS A 116 2.316 -7.394 2.560 1.00 0.00 H new ATOM 0 HA CYS A 116 4.848 -6.553 2.846 1.00 0.00 H new ATOM 0 HB2 CYS A 116 3.423 -8.279 1.129 1.00 0.00 H new ATOM 0 HB3 CYS A 116 4.348 -7.249 0.055 1.00 0.00 H new ATOM 1686 N HIS A 117 5.634 -4.843 1.067 1.00 0.00 N ATOM 1687 CA HIS A 117 6.006 -3.610 0.381 1.00 0.00 C ATOM 1688 C HIS A 117 6.949 -3.897 -0.783 1.00 0.00 C ATOM 1689 O HIS A 117 8.030 -4.453 -0.598 1.00 0.00 O ATOM 1690 CB HIS A 117 6.663 -2.638 1.365 1.00 0.00 C ATOM 1691 CG HIS A 117 7.530 -1.607 0.709 1.00 0.00 C ATOM 1692 ND1 HIS A 117 7.268 -1.085 -0.540 1.00 0.00 N ATOM 1693 CD2 HIS A 117 8.664 -1.001 1.137 1.00 0.00 C ATOM 1694 CE1 HIS A 117 8.203 -0.206 -0.853 1.00 0.00 C ATOM 1695 NE2 HIS A 117 9.060 -0.135 0.148 1.00 0.00 N ATOM 0 H HIS A 117 6.423 -5.432 1.334 1.00 0.00 H new ATOM 0 HA HIS A 117 5.100 -3.155 -0.019 1.00 0.00 H new ATOM 0 HB2 HIS A 117 5.885 -2.134 1.937 1.00 0.00 H new ATOM 0 HB3 HIS A 117 7.264 -3.206 2.075 1.00 0.00 H new ATOM 0 HD2 HIS A 117 9.163 -1.168 2.080 1.00 0.00 H new ATOM 0 HE1 HIS A 117 8.257 0.359 -1.772 1.00 0.00 H new ATOM 0 HE2 HIS A 117 9.883 0.466 0.182 1.00 0.00 H new ATOM 1704 N PHE A 118 6.531 -3.507 -1.983 1.00 0.00 N ATOM 1705 CA PHE A 118 7.337 -3.717 -3.180 1.00 0.00 C ATOM 1706 C PHE A 118 7.796 -2.382 -3.763 1.00 0.00 C ATOM 1707 O PHE A 118 7.032 -1.418 -3.803 1.00 0.00 O ATOM 1708 CB PHE A 118 6.539 -4.491 -4.229 1.00 0.00 C ATOM 1709 CG PHE A 118 6.370 -5.950 -3.913 1.00 0.00 C ATOM 1710 CD1 PHE A 118 5.286 -6.391 -3.171 1.00 0.00 C ATOM 1711 CD2 PHE A 118 7.291 -6.882 -4.365 1.00 0.00 C ATOM 1712 CE1 PHE A 118 5.123 -7.735 -2.889 1.00 0.00 C ATOM 1713 CE2 PHE A 118 7.134 -8.224 -4.083 1.00 0.00 C ATOM 1714 CZ PHE A 118 6.049 -8.652 -3.347 1.00 0.00 C ATOM 0 H PHE A 118 5.638 -3.044 -2.152 1.00 0.00 H new ATOM 0 HA PHE A 118 8.216 -4.298 -2.899 1.00 0.00 H new ATOM 0 HB2 PHE A 118 5.554 -4.035 -4.331 1.00 0.00 H new ATOM 0 HB3 PHE A 118 7.037 -4.394 -5.194 1.00 0.00 H new ATOM 0 HD1 PHE A 118 4.561 -5.677 -2.809 1.00 0.00 H new ATOM 0 HD2 PHE A 118 8.141 -6.554 -4.945 1.00 0.00 H new ATOM 0 HE1 PHE A 118 4.273 -8.067 -2.312 1.00 0.00 H new ATOM 0 HE2 PHE A 118 7.861 -8.939 -4.439 1.00 0.00 H new ATOM 0 HZ PHE A 118 5.924 -9.702 -3.129 1.00 0.00 H new ATOM 1724 N PRO A 119 9.055 -2.310 -4.222 1.00 0.00 N ATOM 1725 CA PRO A 119 9.990 -3.436 -4.189 1.00 0.00 C ATOM 1726 C PRO A 119 10.460 -3.751 -2.773 1.00 0.00 C ATOM 1727 O PRO A 119 10.349 -2.920 -1.872 1.00 0.00 O ATOM 1728 CB PRO A 119 11.179 -2.967 -5.048 1.00 0.00 C ATOM 1729 CG PRO A 119 10.695 -1.723 -5.727 1.00 0.00 C ATOM 1730 CD PRO A 119 9.671 -1.123 -4.814 1.00 0.00 C ATOM 0 HA PRO A 119 9.524 -4.350 -4.556 1.00 0.00 H new ATOM 0 HB2 PRO A 119 12.056 -2.766 -4.433 1.00 0.00 H new ATOM 0 HB3 PRO A 119 11.466 -3.727 -5.774 1.00 0.00 H new ATOM 0 HG2 PRO A 119 11.517 -1.029 -5.900 1.00 0.00 H new ATOM 0 HG3 PRO A 119 10.262 -1.954 -6.700 1.00 0.00 H new ATOM 0 HD2 PRO A 119 10.124 -0.480 -4.060 1.00 0.00 H new ATOM 0 HD3 PRO A 119 8.947 -0.516 -5.357 1.00 0.00 H new ATOM 1738 N PHE A 120 10.988 -4.956 -2.584 1.00 0.00 N ATOM 1739 CA PHE A 120 11.477 -5.378 -1.278 1.00 0.00 C ATOM 1740 C PHE A 120 12.836 -6.058 -1.401 1.00 0.00 C ATOM 1741 O PHE A 120 13.061 -6.859 -2.308 1.00 0.00 O ATOM 1742 CB PHE A 120 10.478 -6.328 -0.616 1.00 0.00 C ATOM 1743 CG PHE A 120 10.547 -7.732 -1.141 1.00 0.00 C ATOM 1744 CD1 PHE A 120 9.864 -8.087 -2.293 1.00 0.00 C ATOM 1745 CD2 PHE A 120 11.293 -8.696 -0.484 1.00 0.00 C ATOM 1746 CE1 PHE A 120 9.925 -9.378 -2.780 1.00 0.00 C ATOM 1747 CE2 PHE A 120 11.358 -9.990 -0.966 1.00 0.00 C ATOM 1748 CZ PHE A 120 10.674 -10.331 -2.116 1.00 0.00 C ATOM 0 H PHE A 120 11.088 -5.656 -3.319 1.00 0.00 H new ATOM 0 HA PHE A 120 11.588 -4.490 -0.656 1.00 0.00 H new ATOM 0 HB2 PHE A 120 10.659 -6.341 0.459 1.00 0.00 H new ATOM 0 HB3 PHE A 120 9.469 -5.942 -0.764 1.00 0.00 H new ATOM 0 HD1 PHE A 120 9.277 -7.346 -2.816 1.00 0.00 H new ATOM 0 HD2 PHE A 120 11.830 -8.434 0.415 1.00 0.00 H new ATOM 0 HE1 PHE A 120 9.388 -9.643 -3.679 1.00 0.00 H new ATOM 0 HE2 PHE A 120 11.943 -10.733 -0.444 1.00 0.00 H new ATOM 0 HZ PHE A 120 10.724 -11.341 -2.496 1.00 0.00 H new ATOM 1758 N LEU A 121 13.737 -5.731 -0.483 1.00 0.00 N ATOM 1759 CA LEU A 121 15.076 -6.309 -0.487 1.00 0.00 C ATOM 1760 C LEU A 121 15.055 -7.725 0.077 1.00 0.00 C ATOM 1761 O LEU A 121 14.132 -8.104 0.795 1.00 0.00 O ATOM 1762 CB LEU A 121 16.025 -5.440 0.343 1.00 0.00 C ATOM 1763 CG LEU A 121 17.499 -5.458 -0.074 1.00 0.00 C ATOM 1764 CD1 LEU A 121 17.652 -5.709 -1.564 1.00 0.00 C ATOM 1765 CD2 LEU A 121 18.163 -4.147 0.307 1.00 0.00 C ATOM 0 H LEU A 121 13.565 -5.069 0.274 1.00 0.00 H new ATOM 0 HA LEU A 121 15.428 -6.348 -1.518 1.00 0.00 H new ATOM 0 HB2 LEU A 121 15.670 -4.410 0.302 1.00 0.00 H new ATOM 0 HB3 LEU A 121 15.960 -5.759 1.383 1.00 0.00 H new ATOM 0 HG LEU A 121 17.988 -6.277 0.454 1.00 0.00 H new ATOM 0 HD11 LEU A 121 18.710 -5.715 -1.825 1.00 0.00 H new ATOM 0 HD12 LEU A 121 17.210 -6.672 -1.818 1.00 0.00 H new ATOM 0 HD13 LEU A 121 17.146 -4.920 -2.120 1.00 0.00 H new ATOM 0 HD21 LEU A 121 19.211 -4.169 0.007 1.00 0.00 H new ATOM 0 HD22 LEU A 121 17.658 -3.323 -0.198 1.00 0.00 H new ATOM 0 HD23 LEU A 121 18.098 -4.006 1.386 1.00 0.00 H new ATOM 1777 N TYR A 122 16.087 -8.493 -0.250 1.00 0.00 N ATOM 1778 CA TYR A 122 16.220 -9.866 0.223 1.00 0.00 C ATOM 1779 C TYR A 122 17.693 -10.236 0.338 1.00 0.00 C ATOM 1780 O TYR A 122 18.387 -10.362 -0.671 1.00 0.00 O ATOM 1781 CB TYR A 122 15.510 -10.835 -0.724 1.00 0.00 C ATOM 1782 CG TYR A 122 15.719 -12.292 -0.372 1.00 0.00 C ATOM 1783 CD1 TYR A 122 15.950 -12.684 0.942 1.00 0.00 C ATOM 1784 CD2 TYR A 122 15.686 -13.275 -1.353 1.00 0.00 C ATOM 1785 CE1 TYR A 122 16.140 -14.011 1.267 1.00 0.00 C ATOM 1786 CE2 TYR A 122 15.875 -14.606 -1.036 1.00 0.00 C ATOM 1787 CZ TYR A 122 16.102 -14.969 0.275 1.00 0.00 C ATOM 1788 OH TYR A 122 16.291 -16.294 0.596 1.00 0.00 O ATOM 0 H TYR A 122 16.853 -8.183 -0.848 1.00 0.00 H new ATOM 0 HA TYR A 122 15.754 -9.940 1.206 1.00 0.00 H new ATOM 0 HB2 TYR A 122 14.442 -10.618 -0.717 1.00 0.00 H new ATOM 0 HB3 TYR A 122 15.864 -10.661 -1.740 1.00 0.00 H new ATOM 0 HD1 TYR A 122 15.981 -11.937 1.721 1.00 0.00 H new ATOM 0 HD2 TYR A 122 15.510 -12.994 -2.381 1.00 0.00 H new ATOM 0 HE1 TYR A 122 16.318 -14.299 2.293 1.00 0.00 H new ATOM 0 HE2 TYR A 122 15.845 -15.358 -1.810 1.00 0.00 H new ATOM 0 HH TYR A 122 15.971 -16.459 1.507 1.00 0.00 H new ATOM 1798 N ASN A 123 18.171 -10.396 1.566 1.00 0.00 N ATOM 1799 CA ASN A 123 19.571 -10.737 1.797 1.00 0.00 C ATOM 1800 C ASN A 123 20.484 -9.792 1.020 1.00 0.00 C ATOM 1801 O ASN A 123 21.571 -10.175 0.590 1.00 0.00 O ATOM 1802 CB ASN A 123 19.844 -12.189 1.394 1.00 0.00 C ATOM 1803 CG ASN A 123 19.852 -12.387 -0.109 1.00 0.00 C ATOM 1804 OD1 ASN A 123 20.382 -11.562 -0.855 1.00 0.00 O ATOM 1805 ND2 ASN A 123 19.261 -13.486 -0.564 1.00 0.00 N ATOM 0 H ASN A 123 17.614 -10.296 2.414 1.00 0.00 H new ATOM 0 HA ASN A 123 19.780 -10.628 2.861 1.00 0.00 H new ATOM 0 HB2 ASN A 123 20.805 -12.501 1.803 1.00 0.00 H new ATOM 0 HB3 ASN A 123 19.085 -12.834 1.837 1.00 0.00 H new ATOM 0 HD21 ASN A 123 19.234 -13.673 -1.566 1.00 0.00 H new ATOM 0 HD22 ASN A 123 18.834 -14.143 0.089 1.00 0.00 H new ATOM 1812 N ASN A 124 20.026 -8.553 0.848 1.00 0.00 N ATOM 1813 CA ASN A 124 20.789 -7.538 0.126 1.00 0.00 C ATOM 1814 C ASN A 124 20.505 -7.598 -1.372 1.00 0.00 C ATOM 1815 O ASN A 124 20.988 -6.764 -2.138 1.00 0.00 O ATOM 1816 CB ASN A 124 22.287 -7.710 0.380 1.00 0.00 C ATOM 1817 CG ASN A 124 22.975 -6.396 0.689 1.00 0.00 C ATOM 1818 OD1 ASN A 124 22.328 -5.412 1.049 1.00 0.00 O ATOM 1819 ND2 ASN A 124 24.296 -6.373 0.552 1.00 0.00 N ATOM 0 H ASN A 124 19.126 -8.228 1.201 1.00 0.00 H new ATOM 0 HA ASN A 124 20.476 -6.562 0.497 1.00 0.00 H new ATOM 0 HB2 ASN A 124 22.435 -8.399 1.212 1.00 0.00 H new ATOM 0 HB3 ASN A 124 22.752 -8.163 -0.496 1.00 0.00 H new ATOM 0 HD21 ASN A 124 24.814 -5.517 0.748 1.00 0.00 H new ATOM 0 HD22 ASN A 124 24.792 -7.212 0.251 1.00 0.00 H new ATOM 1826 N HIS A 125 19.716 -8.582 -1.786 1.00 0.00 N ATOM 1827 CA HIS A 125 19.369 -8.740 -3.192 1.00 0.00 C ATOM 1828 C HIS A 125 18.100 -7.962 -3.522 1.00 0.00 C ATOM 1829 O HIS A 125 17.010 -8.318 -3.079 1.00 0.00 O ATOM 1830 CB HIS A 125 19.177 -10.219 -3.532 1.00 0.00 C ATOM 1831 CG HIS A 125 19.369 -10.531 -4.983 1.00 0.00 C ATOM 1832 ND1 HIS A 125 19.726 -11.781 -5.444 1.00 0.00 N ATOM 1833 CD2 HIS A 125 19.254 -9.747 -6.081 1.00 0.00 C ATOM 1834 CE1 HIS A 125 19.820 -11.753 -6.762 1.00 0.00 C ATOM 1835 NE2 HIS A 125 19.539 -10.530 -7.173 1.00 0.00 N ATOM 0 H HIS A 125 19.305 -9.282 -1.168 1.00 0.00 H new ATOM 0 HA HIS A 125 20.188 -8.344 -3.791 1.00 0.00 H new ATOM 0 HB2 HIS A 125 19.879 -10.812 -2.946 1.00 0.00 H new ATOM 0 HB3 HIS A 125 18.174 -10.525 -3.233 1.00 0.00 H new ATOM 0 HD2 HIS A 125 18.988 -8.700 -6.095 1.00 0.00 H new ATOM 0 HE1 HIS A 125 20.082 -12.588 -7.395 1.00 0.00 H new ATOM 0 HE2 HIS A 125 19.534 -10.217 -8.144 1.00 0.00 H new ATOM 1844 N ASN A 126 18.249 -6.893 -4.297 1.00 0.00 N ATOM 1845 CA ASN A 126 17.110 -6.064 -4.679 1.00 0.00 C ATOM 1846 C ASN A 126 16.018 -6.905 -5.332 1.00 0.00 C ATOM 1847 O ASN A 126 16.212 -7.462 -6.411 1.00 0.00 O ATOM 1848 CB ASN A 126 17.560 -4.956 -5.633 1.00 0.00 C ATOM 1849 CG ASN A 126 17.664 -3.607 -4.948 1.00 0.00 C ATOM 1850 OD1 ASN A 126 16.840 -2.721 -5.172 1.00 0.00 O ATOM 1851 ND2 ASN A 126 18.682 -3.450 -4.107 1.00 0.00 N ATOM 0 H ASN A 126 19.144 -6.580 -4.672 1.00 0.00 H new ATOM 0 HA ASN A 126 16.700 -5.612 -3.776 1.00 0.00 H new ATOM 0 HB2 ASN A 126 18.528 -5.219 -6.059 1.00 0.00 H new ATOM 0 HB3 ASN A 126 16.855 -4.886 -6.462 1.00 0.00 H new ATOM 0 HD22 ASN A 126 19.340 -4.214 -3.954 1.00 0.00 H new ATOM 1857 N TYR A 127 14.869 -6.994 -4.667 1.00 0.00 N ATOM 1858 CA TYR A 127 13.747 -7.772 -5.186 1.00 0.00 C ATOM 1859 C TYR A 127 12.527 -6.889 -5.431 1.00 0.00 C ATOM 1860 O TYR A 127 12.530 -5.702 -5.105 1.00 0.00 O ATOM 1861 CB TYR A 127 13.383 -8.897 -4.217 1.00 0.00 C ATOM 1862 CG TYR A 127 13.995 -10.231 -4.577 1.00 0.00 C ATOM 1863 CD1 TYR A 127 13.339 -11.115 -5.423 1.00 0.00 C ATOM 1864 CD2 TYR A 127 15.229 -10.606 -4.068 1.00 0.00 C ATOM 1865 CE1 TYR A 127 13.898 -12.336 -5.751 1.00 0.00 C ATOM 1866 CE2 TYR A 127 15.797 -11.823 -4.390 1.00 0.00 C ATOM 1867 CZ TYR A 127 15.127 -12.684 -5.233 1.00 0.00 C ATOM 1868 OH TYR A 127 15.689 -13.899 -5.557 1.00 0.00 O ATOM 0 H TYR A 127 14.690 -6.539 -3.772 1.00 0.00 H new ATOM 0 HA TYR A 127 14.057 -8.203 -6.138 1.00 0.00 H new ATOM 0 HB2 TYR A 127 13.705 -8.619 -3.214 1.00 0.00 H new ATOM 0 HB3 TYR A 127 12.298 -9.001 -4.186 1.00 0.00 H new ATOM 0 HD1 TYR A 127 12.377 -10.844 -5.831 1.00 0.00 H new ATOM 0 HD2 TYR A 127 15.756 -9.934 -3.407 1.00 0.00 H new ATOM 0 HE1 TYR A 127 13.375 -13.013 -6.409 1.00 0.00 H new ATOM 0 HE2 TYR A 127 16.759 -12.098 -3.984 1.00 0.00 H new ATOM 0 HH TYR A 127 16.556 -13.988 -5.110 1.00 0.00 H new ATOM 1878 N THR A 128 11.484 -7.481 -6.005 1.00 0.00 N ATOM 1879 CA THR A 128 10.252 -6.756 -6.294 1.00 0.00 C ATOM 1880 C THR A 128 9.139 -7.710 -6.712 1.00 0.00 C ATOM 1881 O THR A 128 8.253 -7.347 -7.486 1.00 0.00 O ATOM 1882 CB THR A 128 10.462 -5.711 -7.405 1.00 0.00 C ATOM 1883 OG1 THR A 128 11.769 -5.136 -7.298 1.00 0.00 O ATOM 1884 CG2 THR A 128 9.412 -4.613 -7.319 1.00 0.00 C ATOM 0 H THR A 128 11.468 -8.463 -6.280 1.00 0.00 H new ATOM 0 HA THR A 128 9.963 -6.245 -5.376 1.00 0.00 H new ATOM 0 HB THR A 128 10.365 -6.213 -8.368 1.00 0.00 H new ATOM 0 HG1 THR A 128 11.894 -4.473 -8.009 1.00 0.00 H new ATOM 0 HG21 THR A 128 9.580 -3.886 -8.114 1.00 0.00 H new ATOM 0 HG22 THR A 128 8.419 -5.049 -7.430 1.00 0.00 H new ATOM 0 HG23 THR A 128 9.484 -4.116 -6.351 1.00 0.00 H new ATOM 1892 N ASP A 129 9.189 -8.931 -6.192 1.00 0.00 N ATOM 1893 CA ASP A 129 8.185 -9.940 -6.504 1.00 0.00 C ATOM 1894 C ASP A 129 8.243 -11.085 -5.502 1.00 0.00 C ATOM 1895 O ASP A 129 9.323 -11.518 -5.104 1.00 0.00 O ATOM 1896 CB ASP A 129 8.384 -10.474 -7.925 1.00 0.00 C ATOM 1897 CG ASP A 129 7.582 -11.734 -8.187 1.00 0.00 C ATOM 1898 OD1 ASP A 129 7.762 -12.718 -7.441 1.00 0.00 O ATOM 1899 OD2 ASP A 129 6.776 -11.735 -9.140 1.00 0.00 O ATOM 0 H ASP A 129 9.917 -9.246 -5.551 1.00 0.00 H new ATOM 0 HA ASP A 129 7.203 -9.472 -6.440 1.00 0.00 H new ATOM 0 HB2 ASP A 129 8.094 -9.706 -8.643 1.00 0.00 H new ATOM 0 HB3 ASP A 129 9.442 -10.680 -8.088 1.00 0.00 H new ATOM 1904 N CYS A 130 7.073 -11.562 -5.093 1.00 0.00 N ATOM 1905 CA CYS A 130 6.986 -12.652 -4.130 1.00 0.00 C ATOM 1906 C CYS A 130 7.931 -13.790 -4.502 1.00 0.00 C ATOM 1907 O CYS A 130 7.541 -14.736 -5.185 1.00 0.00 O ATOM 1908 CB CYS A 130 5.551 -13.173 -4.047 1.00 0.00 C ATOM 1909 SG CYS A 130 4.303 -11.875 -3.766 1.00 0.00 S ATOM 0 H CYS A 130 6.171 -11.210 -5.414 1.00 0.00 H new ATOM 0 HA CYS A 130 7.283 -12.264 -3.156 1.00 0.00 H new ATOM 0 HB2 CYS A 130 5.312 -13.697 -4.972 1.00 0.00 H new ATOM 0 HB3 CYS A 130 5.487 -13.904 -3.241 1.00 0.00 H new ATOM 1914 N THR A 131 9.176 -13.688 -4.049 1.00 0.00 N ATOM 1915 CA THR A 131 10.178 -14.708 -4.333 1.00 0.00 C ATOM 1916 C THR A 131 9.950 -15.954 -3.484 1.00 0.00 C ATOM 1917 O THR A 131 9.230 -15.916 -2.488 1.00 0.00 O ATOM 1918 CB THR A 131 11.603 -14.181 -4.079 1.00 0.00 C ATOM 1919 OG1 THR A 131 12.567 -15.164 -4.476 1.00 0.00 O ATOM 1920 CG2 THR A 131 11.799 -13.837 -2.610 1.00 0.00 C ATOM 0 H THR A 131 9.515 -12.909 -3.484 1.00 0.00 H new ATOM 0 HA THR A 131 10.077 -14.966 -5.387 1.00 0.00 H new ATOM 0 HB THR A 131 11.742 -13.276 -4.670 1.00 0.00 H new ATOM 0 HG1 THR A 131 13.272 -14.736 -5.005 1.00 0.00 H new ATOM 0 HG21 THR A 131 12.813 -13.467 -2.455 1.00 0.00 H new ATOM 0 HG22 THR A 131 11.084 -13.068 -2.318 1.00 0.00 H new ATOM 0 HG23 THR A 131 11.642 -14.729 -2.003 1.00 0.00 H new ATOM 1928 N SER A 132 10.572 -17.059 -3.885 1.00 0.00 N ATOM 1929 CA SER A 132 10.437 -18.317 -3.161 1.00 0.00 C ATOM 1930 C SER A 132 11.804 -18.937 -2.891 1.00 0.00 C ATOM 1931 O SER A 132 11.905 -20.116 -2.550 1.00 0.00 O ATOM 1932 CB SER A 132 9.568 -19.296 -3.953 1.00 0.00 C ATOM 1933 OG SER A 132 8.543 -19.840 -3.141 1.00 0.00 O ATOM 0 H SER A 132 11.174 -17.108 -4.707 1.00 0.00 H new ATOM 0 HA SER A 132 9.956 -18.108 -2.205 1.00 0.00 H new ATOM 0 HB2 SER A 132 9.126 -18.785 -4.808 1.00 0.00 H new ATOM 0 HB3 SER A 132 10.189 -20.100 -4.348 1.00 0.00 H new ATOM 0 HG SER A 132 8.001 -20.461 -3.671 1.00 0.00 H new ATOM 1939 N GLU A 133 12.853 -18.136 -3.044 1.00 0.00 N ATOM 1940 CA GLU A 133 14.215 -18.607 -2.816 1.00 0.00 C ATOM 1941 C GLU A 133 14.314 -19.367 -1.498 1.00 0.00 C ATOM 1942 O GLU A 133 14.122 -20.581 -1.454 1.00 0.00 O ATOM 1943 CB GLU A 133 15.190 -17.428 -2.814 1.00 0.00 C ATOM 1944 CG GLU A 133 15.971 -17.282 -4.110 1.00 0.00 C ATOM 1945 CD GLU A 133 17.462 -17.479 -3.916 1.00 0.00 C ATOM 1946 OE1 GLU A 133 18.062 -16.726 -3.122 1.00 0.00 O ATOM 1947 OE2 GLU A 133 18.030 -18.386 -4.562 1.00 0.00 O ATOM 0 H GLU A 133 12.787 -17.158 -3.325 1.00 0.00 H new ATOM 0 HA GLU A 133 14.479 -19.286 -3.626 1.00 0.00 H new ATOM 0 HB2 GLU A 133 14.635 -16.509 -2.629 1.00 0.00 H new ATOM 0 HB3 GLU A 133 15.891 -17.549 -1.988 1.00 0.00 H new ATOM 0 HG2 GLU A 133 15.603 -18.008 -4.835 1.00 0.00 H new ATOM 0 HG3 GLU A 133 15.790 -16.292 -4.530 1.00 0.00 H new ATOM 1954 N GLY A 134 14.616 -18.643 -0.425 1.00 0.00 N ATOM 1955 CA GLY A 134 14.735 -19.266 0.880 1.00 0.00 C ATOM 1956 C GLY A 134 13.726 -20.378 1.087 1.00 0.00 C ATOM 1957 O GLY A 134 13.988 -21.335 1.816 1.00 0.00 O ATOM 0 H GLY A 134 14.780 -17.636 -0.436 1.00 0.00 H new ATOM 0 HA2 GLY A 134 15.742 -19.667 0.997 1.00 0.00 H new ATOM 0 HA3 GLY A 134 14.601 -18.510 1.654 1.00 0.00 H new ATOM 1961 N ARG A 135 12.570 -20.252 0.445 1.00 0.00 N ATOM 1962 CA ARG A 135 11.518 -21.255 0.562 1.00 0.00 C ATOM 1963 C ARG A 135 11.668 -22.330 -0.509 1.00 0.00 C ATOM 1964 O ARG A 135 12.385 -22.144 -1.493 1.00 0.00 O ATOM 1965 CB ARG A 135 10.141 -20.595 0.450 1.00 0.00 C ATOM 1966 CG ARG A 135 9.718 -19.854 1.707 1.00 0.00 C ATOM 1967 CD ARG A 135 8.206 -19.712 1.788 1.00 0.00 C ATOM 1968 NE ARG A 135 7.566 -20.935 2.260 1.00 0.00 N ATOM 1969 CZ ARG A 135 7.721 -21.420 3.488 1.00 0.00 C ATOM 1970 NH1 ARG A 135 8.491 -20.787 4.361 1.00 0.00 N ATOM 1971 NH2 ARG A 135 7.104 -22.540 3.842 1.00 0.00 N ATOM 0 H ARG A 135 12.338 -19.466 -0.162 1.00 0.00 H new ATOM 0 HA ARG A 135 11.609 -21.728 1.540 1.00 0.00 H new ATOM 0 HB2 ARG A 135 10.149 -19.898 -0.388 1.00 0.00 H new ATOM 0 HB3 ARG A 135 9.398 -21.359 0.222 1.00 0.00 H new ATOM 0 HG2 ARG A 135 10.082 -20.388 2.585 1.00 0.00 H new ATOM 0 HG3 ARG A 135 10.179 -18.866 1.721 1.00 0.00 H new ATOM 0 HD2 ARG A 135 7.955 -18.890 2.458 1.00 0.00 H new ATOM 0 HD3 ARG A 135 7.813 -19.454 0.805 1.00 0.00 H new ATOM 0 HE ARG A 135 6.967 -21.446 1.612 1.00 0.00 H new ATOM 0 HH11 ARG A 135 8.966 -19.926 4.091 1.00 0.00 H new ATOM 0 HH12 ARG A 135 8.608 -21.161 5.303 1.00 0.00 H new ATOM 0 HH21 ARG A 135 6.511 -23.029 3.172 1.00 0.00 H new ATOM 0 HH22 ARG A 135 7.223 -22.912 4.784 1.00 0.00 H new ATOM 1985 N ARG A 136 10.987 -23.454 -0.312 1.00 0.00 N ATOM 1986 CA ARG A 136 11.045 -24.559 -1.261 1.00 0.00 C ATOM 1987 C ARG A 136 9.663 -25.166 -1.476 1.00 0.00 C ATOM 1988 O ARG A 136 9.530 -26.248 -2.048 1.00 0.00 O ATOM 1989 CB ARG A 136 12.015 -25.634 -0.767 1.00 0.00 C ATOM 1990 CG ARG A 136 13.477 -25.274 -0.974 1.00 0.00 C ATOM 1991 CD ARG A 136 14.394 -26.189 -0.177 1.00 0.00 C ATOM 1992 NE ARG A 136 14.293 -27.578 -0.610 1.00 0.00 N ATOM 1993 CZ ARG A 136 15.004 -28.092 -1.609 1.00 0.00 C ATOM 1994 NH1 ARG A 136 15.864 -27.331 -2.273 1.00 0.00 N ATOM 1995 NH2 ARG A 136 14.857 -29.365 -1.945 1.00 0.00 N ATOM 0 H ARG A 136 10.389 -23.623 0.496 1.00 0.00 H new ATOM 0 HA ARG A 136 11.402 -24.167 -2.213 1.00 0.00 H new ATOM 0 HB2 ARG A 136 11.839 -25.810 0.294 1.00 0.00 H new ATOM 0 HB3 ARG A 136 11.803 -26.569 -1.285 1.00 0.00 H new ATOM 0 HG2 ARG A 136 13.723 -25.343 -2.034 1.00 0.00 H new ATOM 0 HG3 ARG A 136 13.644 -24.239 -0.675 1.00 0.00 H new ATOM 0 HD2 ARG A 136 15.425 -25.851 -0.283 1.00 0.00 H new ATOM 0 HD3 ARG A 136 14.143 -26.120 0.882 1.00 0.00 H new ATOM 0 HE ARG A 136 13.640 -28.189 -0.119 1.00 0.00 H new ATOM 0 HH11 ARG A 136 15.980 -26.350 -2.017 1.00 0.00 H new ATOM 0 HH12 ARG A 136 16.409 -27.726 -3.039 1.00 0.00 H new ATOM 0 HH21 ARG A 136 14.197 -29.954 -1.437 1.00 0.00 H new ATOM 0 HH22 ARG A 136 15.404 -29.756 -2.712 1.00 0.00 H new ATOM 2009 N ASP A 137 8.635 -24.462 -1.013 1.00 0.00 N ATOM 2010 CA ASP A 137 7.261 -24.930 -1.154 1.00 0.00 C ATOM 2011 C ASP A 137 6.399 -23.887 -1.858 1.00 0.00 C ATOM 2012 O ASP A 137 6.463 -22.700 -1.541 1.00 0.00 O ATOM 2013 CB ASP A 137 6.668 -25.257 0.218 1.00 0.00 C ATOM 2014 CG ASP A 137 7.376 -24.527 1.343 1.00 0.00 C ATOM 2015 OD1 ASP A 137 7.939 -23.443 1.085 1.00 0.00 O ATOM 2016 OD2 ASP A 137 7.366 -25.040 2.481 1.00 0.00 O ATOM 0 H ASP A 137 8.728 -23.565 -0.537 1.00 0.00 H new ATOM 0 HA ASP A 137 7.273 -25.834 -1.762 1.00 0.00 H new ATOM 0 HB2 ASP A 137 5.611 -24.993 0.226 1.00 0.00 H new ATOM 0 HB3 ASP A 137 6.729 -26.332 0.391 1.00 0.00 H new ATOM 2021 N ASN A 138 5.593 -24.340 -2.813 1.00 0.00 N ATOM 2022 CA ASN A 138 4.719 -23.445 -3.562 1.00 0.00 C ATOM 2023 C ASN A 138 4.084 -22.408 -2.640 1.00 0.00 C ATOM 2024 O ASN A 138 3.017 -22.639 -2.072 1.00 0.00 O ATOM 2025 CB ASN A 138 3.629 -24.245 -4.277 1.00 0.00 C ATOM 2026 CG ASN A 138 3.325 -25.558 -3.583 1.00 0.00 C ATOM 2027 OD1 ASN A 138 2.950 -25.582 -2.411 1.00 0.00 O ATOM 2028 ND2 ASN A 138 3.487 -26.661 -4.305 1.00 0.00 N ATOM 0 H ASN A 138 5.527 -25.321 -3.086 1.00 0.00 H new ATOM 0 HA ASN A 138 5.323 -22.923 -4.304 1.00 0.00 H new ATOM 0 HB2 ASN A 138 2.719 -23.647 -4.331 1.00 0.00 H new ATOM 0 HB3 ASN A 138 3.941 -24.443 -5.302 1.00 0.00 H new ATOM 0 HD21 ASN A 138 3.299 -27.574 -3.891 1.00 0.00 H new ATOM 0 HD22 ASN A 138 3.800 -26.595 -5.274 1.00 0.00 H new ATOM 2035 N MET A 139 4.746 -21.265 -2.499 1.00 0.00 N ATOM 2036 CA MET A 139 4.246 -20.192 -1.647 1.00 0.00 C ATOM 2037 C MET A 139 5.115 -18.945 -1.776 1.00 0.00 C ATOM 2038 O MET A 139 5.686 -18.470 -0.795 1.00 0.00 O ATOM 2039 CB MET A 139 4.204 -20.650 -0.188 1.00 0.00 C ATOM 2040 CG MET A 139 2.905 -20.301 0.521 1.00 0.00 C ATOM 2041 SD MET A 139 2.680 -21.223 2.054 1.00 0.00 S ATOM 2042 CE MET A 139 3.174 -22.865 1.536 1.00 0.00 C ATOM 0 H MET A 139 5.630 -21.057 -2.964 1.00 0.00 H new ATOM 0 HA MET A 139 3.236 -19.944 -1.972 1.00 0.00 H new ATOM 0 HB2 MET A 139 4.350 -21.729 -0.150 1.00 0.00 H new ATOM 0 HB3 MET A 139 5.036 -20.196 0.351 1.00 0.00 H new ATOM 0 HG2 MET A 139 2.890 -19.233 0.739 1.00 0.00 H new ATOM 0 HG3 MET A 139 2.066 -20.502 -0.146 1.00 0.00 H new ATOM 0 HE1 MET A 139 2.814 -23.598 2.258 1.00 0.00 H new ATOM 0 HE2 MET A 139 2.748 -23.081 0.556 1.00 0.00 H new ATOM 0 HE3 MET A 139 4.261 -22.917 1.478 1.00 0.00 H new ATOM 2052 N LYS A 140 5.210 -18.420 -2.993 1.00 0.00 N ATOM 2053 CA LYS A 140 6.009 -17.227 -3.250 1.00 0.00 C ATOM 2054 C LYS A 140 5.924 -16.253 -2.081 1.00 0.00 C ATOM 2055 O LYS A 140 4.873 -15.663 -1.825 1.00 0.00 O ATOM 2056 CB LYS A 140 5.540 -16.542 -4.536 1.00 0.00 C ATOM 2057 CG LYS A 140 6.266 -17.023 -5.781 1.00 0.00 C ATOM 2058 CD LYS A 140 5.637 -18.289 -6.340 1.00 0.00 C ATOM 2059 CE LYS A 140 4.444 -17.974 -7.227 1.00 0.00 C ATOM 2060 NZ LYS A 140 3.896 -19.196 -7.877 1.00 0.00 N ATOM 0 H LYS A 140 4.744 -18.801 -3.816 1.00 0.00 H new ATOM 0 HA LYS A 140 7.048 -17.534 -3.368 1.00 0.00 H new ATOM 0 HB2 LYS A 140 4.471 -16.714 -4.660 1.00 0.00 H new ATOM 0 HB3 LYS A 140 5.681 -15.466 -4.437 1.00 0.00 H new ATOM 0 HG2 LYS A 140 6.247 -16.241 -6.540 1.00 0.00 H new ATOM 0 HG3 LYS A 140 7.313 -17.210 -5.543 1.00 0.00 H new ATOM 0 HD2 LYS A 140 6.381 -18.844 -6.912 1.00 0.00 H new ATOM 0 HD3 LYS A 140 5.321 -18.933 -5.519 1.00 0.00 H new ATOM 0 HE2 LYS A 140 3.664 -17.499 -6.631 1.00 0.00 H new ATOM 0 HE3 LYS A 140 4.741 -17.258 -7.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 3.084 -18.938 -8.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 4.632 -19.636 -8.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 3.589 -19.870 -7.147 1.00 0.00 H new ATOM 2074 N TRP A 141 7.037 -16.087 -1.374 1.00 0.00 N ATOM 2075 CA TRP A 141 7.086 -15.183 -0.231 1.00 0.00 C ATOM 2076 C TRP A 141 7.590 -13.805 -0.647 1.00 0.00 C ATOM 2077 O TRP A 141 8.207 -13.649 -1.702 1.00 0.00 O ATOM 2078 CB TRP A 141 7.980 -15.761 0.868 1.00 0.00 C ATOM 2079 CG TRP A 141 9.430 -15.809 0.496 1.00 0.00 C ATOM 2080 CD1 TRP A 141 10.087 -16.842 -0.111 1.00 0.00 C ATOM 2081 CD2 TRP A 141 10.404 -14.782 0.707 1.00 0.00 C ATOM 2082 NE1 TRP A 141 11.410 -16.519 -0.288 1.00 0.00 N ATOM 2083 CE2 TRP A 141 11.630 -15.260 0.206 1.00 0.00 C ATOM 2084 CE3 TRP A 141 10.361 -13.504 1.272 1.00 0.00 C ATOM 2085 CZ2 TRP A 141 12.798 -14.504 0.253 1.00 0.00 C ATOM 2086 CZ3 TRP A 141 11.521 -12.756 1.317 1.00 0.00 C ATOM 2087 CH2 TRP A 141 12.726 -13.258 0.810 1.00 0.00 C ATOM 0 H TRP A 141 7.916 -16.566 -1.572 1.00 0.00 H new ATOM 0 HA TRP A 141 6.073 -15.075 0.158 1.00 0.00 H new ATOM 0 HB2 TRP A 141 7.865 -15.162 1.771 1.00 0.00 H new ATOM 0 HB3 TRP A 141 7.641 -16.769 1.108 1.00 0.00 H new ATOM 0 HD1 TRP A 141 9.632 -17.776 -0.408 1.00 0.00 H new ATOM 0 HE1 TRP A 141 12.114 -17.119 -0.717 1.00 0.00 H new ATOM 0 HE3 TRP A 141 9.437 -13.109 1.666 1.00 0.00 H new ATOM 0 HZ2 TRP A 141 13.729 -14.889 -0.137 1.00 0.00 H new ATOM 0 HZ3 TRP A 141 11.498 -11.767 1.751 1.00 0.00 H new ATOM 0 HH2 TRP A 141 13.616 -12.648 0.860 1.00 0.00 H new ATOM 2098 N CYS A 142 7.319 -12.807 0.186 1.00 0.00 N ATOM 2099 CA CYS A 142 7.737 -11.439 -0.091 1.00 0.00 C ATOM 2100 C CYS A 142 8.212 -10.750 1.185 1.00 0.00 C ATOM 2101 O CYS A 142 7.934 -11.210 2.292 1.00 0.00 O ATOM 2102 CB CYS A 142 6.579 -10.656 -0.722 1.00 0.00 C ATOM 2103 SG CYS A 142 6.631 -8.855 -0.438 1.00 0.00 S ATOM 0 H CYS A 142 6.809 -12.921 1.062 1.00 0.00 H new ATOM 0 HA CYS A 142 8.571 -11.465 -0.793 1.00 0.00 H new ATOM 0 HB2 CYS A 142 6.577 -10.841 -1.796 1.00 0.00 H new ATOM 0 HB3 CYS A 142 5.639 -11.045 -0.330 1.00 0.00 H new ATOM 2108 N GLY A 143 8.927 -9.641 1.023 1.00 0.00 N ATOM 2109 CA GLY A 143 9.426 -8.904 2.168 1.00 0.00 C ATOM 2110 C GLY A 143 8.431 -7.879 2.677 1.00 0.00 C ATOM 2111 O GLY A 143 7.953 -7.036 1.918 1.00 0.00 O ATOM 0 H GLY A 143 9.170 -9.240 0.117 1.00 0.00 H new ATOM 0 HA2 GLY A 143 9.665 -9.603 2.970 1.00 0.00 H new ATOM 0 HA3 GLY A 143 10.354 -8.401 1.896 1.00 0.00 H new ATOM 2115 N THR A 144 8.119 -7.951 3.967 1.00 0.00 N ATOM 2116 CA THR A 144 7.178 -7.022 4.577 1.00 0.00 C ATOM 2117 C THR A 144 7.811 -5.649 4.776 1.00 0.00 C ATOM 2118 O THR A 144 7.166 -4.723 5.269 1.00 0.00 O ATOM 2119 CB THR A 144 6.675 -7.545 5.936 1.00 0.00 C ATOM 2120 OG1 THR A 144 7.776 -8.036 6.710 1.00 0.00 O ATOM 2121 CG2 THR A 144 5.651 -8.653 5.744 1.00 0.00 C ATOM 0 H THR A 144 8.505 -8.643 4.609 1.00 0.00 H new ATOM 0 HA THR A 144 6.333 -6.933 3.894 1.00 0.00 H new ATOM 0 HB THR A 144 6.199 -6.719 6.464 1.00 0.00 H new ATOM 0 HG1 THR A 144 8.610 -7.644 6.377 1.00 0.00 H new ATOM 0 HG21 THR A 144 5.310 -9.006 6.717 1.00 0.00 H new ATOM 0 HG22 THR A 144 4.801 -8.269 5.180 1.00 0.00 H new ATOM 0 HG23 THR A 144 6.107 -9.479 5.197 1.00 0.00 H new ATOM 2129 N THR A 145 9.077 -5.523 4.388 1.00 0.00 N ATOM 2130 CA THR A 145 9.796 -4.263 4.522 1.00 0.00 C ATOM 2131 C THR A 145 10.622 -3.972 3.273 1.00 0.00 C ATOM 2132 O THR A 145 10.986 -4.885 2.532 1.00 0.00 O ATOM 2133 CB THR A 145 10.727 -4.274 5.749 1.00 0.00 C ATOM 2134 OG1 THR A 145 11.875 -5.088 5.485 1.00 0.00 O ATOM 2135 CG2 THR A 145 9.997 -4.800 6.976 1.00 0.00 C ATOM 0 H THR A 145 9.625 -6.279 3.978 1.00 0.00 H new ATOM 0 HA THR A 145 9.048 -3.481 4.653 1.00 0.00 H new ATOM 0 HB THR A 145 11.046 -3.250 5.946 1.00 0.00 H new ATOM 0 HG1 THR A 145 11.691 -6.011 5.758 1.00 0.00 H new ATOM 0 HG21 THR A 145 10.674 -4.799 7.830 1.00 0.00 H new ATOM 0 HG22 THR A 145 9.140 -4.162 7.191 1.00 0.00 H new ATOM 0 HG23 THR A 145 9.653 -5.817 6.787 1.00 0.00 H new ATOM 2143 N GLN A 146 10.912 -2.697 3.045 1.00 0.00 N ATOM 2144 CA GLN A 146 11.694 -2.287 1.884 1.00 0.00 C ATOM 2145 C GLN A 146 13.079 -2.925 1.904 1.00 0.00 C ATOM 2146 O GLN A 146 13.796 -2.908 0.903 1.00 0.00 O ATOM 2147 CB GLN A 146 11.821 -0.763 1.842 1.00 0.00 C ATOM 2148 CG GLN A 146 12.881 -0.216 2.785 1.00 0.00 C ATOM 2149 CD GLN A 146 12.379 0.952 3.610 1.00 0.00 C ATOM 2150 OE1 GLN A 146 12.201 2.058 3.099 1.00 0.00 O ATOM 2151 NE2 GLN A 146 12.151 0.713 4.896 1.00 0.00 N ATOM 0 H GLN A 146 10.618 -1.929 3.648 1.00 0.00 H new ATOM 0 HA GLN A 146 11.173 -2.627 0.989 1.00 0.00 H new ATOM 0 HB2 GLN A 146 12.058 -0.454 0.824 1.00 0.00 H new ATOM 0 HB3 GLN A 146 10.858 -0.319 2.094 1.00 0.00 H new ATOM 0 HG2 GLN A 146 13.214 -1.011 3.452 1.00 0.00 H new ATOM 0 HG3 GLN A 146 13.749 0.099 2.206 1.00 0.00 H new ATOM 0 HE21 GLN A 146 12.312 -0.219 5.278 1.00 0.00 H new ATOM 0 HE22 GLN A 146 11.815 1.461 5.502 1.00 0.00 H new ATOM 2160 N ASN A 147 13.453 -3.483 3.051 1.00 0.00 N ATOM 2161 CA ASN A 147 14.756 -4.122 3.201 1.00 0.00 C ATOM 2162 C ASN A 147 14.660 -5.363 4.084 1.00 0.00 C ATOM 2163 O ASN A 147 14.843 -5.286 5.299 1.00 0.00 O ATOM 2164 CB ASN A 147 15.762 -3.135 3.796 1.00 0.00 C ATOM 2165 CG ASN A 147 15.476 -1.703 3.388 1.00 0.00 C ATOM 2166 OD1 ASN A 147 15.417 -1.383 2.201 1.00 0.00 O ATOM 2167 ND2 ASN A 147 15.296 -0.832 4.374 1.00 0.00 N ATOM 0 H ASN A 147 12.873 -3.506 3.890 1.00 0.00 H new ATOM 0 HA ASN A 147 15.097 -4.431 2.213 1.00 0.00 H new ATOM 0 HB2 ASN A 147 15.742 -3.211 4.883 1.00 0.00 H new ATOM 0 HB3 ASN A 147 16.768 -3.407 3.476 1.00 0.00 H new ATOM 0 HD21 ASN A 147 15.100 0.146 4.161 1.00 0.00 H new ATOM 0 HD22 ASN A 147 15.354 -1.141 5.344 1.00 0.00 H new ATOM 2174 N TYR A 148 14.376 -6.506 3.465 1.00 0.00 N ATOM 2175 CA TYR A 148 14.261 -7.763 4.197 1.00 0.00 C ATOM 2176 C TYR A 148 15.484 -7.992 5.076 1.00 0.00 C ATOM 2177 O TYR A 148 15.412 -7.875 6.298 1.00 0.00 O ATOM 2178 CB TYR A 148 14.101 -8.925 3.219 1.00 0.00 C ATOM 2179 CG TYR A 148 14.068 -10.284 3.876 1.00 0.00 C ATOM 2180 CD1 TYR A 148 13.935 -10.414 5.253 1.00 0.00 C ATOM 2181 CD2 TYR A 148 14.174 -11.440 3.115 1.00 0.00 C ATOM 2182 CE1 TYR A 148 13.909 -11.660 5.850 1.00 0.00 C ATOM 2183 CE2 TYR A 148 14.148 -12.687 3.703 1.00 0.00 C ATOM 2184 CZ TYR A 148 14.017 -12.793 5.072 1.00 0.00 C ATOM 2185 OH TYR A 148 13.992 -14.036 5.663 1.00 0.00 O ATOM 0 H TYR A 148 14.222 -6.587 2.460 1.00 0.00 H new ATOM 0 HA TYR A 148 13.381 -7.707 4.837 1.00 0.00 H new ATOM 0 HB2 TYR A 148 13.180 -8.785 2.652 1.00 0.00 H new ATOM 0 HB3 TYR A 148 14.923 -8.899 2.503 1.00 0.00 H new ATOM 0 HD1 TYR A 148 13.851 -9.528 5.866 1.00 0.00 H new ATOM 0 HD2 TYR A 148 14.279 -11.361 2.043 1.00 0.00 H new ATOM 0 HE1 TYR A 148 13.805 -11.746 6.921 1.00 0.00 H new ATOM 0 HE2 TYR A 148 14.230 -13.576 3.095 1.00 0.00 H new ATOM 0 HH TYR A 148 13.099 -14.427 5.565 1.00 0.00 H new ATOM 2195 N ASP A 149 16.608 -8.314 4.445 1.00 0.00 N ATOM 2196 CA ASP A 149 17.848 -8.555 5.173 1.00 0.00 C ATOM 2197 C ASP A 149 18.097 -7.457 6.203 1.00 0.00 C ATOM 2198 O ASP A 149 18.806 -7.664 7.187 1.00 0.00 O ATOM 2199 CB ASP A 149 19.027 -8.635 4.202 1.00 0.00 C ATOM 2200 CG ASP A 149 20.210 -9.381 4.788 1.00 0.00 C ATOM 2201 OD1 ASP A 149 20.069 -9.942 5.895 1.00 0.00 O ATOM 2202 OD2 ASP A 149 21.277 -9.404 4.140 1.00 0.00 O ATOM 0 H ASP A 149 16.686 -8.414 3.433 1.00 0.00 H new ATOM 0 HA ASP A 149 17.753 -9.506 5.697 1.00 0.00 H new ATOM 0 HB2 ASP A 149 18.706 -9.131 3.286 1.00 0.00 H new ATOM 0 HB3 ASP A 149 19.337 -7.627 3.927 1.00 0.00 H new ATOM 2207 N ALA A 150 17.510 -6.288 5.965 1.00 0.00 N ATOM 2208 CA ALA A 150 17.670 -5.156 6.869 1.00 0.00 C ATOM 2209 C ALA A 150 16.604 -5.163 7.960 1.00 0.00 C ATOM 2210 O ALA A 150 16.753 -4.502 8.988 1.00 0.00 O ATOM 2211 CB ALA A 150 17.617 -3.853 6.085 1.00 0.00 C ATOM 0 H ALA A 150 16.920 -6.101 5.154 1.00 0.00 H new ATOM 0 HA ALA A 150 18.643 -5.243 7.354 1.00 0.00 H new ATOM 0 HB1 ALA A 150 17.737 -3.012 6.768 1.00 0.00 H new ATOM 0 HB2 ALA A 150 18.420 -3.839 5.348 1.00 0.00 H new ATOM 0 HB3 ALA A 150 16.656 -3.773 5.577 1.00 0.00 H new ATOM 2217 N ASP A 151 15.530 -5.911 7.731 1.00 0.00 N ATOM 2218 CA ASP A 151 14.440 -6.000 8.697 1.00 0.00 C ATOM 2219 C ASP A 151 14.321 -7.413 9.261 1.00 0.00 C ATOM 2220 O ASP A 151 14.274 -7.604 10.476 1.00 0.00 O ATOM 2221 CB ASP A 151 13.119 -5.585 8.047 1.00 0.00 C ATOM 2222 CG ASP A 151 12.474 -4.405 8.747 1.00 0.00 C ATOM 2223 OD1 ASP A 151 12.896 -3.259 8.488 1.00 0.00 O ATOM 2224 OD2 ASP A 151 11.548 -4.628 9.554 1.00 0.00 O ATOM 0 H ASP A 151 15.391 -6.464 6.886 1.00 0.00 H new ATOM 0 HA ASP A 151 14.663 -5.320 9.519 1.00 0.00 H new ATOM 0 HB2 ASP A 151 13.296 -5.331 7.002 1.00 0.00 H new ATOM 0 HB3 ASP A 151 12.431 -6.430 8.058 1.00 0.00 H new ATOM 2229 N GLN A 152 14.271 -8.398 8.370 1.00 0.00 N ATOM 2230 CA GLN A 152 14.156 -9.794 8.773 1.00 0.00 C ATOM 2231 C GLN A 152 12.695 -10.185 8.975 1.00 0.00 C ATOM 2232 O GLN A 152 12.283 -10.535 10.080 1.00 0.00 O ATOM 2233 CB GLN A 152 14.945 -10.045 10.060 1.00 0.00 C ATOM 2234 CG GLN A 152 15.252 -11.513 10.310 1.00 0.00 C ATOM 2235 CD GLN A 152 16.713 -11.756 10.634 1.00 0.00 C ATOM 2236 OE1 GLN A 152 17.097 -11.830 11.802 1.00 0.00 O ATOM 2237 NE2 GLN A 152 17.536 -11.881 9.601 1.00 0.00 N ATOM 0 H GLN A 152 14.309 -8.254 7.361 1.00 0.00 H new ATOM 0 HA GLN A 152 14.572 -10.409 7.975 1.00 0.00 H new ATOM 0 HB2 GLN A 152 15.882 -9.489 10.016 1.00 0.00 H new ATOM 0 HB3 GLN A 152 14.380 -9.652 10.905 1.00 0.00 H new ATOM 0 HG2 GLN A 152 14.636 -11.874 11.134 1.00 0.00 H new ATOM 0 HG3 GLN A 152 14.978 -12.093 9.429 1.00 0.00 H new ATOM 0 HE21 GLN A 152 17.174 -11.813 8.650 1.00 0.00 H new ATOM 0 HE22 GLN A 152 18.530 -12.045 9.758 1.00 0.00 H new ATOM 2246 N LYS A 153 11.918 -10.122 7.898 1.00 0.00 N ATOM 2247 CA LYS A 153 10.503 -10.468 7.956 1.00 0.00 C ATOM 2248 C LYS A 153 9.933 -10.670 6.555 1.00 0.00 C ATOM 2249 O LYS A 153 9.851 -9.728 5.766 1.00 0.00 O ATOM 2250 CB LYS A 153 9.718 -9.377 8.685 1.00 0.00 C ATOM 2251 CG LYS A 153 9.599 -9.612 10.183 1.00 0.00 C ATOM 2252 CD LYS A 153 10.343 -8.549 10.974 1.00 0.00 C ATOM 2253 CE LYS A 153 9.986 -8.602 12.451 1.00 0.00 C ATOM 2254 NZ LYS A 153 10.794 -9.616 13.183 1.00 0.00 N ATOM 0 H LYS A 153 12.245 -9.835 6.975 1.00 0.00 H new ATOM 0 HA LYS A 153 10.407 -11.404 8.506 1.00 0.00 H new ATOM 0 HB2 LYS A 153 10.203 -8.416 8.514 1.00 0.00 H new ATOM 0 HB3 LYS A 153 8.718 -9.311 8.255 1.00 0.00 H new ATOM 0 HG2 LYS A 153 8.547 -9.611 10.470 1.00 0.00 H new ATOM 0 HG3 LYS A 153 9.996 -10.596 10.431 1.00 0.00 H new ATOM 0 HD2 LYS A 153 11.417 -8.689 10.853 1.00 0.00 H new ATOM 0 HD3 LYS A 153 10.103 -7.563 10.576 1.00 0.00 H new ATOM 0 HE2 LYS A 153 10.144 -7.621 12.898 1.00 0.00 H new ATOM 0 HE3 LYS A 153 8.927 -8.835 12.560 1.00 0.00 H new ATOM 0 HZ1 LYS A 153 10.520 -9.620 14.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 153 10.624 -10.557 12.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 153 11.804 -9.380 13.101 1.00 0.00 H new ATOM 2268 N PHE A 154 9.539 -11.904 6.253 1.00 0.00 N ATOM 2269 CA PHE A 154 8.975 -12.228 4.948 1.00 0.00 C ATOM 2270 C PHE A 154 7.521 -12.672 5.081 1.00 0.00 C ATOM 2271 O PHE A 154 7.063 -13.008 6.173 1.00 0.00 O ATOM 2272 CB PHE A 154 9.799 -13.327 4.273 1.00 0.00 C ATOM 2273 CG PHE A 154 10.148 -14.465 5.189 1.00 0.00 C ATOM 2274 CD1 PHE A 154 11.208 -14.358 6.074 1.00 0.00 C ATOM 2275 CD2 PHE A 154 9.415 -15.640 5.165 1.00 0.00 C ATOM 2276 CE1 PHE A 154 11.532 -15.404 6.918 1.00 0.00 C ATOM 2277 CE2 PHE A 154 9.734 -16.689 6.007 1.00 0.00 C ATOM 2278 CZ PHE A 154 10.794 -16.571 6.884 1.00 0.00 C ATOM 0 H PHE A 154 9.600 -12.695 6.894 1.00 0.00 H new ATOM 0 HA PHE A 154 9.006 -11.330 4.331 1.00 0.00 H new ATOM 0 HB2 PHE A 154 9.242 -13.715 3.420 1.00 0.00 H new ATOM 0 HB3 PHE A 154 10.718 -12.892 3.881 1.00 0.00 H new ATOM 0 HD1 PHE A 154 11.788 -13.447 6.105 1.00 0.00 H new ATOM 0 HD2 PHE A 154 8.585 -15.738 4.481 1.00 0.00 H new ATOM 0 HE1 PHE A 154 12.361 -15.309 7.603 1.00 0.00 H new ATOM 0 HE2 PHE A 154 9.155 -17.600 5.979 1.00 0.00 H new ATOM 0 HZ PHE A 154 11.046 -17.390 7.542 1.00 0.00 H new ATOM 2288 N GLY A 155 6.801 -12.671 3.963 1.00 0.00 N ATOM 2289 CA GLY A 155 5.405 -13.075 3.982 1.00 0.00 C ATOM 2290 C GLY A 155 4.938 -13.620 2.647 1.00 0.00 C ATOM 2291 O GLY A 155 5.362 -13.146 1.592 1.00 0.00 O ATOM 0 H GLY A 155 7.157 -12.399 3.047 1.00 0.00 H new ATOM 0 HA2 GLY A 155 5.261 -13.834 4.751 1.00 0.00 H new ATOM 0 HA3 GLY A 155 4.787 -12.221 4.258 1.00 0.00 H new ATOM 2295 N PHE A 156 4.059 -14.616 2.692 1.00 0.00 N ATOM 2296 CA PHE A 156 3.530 -15.226 1.477 1.00 0.00 C ATOM 2297 C PHE A 156 2.375 -14.403 0.915 1.00 0.00 C ATOM 2298 O PHE A 156 1.407 -14.114 1.619 1.00 0.00 O ATOM 2299 CB PHE A 156 3.063 -16.654 1.760 1.00 0.00 C ATOM 2300 CG PHE A 156 4.013 -17.439 2.619 1.00 0.00 C ATOM 2301 CD1 PHE A 156 5.319 -17.011 2.798 1.00 0.00 C ATOM 2302 CD2 PHE A 156 3.601 -18.603 3.247 1.00 0.00 C ATOM 2303 CE1 PHE A 156 6.196 -17.730 3.587 1.00 0.00 C ATOM 2304 CE2 PHE A 156 4.474 -19.326 4.038 1.00 0.00 C ATOM 2305 CZ PHE A 156 5.774 -18.889 4.208 1.00 0.00 C ATOM 0 H PHE A 156 3.698 -15.018 3.557 1.00 0.00 H new ATOM 0 HA PHE A 156 4.329 -15.253 0.736 1.00 0.00 H new ATOM 0 HB2 PHE A 156 2.089 -16.619 2.249 1.00 0.00 H new ATOM 0 HB3 PHE A 156 2.926 -17.177 0.813 1.00 0.00 H new ATOM 0 HD1 PHE A 156 5.655 -16.105 2.315 1.00 0.00 H new ATOM 0 HD2 PHE A 156 2.586 -18.949 3.117 1.00 0.00 H new ATOM 0 HE1 PHE A 156 7.211 -17.386 3.718 1.00 0.00 H new ATOM 0 HE2 PHE A 156 4.140 -20.232 4.523 1.00 0.00 H new ATOM 0 HZ PHE A 156 6.458 -19.453 4.825 1.00 0.00 H new ATOM 2315 N CYS A 157 2.484 -14.026 -0.354 1.00 0.00 N ATOM 2316 CA CYS A 157 1.447 -13.236 -1.008 1.00 0.00 C ATOM 2317 C CYS A 157 0.655 -14.084 -1.997 1.00 0.00 C ATOM 2318 O CYS A 157 0.985 -15.245 -2.239 1.00 0.00 O ATOM 2319 CB CYS A 157 2.060 -12.032 -1.731 1.00 0.00 C ATOM 2320 SG CYS A 157 3.882 -12.032 -1.787 1.00 0.00 S ATOM 0 H CYS A 157 3.279 -14.254 -0.950 1.00 0.00 H new ATOM 0 HA CYS A 157 0.767 -12.877 -0.235 1.00 0.00 H new ATOM 0 HB2 CYS A 157 1.678 -12.004 -2.751 1.00 0.00 H new ATOM 0 HB3 CYS A 157 1.724 -11.119 -1.239 1.00 0.00 H new ATOM 2325 N PRO A 158 -0.405 -13.508 -2.583 1.00 0.00 N ATOM 2326 CA PRO A 158 -1.253 -14.209 -3.551 1.00 0.00 C ATOM 2327 C PRO A 158 -0.570 -14.381 -4.902 1.00 0.00 C ATOM 2328 O PRO A 158 0.635 -14.160 -5.033 1.00 0.00 O ATOM 2329 CB PRO A 158 -2.470 -13.293 -3.678 1.00 0.00 C ATOM 2330 CG PRO A 158 -1.952 -11.933 -3.362 1.00 0.00 C ATOM 2331 CD PRO A 158 -0.861 -12.127 -2.342 1.00 0.00 C ATOM 0 HA PRO A 158 -1.495 -15.221 -3.227 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -2.893 -13.333 -4.682 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -3.261 -13.586 -2.987 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -1.566 -11.445 -4.257 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -2.744 -11.296 -2.969 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -0.053 -11.408 -2.477 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -1.234 -11.999 -1.326 1.00 0.00 H new ATOM 2339 N MET A 159 -1.345 -14.776 -5.907 1.00 0.00 N ATOM 2340 CA MET A 159 -0.813 -14.976 -7.250 1.00 0.00 C ATOM 2341 C MET A 159 0.057 -13.798 -7.673 1.00 0.00 C ATOM 2342 O MET A 159 0.092 -12.767 -7.001 1.00 0.00 O ATOM 2343 CB MET A 159 -1.956 -15.167 -8.250 1.00 0.00 C ATOM 2344 CG MET A 159 -1.875 -16.472 -9.025 1.00 0.00 C ATOM 2345 SD MET A 159 -1.136 -16.265 -10.657 1.00 0.00 S ATOM 2346 CE MET A 159 -1.465 -17.869 -11.383 1.00 0.00 C ATOM 0 H MET A 159 -2.343 -14.964 -5.817 1.00 0.00 H new ATOM 0 HA MET A 159 -0.195 -15.874 -7.239 1.00 0.00 H new ATOM 0 HB2 MET A 159 -2.905 -15.130 -7.715 1.00 0.00 H new ATOM 0 HB3 MET A 159 -1.954 -14.335 -8.954 1.00 0.00 H new ATOM 0 HG2 MET A 159 -1.290 -17.193 -8.454 1.00 0.00 H new ATOM 0 HG3 MET A 159 -2.876 -16.888 -9.134 1.00 0.00 H new ATOM 0 HE1 MET A 159 -1.067 -17.898 -12.397 1.00 0.00 H new ATOM 0 HE2 MET A 159 -0.988 -18.644 -10.784 1.00 0.00 H new ATOM 0 HE3 MET A 159 -2.541 -18.042 -11.411 1.00 0.00 H new ATOM 2356 N ALA A 160 0.758 -13.957 -8.790 1.00 0.00 N ATOM 2357 CA ALA A 160 1.628 -12.907 -9.303 1.00 0.00 C ATOM 2358 C ALA A 160 1.183 -12.452 -10.689 1.00 0.00 C ATOM 2359 O ALA A 160 0.103 -12.893 -11.137 1.00 0.00 O ATOM 2360 CB ALA A 160 3.071 -13.389 -9.342 1.00 0.00 C ATOM 2361 OXT ALA A 160 1.916 -11.659 -11.315 1.00 0.00 O ATOM 0 H ALA A 160 0.740 -14.804 -9.358 1.00 0.00 H new ATOM 0 HA ALA A 160 1.560 -12.052 -8.630 1.00 0.00 H new ATOM 0 HB1 ALA A 160 3.710 -12.594 -9.727 1.00 0.00 H new ATOM 0 HB2 ALA A 160 3.392 -13.657 -8.336 1.00 0.00 H new ATOM 0 HB3 ALA A 160 3.146 -14.261 -9.991 1.00 0.00 H new TER 2367 ALA A 160 HETATM 2368 C1 NAG A 161 18.862 -2.188 -3.404 1.00 0.00 C HETATM 2369 C2 NAG A 161 20.336 -1.980 -3.100 1.00 0.00 C HETATM 2370 C3 NAG A 161 20.517 -0.624 -2.429 1.00 0.00 C HETATM 2371 C4 NAG A 161 20.015 0.505 -3.359 1.00 0.00 C HETATM 2372 C5 NAG A 161 18.495 0.223 -3.654 1.00 0.00 C HETATM 2373 C6 NAG A 161 17.894 1.252 -4.625 1.00 0.00 C HETATM 2374 C7 NAG A 161 22.004 -3.653 -2.503 1.00 0.00 C HETATM 2375 C8 NAG A 161 22.423 -4.731 -1.507 1.00 0.00 C HETATM 2376 N2 NAG A 161 20.859 -3.031 -2.239 1.00 0.00 N HETATM 2377 O3 NAG A 161 21.890 -0.418 -2.140 1.00 0.00 O HETATM 2378 O4 NAG A 161 20.213 1.740 -2.681 1.00 0.00 O HETATM 2379 O5 NAG A 161 18.379 -1.110 -4.229 1.00 0.00 O HETATM 2380 O6 NAG A 161 17.527 0.583 -5.832 1.00 0.00 O HETATM 2381 O7 NAG A 161 22.694 -3.387 -3.487 1.00 0.00 O HETATM 0 HO6 NAG A 161 17.685 -0.379 -5.734 1.00 0.00 H new HETATM 0 HO4 NAG A 161 20.215 2.473 -3.331 1.00 0.00 H new HETATM 0 HO3 NAG A 161 22.064 0.542 -2.046 1.00 0.00 H new HETATM 0 HN2 NAG A 161 20.331 -3.298 -1.408 1.00 0.00 H new HETATM 0 H83 NAG A 161 22.540 -4.287 -0.518 1.00 0.00 H new HETATM 0 H82 NAG A 161 21.659 -5.507 -1.468 1.00 0.00 H new HETATM 0 H81 NAG A 161 23.370 -5.170 -1.822 1.00 0.00 H new HETATM 0 H62 NAG A 161 17.022 1.729 -4.178 1.00 0.00 H new HETATM 0 H61 NAG A 161 18.617 2.041 -4.835 1.00 0.00 H new HETATM 0 H5 NAG A 161 17.942 0.297 -2.717 1.00 0.00 H new HETATM 0 H4 NAG A 161 20.550 0.549 -4.308 1.00 0.00 H new HETATM 0 H3 NAG A 161 19.939 -0.608 -1.505 1.00 0.00 H new HETATM 0 H2 NAG A 161 20.891 -2.015 -4.038 1.00 0.00 H new