USER MOD reduce.3.24.130724 H: found=0, std=0, add=2148, rem=0, adj=61 USER MOD reduce.3.24.130724 removed 2145 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: D 55 THR OG1 : rot 120:sc= 0.418 USER MOD Set 1.2: D 57 SER OG : rot 180:sc= 0.394 USER MOD Set 2.1: D 7 THR OG1 : rot -68:sc= 0.564 USER MOD Set 2.2: D 9 THR OG1 : rot -40:sc= 0.489 USER MOD Set 3.1: C 55 THR OG1 : rot 120:sc= 0.144 USER MOD Set 3.2: C 57 SER OG : rot 180:sc= 0.454 USER MOD Set 4.1: C 22 THR OG1 : rot 180:sc= -0.642 USER MOD Set 4.2: C 25 ASN : amide:sc= 0.107 K(o=-0.53,f=-2.6!) USER MOD Set 5.1: A 123 LYS NZ :NH3+ 160:sc= 0 (180deg=-0.207) USER MOD Set 5.2: A 127 TYR OH : rot 180:sc= 0 USER MOD Set 6.1: A 44 LYS NZ :NH3+ -171:sc= 0.0991 (180deg=0) USER MOD Set 6.2: A 110 GLN : amide:sc= -4.01 K(o=-3.9,f=-7.3!) USER MOD Set 7.1: A 88 CYS SG : rot -73:sc= -0.133 USER MOD Set 7.2: A 90 SER OG : rot 180:sc= -0.219 USER MOD Set 8.1: A 66 SER OG : rot -150:sc= -1.14 USER MOD Set 8.2: A 68 ASN : amide:sc= -1.99 K(o=-3.1,f=-9.3!) USER MOD Set 9.1: A 52 THR OG1 : rot -144:sc= 1.28 USER MOD Set 9.2: A 58 HIS : no HE2:sc= -3.71! C(o=-2.4!,f=-8.7!) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 TYR OH : rot -110:sc= 0.0552 USER MOD Single : A 30 LYS NZ :NH3+ 172:sc= 0.251 (180deg=0.227) USER MOD Single : A 31 MET CE :methyl -140:sc= -2.48 (180deg=-3.32!) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 42:sc= 0.147 USER MOD Single : A 42 LYS NZ :NH3+ -166:sc= -0.0227 (180deg=-0.323) USER MOD Single : A 48 TYR OH : rot 80:sc= -1.32 USER MOD Single : A 50 GLN : amide:sc= -0.63 K(o=-0.63,f=-4.7!) USER MOD Single : A 51 GLN : amide:sc= -0.203 K(o=-0.2,f=-1.1) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 CYS SG : rot -140:sc= -3.06 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 THR OG1 : rot 83:sc= 0.00427 USER MOD Single : A 80 CYS SG : rot -40:sc= -7.51! USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 GLN : amide:sc= -0.355 K(o=-0.36,f=-3!) USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 LYS NZ :NH3+ -136:sc= 1.27 (180deg=-0.218) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 LYS NZ :NH3+ 169:sc= -0.0724 (180deg=-0.107) USER MOD Single : A 109 MET CE :methyl -152:sc= -2.51 (180deg=-4.63!) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 GLN : amide:sc= -0.236 X(o=-0.24,f=-0.17) USER MOD Single : A 120 HIS : no HD1:sc= -1.95 K(o=-2,f=-2.6!) USER MOD Single : A 121 CYS SG : rot 58:sc= 0.0537 USER MOD Single : A 125 ASN : amide:sc= -1.98 K(o=-2,f=-4.3!) USER MOD Single : A 129 ASN : amide:sc= -2.46 K(o=-2.5,f=-0.15) USER MOD Single : A 130 ASN : amide:sc= -1.32 K(o=-1.3,f=-1.9!) USER MOD Single : B 940 GLN : amide:sc= -0.276 X(o=-0.28,f=-0.47) USER MOD Single : B 950 TYR OH : rot 150:sc= -0.657 USER MOD Single : C 1 MET CE :methyl 166:sc= -1.01 (180deg=-2.09) USER MOD Single : C 1 MET N :NH3+ 166:sc= 1.27 (180deg=1.08) USER MOD Single : C 2 GLN : amide:sc= -1.36 K(o=-1.4,f=-0.67) USER MOD Single : C 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 7 THR OG1 : rot 180:sc= 0 USER MOD Single : C 12 THR OG1 : rot 35:sc= -1.24 USER MOD Single : C 14 THR OG1 : rot -92:sc= 1.44 USER MOD Single : C 20 SER OG : rot 180:sc= 0 USER MOD Single : C 27 LYS NZ :NH3+ 157:sc= -0.0457 (180deg=-0.534) USER MOD Single : C 29 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.029) USER MOD Single : C 31 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : C 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 40 GLN : amide:sc= -0.0228 X(o=-0.023,f=-0.37) USER MOD Single : C 41 GLN : amide:sc= -5.69 K(o=-5.7,f=-9.2!) USER MOD Single : C 48 LYS NZ :NH3+ 155:sc= -0.183 (180deg=-0.866) USER MOD Single : C 49 GLN : amide:sc= -2.23 K(o=-2.2,f=-3.4!) USER MOD Single : C 59 TYR OH : rot 160:sc= 0.719 USER MOD Single : C 60 ASN : amide:sc= -0.161 K(o=-0.16,f=-1.5!) USER MOD Single : C 62 GLN : amide:sc= -0.0209 K(o=-0.021,f=-1.4!) USER MOD Single : C 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 65 SER OG : rot 66:sc= 0.512 USER MOD Single : C 66 THR OG1 : rot 180:sc= 0 USER MOD Single : C 68 HIS : no HD1:sc= -1.51 K(o=-1.5,f=-4.4!) USER MOD Single : D 1 MET CE :methyl 167:sc= -1.73 (180deg=-2.49) USER MOD Single : D 1 MET N :NH3+ 164:sc= 1.2 (180deg=1.02) USER MOD Single : D 2 GLN : amide:sc= -1.65 K(o=-1.7,f=-5.1!) USER MOD Single : D 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 11 LYS NZ :NH3+ 163:sc= 0 (180deg=-0.27) USER MOD Single : D 12 THR OG1 : rot -175:sc= -1.43 USER MOD Single : D 14 THR OG1 : rot -80:sc= 1.51 USER MOD Single : D 20 SER OG : rot 180:sc= 0 USER MOD Single : D 22 THR OG1 : rot 180:sc= 0.0398 USER MOD Single : D 25 ASN : amide:sc= 0.168 K(o=0.17,f=-1.6!) USER MOD Single : D 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 29 LYS NZ :NH3+ -160:sc= -0.0297 (180deg=-0.396) USER MOD Single : D 31 GLN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Single : D 33 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0633) USER MOD Single : D 40 GLN : amide:sc= -0.261 K(o=-0.26,f=-4.6!) USER MOD Single : D 41 GLN : amide:sc= -2.48! C(o=-2.5!,f=-10!) USER MOD Single : D 49 GLN : amide:sc= 0 X(o=0,f=-0.014) USER MOD Single : D 59 TYR OH : rot 180:sc= 0.397 USER MOD Single : D 60 ASN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : D 62 GLN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Single : D 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 65 SER OG : rot 78:sc= 0.0406 USER MOD Single : D 66 THR OG1 : rot 180:sc= 0 USER MOD Single : D 68 HIS : no HE2:sc= -1.75 X(o=-1.8,f=-2) USER MOD ----------------------------------------------------------------- ATOM 1 N MET C 1 -18.902 6.710 10.274 1.00 0.00 N ATOM 2 CA MET C 1 -18.143 7.457 9.234 1.00 0.00 C ATOM 3 C MET C 1 -19.110 7.969 8.187 1.00 0.00 C ATOM 4 O MET C 1 -19.172 7.450 7.076 1.00 0.00 O ATOM 5 CB MET C 1 -17.118 6.530 8.580 1.00 0.00 C ATOM 6 CG MET C 1 -16.277 7.325 7.578 1.00 0.00 C ATOM 7 SD MET C 1 -15.262 6.190 6.604 1.00 0.00 S ATOM 8 CE MET C 1 -16.596 5.572 5.552 1.00 0.00 C ATOM 0 H1 MET C 1 -18.241 6.160 10.859 1.00 0.00 H new ATOM 0 H2 MET C 1 -19.420 7.382 10.876 1.00 0.00 H new ATOM 0 H3 MET C 1 -19.577 6.065 9.815 1.00 0.00 H new ATOM 0 HA MET C 1 -17.621 8.297 9.693 1.00 0.00 H new ATOM 0 HB2 MET C 1 -16.475 6.087 9.341 1.00 0.00 H new ATOM 0 HB3 MET C 1 -17.625 5.708 8.074 1.00 0.00 H new ATOM 0 HG2 MET C 1 -16.926 7.903 6.921 1.00 0.00 H new ATOM 0 HG3 MET C 1 -15.641 8.037 8.105 1.00 0.00 H new ATOM 0 HE1 MET C 1 -16.171 5.038 4.702 1.00 0.00 H new ATOM 0 HE2 MET C 1 -17.229 4.895 6.126 1.00 0.00 H new ATOM 0 HE3 MET C 1 -17.193 6.410 5.192 1.00 0.00 H new ATOM 20 N GLN C 2 -19.853 8.994 8.553 1.00 0.00 N ATOM 21 CA GLN C 2 -20.814 9.586 7.647 1.00 0.00 C ATOM 22 C GLN C 2 -20.110 10.178 6.441 1.00 0.00 C ATOM 23 O GLN C 2 -18.919 10.447 6.478 1.00 0.00 O ATOM 24 CB GLN C 2 -21.587 10.670 8.381 1.00 0.00 C ATOM 25 CG GLN C 2 -20.656 11.850 8.593 1.00 0.00 C ATOM 26 CD GLN C 2 -21.202 12.760 9.689 1.00 0.00 C ATOM 27 OE1 GLN C 2 -21.540 12.291 10.777 1.00 0.00 O ATOM 28 NE2 GLN C 2 -21.300 14.042 9.469 1.00 0.00 N ATOM 0 H GLN C 2 -19.809 9.434 9.472 1.00 0.00 H new ATOM 0 HA GLN C 2 -21.502 8.815 7.299 1.00 0.00 H new ATOM 0 HB2 GLN C 2 -22.460 10.973 7.803 1.00 0.00 H new ATOM 0 HB3 GLN C 2 -21.952 10.296 9.338 1.00 0.00 H new ATOM 0 HG2 GLN C 2 -19.663 11.494 8.866 1.00 0.00 H new ATOM 0 HG3 GLN C 2 -20.550 12.410 7.664 1.00 0.00 H new ATOM 0 HE21 GLN C 2 -21.019 14.428 8.567 1.00 0.00 H new ATOM 0 HE22 GLN C 2 -21.657 14.659 10.199 1.00 0.00 H new ATOM 37 N ILE C 3 -20.859 10.349 5.369 1.00 0.00 N ATOM 38 CA ILE C 3 -20.314 10.887 4.135 1.00 0.00 C ATOM 39 C ILE C 3 -21.297 11.864 3.512 1.00 0.00 C ATOM 40 O ILE C 3 -22.505 11.677 3.595 1.00 0.00 O ATOM 41 CB ILE C 3 -20.041 9.732 3.181 1.00 0.00 C ATOM 42 CG1 ILE C 3 -21.284 8.837 3.149 1.00 0.00 C ATOM 43 CG2 ILE C 3 -18.826 8.942 3.672 1.00 0.00 C ATOM 44 CD1 ILE C 3 -21.100 7.708 2.146 1.00 0.00 C ATOM 0 H ILE C 3 -21.853 10.122 5.327 1.00 0.00 H new ATOM 0 HA ILE C 3 -19.387 11.422 4.341 1.00 0.00 H new ATOM 0 HB ILE C 3 -19.828 10.102 2.178 1.00 0.00 H new ATOM 0 HG12 ILE C 3 -21.468 8.424 4.141 1.00 0.00 H new ATOM 0 HG13 ILE C 3 -22.159 9.429 2.883 1.00 0.00 H new ATOM 0 HG21 ILE C 3 -18.630 8.115 2.990 1.00 0.00 H new ATOM 0 HG22 ILE C 3 -17.956 9.598 3.707 1.00 0.00 H new ATOM 0 HG23 ILE C 3 -19.026 8.550 4.669 1.00 0.00 H new ATOM 0 HD11 ILE C 3 -21.992 7.082 2.136 1.00 0.00 H new ATOM 0 HD12 ILE C 3 -20.939 8.127 1.153 1.00 0.00 H new ATOM 0 HD13 ILE C 3 -20.237 7.106 2.430 1.00 0.00 H new ATOM 56 N PHE C 4 -20.771 12.908 2.898 1.00 0.00 N ATOM 57 CA PHE C 4 -21.613 13.921 2.281 1.00 0.00 C ATOM 58 C PHE C 4 -21.953 13.553 0.841 1.00 0.00 C ATOM 59 O PHE C 4 -21.066 13.317 0.035 1.00 0.00 O ATOM 60 CB PHE C 4 -20.875 15.257 2.304 1.00 0.00 C ATOM 61 CG PHE C 4 -21.005 15.897 3.669 1.00 0.00 C ATOM 62 CD1 PHE C 4 -20.680 15.175 4.827 1.00 0.00 C ATOM 63 CD2 PHE C 4 -21.430 17.224 3.769 1.00 0.00 C ATOM 64 CE1 PHE C 4 -20.784 15.785 6.083 1.00 0.00 C ATOM 65 CE2 PHE C 4 -21.539 17.832 5.026 1.00 0.00 C ATOM 66 CZ PHE C 4 -21.215 17.114 6.183 1.00 0.00 C ATOM 0 H PHE C 4 -19.769 13.078 2.812 1.00 0.00 H new ATOM 0 HA PHE C 4 -22.545 13.990 2.842 1.00 0.00 H new ATOM 0 HB2 PHE C 4 -19.823 15.105 2.063 1.00 0.00 H new ATOM 0 HB3 PHE C 4 -21.283 15.921 1.542 1.00 0.00 H new ATOM 0 HD1 PHE C 4 -20.350 14.150 4.750 1.00 0.00 H new ATOM 0 HD2 PHE C 4 -21.675 17.781 2.877 1.00 0.00 H new ATOM 0 HE1 PHE C 4 -20.532 15.231 6.975 1.00 0.00 H new ATOM 0 HE2 PHE C 4 -21.873 18.856 5.103 1.00 0.00 H new ATOM 0 HZ PHE C 4 -21.297 17.584 7.152 1.00 0.00 H new ATOM 76 N VAL C 5 -23.241 13.514 0.519 1.00 0.00 N ATOM 77 CA VAL C 5 -23.659 13.190 -0.840 1.00 0.00 C ATOM 78 C VAL C 5 -24.274 14.416 -1.499 1.00 0.00 C ATOM 79 O VAL C 5 -25.306 14.909 -1.062 1.00 0.00 O ATOM 80 CB VAL C 5 -24.672 12.049 -0.804 1.00 0.00 C ATOM 81 CG1 VAL C 5 -25.151 11.739 -2.226 1.00 0.00 C ATOM 82 CG2 VAL C 5 -24.000 10.812 -0.202 1.00 0.00 C ATOM 0 H VAL C 5 -24.004 13.700 1.170 1.00 0.00 H new ATOM 0 HA VAL C 5 -22.791 12.879 -1.421 1.00 0.00 H new ATOM 0 HB VAL C 5 -25.531 12.335 -0.197 1.00 0.00 H new ATOM 0 HG11 VAL C 5 -25.874 10.924 -2.197 1.00 0.00 H new ATOM 0 HG12 VAL C 5 -25.620 12.625 -2.653 1.00 0.00 H new ATOM 0 HG13 VAL C 5 -24.300 11.447 -2.841 1.00 0.00 H new ATOM 0 HG21 VAL C 5 -24.714 9.989 -0.171 1.00 0.00 H new ATOM 0 HG22 VAL C 5 -23.145 10.528 -0.815 1.00 0.00 H new ATOM 0 HG23 VAL C 5 -23.662 11.038 0.809 1.00 0.00 H new ATOM 92 N LYS C 6 -23.635 14.915 -2.548 1.00 0.00 N ATOM 93 CA LYS C 6 -24.145 16.097 -3.229 1.00 0.00 C ATOM 94 C LYS C 6 -24.909 15.707 -4.493 1.00 0.00 C ATOM 95 O LYS C 6 -24.404 14.958 -5.328 1.00 0.00 O ATOM 96 CB LYS C 6 -22.988 17.026 -3.585 1.00 0.00 C ATOM 97 CG LYS C 6 -23.507 18.459 -3.702 1.00 0.00 C ATOM 98 CD LYS C 6 -22.528 19.400 -3.010 1.00 0.00 C ATOM 99 CE LYS C 6 -21.313 19.623 -3.912 1.00 0.00 C ATOM 100 NZ LYS C 6 -20.394 20.607 -3.271 1.00 0.00 N1+ ATOM 0 H LYS C 6 -22.777 14.528 -2.941 1.00 0.00 H new ATOM 0 HA LYS C 6 -24.832 16.614 -2.559 1.00 0.00 H new ATOM 0 HB2 LYS C 6 -22.213 16.969 -2.821 1.00 0.00 H new ATOM 0 HB3 LYS C 6 -22.532 16.714 -4.525 1.00 0.00 H new ATOM 0 HG2 LYS C 6 -23.617 18.735 -4.751 1.00 0.00 H new ATOM 0 HG3 LYS C 6 -24.494 18.540 -3.246 1.00 0.00 H new ATOM 0 HD2 LYS C 6 -23.013 20.352 -2.793 1.00 0.00 H new ATOM 0 HD3 LYS C 6 -22.214 18.978 -2.056 1.00 0.00 H new ATOM 0 HE2 LYS C 6 -20.793 18.680 -4.080 1.00 0.00 H new ATOM 0 HE3 LYS C 6 -21.633 19.989 -4.887 1.00 0.00 H new ATOM 0 HZ1 LYS C 6 -19.567 20.760 -3.883 1.00 0.00 H new ATOM 0 HZ2 LYS C 6 -20.893 21.509 -3.132 1.00 0.00 H new ATOM 0 HZ3 LYS C 6 -20.080 20.240 -2.350 1.00 0.00 H new ATOM 114 N THR C 7 -26.129 16.216 -4.624 1.00 0.00 N ATOM 115 CA THR C 7 -26.959 15.913 -5.784 1.00 0.00 C ATOM 116 C THR C 7 -26.701 16.888 -6.924 1.00 0.00 C ATOM 117 O THR C 7 -25.883 17.799 -6.811 1.00 0.00 O ATOM 118 CB THR C 7 -28.439 15.952 -5.408 1.00 0.00 C ATOM 119 OG1 THR C 7 -28.783 17.257 -4.966 1.00 0.00 O ATOM 120 CG2 THR C 7 -28.711 14.938 -4.294 1.00 0.00 C ATOM 0 H THR C 7 -26.564 16.839 -3.943 1.00 0.00 H new ATOM 0 HA THR C 7 -26.695 14.910 -6.120 1.00 0.00 H new ATOM 0 HB THR C 7 -29.042 15.698 -6.279 1.00 0.00 H new ATOM 0 HG1 THR C 7 -29.733 17.281 -4.727 1.00 0.00 H new ATOM 0 HG21 THR C 7 -29.767 14.966 -4.026 1.00 0.00 H new ATOM 0 HG22 THR C 7 -28.451 13.938 -4.641 1.00 0.00 H new ATOM 0 HG23 THR C 7 -28.108 15.187 -3.420 1.00 0.00 H new ATOM 190 N THR C 12 -26.650 18.953 -0.534 1.00 0.00 N ATOM 191 CA THR C 12 -25.783 17.956 0.083 1.00 0.00 C ATOM 192 C THR C 12 -26.499 17.261 1.236 1.00 0.00 C ATOM 193 O THR C 12 -27.108 17.909 2.087 1.00 0.00 O ATOM 194 CB THR C 12 -24.513 18.616 0.598 1.00 0.00 C ATOM 195 OG1 THR C 12 -23.814 19.201 -0.486 1.00 0.00 O ATOM 196 CG2 THR C 12 -23.633 17.567 1.280 1.00 0.00 C ATOM 0 HA THR C 12 -25.526 17.213 -0.671 1.00 0.00 H new ATOM 0 HB THR C 12 -24.770 19.391 1.320 1.00 0.00 H new ATOM 0 HG1 THR C 12 -24.456 19.556 -1.136 1.00 0.00 H new ATOM 0 HG21 THR C 12 -22.723 18.040 1.649 1.00 0.00 H new ATOM 0 HG22 THR C 12 -24.176 17.124 2.115 1.00 0.00 H new ATOM 0 HG23 THR C 12 -23.372 16.789 0.563 1.00 0.00 H new ATOM 204 N ILE C 13 -26.430 15.937 1.244 1.00 0.00 N ATOM 205 CA ILE C 13 -27.080 15.144 2.273 1.00 0.00 C ATOM 206 C ILE C 13 -26.090 14.182 2.919 1.00 0.00 C ATOM 207 O ILE C 13 -25.726 13.170 2.324 1.00 0.00 O ATOM 208 CB ILE C 13 -28.221 14.338 1.648 1.00 0.00 C ATOM 209 CG1 ILE C 13 -28.362 14.720 0.168 1.00 0.00 C ATOM 210 CG2 ILE C 13 -29.525 14.641 2.386 1.00 0.00 C ATOM 211 CD1 ILE C 13 -29.511 13.943 -0.458 1.00 0.00 C ATOM 0 H ILE C 13 -25.928 15.389 0.545 1.00 0.00 H new ATOM 0 HA ILE C 13 -27.467 15.818 3.037 1.00 0.00 H new ATOM 0 HB ILE C 13 -28.003 13.273 1.728 1.00 0.00 H new ATOM 0 HG12 ILE C 13 -28.542 15.791 0.075 1.00 0.00 H new ATOM 0 HG13 ILE C 13 -27.434 14.505 -0.362 1.00 0.00 H new ATOM 0 HG21 ILE C 13 -30.337 14.067 1.940 1.00 0.00 H new ATOM 0 HG22 ILE C 13 -29.421 14.368 3.436 1.00 0.00 H new ATOM 0 HG23 ILE C 13 -29.748 15.705 2.309 1.00 0.00 H new ATOM 0 HD11 ILE C 13 -29.607 14.218 -1.508 1.00 0.00 H new ATOM 0 HD12 ILE C 13 -29.313 12.874 -0.379 1.00 0.00 H new ATOM 0 HD13 ILE C 13 -30.438 14.180 0.065 1.00 0.00 H new ATOM 223 N THR C 14 -25.659 14.493 4.138 1.00 0.00 N ATOM 224 CA THR C 14 -24.721 13.632 4.830 1.00 0.00 C ATOM 225 C THR C 14 -25.434 12.389 5.342 1.00 0.00 C ATOM 226 O THR C 14 -26.491 12.479 5.967 1.00 0.00 O ATOM 227 CB THR C 14 -24.080 14.372 5.999 1.00 0.00 C ATOM 228 OG1 THR C 14 -23.553 15.611 5.550 1.00 0.00 O ATOM 229 CG2 THR C 14 -22.955 13.524 6.566 1.00 0.00 C ATOM 0 H THR C 14 -25.943 15.324 4.657 1.00 0.00 H new ATOM 0 HA THR C 14 -23.941 13.337 4.128 1.00 0.00 H new ATOM 0 HB THR C 14 -24.830 14.557 6.768 1.00 0.00 H new ATOM 0 HG1 THR C 14 -22.614 15.494 5.294 1.00 0.00 H new ATOM 0 HG21 THR C 14 -22.492 14.047 7.403 1.00 0.00 H new ATOM 0 HG22 THR C 14 -23.356 12.571 6.911 1.00 0.00 H new ATOM 0 HG23 THR C 14 -22.209 13.345 5.792 1.00 0.00 H new ATOM 237 N LEU C 15 -24.851 11.230 5.068 1.00 0.00 N ATOM 238 CA LEU C 15 -25.436 9.970 5.499 1.00 0.00 C ATOM 239 C LEU C 15 -24.449 9.192 6.361 1.00 0.00 C ATOM 240 O LEU C 15 -23.305 8.993 5.967 1.00 0.00 O ATOM 241 CB LEU C 15 -25.812 9.129 4.276 1.00 0.00 C ATOM 242 CG LEU C 15 -26.930 9.818 3.495 1.00 0.00 C ATOM 243 CD1 LEU C 15 -27.139 9.092 2.164 1.00 0.00 C ATOM 244 CD2 LEU C 15 -28.224 9.768 4.308 1.00 0.00 C ATOM 0 H LEU C 15 -23.977 11.137 4.551 1.00 0.00 H new ATOM 0 HA LEU C 15 -26.329 10.185 6.087 1.00 0.00 H new ATOM 0 HB2 LEU C 15 -24.940 8.992 3.636 1.00 0.00 H new ATOM 0 HB3 LEU C 15 -26.135 8.137 4.591 1.00 0.00 H new ATOM 0 HG LEU C 15 -26.658 10.857 3.307 1.00 0.00 H new ATOM 0 HD11 LEU C 15 -27.936 9.581 1.604 1.00 0.00 H new ATOM 0 HD12 LEU C 15 -26.217 9.123 1.584 1.00 0.00 H new ATOM 0 HD13 LEU C 15 -27.413 8.054 2.355 1.00 0.00 H new ATOM 0 HD21 LEU C 15 -29.022 10.259 3.752 1.00 0.00 H new ATOM 0 HD22 LEU C 15 -28.497 8.729 4.494 1.00 0.00 H new ATOM 0 HD23 LEU C 15 -28.076 10.280 5.259 1.00 0.00 H new ATOM 256 N GLU C 16 -24.897 8.747 7.531 1.00 0.00 N ATOM 257 CA GLU C 16 -24.031 7.988 8.430 1.00 0.00 C ATOM 258 C GLU C 16 -23.757 6.597 7.880 1.00 0.00 C ATOM 259 O GLU C 16 -24.666 5.778 7.750 1.00 0.00 O ATOM 260 CB GLU C 16 -24.694 7.849 9.789 1.00 0.00 C ATOM 261 CG GLU C 16 -23.779 7.064 10.727 1.00 0.00 C ATOM 262 CD GLU C 16 -24.423 6.959 12.104 1.00 0.00 C ATOM 263 OE1 GLU C 16 -25.513 7.484 12.267 1.00 0.00 O ATOM 264 OE2 GLU C 16 -23.821 6.356 12.977 1.00 0.00 O1- ATOM 0 H GLU C 16 -25.845 8.896 7.877 1.00 0.00 H new ATOM 0 HA GLU C 16 -23.089 8.528 8.521 1.00 0.00 H new ATOM 0 HB2 GLU C 16 -24.901 8.834 10.207 1.00 0.00 H new ATOM 0 HB3 GLU C 16 -25.652 7.339 9.687 1.00 0.00 H new ATOM 0 HG2 GLU C 16 -23.597 6.068 10.323 1.00 0.00 H new ATOM 0 HG3 GLU C 16 -22.811 7.559 10.804 1.00 0.00 H new ATOM 271 N VAL C 17 -22.496 6.340 7.574 1.00 0.00 N ATOM 272 CA VAL C 17 -22.099 5.046 7.047 1.00 0.00 C ATOM 273 C VAL C 17 -20.783 4.591 7.675 1.00 0.00 C ATOM 274 O VAL C 17 -20.068 5.387 8.284 1.00 0.00 O ATOM 275 CB VAL C 17 -21.936 5.150 5.541 1.00 0.00 C ATOM 276 CG1 VAL C 17 -23.236 5.683 4.935 1.00 0.00 C ATOM 277 CG2 VAL C 17 -20.792 6.108 5.232 1.00 0.00 C ATOM 0 H VAL C 17 -21.733 7.008 7.681 1.00 0.00 H new ATOM 0 HA VAL C 17 -22.869 4.313 7.288 1.00 0.00 H new ATOM 0 HB VAL C 17 -21.714 4.171 5.117 1.00 0.00 H new ATOM 0 HG11 VAL C 17 -23.128 5.761 3.853 1.00 0.00 H new ATOM 0 HG12 VAL C 17 -24.053 5.001 5.170 1.00 0.00 H new ATOM 0 HG13 VAL C 17 -23.454 6.667 5.350 1.00 0.00 H new ATOM 0 HG21 VAL C 17 -20.667 6.189 4.152 1.00 0.00 H new ATOM 0 HG22 VAL C 17 -21.018 7.091 5.646 1.00 0.00 H new ATOM 0 HG23 VAL C 17 -19.871 5.730 5.676 1.00 0.00 H new ATOM 287 N GLU C 18 -20.464 3.314 7.510 1.00 0.00 N ATOM 288 CA GLU C 18 -19.222 2.774 8.047 1.00 0.00 C ATOM 289 C GLU C 18 -18.242 2.494 6.917 1.00 0.00 C ATOM 290 O GLU C 18 -18.648 2.298 5.774 1.00 0.00 O ATOM 291 CB GLU C 18 -19.491 1.486 8.823 1.00 0.00 C ATOM 292 CG GLU C 18 -20.352 1.797 10.045 1.00 0.00 C ATOM 293 CD GLU C 18 -19.631 2.779 10.961 1.00 0.00 C ATOM 294 OE1 GLU C 18 -18.440 2.607 11.158 1.00 0.00 O ATOM 295 OE2 GLU C 18 -20.279 3.688 11.449 1.00 0.00 O1- ATOM 0 H GLU C 18 -21.043 2.637 7.013 1.00 0.00 H new ATOM 0 HA GLU C 18 -18.790 3.511 8.724 1.00 0.00 H new ATOM 0 HB2 GLU C 18 -19.997 0.763 8.183 1.00 0.00 H new ATOM 0 HB3 GLU C 18 -18.550 1.033 9.134 1.00 0.00 H new ATOM 0 HG2 GLU C 18 -21.307 2.217 9.729 1.00 0.00 H new ATOM 0 HG3 GLU C 18 -20.572 0.877 10.587 1.00 0.00 H new ATOM 302 N PRO C 19 -16.966 2.478 7.202 1.00 0.00 N ATOM 303 CA PRO C 19 -15.927 2.223 6.164 1.00 0.00 C ATOM 304 C PRO C 19 -16.162 0.902 5.430 1.00 0.00 C ATOM 305 O PRO C 19 -15.943 0.800 4.224 1.00 0.00 O ATOM 306 CB PRO C 19 -14.627 2.182 6.964 1.00 0.00 C ATOM 307 CG PRO C 19 -14.905 2.953 8.207 1.00 0.00 C ATOM 308 CD PRO C 19 -16.366 2.690 8.533 1.00 0.00 C ATOM 0 HA PRO C 19 -15.928 2.983 5.382 1.00 0.00 H new ATOM 0 HB2 PRO C 19 -14.339 1.156 7.194 1.00 0.00 H new ATOM 0 HB3 PRO C 19 -13.805 2.625 6.402 1.00 0.00 H new ATOM 0 HG2 PRO C 19 -14.257 2.630 9.022 1.00 0.00 H new ATOM 0 HG3 PRO C 19 -14.722 4.017 8.057 1.00 0.00 H new ATOM 0 HD2 PRO C 19 -16.486 1.817 9.174 1.00 0.00 H new ATOM 0 HD3 PRO C 19 -16.822 3.533 9.053 1.00 0.00 H new ATOM 316 N SER C 20 -16.613 -0.106 6.171 1.00 0.00 N ATOM 317 CA SER C 20 -16.882 -1.417 5.587 1.00 0.00 C ATOM 318 C SER C 20 -18.248 -1.444 4.891 1.00 0.00 C ATOM 319 O SER C 20 -18.595 -2.424 4.234 1.00 0.00 O ATOM 320 CB SER C 20 -16.838 -2.492 6.674 1.00 0.00 C ATOM 321 OG SER C 20 -17.941 -2.318 7.554 1.00 0.00 O ATOM 0 H SER C 20 -16.799 -0.042 7.172 1.00 0.00 H new ATOM 0 HA SER C 20 -16.113 -1.618 4.842 1.00 0.00 H new ATOM 0 HB2 SER C 20 -16.872 -3.483 6.222 1.00 0.00 H new ATOM 0 HB3 SER C 20 -15.902 -2.426 7.229 1.00 0.00 H new ATOM 0 HG SER C 20 -17.916 -3.007 8.250 1.00 0.00 H new ATOM 327 N ASP C 21 -19.022 -0.371 5.049 1.00 0.00 N ATOM 328 CA ASP C 21 -20.347 -0.293 4.443 1.00 0.00 C ATOM 329 C ASP C 21 -20.266 -0.440 2.930 1.00 0.00 C ATOM 330 O ASP C 21 -19.381 0.124 2.283 1.00 0.00 O ATOM 331 CB ASP C 21 -20.991 1.048 4.784 1.00 0.00 C ATOM 332 CG ASP C 21 -22.482 0.998 4.479 1.00 0.00 C ATOM 333 OD1 ASP C 21 -23.051 -0.074 4.593 1.00 0.00 O ATOM 334 OD2 ASP C 21 -23.033 2.030 4.136 1.00 0.00 O1- ATOM 0 H ASP C 21 -18.755 0.452 5.589 1.00 0.00 H new ATOM 0 HA ASP C 21 -20.951 -1.109 4.841 1.00 0.00 H new ATOM 0 HB2 ASP C 21 -20.834 1.280 5.837 1.00 0.00 H new ATOM 0 HB3 ASP C 21 -20.520 1.845 4.209 1.00 0.00 H new ATOM 339 N THR C 22 -21.198 -1.206 2.370 1.00 0.00 N ATOM 340 CA THR C 22 -21.223 -1.426 0.933 1.00 0.00 C ATOM 341 C THR C 22 -21.840 -0.231 0.208 1.00 0.00 C ATOM 342 O THR C 22 -22.546 0.590 0.806 1.00 0.00 O ATOM 343 CB THR C 22 -22.016 -2.695 0.615 1.00 0.00 C ATOM 344 OG1 THR C 22 -23.378 -2.512 0.975 1.00 0.00 O ATOM 345 CG2 THR C 22 -21.428 -3.863 1.405 1.00 0.00 C ATOM 0 H THR C 22 -21.939 -1.680 2.887 1.00 0.00 H new ATOM 0 HA THR C 22 -20.196 -1.544 0.586 1.00 0.00 H new ATOM 0 HB THR C 22 -21.955 -2.906 -0.453 1.00 0.00 H new ATOM 0 HG1 THR C 22 -23.883 -3.326 0.769 1.00 0.00 H new ATOM 0 HG21 THR C 22 -21.989 -4.771 1.183 1.00 0.00 H new ATOM 0 HG22 THR C 22 -20.384 -4.003 1.124 1.00 0.00 H new ATOM 0 HG23 THR C 22 -21.491 -3.649 2.472 1.00 0.00 H new ATOM 353 N ILE C 23 -21.567 -0.139 -1.088 1.00 0.00 N ATOM 354 CA ILE C 23 -22.095 0.953 -1.897 1.00 0.00 C ATOM 355 C ILE C 23 -23.617 0.878 -1.944 1.00 0.00 C ATOM 356 O ILE C 23 -24.302 1.899 -1.890 1.00 0.00 O ATOM 357 CB ILE C 23 -21.525 0.887 -3.317 1.00 0.00 C ATOM 358 CG1 ILE C 23 -19.989 0.989 -3.275 1.00 0.00 C ATOM 359 CG2 ILE C 23 -22.097 2.034 -4.152 1.00 0.00 C ATOM 360 CD1 ILE C 23 -19.544 2.282 -2.573 1.00 0.00 C ATOM 0 H ILE C 23 -20.986 -0.804 -1.599 1.00 0.00 H new ATOM 0 HA ILE C 23 -21.798 1.899 -1.444 1.00 0.00 H new ATOM 0 HB ILE C 23 -21.803 -0.065 -3.770 1.00 0.00 H new ATOM 0 HG12 ILE C 23 -19.577 0.126 -2.751 1.00 0.00 H new ATOM 0 HG13 ILE C 23 -19.591 0.966 -4.290 1.00 0.00 H new ATOM 0 HG21 ILE C 23 -21.691 1.986 -5.162 1.00 0.00 H new ATOM 0 HG22 ILE C 23 -23.183 1.948 -4.193 1.00 0.00 H new ATOM 0 HG23 ILE C 23 -21.825 2.986 -3.696 1.00 0.00 H new ATOM 0 HD11 ILE C 23 -18.455 2.331 -2.556 1.00 0.00 H new ATOM 0 HD12 ILE C 23 -19.937 3.143 -3.113 1.00 0.00 H new ATOM 0 HD13 ILE C 23 -19.923 2.290 -1.551 1.00 0.00 H new ATOM 372 N GLU C 24 -24.136 -0.341 -2.041 1.00 0.00 N ATOM 373 CA GLU C 24 -25.577 -0.539 -2.093 1.00 0.00 C ATOM 374 C GLU C 24 -26.222 0.013 -0.826 1.00 0.00 C ATOM 375 O GLU C 24 -27.293 0.615 -0.876 1.00 0.00 O ATOM 376 CB GLU C 24 -25.905 -2.028 -2.229 1.00 0.00 C ATOM 377 CG GLU C 24 -25.494 -2.524 -3.617 1.00 0.00 C ATOM 378 CD GLU C 24 -25.625 -4.043 -3.688 1.00 0.00 C ATOM 379 OE1 GLU C 24 -25.755 -4.657 -2.642 1.00 0.00 O ATOM 380 OE2 GLU C 24 -25.591 -4.570 -4.788 1.00 0.00 O1- ATOM 0 H GLU C 24 -23.585 -1.198 -2.085 1.00 0.00 H new ATOM 0 HA GLU C 24 -25.971 -0.009 -2.961 1.00 0.00 H new ATOM 0 HB2 GLU C 24 -25.382 -2.597 -1.460 1.00 0.00 H new ATOM 0 HB3 GLU C 24 -26.972 -2.190 -2.076 1.00 0.00 H new ATOM 0 HG2 GLU C 24 -26.121 -2.061 -4.378 1.00 0.00 H new ATOM 0 HG3 GLU C 24 -24.466 -2.229 -3.828 1.00 0.00 H new ATOM 387 N ASN C 25 -25.560 -0.188 0.309 1.00 0.00 N ATOM 388 CA ASN C 25 -26.084 0.309 1.575 1.00 0.00 C ATOM 389 C ASN C 25 -26.187 1.827 1.547 1.00 0.00 C ATOM 390 O ASN C 25 -27.183 2.405 1.989 1.00 0.00 O ATOM 391 CB ASN C 25 -25.159 -0.109 2.717 1.00 0.00 C ATOM 392 CG ASN C 25 -25.283 -1.607 2.965 1.00 0.00 C ATOM 393 OD1 ASN C 25 -26.279 -2.219 2.579 1.00 0.00 O ATOM 394 ND2 ASN C 25 -24.326 -2.238 3.587 1.00 0.00 N ATOM 0 H ASN C 25 -24.672 -0.685 0.378 1.00 0.00 H new ATOM 0 HA ASN C 25 -27.076 -0.115 1.729 1.00 0.00 H new ATOM 0 HB2 ASN C 25 -24.127 0.143 2.472 1.00 0.00 H new ATOM 0 HB3 ASN C 25 -25.415 0.441 3.623 1.00 0.00 H new ATOM 0 HD21 ASN C 25 -24.402 -3.241 3.755 1.00 0.00 H new ATOM 0 HD22 ASN C 25 -23.502 -1.728 3.906 1.00 0.00 H new ATOM 401 N VAL C 26 -25.157 2.464 1.008 1.00 0.00 N ATOM 402 CA VAL C 26 -25.141 3.916 0.913 1.00 0.00 C ATOM 403 C VAL C 26 -26.296 4.400 0.040 1.00 0.00 C ATOM 404 O VAL C 26 -26.987 5.366 0.369 1.00 0.00 O ATOM 405 CB VAL C 26 -23.805 4.374 0.336 1.00 0.00 C ATOM 406 CG1 VAL C 26 -23.875 5.868 0.018 1.00 0.00 C ATOM 407 CG2 VAL C 26 -22.712 4.114 1.371 1.00 0.00 C ATOM 0 H VAL C 26 -24.328 2.003 0.633 1.00 0.00 H new ATOM 0 HA VAL C 26 -25.263 4.344 1.908 1.00 0.00 H new ATOM 0 HB VAL C 26 -23.582 3.827 -0.580 1.00 0.00 H new ATOM 0 HG11 VAL C 26 -22.921 6.197 -0.394 1.00 0.00 H new ATOM 0 HG12 VAL C 26 -24.667 6.048 -0.709 1.00 0.00 H new ATOM 0 HG13 VAL C 26 -24.087 6.425 0.931 1.00 0.00 H new ATOM 0 HG21 VAL C 26 -21.750 4.436 0.973 1.00 0.00 H new ATOM 0 HG22 VAL C 26 -22.933 4.671 2.281 1.00 0.00 H new ATOM 0 HG23 VAL C 26 -22.672 3.049 1.598 1.00 0.00 H new ATOM 417 N LYS C 27 -26.506 3.705 -1.068 1.00 0.00 N ATOM 418 CA LYS C 27 -27.585 4.049 -1.986 1.00 0.00 C ATOM 419 C LYS C 27 -28.935 4.003 -1.269 1.00 0.00 C ATOM 420 O LYS C 27 -29.790 4.855 -1.491 1.00 0.00 O ATOM 421 CB LYS C 27 -27.585 3.056 -3.151 1.00 0.00 C ATOM 422 CG LYS C 27 -26.932 3.681 -4.391 1.00 0.00 C ATOM 423 CD LYS C 27 -25.678 2.890 -4.759 1.00 0.00 C ATOM 424 CE LYS C 27 -26.073 1.510 -5.285 1.00 0.00 C ATOM 425 NZ LYS C 27 -26.769 1.658 -6.594 1.00 0.00 N1+ ATOM 0 H LYS C 27 -25.946 2.902 -1.354 1.00 0.00 H new ATOM 0 HA LYS C 27 -27.427 5.061 -2.359 1.00 0.00 H new ATOM 0 HB2 LYS C 27 -27.047 2.152 -2.866 1.00 0.00 H new ATOM 0 HB3 LYS C 27 -28.608 2.758 -3.383 1.00 0.00 H new ATOM 0 HG2 LYS C 27 -27.634 3.679 -5.225 1.00 0.00 H new ATOM 0 HG3 LYS C 27 -26.674 4.722 -4.194 1.00 0.00 H new ATOM 0 HD2 LYS C 27 -25.106 3.428 -5.515 1.00 0.00 H new ATOM 0 HD3 LYS C 27 -25.033 2.786 -3.886 1.00 0.00 H new ATOM 0 HE2 LYS C 27 -25.187 0.886 -5.401 1.00 0.00 H new ATOM 0 HE3 LYS C 27 -26.725 1.009 -4.569 1.00 0.00 H new ATOM 0 HZ1 LYS C 27 -26.693 0.770 -7.130 1.00 0.00 H new ATOM 0 HZ2 LYS C 27 -27.772 1.880 -6.431 1.00 0.00 H new ATOM 0 HZ3 LYS C 27 -26.328 2.428 -7.136 1.00 0.00 H new ATOM 439 N ALA C 28 -29.117 3.012 -0.405 1.00 0.00 N ATOM 440 CA ALA C 28 -30.366 2.884 0.337 1.00 0.00 C ATOM 441 C ALA C 28 -30.589 4.115 1.198 1.00 0.00 C ATOM 442 O ALA C 28 -31.702 4.633 1.285 1.00 0.00 O ATOM 443 CB ALA C 28 -30.316 1.653 1.232 1.00 0.00 C ATOM 0 H ALA C 28 -28.424 2.292 -0.202 1.00 0.00 H new ATOM 0 HA ALA C 28 -31.185 2.785 -0.375 1.00 0.00 H new ATOM 0 HB1 ALA C 28 -31.253 1.565 1.782 1.00 0.00 H new ATOM 0 HB2 ALA C 28 -30.170 0.763 0.619 1.00 0.00 H new ATOM 0 HB3 ALA C 28 -29.489 1.748 1.936 1.00 0.00 H new ATOM 449 N LYS C 29 -29.521 4.593 1.821 1.00 0.00 N ATOM 450 CA LYS C 29 -29.629 5.779 2.651 1.00 0.00 C ATOM 451 C LYS C 29 -30.119 6.936 1.803 1.00 0.00 C ATOM 452 O LYS C 29 -30.933 7.746 2.246 1.00 0.00 O ATOM 453 CB LYS C 29 -28.275 6.112 3.265 1.00 0.00 C ATOM 454 CG LYS C 29 -28.014 5.161 4.426 1.00 0.00 C ATOM 455 CD LYS C 29 -26.594 4.632 4.329 1.00 0.00 C ATOM 456 CE LYS C 29 -26.289 3.801 5.561 1.00 0.00 C ATOM 457 NZ LYS C 29 -26.959 2.476 5.445 1.00 0.00 N1+ ATOM 0 H LYS C 29 -28.587 4.185 1.768 1.00 0.00 H new ATOM 0 HA LYS C 29 -30.338 5.596 3.458 1.00 0.00 H new ATOM 0 HB2 LYS C 29 -27.488 6.018 2.517 1.00 0.00 H new ATOM 0 HB3 LYS C 29 -28.262 7.145 3.613 1.00 0.00 H new ATOM 0 HG2 LYS C 29 -28.158 5.678 5.375 1.00 0.00 H new ATOM 0 HG3 LYS C 29 -28.725 4.335 4.402 1.00 0.00 H new ATOM 0 HD2 LYS C 29 -26.479 4.027 3.429 1.00 0.00 H new ATOM 0 HD3 LYS C 29 -25.889 5.459 4.249 1.00 0.00 H new ATOM 0 HE2 LYS C 29 -25.212 3.668 5.665 1.00 0.00 H new ATOM 0 HE3 LYS C 29 -26.635 4.318 6.456 1.00 0.00 H new ATOM 0 HZ1 LYS C 29 -26.669 1.870 6.239 1.00 0.00 H new ATOM 0 HZ2 LYS C 29 -27.991 2.606 5.467 1.00 0.00 H new ATOM 0 HZ3 LYS C 29 -26.686 2.026 4.548 1.00 0.00 H new ATOM 471 N ILE C 30 -29.632 6.997 0.569 1.00 0.00 N ATOM 472 CA ILE C 30 -30.051 8.056 -0.345 1.00 0.00 C ATOM 473 C ILE C 30 -31.537 7.910 -0.667 1.00 0.00 C ATOM 474 O ILE C 30 -32.260 8.898 -0.752 1.00 0.00 O ATOM 475 CB ILE C 30 -29.223 8.040 -1.639 1.00 0.00 C ATOM 476 CG1 ILE C 30 -27.791 8.486 -1.337 1.00 0.00 C ATOM 477 CG2 ILE C 30 -29.839 9.017 -2.652 1.00 0.00 C ATOM 478 CD1 ILE C 30 -27.743 10.009 -1.223 1.00 0.00 C ATOM 0 H ILE C 30 -28.957 6.338 0.181 1.00 0.00 H new ATOM 0 HA ILE C 30 -29.882 9.014 0.147 1.00 0.00 H new ATOM 0 HB ILE C 30 -29.219 7.030 -2.049 1.00 0.00 H new ATOM 0 HG12 ILE C 30 -27.445 8.030 -0.409 1.00 0.00 H new ATOM 0 HG13 ILE C 30 -27.120 8.149 -2.127 1.00 0.00 H new ATOM 0 HG21 ILE C 30 -29.252 9.007 -3.571 1.00 0.00 H new ATOM 0 HG22 ILE C 30 -30.863 8.715 -2.872 1.00 0.00 H new ATOM 0 HG23 ILE C 30 -29.839 10.023 -2.233 1.00 0.00 H new ATOM 0 HD11 ILE C 30 -26.722 10.326 -1.008 1.00 0.00 H new ATOM 0 HD12 ILE C 30 -28.071 10.455 -2.162 1.00 0.00 H new ATOM 0 HD13 ILE C 30 -28.401 10.335 -0.418 1.00 0.00 H new ATOM 490 N GLN C 31 -31.983 6.670 -0.849 1.00 0.00 N ATOM 491 CA GLN C 31 -33.384 6.407 -1.167 1.00 0.00 C ATOM 492 C GLN C 31 -34.302 6.944 -0.066 1.00 0.00 C ATOM 493 O GLN C 31 -35.356 7.510 -0.348 1.00 0.00 O ATOM 494 CB GLN C 31 -33.617 4.900 -1.322 1.00 0.00 C ATOM 495 CG GLN C 31 -35.067 4.650 -1.735 1.00 0.00 C ATOM 496 CD GLN C 31 -35.290 3.168 -2.009 1.00 0.00 C ATOM 497 OE1 GLN C 31 -34.341 2.385 -2.003 1.00 0.00 O ATOM 498 NE2 GLN C 31 -36.497 2.735 -2.253 1.00 0.00 N ATOM 0 H GLN C 31 -31.399 5.836 -0.782 1.00 0.00 H new ATOM 0 HA GLN C 31 -33.617 6.914 -2.104 1.00 0.00 H new ATOM 0 HB2 GLN C 31 -32.938 4.491 -2.071 1.00 0.00 H new ATOM 0 HB3 GLN C 31 -33.401 4.389 -0.384 1.00 0.00 H new ATOM 0 HG2 GLN C 31 -35.740 4.986 -0.946 1.00 0.00 H new ATOM 0 HG3 GLN C 31 -35.304 5.231 -2.626 1.00 0.00 H new ATOM 0 HE21 GLN C 31 -37.282 3.387 -2.257 1.00 0.00 H new ATOM 0 HE22 GLN C 31 -36.656 1.745 -2.439 1.00 0.00 H new ATOM 507 N ASP C 32 -33.911 6.745 1.190 1.00 0.00 N ATOM 508 CA ASP C 32 -34.727 7.207 2.316 1.00 0.00 C ATOM 509 C ASP C 32 -34.742 8.740 2.422 1.00 0.00 C ATOM 510 O ASP C 32 -35.807 9.348 2.536 1.00 0.00 O ATOM 511 CB ASP C 32 -34.187 6.610 3.616 1.00 0.00 C ATOM 512 CG ASP C 32 -35.108 6.955 4.786 1.00 0.00 C ATOM 513 OD1 ASP C 32 -36.047 7.706 4.578 1.00 0.00 O ATOM 514 OD2 ASP C 32 -34.858 6.462 5.873 1.00 0.00 O1- ATOM 0 H ASP C 32 -33.046 6.274 1.455 1.00 0.00 H new ATOM 0 HA ASP C 32 -35.751 6.875 2.145 1.00 0.00 H new ATOM 0 HB2 ASP C 32 -34.103 5.528 3.519 1.00 0.00 H new ATOM 0 HB3 ASP C 32 -33.185 6.992 3.810 1.00 0.00 H new ATOM 519 N LYS C 33 -33.559 9.355 2.400 1.00 0.00 N ATOM 520 CA LYS C 33 -33.450 10.815 2.510 1.00 0.00 C ATOM 521 C LYS C 33 -34.099 11.532 1.333 1.00 0.00 C ATOM 522 O LYS C 33 -34.759 12.557 1.502 1.00 0.00 O ATOM 523 CB LYS C 33 -31.989 11.227 2.597 1.00 0.00 C ATOM 524 CG LYS C 33 -31.484 10.999 4.018 1.00 0.00 C ATOM 525 CD LYS C 33 -30.749 12.252 4.470 1.00 0.00 C ATOM 526 CE LYS C 33 -30.422 12.151 5.958 1.00 0.00 C ATOM 527 NZ LYS C 33 -29.787 13.423 6.405 1.00 0.00 N1+ ATOM 0 H LYS C 33 -32.666 8.871 2.308 1.00 0.00 H new ATOM 0 HA LYS C 33 -33.979 11.105 3.418 1.00 0.00 H new ATOM 0 HB2 LYS C 33 -31.394 10.649 1.890 1.00 0.00 H new ATOM 0 HB3 LYS C 33 -31.878 12.276 2.324 1.00 0.00 H new ATOM 0 HG2 LYS C 33 -32.317 10.785 4.687 1.00 0.00 H new ATOM 0 HG3 LYS C 33 -30.819 10.136 4.051 1.00 0.00 H new ATOM 0 HD2 LYS C 33 -29.832 12.374 3.894 1.00 0.00 H new ATOM 0 HD3 LYS C 33 -31.363 13.133 4.282 1.00 0.00 H new ATOM 0 HE2 LYS C 33 -31.330 11.963 6.531 1.00 0.00 H new ATOM 0 HE3 LYS C 33 -29.751 11.312 6.139 1.00 0.00 H new ATOM 0 HZ1 LYS C 33 -29.561 13.361 7.418 1.00 0.00 H new ATOM 0 HZ2 LYS C 33 -28.913 13.583 5.865 1.00 0.00 H new ATOM 0 HZ3 LYS C 33 -30.443 14.214 6.244 1.00 0.00 H new ATOM 541 N GLU C 34 -33.893 10.994 0.144 1.00 0.00 N ATOM 542 CA GLU C 34 -34.446 11.585 -1.063 1.00 0.00 C ATOM 543 C GLU C 34 -35.126 10.510 -1.890 1.00 0.00 C ATOM 544 O GLU C 34 -34.714 9.356 -1.863 1.00 0.00 O ATOM 545 CB GLU C 34 -33.336 12.243 -1.883 1.00 0.00 C ATOM 546 CG GLU C 34 -32.688 13.358 -1.067 1.00 0.00 C ATOM 547 CD GLU C 34 -33.704 14.466 -0.809 1.00 0.00 C ATOM 548 OE1 GLU C 34 -34.670 14.540 -1.550 1.00 0.00 O ATOM 549 OE2 GLU C 34 -33.502 15.222 0.126 1.00 0.00 O1- ATOM 0 H GLU C 34 -33.346 10.147 -0.012 1.00 0.00 H new ATOM 0 HA GLU C 34 -35.176 12.345 -0.785 1.00 0.00 H new ATOM 0 HB2 GLU C 34 -32.588 11.501 -2.162 1.00 0.00 H new ATOM 0 HB3 GLU C 34 -33.745 12.647 -2.809 1.00 0.00 H new ATOM 0 HG2 GLU C 34 -32.320 12.962 -0.121 1.00 0.00 H new ATOM 0 HG3 GLU C 34 -31.827 13.759 -1.601 1.00 0.00 H new ATOM 556 N GLY C 35 -36.165 10.887 -2.618 1.00 0.00 N ATOM 557 CA GLY C 35 -36.884 9.926 -3.439 1.00 0.00 C ATOM 558 C GLY C 35 -36.083 9.559 -4.685 1.00 0.00 C ATOM 559 O GLY C 35 -36.515 9.824 -5.806 1.00 0.00 O ATOM 0 H GLY C 35 -36.526 11.840 -2.658 1.00 0.00 H new ATOM 0 HA2 GLY C 35 -37.089 9.027 -2.857 1.00 0.00 H new ATOM 0 HA3 GLY C 35 -37.848 10.343 -3.732 1.00 0.00 H new ATOM 563 N ILE C 36 -34.919 8.940 -4.484 1.00 0.00 N ATOM 564 CA ILE C 36 -34.077 8.534 -5.604 1.00 0.00 C ATOM 565 C ILE C 36 -33.953 6.998 -5.641 1.00 0.00 C ATOM 566 O ILE C 36 -33.462 6.405 -4.681 1.00 0.00 O ATOM 567 CB ILE C 36 -32.684 9.153 -5.470 1.00 0.00 C ATOM 568 CG1 ILE C 36 -32.832 10.666 -5.302 1.00 0.00 C ATOM 569 CG2 ILE C 36 -31.870 8.858 -6.736 1.00 0.00 C ATOM 570 CD1 ILE C 36 -31.455 11.300 -5.169 1.00 0.00 C ATOM 0 H ILE C 36 -34.542 8.712 -3.564 1.00 0.00 H new ATOM 0 HA ILE C 36 -34.537 8.883 -6.529 1.00 0.00 H new ATOM 0 HB ILE C 36 -32.171 8.731 -4.606 1.00 0.00 H new ATOM 0 HG12 ILE C 36 -33.357 11.088 -6.159 1.00 0.00 H new ATOM 0 HG13 ILE C 36 -33.433 10.887 -4.420 1.00 0.00 H new ATOM 0 HG21 ILE C 36 -30.878 9.299 -6.641 1.00 0.00 H new ATOM 0 HG22 ILE C 36 -31.777 7.780 -6.866 1.00 0.00 H new ATOM 0 HG23 ILE C 36 -32.376 9.286 -7.602 1.00 0.00 H new ATOM 0 HD11 ILE C 36 -31.561 12.378 -5.049 1.00 0.00 H new ATOM 0 HD12 ILE C 36 -30.947 10.886 -4.298 1.00 0.00 H new ATOM 0 HD13 ILE C 36 -30.870 11.090 -6.064 1.00 0.00 H new ATOM 582 N PRO C 37 -34.370 6.337 -6.702 1.00 0.00 N ATOM 583 CA PRO C 37 -34.269 4.849 -6.792 1.00 0.00 C ATOM 584 C PRO C 37 -32.823 4.398 -6.988 1.00 0.00 C ATOM 585 O PRO C 37 -31.976 5.184 -7.408 1.00 0.00 O ATOM 586 CB PRO C 37 -35.129 4.502 -8.005 1.00 0.00 C ATOM 587 CG PRO C 37 -35.068 5.713 -8.871 1.00 0.00 C ATOM 588 CD PRO C 37 -34.970 6.908 -7.923 1.00 0.00 C ATOM 0 HA PRO C 37 -34.602 4.350 -5.882 1.00 0.00 H new ATOM 0 HB2 PRO C 37 -34.745 3.624 -8.524 1.00 0.00 H new ATOM 0 HB3 PRO C 37 -36.154 4.276 -7.712 1.00 0.00 H new ATOM 0 HG2 PRO C 37 -34.206 5.673 -9.537 1.00 0.00 H new ATOM 0 HG3 PRO C 37 -35.955 5.787 -9.501 1.00 0.00 H new ATOM 0 HD2 PRO C 37 -34.350 7.701 -8.341 1.00 0.00 H new ATOM 0 HD3 PRO C 37 -35.950 7.342 -7.723 1.00 0.00 H new ATOM 596 N PRO C 38 -32.517 3.165 -6.691 1.00 0.00 N ATOM 597 CA PRO C 38 -31.130 2.638 -6.834 1.00 0.00 C ATOM 598 C PRO C 38 -30.607 2.744 -8.262 1.00 0.00 C ATOM 599 O PRO C 38 -29.410 2.932 -8.478 1.00 0.00 O ATOM 600 CB PRO C 38 -31.239 1.174 -6.402 1.00 0.00 C ATOM 601 CG PRO C 38 -32.686 0.848 -6.495 1.00 0.00 C ATOM 602 CD PRO C 38 -33.435 2.139 -6.193 1.00 0.00 C ATOM 0 HA PRO C 38 -30.423 3.211 -6.234 1.00 0.00 H new ATOM 0 HB2 PRO C 38 -30.647 0.527 -7.049 1.00 0.00 H new ATOM 0 HB3 PRO C 38 -30.868 1.034 -5.387 1.00 0.00 H new ATOM 0 HG2 PRO C 38 -32.938 0.476 -7.488 1.00 0.00 H new ATOM 0 HG3 PRO C 38 -32.955 0.067 -5.784 1.00 0.00 H new ATOM 0 HD2 PRO C 38 -34.399 2.177 -6.701 1.00 0.00 H new ATOM 0 HD3 PRO C 38 -33.631 2.254 -5.127 1.00 0.00 H new ATOM 610 N ASP C 39 -31.505 2.635 -9.232 1.00 0.00 N ATOM 611 CA ASP C 39 -31.107 2.737 -10.629 1.00 0.00 C ATOM 612 C ASP C 39 -30.602 4.149 -10.926 1.00 0.00 C ATOM 613 O ASP C 39 -29.596 4.328 -11.613 1.00 0.00 O ATOM 614 CB ASP C 39 -32.289 2.404 -11.542 1.00 0.00 C ATOM 615 CG ASP C 39 -31.826 2.322 -12.993 1.00 0.00 C ATOM 616 OD1 ASP C 39 -30.704 2.719 -13.261 1.00 0.00 O ATOM 617 OD2 ASP C 39 -32.601 1.862 -13.816 1.00 0.00 O1- ATOM 0 H ASP C 39 -32.501 2.478 -9.080 1.00 0.00 H new ATOM 0 HA ASP C 39 -30.305 2.024 -10.818 1.00 0.00 H new ATOM 0 HB2 ASP C 39 -32.735 1.456 -11.241 1.00 0.00 H new ATOM 0 HB3 ASP C 39 -33.062 3.166 -11.442 1.00 0.00 H new ATOM 622 N GLN C 40 -31.313 5.143 -10.399 1.00 0.00 N ATOM 623 CA GLN C 40 -30.940 6.541 -10.608 1.00 0.00 C ATOM 624 C GLN C 40 -29.872 6.988 -9.612 1.00 0.00 C ATOM 625 O GLN C 40 -29.293 8.061 -9.763 1.00 0.00 O ATOM 626 CB GLN C 40 -32.175 7.434 -10.456 1.00 0.00 C ATOM 627 CG GLN C 40 -33.181 7.093 -11.556 1.00 0.00 C ATOM 628 CD GLN C 40 -34.419 7.974 -11.430 1.00 0.00 C ATOM 629 OE1 GLN C 40 -34.306 9.179 -11.202 1.00 0.00 O ATOM 630 NE2 GLN C 40 -35.602 7.442 -11.570 1.00 0.00 N ATOM 0 H GLN C 40 -32.147 5.008 -9.827 1.00 0.00 H new ATOM 0 HA GLN C 40 -30.532 6.632 -11.615 1.00 0.00 H new ATOM 0 HB2 GLN C 40 -32.627 7.286 -9.475 1.00 0.00 H new ATOM 0 HB3 GLN C 40 -31.889 8.484 -10.521 1.00 0.00 H new ATOM 0 HG2 GLN C 40 -32.723 7.235 -12.535 1.00 0.00 H new ATOM 0 HG3 GLN C 40 -33.465 6.043 -11.487 1.00 0.00 H new ATOM 0 HE21 GLN C 40 -35.693 6.444 -11.759 1.00 0.00 H new ATOM 0 HE22 GLN C 40 -36.436 8.024 -11.491 1.00 0.00 H new ATOM 639 N GLN C 41 -29.602 6.172 -8.597 1.00 0.00 N ATOM 640 CA GLN C 41 -28.588 6.537 -7.613 1.00 0.00 C ATOM 641 C GLN C 41 -27.197 6.233 -8.135 1.00 0.00 C ATOM 642 O GLN C 41 -26.640 5.169 -7.865 1.00 0.00 O ATOM 643 CB GLN C 41 -28.795 5.781 -6.299 1.00 0.00 C ATOM 644 CG GLN C 41 -29.917 6.436 -5.501 1.00 0.00 C ATOM 645 CD GLN C 41 -30.332 5.531 -4.350 1.00 0.00 C ATOM 646 OE1 GLN C 41 -29.913 4.378 -4.289 1.00 0.00 O ATOM 647 NE2 GLN C 41 -31.146 5.981 -3.440 1.00 0.00 N ATOM 0 H GLN C 41 -30.059 5.274 -8.436 1.00 0.00 H new ATOM 0 HA GLN C 41 -28.687 7.607 -7.432 1.00 0.00 H new ATOM 0 HB2 GLN C 41 -29.041 4.739 -6.503 1.00 0.00 H new ATOM 0 HB3 GLN C 41 -27.873 5.783 -5.718 1.00 0.00 H new ATOM 0 HG2 GLN C 41 -29.586 7.400 -5.115 1.00 0.00 H new ATOM 0 HG3 GLN C 41 -30.772 6.629 -6.150 1.00 0.00 H new ATOM 0 HE21 GLN C 41 -31.492 6.939 -3.494 1.00 0.00 H new ATOM 0 HE22 GLN C 41 -31.438 5.376 -2.673 1.00 0.00 H new ATOM 656 N ARG C 42 -26.626 7.179 -8.865 1.00 0.00 N ATOM 657 CA ARG C 42 -25.287 6.993 -9.384 1.00 0.00 C ATOM 658 C ARG C 42 -24.294 7.671 -8.453 1.00 0.00 C ATOM 659 O ARG C 42 -24.175 8.897 -8.449 1.00 0.00 O ATOM 660 CB ARG C 42 -25.180 7.586 -10.787 1.00 0.00 C ATOM 661 CG ARG C 42 -26.105 6.824 -11.737 1.00 0.00 C ATOM 662 CD ARG C 42 -25.989 7.415 -13.141 1.00 0.00 C ATOM 663 NE ARG C 42 -24.638 7.224 -13.657 1.00 0.00 N ATOM 664 CZ ARG C 42 -24.241 6.058 -14.169 1.00 0.00 C ATOM 665 NH1 ARG C 42 -25.058 5.035 -14.219 1.00 0.00 N1+ ATOM 666 NH2 ARG C 42 -23.026 5.937 -14.630 1.00 0.00 N ATOM 0 H ARG C 42 -27.063 8.068 -9.107 1.00 0.00 H new ATOM 0 HA ARG C 42 -25.064 5.928 -9.441 1.00 0.00 H new ATOM 0 HB2 ARG C 42 -25.451 8.642 -10.768 1.00 0.00 H new ATOM 0 HB3 ARG C 42 -24.151 7.527 -11.140 1.00 0.00 H new ATOM 0 HG2 ARG C 42 -25.838 5.767 -11.752 1.00 0.00 H new ATOM 0 HG3 ARG C 42 -27.136 6.888 -11.388 1.00 0.00 H new ATOM 0 HD2 ARG C 42 -26.711 6.939 -13.805 1.00 0.00 H new ATOM 0 HD3 ARG C 42 -26.230 8.478 -13.117 1.00 0.00 H new ATOM 0 HE ARG C 42 -23.980 8.002 -13.625 1.00 0.00 H new ATOM 0 HH11 ARG C 42 -26.010 5.125 -13.864 1.00 0.00 H new ATOM 0 HH12 ARG C 42 -24.742 4.149 -14.613 1.00 0.00 H new ATOM 0 HH21 ARG C 42 -22.387 6.731 -14.597 1.00 0.00 H new ATOM 0 HH22 ARG C 42 -22.716 5.048 -15.023 1.00 0.00 H new ATOM 680 N LEU C 43 -23.601 6.866 -7.656 1.00 0.00 N ATOM 681 CA LEU C 43 -22.631 7.395 -6.708 1.00 0.00 C ATOM 682 C LEU C 43 -21.232 7.349 -7.309 1.00 0.00 C ATOM 683 O LEU C 43 -20.725 6.279 -7.647 1.00 0.00 O ATOM 684 CB LEU C 43 -22.658 6.562 -5.416 1.00 0.00 C ATOM 685 CG LEU C 43 -24.070 6.557 -4.807 1.00 0.00 C ATOM 686 CD1 LEU C 43 -24.104 5.617 -3.600 1.00 0.00 C ATOM 687 CD2 LEU C 43 -24.444 7.967 -4.340 1.00 0.00 C ATOM 0 H LEU C 43 -23.693 5.850 -7.648 1.00 0.00 H new ATOM 0 HA LEU C 43 -22.890 8.429 -6.481 1.00 0.00 H new ATOM 0 HB2 LEU C 43 -22.344 5.540 -5.629 1.00 0.00 H new ATOM 0 HB3 LEU C 43 -21.947 6.971 -4.698 1.00 0.00 H new ATOM 0 HG LEU C 43 -24.778 6.221 -5.565 1.00 0.00 H new ATOM 0 HD11 LEU C 43 -25.105 5.614 -3.169 1.00 0.00 H new ATOM 0 HD12 LEU C 43 -23.843 4.608 -3.918 1.00 0.00 H new ATOM 0 HD13 LEU C 43 -23.388 5.959 -2.852 1.00 0.00 H new ATOM 0 HD21 LEU C 43 -25.446 7.954 -3.910 1.00 0.00 H new ATOM 0 HD22 LEU C 43 -23.730 8.302 -3.587 1.00 0.00 H new ATOM 0 HD23 LEU C 43 -24.423 8.649 -5.190 1.00 0.00 H new ATOM 699 N ILE C 44 -20.612 8.517 -7.442 1.00 0.00 N ATOM 700 CA ILE C 44 -19.266 8.603 -7.998 1.00 0.00 C ATOM 701 C ILE C 44 -18.348 9.345 -7.034 1.00 0.00 C ATOM 702 O ILE C 44 -18.666 10.446 -6.586 1.00 0.00 O ATOM 703 CB ILE C 44 -19.298 9.314 -9.353 1.00 0.00 C ATOM 704 CG1 ILE C 44 -20.175 8.511 -10.317 1.00 0.00 C ATOM 705 CG2 ILE C 44 -17.879 9.414 -9.916 1.00 0.00 C ATOM 706 CD1 ILE C 44 -20.398 9.312 -11.601 1.00 0.00 C ATOM 0 H ILE C 44 -21.018 9.414 -7.174 1.00 0.00 H new ATOM 0 HA ILE C 44 -18.880 7.594 -8.143 1.00 0.00 H new ATOM 0 HB ILE C 44 -19.706 10.317 -9.231 1.00 0.00 H new ATOM 0 HG12 ILE C 44 -19.699 7.558 -10.549 1.00 0.00 H new ATOM 0 HG13 ILE C 44 -21.132 8.283 -9.849 1.00 0.00 H new ATOM 0 HG21 ILE C 44 -17.905 9.921 -10.881 1.00 0.00 H new ATOM 0 HG22 ILE C 44 -17.253 9.980 -9.226 1.00 0.00 H new ATOM 0 HG23 ILE C 44 -17.467 8.413 -10.043 1.00 0.00 H new ATOM 0 HD11 ILE C 44 -21.023 8.737 -12.285 1.00 0.00 H new ATOM 0 HD12 ILE C 44 -20.893 10.253 -11.361 1.00 0.00 H new ATOM 0 HD13 ILE C 44 -19.437 9.517 -12.073 1.00 0.00 H new ATOM 718 N PHE C 45 -17.216 8.735 -6.706 1.00 0.00 N ATOM 719 CA PHE C 45 -16.275 9.354 -5.783 1.00 0.00 C ATOM 720 C PHE C 45 -14.870 9.360 -6.376 1.00 0.00 C ATOM 721 O PHE C 45 -14.386 8.336 -6.854 1.00 0.00 O ATOM 722 CB PHE C 45 -16.273 8.592 -4.457 1.00 0.00 C ATOM 723 CG PHE C 45 -15.349 9.281 -3.482 1.00 0.00 C ATOM 724 CD1 PHE C 45 -15.778 10.434 -2.814 1.00 0.00 C ATOM 725 CD2 PHE C 45 -14.069 8.769 -3.250 1.00 0.00 C ATOM 726 CE1 PHE C 45 -14.922 11.077 -1.912 1.00 0.00 C ATOM 727 CE2 PHE C 45 -13.214 9.413 -2.347 1.00 0.00 C ATOM 728 CZ PHE C 45 -13.641 10.568 -1.678 1.00 0.00 C ATOM 0 H PHE C 45 -16.930 7.823 -7.061 1.00 0.00 H new ATOM 0 HA PHE C 45 -16.585 10.384 -5.609 1.00 0.00 H new ATOM 0 HB2 PHE C 45 -17.283 8.548 -4.049 1.00 0.00 H new ATOM 0 HB3 PHE C 45 -15.949 7.564 -4.617 1.00 0.00 H new ATOM 0 HD1 PHE C 45 -16.768 10.827 -2.994 1.00 0.00 H new ATOM 0 HD2 PHE C 45 -13.740 7.879 -3.766 1.00 0.00 H new ATOM 0 HE1 PHE C 45 -15.251 11.967 -1.396 1.00 0.00 H new ATOM 0 HE2 PHE C 45 -12.225 9.019 -2.166 1.00 0.00 H new ATOM 0 HZ PHE C 45 -12.981 11.065 -0.982 1.00 0.00 H new ATOM 738 N ALA C 46 -14.224 10.521 -6.348 1.00 0.00 N ATOM 739 CA ALA C 46 -12.876 10.646 -6.893 1.00 0.00 C ATOM 740 C ALA C 46 -12.879 10.379 -8.394 1.00 0.00 C ATOM 741 O ALA C 46 -11.875 9.931 -8.954 1.00 0.00 O ATOM 742 CB ALA C 46 -11.937 9.656 -6.203 1.00 0.00 C ATOM 0 H ALA C 46 -14.607 11.382 -5.958 1.00 0.00 H new ATOM 0 HA ALA C 46 -12.527 11.663 -6.714 1.00 0.00 H new ATOM 0 HB1 ALA C 46 -10.934 9.757 -6.617 1.00 0.00 H new ATOM 0 HB2 ALA C 46 -11.911 9.864 -5.133 1.00 0.00 H new ATOM 0 HB3 ALA C 46 -12.296 8.640 -6.366 1.00 0.00 H new ATOM 748 N GLY C 47 -14.005 10.654 -9.040 1.00 0.00 N ATOM 749 CA GLY C 47 -14.120 10.438 -10.480 1.00 0.00 C ATOM 750 C GLY C 47 -14.259 8.952 -10.809 1.00 0.00 C ATOM 751 O GLY C 47 -14.085 8.550 -11.958 1.00 0.00 O ATOM 0 H GLY C 47 -14.846 11.024 -8.596 1.00 0.00 H new ATOM 0 HA2 GLY C 47 -14.985 10.980 -10.863 1.00 0.00 H new ATOM 0 HA3 GLY C 47 -13.241 10.843 -10.982 1.00 0.00 H new ATOM 755 N LYS C 48 -14.569 8.142 -9.800 1.00 0.00 N ATOM 756 CA LYS C 48 -14.722 6.710 -10.010 1.00 0.00 C ATOM 757 C LYS C 48 -16.136 6.268 -9.646 1.00 0.00 C ATOM 758 O LYS C 48 -16.655 6.625 -8.590 1.00 0.00 O ATOM 759 CB LYS C 48 -13.712 5.953 -9.152 1.00 0.00 C ATOM 760 CG LYS C 48 -12.298 6.369 -9.570 1.00 0.00 C ATOM 761 CD LYS C 48 -11.273 5.736 -8.635 1.00 0.00 C ATOM 762 CE LYS C 48 -11.140 4.247 -8.941 1.00 0.00 C ATOM 763 NZ LYS C 48 -10.615 4.054 -10.290 1.00 0.00 N1+ ATOM 0 H LYS C 48 -14.717 8.451 -8.839 1.00 0.00 H new ATOM 0 HA LYS C 48 -14.544 6.489 -11.062 1.00 0.00 H new ATOM 0 HB2 LYS C 48 -13.874 6.173 -8.097 1.00 0.00 H new ATOM 0 HB3 LYS C 48 -13.841 4.878 -9.277 1.00 0.00 H new ATOM 0 HG2 LYS C 48 -12.107 6.058 -10.597 1.00 0.00 H new ATOM 0 HG3 LYS C 48 -12.206 7.455 -9.543 1.00 0.00 H new ATOM 0 HD2 LYS C 48 -10.308 6.228 -8.753 1.00 0.00 H new ATOM 0 HD3 LYS C 48 -11.578 5.877 -7.598 1.00 0.00 H new ATOM 0 HE2 LYS C 48 -10.477 3.777 -8.214 1.00 0.00 H new ATOM 0 HE3 LYS C 48 -12.111 3.761 -8.848 1.00 0.00 H new ATOM 0 HZ1 LYS C 48 -10.139 3.131 -10.349 1.00 0.00 H new ATOM 0 HZ2 LYS C 48 -11.397 4.084 -10.975 1.00 0.00 H new ATOM 0 HZ3 LYS C 48 -9.934 4.809 -10.509 1.00 0.00 H new ATOM 775 N GLN C 49 -16.752 5.484 -10.524 1.00 0.00 N ATOM 776 CA GLN C 49 -18.102 4.995 -10.275 1.00 0.00 C ATOM 777 C GLN C 49 -18.080 3.926 -9.189 1.00 0.00 C ATOM 778 O GLN C 49 -17.262 3.006 -9.230 1.00 0.00 O ATOM 779 CB GLN C 49 -18.694 4.422 -11.567 1.00 0.00 C ATOM 780 CG GLN C 49 -20.144 3.990 -11.328 1.00 0.00 C ATOM 781 CD GLN C 49 -21.005 5.197 -10.978 1.00 0.00 C ATOM 782 OE1 GLN C 49 -21.063 6.160 -11.741 1.00 0.00 O ATOM 783 NE2 GLN C 49 -21.686 5.199 -9.865 1.00 0.00 N ATOM 0 H GLN C 49 -16.343 5.176 -11.406 1.00 0.00 H new ATOM 0 HA GLN C 49 -18.724 5.824 -9.937 1.00 0.00 H new ATOM 0 HB2 GLN C 49 -18.654 5.170 -12.359 1.00 0.00 H new ATOM 0 HB3 GLN C 49 -18.102 3.570 -11.902 1.00 0.00 H new ATOM 0 HG2 GLN C 49 -20.537 3.501 -12.220 1.00 0.00 H new ATOM 0 HG3 GLN C 49 -20.184 3.259 -10.520 1.00 0.00 H new ATOM 0 HE21 GLN C 49 -21.635 4.399 -9.235 1.00 0.00 H new ATOM 0 HE22 GLN C 49 -22.269 6.001 -9.625 1.00 0.00 H new ATOM 792 N LEU C 50 -18.973 4.056 -8.213 1.00 0.00 N ATOM 793 CA LEU C 50 -19.030 3.091 -7.123 1.00 0.00 C ATOM 794 C LEU C 50 -19.810 1.854 -7.562 1.00 0.00 C ATOM 795 O LEU C 50 -21.042 1.844 -7.537 1.00 0.00 O ATOM 796 CB LEU C 50 -19.704 3.724 -5.902 1.00 0.00 C ATOM 797 CG LEU C 50 -18.964 5.006 -5.503 1.00 0.00 C ATOM 798 CD1 LEU C 50 -19.680 5.664 -4.322 1.00 0.00 C ATOM 799 CD2 LEU C 50 -17.528 4.671 -5.097 1.00 0.00 C ATOM 0 H LEU C 50 -19.658 4.810 -8.155 1.00 0.00 H new ATOM 0 HA LEU C 50 -18.015 2.795 -6.858 1.00 0.00 H new ATOM 0 HB2 LEU C 50 -20.746 3.951 -6.128 1.00 0.00 H new ATOM 0 HB3 LEU C 50 -19.704 3.020 -5.070 1.00 0.00 H new ATOM 0 HG LEU C 50 -18.951 5.689 -6.352 1.00 0.00 H new ATOM 0 HD11 LEU C 50 -19.153 6.575 -4.039 1.00 0.00 H new ATOM 0 HD12 LEU C 50 -20.703 5.910 -4.608 1.00 0.00 H new ATOM 0 HD13 LEU C 50 -19.695 4.976 -3.477 1.00 0.00 H new ATOM 0 HD21 LEU C 50 -17.007 5.586 -4.815 1.00 0.00 H new ATOM 0 HD22 LEU C 50 -17.540 3.984 -4.251 1.00 0.00 H new ATOM 0 HD23 LEU C 50 -17.012 4.204 -5.936 1.00 0.00 H new ATOM 811 N GLU C 51 -19.083 0.820 -7.971 1.00 0.00 N ATOM 812 CA GLU C 51 -19.709 -0.418 -8.423 1.00 0.00 C ATOM 813 C GLU C 51 -20.346 -1.160 -7.254 1.00 0.00 C ATOM 814 O GLU C 51 -19.784 -1.218 -6.160 1.00 0.00 O ATOM 815 CB GLU C 51 -18.673 -1.317 -9.103 1.00 0.00 C ATOM 816 CG GLU C 51 -19.366 -2.561 -9.662 1.00 0.00 C ATOM 817 CD GLU C 51 -18.354 -3.440 -10.390 1.00 0.00 C ATOM 818 OE1 GLU C 51 -17.194 -3.068 -10.426 1.00 0.00 O ATOM 819 OE2 GLU C 51 -18.756 -4.473 -10.902 1.00 0.00 O1- ATOM 0 H GLU C 51 -18.063 0.814 -7.999 1.00 0.00 H new ATOM 0 HA GLU C 51 -20.489 -0.162 -9.140 1.00 0.00 H new ATOM 0 HB2 GLU C 51 -18.175 -0.773 -9.906 1.00 0.00 H new ATOM 0 HB3 GLU C 51 -17.902 -1.607 -8.389 1.00 0.00 H new ATOM 0 HG2 GLU C 51 -19.832 -3.123 -8.852 1.00 0.00 H new ATOM 0 HG3 GLU C 51 -20.163 -2.267 -10.345 1.00 0.00 H new ATOM 826 N ASP C 52 -21.522 -1.726 -7.490 1.00 0.00 N ATOM 827 CA ASP C 52 -22.222 -2.459 -6.445 1.00 0.00 C ATOM 828 C ASP C 52 -21.372 -3.630 -5.964 1.00 0.00 C ATOM 829 O ASP C 52 -20.665 -4.261 -6.749 1.00 0.00 O ATOM 830 CB ASP C 52 -23.560 -2.979 -6.977 1.00 0.00 C ATOM 831 CG ASP C 52 -24.525 -1.818 -7.178 1.00 0.00 C ATOM 832 OD1 ASP C 52 -24.225 -0.737 -6.701 1.00 0.00 O ATOM 833 OD2 ASP C 52 -25.550 -2.028 -7.805 1.00 0.00 O1- ATOM 0 H ASP C 52 -22.007 -1.692 -8.387 1.00 0.00 H new ATOM 0 HA ASP C 52 -22.405 -1.785 -5.608 1.00 0.00 H new ATOM 0 HB2 ASP C 52 -23.407 -3.503 -7.920 1.00 0.00 H new ATOM 0 HB3 ASP C 52 -23.984 -3.699 -6.277 1.00 0.00 H new ATOM 838 N GLY C 53 -21.442 -3.905 -4.668 1.00 0.00 N ATOM 839 CA GLY C 53 -20.670 -4.995 -4.080 1.00 0.00 C ATOM 840 C GLY C 53 -19.380 -4.475 -3.446 1.00 0.00 C ATOM 841 O GLY C 53 -18.772 -5.151 -2.617 1.00 0.00 O ATOM 0 H GLY C 53 -22.023 -3.391 -4.005 1.00 0.00 H new ATOM 0 HA2 GLY C 53 -21.270 -5.504 -3.326 1.00 0.00 H new ATOM 0 HA3 GLY C 53 -20.431 -5.731 -4.848 1.00 0.00 H new ATOM 845 N ARG C 54 -18.977 -3.262 -3.822 1.00 0.00 N ATOM 846 CA ARG C 54 -17.772 -2.659 -3.260 1.00 0.00 C ATOM 847 C ARG C 54 -18.096 -1.976 -1.939 1.00 0.00 C ATOM 848 O ARG C 54 -19.263 -1.843 -1.567 1.00 0.00 O ATOM 849 CB ARG C 54 -17.183 -1.625 -4.218 1.00 0.00 C ATOM 850 CG ARG C 54 -16.828 -2.264 -5.563 1.00 0.00 C ATOM 851 CD ARG C 54 -15.434 -2.908 -5.499 1.00 0.00 C ATOM 852 NE ARG C 54 -15.463 -4.162 -4.747 1.00 0.00 N ATOM 853 CZ ARG C 54 -15.968 -5.286 -5.263 1.00 0.00 C ATOM 854 NH1 ARG C 54 -16.468 -5.304 -6.472 1.00 0.00 N1+ ATOM 855 NH2 ARG C 54 -15.954 -6.382 -4.551 1.00 0.00 N ATOM 0 H ARG C 54 -19.463 -2.683 -4.507 1.00 0.00 H new ATOM 0 HA ARG C 54 -17.044 -3.454 -3.099 1.00 0.00 H new ATOM 0 HB2 ARG C 54 -17.899 -0.818 -4.372 1.00 0.00 H new ATOM 0 HB3 ARG C 54 -16.291 -1.180 -3.776 1.00 0.00 H new ATOM 0 HG2 ARG C 54 -17.572 -3.017 -5.823 1.00 0.00 H new ATOM 0 HG3 ARG C 54 -16.851 -1.509 -6.349 1.00 0.00 H new ATOM 0 HD2 ARG C 54 -15.071 -3.096 -6.509 1.00 0.00 H new ATOM 0 HD3 ARG C 54 -14.733 -2.217 -5.031 1.00 0.00 H new ATOM 0 HE ARG C 54 -15.086 -4.179 -3.799 1.00 0.00 H new ATOM 0 HH11 ARG C 54 -16.476 -4.452 -7.033 1.00 0.00 H new ATOM 0 HH12 ARG C 54 -16.850 -6.170 -6.853 1.00 0.00 H new ATOM 0 HH21 ARG C 54 -15.560 -6.374 -3.610 1.00 0.00 H new ATOM 0 HH22 ARG C 54 -16.337 -7.245 -4.936 1.00 0.00 H new ATOM 869 N THR C 55 -17.056 -1.542 -1.238 1.00 0.00 N ATOM 870 CA THR C 55 -17.234 -0.870 0.041 1.00 0.00 C ATOM 871 C THR C 55 -16.676 0.544 -0.025 1.00 0.00 C ATOM 872 O THR C 55 -15.950 0.889 -0.952 1.00 0.00 O ATOM 873 CB THR C 55 -16.523 -1.650 1.145 1.00 0.00 C ATOM 874 OG1 THR C 55 -15.124 -1.656 0.894 1.00 0.00 O ATOM 875 CG2 THR C 55 -17.043 -3.086 1.167 1.00 0.00 C ATOM 0 H THR C 55 -16.085 -1.643 -1.533 1.00 0.00 H new ATOM 0 HA THR C 55 -18.300 -0.822 0.263 1.00 0.00 H new ATOM 0 HB THR C 55 -16.717 -1.178 2.108 1.00 0.00 H new ATOM 0 HG1 THR C 55 -14.655 -1.233 1.643 1.00 0.00 H new ATOM 0 HG21 THR C 55 -16.537 -3.644 1.954 1.00 0.00 H new ATOM 0 HG22 THR C 55 -18.116 -3.081 1.358 1.00 0.00 H new ATOM 0 HG23 THR C 55 -16.848 -3.558 0.204 1.00 0.00 H new ATOM 883 N LEU C 56 -17.024 1.366 0.954 1.00 0.00 N ATOM 884 CA LEU C 56 -16.540 2.739 0.967 1.00 0.00 C ATOM 885 C LEU C 56 -15.016 2.765 1.073 1.00 0.00 C ATOM 886 O LEU C 56 -14.352 3.573 0.420 1.00 0.00 O ATOM 887 CB LEU C 56 -17.169 3.502 2.138 1.00 0.00 C ATOM 888 CG LEU C 56 -18.657 3.722 1.856 1.00 0.00 C ATOM 889 CD1 LEU C 56 -19.349 4.239 3.116 1.00 0.00 C ATOM 890 CD2 LEU C 56 -18.822 4.749 0.733 1.00 0.00 C ATOM 0 H LEU C 56 -17.628 1.113 1.736 1.00 0.00 H new ATOM 0 HA LEU C 56 -16.828 3.224 0.034 1.00 0.00 H new ATOM 0 HB2 LEU C 56 -17.041 2.941 3.064 1.00 0.00 H new ATOM 0 HB3 LEU C 56 -16.667 4.460 2.275 1.00 0.00 H new ATOM 0 HG LEU C 56 -19.107 2.776 1.555 1.00 0.00 H new ATOM 0 HD11 LEU C 56 -20.408 4.395 2.912 1.00 0.00 H new ATOM 0 HD12 LEU C 56 -19.238 3.509 3.918 1.00 0.00 H new ATOM 0 HD13 LEU C 56 -18.896 5.183 3.419 1.00 0.00 H new ATOM 0 HD21 LEU C 56 -19.883 4.904 0.534 1.00 0.00 H new ATOM 0 HD22 LEU C 56 -18.368 5.693 1.034 1.00 0.00 H new ATOM 0 HD23 LEU C 56 -18.333 4.383 -0.170 1.00 0.00 H new ATOM 902 N SER C 57 -14.466 1.873 1.889 1.00 0.00 N ATOM 903 CA SER C 57 -13.019 1.803 2.066 1.00 0.00 C ATOM 904 C SER C 57 -12.318 1.437 0.758 1.00 0.00 C ATOM 905 O SER C 57 -11.163 1.800 0.547 1.00 0.00 O ATOM 906 CB SER C 57 -12.677 0.762 3.132 1.00 0.00 C ATOM 907 OG SER C 57 -13.083 -0.523 2.681 1.00 0.00 O ATOM 0 H SER C 57 -14.995 1.193 2.435 1.00 0.00 H new ATOM 0 HA SER C 57 -12.671 2.786 2.381 1.00 0.00 H new ATOM 0 HB2 SER C 57 -11.606 0.768 3.332 1.00 0.00 H new ATOM 0 HB3 SER C 57 -13.178 1.006 4.069 1.00 0.00 H new ATOM 0 HG SER C 57 -12.864 -1.193 3.362 1.00 0.00 H new ATOM 913 N ASP C 58 -13.019 0.726 -0.121 1.00 0.00 N ATOM 914 CA ASP C 58 -12.435 0.336 -1.402 1.00 0.00 C ATOM 915 C ASP C 58 -12.078 1.572 -2.215 1.00 0.00 C ATOM 916 O ASP C 58 -11.076 1.594 -2.929 1.00 0.00 O ATOM 917 CB ASP C 58 -13.398 -0.551 -2.189 1.00 0.00 C ATOM 918 CG ASP C 58 -13.495 -1.917 -1.519 1.00 0.00 C ATOM 919 OD1 ASP C 58 -12.654 -2.204 -0.682 1.00 0.00 O ATOM 920 OD2 ASP C 58 -14.408 -2.656 -1.849 1.00 0.00 O1- ATOM 0 H ASP C 58 -13.978 0.412 0.026 1.00 0.00 H new ATOM 0 HA ASP C 58 -11.527 -0.233 -1.205 1.00 0.00 H new ATOM 0 HB2 ASP C 58 -14.383 -0.086 -2.235 1.00 0.00 H new ATOM 0 HB3 ASP C 58 -13.050 -0.662 -3.216 1.00 0.00 H new ATOM 925 N TYR C 59 -12.911 2.594 -2.097 1.00 0.00 N ATOM 926 CA TYR C 59 -12.703 3.840 -2.820 1.00 0.00 C ATOM 927 C TYR C 59 -11.992 4.876 -1.949 1.00 0.00 C ATOM 928 O TYR C 59 -11.938 6.056 -2.299 1.00 0.00 O ATOM 929 CB TYR C 59 -14.055 4.380 -3.261 1.00 0.00 C ATOM 930 CG TYR C 59 -14.615 3.474 -4.326 1.00 0.00 C ATOM 931 CD1 TYR C 59 -15.225 2.266 -3.967 1.00 0.00 C ATOM 932 CD2 TYR C 59 -14.534 3.845 -5.672 1.00 0.00 C ATOM 933 CE1 TYR C 59 -15.750 1.437 -4.952 1.00 0.00 C ATOM 934 CE2 TYR C 59 -15.062 3.009 -6.658 1.00 0.00 C ATOM 935 CZ TYR C 59 -15.672 1.803 -6.298 1.00 0.00 C ATOM 936 OH TYR C 59 -16.204 0.978 -7.268 1.00 0.00 O ATOM 0 H TYR C 59 -13.741 2.585 -1.505 1.00 0.00 H new ATOM 0 HA TYR C 59 -12.071 3.643 -3.686 1.00 0.00 H new ATOM 0 HB2 TYR C 59 -14.737 4.431 -2.412 1.00 0.00 H new ATOM 0 HB3 TYR C 59 -13.949 5.394 -3.646 1.00 0.00 H new ATOM 0 HD1 TYR C 59 -15.288 1.979 -2.928 1.00 0.00 H new ATOM 0 HD2 TYR C 59 -14.064 4.777 -5.949 1.00 0.00 H new ATOM 0 HE1 TYR C 59 -16.221 0.505 -4.675 1.00 0.00 H new ATOM 0 HE2 TYR C 59 -14.999 3.294 -7.698 1.00 0.00 H new ATOM 0 HH TYR C 59 -16.360 1.494 -8.087 1.00 0.00 H new ATOM 946 N ASN C 60 -11.452 4.435 -0.816 1.00 0.00 N ATOM 947 CA ASN C 60 -10.757 5.341 0.088 1.00 0.00 C ATOM 948 C ASN C 60 -11.680 6.475 0.514 1.00 0.00 C ATOM 949 O ASN C 60 -11.262 7.630 0.610 1.00 0.00 O ATOM 950 CB ASN C 60 -9.514 5.915 -0.601 1.00 0.00 C ATOM 951 CG ASN C 60 -8.543 6.464 0.441 1.00 0.00 C ATOM 952 OD1 ASN C 60 -8.417 5.905 1.531 1.00 0.00 O ATOM 953 ND2 ASN C 60 -7.843 7.532 0.168 1.00 0.00 N ATOM 0 H ASN C 60 -11.483 3.464 -0.505 1.00 0.00 H new ATOM 0 HA ASN C 60 -10.452 4.784 0.974 1.00 0.00 H new ATOM 0 HB2 ASN C 60 -9.026 5.140 -1.192 1.00 0.00 H new ATOM 0 HB3 ASN C 60 -9.804 6.707 -1.292 1.00 0.00 H new ATOM 0 HD21 ASN C 60 -7.191 7.904 0.858 1.00 0.00 H new ATOM 0 HD22 ASN C 60 -7.949 7.994 -0.735 1.00 0.00 H new ATOM 960 N ILE C 61 -12.937 6.134 0.779 1.00 0.00 N ATOM 961 CA ILE C 61 -13.913 7.127 1.206 1.00 0.00 C ATOM 962 C ILE C 61 -13.898 7.246 2.724 1.00 0.00 C ATOM 963 O ILE C 61 -14.233 6.300 3.437 1.00 0.00 O ATOM 964 CB ILE C 61 -15.307 6.728 0.712 1.00 0.00 C ATOM 965 CG1 ILE C 61 -15.296 6.735 -0.820 1.00 0.00 C ATOM 966 CG2 ILE C 61 -16.343 7.729 1.234 1.00 0.00 C ATOM 967 CD1 ILE C 61 -16.530 6.011 -1.361 1.00 0.00 C ATOM 0 H ILE C 61 -13.301 5.184 0.706 1.00 0.00 H new ATOM 0 HA ILE C 61 -13.655 8.096 0.779 1.00 0.00 H new ATOM 0 HB ILE C 61 -15.568 5.734 1.076 1.00 0.00 H new ATOM 0 HG12 ILE C 61 -15.278 7.762 -1.186 1.00 0.00 H new ATOM 0 HG13 ILE C 61 -14.391 6.250 -1.187 1.00 0.00 H new ATOM 0 HG21 ILE C 61 -17.334 7.444 0.882 1.00 0.00 H new ATOM 0 HG22 ILE C 61 -16.332 7.729 2.324 1.00 0.00 H new ATOM 0 HG23 ILE C 61 -16.101 8.727 0.868 1.00 0.00 H new ATOM 0 HD11 ILE C 61 -16.510 6.023 -2.451 1.00 0.00 H new ATOM 0 HD12 ILE C 61 -16.530 4.979 -1.009 1.00 0.00 H new ATOM 0 HD13 ILE C 61 -17.431 6.514 -1.009 1.00 0.00 H new ATOM 979 N GLN C 62 -13.496 8.415 3.205 1.00 0.00 N ATOM 980 CA GLN C 62 -13.424 8.664 4.637 1.00 0.00 C ATOM 981 C GLN C 62 -14.652 9.429 5.103 1.00 0.00 C ATOM 982 O GLN C 62 -15.576 9.669 4.329 1.00 0.00 O ATOM 983 CB GLN C 62 -12.162 9.461 4.973 1.00 0.00 C ATOM 984 CG GLN C 62 -10.925 8.581 4.770 1.00 0.00 C ATOM 985 CD GLN C 62 -9.657 9.417 4.918 1.00 0.00 C ATOM 986 OE1 GLN C 62 -9.667 10.615 4.639 1.00 0.00 O ATOM 987 NE2 GLN C 62 -8.560 8.852 5.342 1.00 0.00 N ATOM 0 H GLN C 62 -13.215 9.205 2.624 1.00 0.00 H new ATOM 0 HA GLN C 62 -13.387 7.704 5.152 1.00 0.00 H new ATOM 0 HB2 GLN C 62 -12.099 10.345 4.338 1.00 0.00 H new ATOM 0 HB3 GLN C 62 -12.205 9.811 6.004 1.00 0.00 H new ATOM 0 HG2 GLN C 62 -10.922 7.770 5.498 1.00 0.00 H new ATOM 0 HG3 GLN C 62 -10.954 8.122 3.782 1.00 0.00 H new ATOM 0 HE21 GLN C 62 -8.554 7.858 5.573 1.00 0.00 H new ATOM 0 HE22 GLN C 62 -7.708 9.404 5.443 1.00 0.00 H new ATOM 996 N LYS C 63 -14.662 9.805 6.372 1.00 0.00 N ATOM 997 CA LYS C 63 -15.792 10.537 6.918 1.00 0.00 C ATOM 998 C LYS C 63 -15.898 11.910 6.248 1.00 0.00 C ATOM 999 O LYS C 63 -14.893 12.489 5.838 1.00 0.00 O ATOM 1000 CB LYS C 63 -15.624 10.750 8.422 1.00 0.00 C ATOM 1001 CG LYS C 63 -16.974 11.121 9.038 1.00 0.00 C ATOM 1002 CD LYS C 63 -16.766 11.502 10.502 1.00 0.00 C ATOM 1003 CE LYS C 63 -18.085 11.991 11.092 1.00 0.00 C ATOM 1004 NZ LYS C 63 -17.875 12.376 12.515 1.00 0.00 N1+ ATOM 0 H LYS C 63 -13.910 9.618 7.036 1.00 0.00 H new ATOM 0 HA LYS C 63 -16.692 9.952 6.730 1.00 0.00 H new ATOM 0 HB2 LYS C 63 -15.237 9.844 8.887 1.00 0.00 H new ATOM 0 HB3 LYS C 63 -14.897 11.540 8.609 1.00 0.00 H new ATOM 0 HG2 LYS C 63 -17.421 11.952 8.493 1.00 0.00 H new ATOM 0 HG3 LYS C 63 -17.666 10.282 8.962 1.00 0.00 H new ATOM 0 HD2 LYS C 63 -16.400 10.643 11.064 1.00 0.00 H new ATOM 0 HD3 LYS C 63 -16.008 12.281 10.582 1.00 0.00 H new ATOM 0 HE2 LYS C 63 -18.457 12.844 10.524 1.00 0.00 H new ATOM 0 HE3 LYS C 63 -18.840 11.208 11.023 1.00 0.00 H new ATOM 0 HZ1 LYS C 63 -18.773 12.710 12.920 1.00 0.00 H new ATOM 0 HZ2 LYS C 63 -17.538 11.551 13.052 1.00 0.00 H new ATOM 0 HZ3 LYS C 63 -17.167 13.136 12.568 1.00 0.00 H new ATOM 1018 N GLU C 64 -17.117 12.424 6.149 1.00 0.00 N ATOM 1019 CA GLU C 64 -17.353 13.727 5.542 1.00 0.00 C ATOM 1020 C GLU C 64 -16.768 13.787 4.135 1.00 0.00 C ATOM 1021 O GLU C 64 -16.166 14.787 3.746 1.00 0.00 O ATOM 1022 CB GLU C 64 -16.738 14.836 6.402 1.00 0.00 C ATOM 1023 CG GLU C 64 -17.386 14.837 7.789 1.00 0.00 C ATOM 1024 CD GLU C 64 -16.883 16.028 8.597 1.00 0.00 C ATOM 1025 OE1 GLU C 64 -15.967 16.689 8.135 1.00 0.00 O ATOM 1026 OE2 GLU C 64 -17.420 16.263 9.668 1.00 0.00 O1- ATOM 0 H GLU C 64 -17.960 11.957 6.482 1.00 0.00 H new ATOM 0 HA GLU C 64 -18.431 13.877 5.479 1.00 0.00 H new ATOM 0 HB2 GLU C 64 -15.663 14.684 6.493 1.00 0.00 H new ATOM 0 HB3 GLU C 64 -16.883 15.804 5.922 1.00 0.00 H new ATOM 0 HG2 GLU C 64 -18.471 14.884 7.693 1.00 0.00 H new ATOM 0 HG3 GLU C 64 -17.152 13.908 8.310 1.00 0.00 H new ATOM 1033 N SER C 65 -16.959 12.716 3.373 1.00 0.00 N ATOM 1034 CA SER C 65 -16.456 12.668 2.005 1.00 0.00 C ATOM 1035 C SER C 65 -17.557 13.059 1.031 1.00 0.00 C ATOM 1036 O SER C 65 -18.635 12.464 1.031 1.00 0.00 O ATOM 1037 CB SER C 65 -15.956 11.262 1.678 1.00 0.00 C ATOM 1038 OG SER C 65 -14.756 11.015 2.397 1.00 0.00 O ATOM 0 H SER C 65 -17.454 11.877 3.675 1.00 0.00 H new ATOM 0 HA SER C 65 -15.629 13.371 1.912 1.00 0.00 H new ATOM 0 HB2 SER C 65 -16.712 10.523 1.944 1.00 0.00 H new ATOM 0 HB3 SER C 65 -15.779 11.166 0.607 1.00 0.00 H new ATOM 0 HG SER C 65 -14.948 10.999 3.358 1.00 0.00 H new ATOM 1044 N THR C 66 -17.286 14.062 0.207 1.00 0.00 N ATOM 1045 CA THR C 66 -18.272 14.520 -0.760 1.00 0.00 C ATOM 1046 C THR C 66 -18.370 13.530 -1.917 1.00 0.00 C ATOM 1047 O THR C 66 -17.362 13.159 -2.519 1.00 0.00 O ATOM 1048 CB THR C 66 -17.886 15.904 -1.290 1.00 0.00 C ATOM 1049 OG1 THR C 66 -17.725 16.794 -0.196 1.00 0.00 O ATOM 1050 CG2 THR C 66 -18.991 16.431 -2.208 1.00 0.00 C ATOM 0 H THR C 66 -16.401 14.569 0.189 1.00 0.00 H new ATOM 0 HA THR C 66 -19.242 14.587 -0.267 1.00 0.00 H new ATOM 0 HB THR C 66 -16.954 15.831 -1.850 1.00 0.00 H new ATOM 0 HG1 THR C 66 -17.476 17.681 -0.530 1.00 0.00 H new ATOM 0 HG21 THR C 66 -18.713 17.416 -2.583 1.00 0.00 H new ATOM 0 HG22 THR C 66 -19.124 15.747 -3.046 1.00 0.00 H new ATOM 0 HG23 THR C 66 -19.924 16.506 -1.649 1.00 0.00 H new ATOM 1058 N LEU C 67 -19.590 13.104 -2.217 1.00 0.00 N ATOM 1059 CA LEU C 67 -19.820 12.156 -3.296 1.00 0.00 C ATOM 1060 C LEU C 67 -20.702 12.780 -4.366 1.00 0.00 C ATOM 1061 O LEU C 67 -21.615 13.545 -4.059 1.00 0.00 O ATOM 1062 CB LEU C 67 -20.492 10.893 -2.752 1.00 0.00 C ATOM 1063 CG LEU C 67 -19.421 9.879 -2.351 1.00 0.00 C ATOM 1064 CD1 LEU C 67 -18.728 10.349 -1.071 1.00 0.00 C ATOM 1065 CD2 LEU C 67 -20.072 8.515 -2.110 1.00 0.00 C ATOM 0 H LEU C 67 -20.434 13.401 -1.728 1.00 0.00 H new ATOM 0 HA LEU C 67 -18.858 11.891 -3.736 1.00 0.00 H new ATOM 0 HB2 LEU C 67 -21.114 11.141 -1.892 1.00 0.00 H new ATOM 0 HB3 LEU C 67 -21.150 10.464 -3.508 1.00 0.00 H new ATOM 0 HG LEU C 67 -18.686 9.792 -3.151 1.00 0.00 H new ATOM 0 HD11 LEU C 67 -17.964 9.626 -0.784 1.00 0.00 H new ATOM 0 HD12 LEU C 67 -18.263 11.319 -1.244 1.00 0.00 H new ATOM 0 HD13 LEU C 67 -19.463 10.437 -0.271 1.00 0.00 H new ATOM 0 HD21 LEU C 67 -19.308 7.792 -1.824 1.00 0.00 H new ATOM 0 HD22 LEU C 67 -20.809 8.599 -1.311 1.00 0.00 H new ATOM 0 HD23 LEU C 67 -20.564 8.180 -3.023 1.00 0.00 H new ATOM 1077 N HIS C 68 -20.424 12.454 -5.618 1.00 0.00 N ATOM 1078 CA HIS C 68 -21.204 12.996 -6.718 1.00 0.00 C ATOM 1079 C HIS C 68 -22.386 12.079 -7.024 1.00 0.00 C ATOM 1080 O HIS C 68 -22.209 10.956 -7.498 1.00 0.00 O ATOM 1081 CB HIS C 68 -20.315 13.139 -7.958 1.00 0.00 C ATOM 1082 CG HIS C 68 -20.930 14.120 -8.920 1.00 0.00 C ATOM 1083 ND1 HIS C 68 -22.070 13.826 -9.650 1.00 0.00 N ATOM 1084 CD2 HIS C 68 -20.565 15.390 -9.290 1.00 0.00 C ATOM 1085 CE1 HIS C 68 -22.348 14.899 -10.417 1.00 0.00 C ATOM 1086 NE2 HIS C 68 -21.461 15.880 -10.235 1.00 0.00 N ATOM 0 H HIS C 68 -19.672 11.823 -5.896 1.00 0.00 H new ATOM 0 HA HIS C 68 -21.586 13.977 -6.436 1.00 0.00 H new ATOM 0 HB2 HIS C 68 -19.321 13.477 -7.666 1.00 0.00 H new ATOM 0 HB3 HIS C 68 -20.193 12.170 -8.442 1.00 0.00 H new ATOM 0 HD2 HIS C 68 -19.711 15.928 -8.906 1.00 0.00 H new ATOM 0 HE1 HIS C 68 -23.186 14.958 -11.096 1.00 0.00 H new ATOM 0 HE2 HIS C 68 -21.444 16.792 -10.691 1.00 0.00 H new ATOM 1094 N LEU C 69 -23.591 12.571 -6.749 1.00 0.00 N ATOM 1095 CA LEU C 69 -24.805 11.802 -6.999 1.00 0.00 C ATOM 1096 C LEU C 69 -25.449 12.271 -8.292 1.00 0.00 C ATOM 1097 O LEU C 69 -25.806 13.442 -8.429 1.00 0.00 O ATOM 1098 CB LEU C 69 -25.785 11.979 -5.833 1.00 0.00 C ATOM 1099 CG LEU C 69 -27.114 11.271 -6.128 1.00 0.00 C ATOM 1100 CD1 LEU C 69 -26.889 9.770 -6.330 1.00 0.00 C ATOM 1101 CD2 LEU C 69 -28.062 11.475 -4.946 1.00 0.00 C ATOM 0 H LEU C 69 -23.752 13.497 -6.354 1.00 0.00 H new ATOM 0 HA LEU C 69 -24.549 10.746 -7.088 1.00 0.00 H new ATOM 0 HB2 LEU C 69 -25.348 11.576 -4.920 1.00 0.00 H new ATOM 0 HB3 LEU C 69 -25.963 13.040 -5.660 1.00 0.00 H new ATOM 0 HG LEU C 69 -27.543 11.692 -7.038 1.00 0.00 H new ATOM 0 HD11 LEU C 69 -27.842 9.284 -6.538 1.00 0.00 H new ATOM 0 HD12 LEU C 69 -26.211 9.613 -7.169 1.00 0.00 H new ATOM 0 HD13 LEU C 69 -26.453 9.343 -5.427 1.00 0.00 H new ATOM 0 HD21 LEU C 69 -29.009 10.975 -5.148 1.00 0.00 H new ATOM 0 HD22 LEU C 69 -27.615 11.055 -4.045 1.00 0.00 H new ATOM 0 HD23 LEU C 69 -28.239 12.541 -4.801 1.00 0.00 H new ATOM 1113 N VAL C 70 -25.590 11.354 -9.237 1.00 0.00 N ATOM 1114 CA VAL C 70 -26.192 11.683 -10.520 1.00 0.00 C ATOM 1115 C VAL C 70 -27.466 10.878 -10.712 1.00 0.00 C ATOM 1116 O VAL C 70 -27.503 9.673 -10.442 1.00 0.00 O ATOM 1117 CB VAL C 70 -25.216 11.406 -11.668 1.00 0.00 C ATOM 1118 CG1 VAL C 70 -25.904 11.696 -13.003 1.00 0.00 C ATOM 1119 CG2 VAL C 70 -23.991 12.308 -11.530 1.00 0.00 C ATOM 0 H VAL C 70 -25.298 10.382 -9.141 1.00 0.00 H new ATOM 0 HA VAL C 70 -26.433 12.746 -10.527 1.00 0.00 H new ATOM 0 HB VAL C 70 -24.906 10.362 -11.632 1.00 0.00 H new ATOM 0 HG11 VAL C 70 -25.210 11.499 -13.820 1.00 0.00 H new ATOM 0 HG12 VAL C 70 -26.779 11.055 -13.108 1.00 0.00 H new ATOM 0 HG13 VAL C 70 -26.213 12.741 -13.033 1.00 0.00 H new ATOM 0 HG21 VAL C 70 -23.299 12.109 -12.348 1.00 0.00 H new ATOM 0 HG22 VAL C 70 -24.302 13.352 -11.564 1.00 0.00 H new ATOM 0 HG23 VAL C 70 -23.497 12.108 -10.579 1.00 0.00 H new ATOM 1129 N LEU C 71 -28.516 11.561 -11.148 1.00 0.00 N ATOM 1130 CA LEU C 71 -29.801 10.914 -11.350 1.00 0.00 C ATOM 1131 C LEU C 71 -29.922 10.433 -12.792 1.00 0.00 C ATOM 1132 O LEU C 71 -29.800 11.221 -13.731 1.00 0.00 O ATOM 1133 CB LEU C 71 -30.921 11.906 -11.046 1.00 0.00 C ATOM 1134 CG LEU C 71 -30.574 12.691 -9.779 1.00 0.00 C ATOM 1135 CD1 LEU C 71 -31.760 13.566 -9.381 1.00 0.00 C ATOM 1136 CD2 LEU C 71 -30.236 11.726 -8.641 1.00 0.00 C ATOM 0 H LEU C 71 -28.502 12.557 -11.367 1.00 0.00 H new ATOM 0 HA LEU C 71 -29.880 10.056 -10.682 1.00 0.00 H new ATOM 0 HB2 LEU C 71 -31.055 12.589 -11.885 1.00 0.00 H new ATOM 0 HB3 LEU C 71 -31.864 11.377 -10.912 1.00 0.00 H new ATOM 0 HG LEU C 71 -29.707 13.323 -9.975 1.00 0.00 H new ATOM 0 HD11 LEU C 71 -31.513 14.125 -8.479 1.00 0.00 H new ATOM 0 HD12 LEU C 71 -31.986 14.262 -10.189 1.00 0.00 H new ATOM 0 HD13 LEU C 71 -32.629 12.936 -9.191 1.00 0.00 H new ATOM 0 HD21 LEU C 71 -29.990 12.294 -7.743 1.00 0.00 H new ATOM 0 HD22 LEU C 71 -31.094 11.084 -8.441 1.00 0.00 H new ATOM 0 HD23 LEU C 71 -29.382 11.111 -8.927 1.00 0.00 H new ATOM 1243 N MET D 1 3.141 -26.651 1.661 1.00 0.00 N ATOM 1244 CA MET D 1 3.558 -25.347 2.247 1.00 0.00 C ATOM 1245 C MET D 1 2.462 -24.322 2.025 1.00 0.00 C ATOM 1246 O MET D 1 2.565 -23.473 1.146 1.00 0.00 O ATOM 1247 CB MET D 1 4.852 -24.876 1.578 1.00 0.00 C ATOM 1248 CG MET D 1 5.340 -23.597 2.256 1.00 0.00 C ATOM 1249 SD MET D 1 6.755 -22.923 1.357 1.00 0.00 S ATOM 1250 CE MET D 1 5.808 -22.213 -0.008 1.00 0.00 C ATOM 0 H1 MET D 1 3.971 -27.270 1.566 1.00 0.00 H new ATOM 0 H2 MET D 1 2.441 -27.103 2.283 1.00 0.00 H new ATOM 0 H3 MET D 1 2.719 -26.491 0.724 1.00 0.00 H new ATOM 0 HA MET D 1 3.730 -25.465 3.317 1.00 0.00 H new ATOM 0 HB2 MET D 1 5.614 -25.652 1.650 1.00 0.00 H new ATOM 0 HB3 MET D 1 4.680 -24.695 0.517 1.00 0.00 H new ATOM 0 HG2 MET D 1 4.535 -22.862 2.288 1.00 0.00 H new ATOM 0 HG3 MET D 1 5.621 -23.807 3.288 1.00 0.00 H new ATOM 0 HE1 MET D 1 6.445 -21.540 -0.582 1.00 0.00 H new ATOM 0 HE2 MET D 1 5.448 -23.012 -0.656 1.00 0.00 H new ATOM 0 HE3 MET D 1 4.958 -21.657 0.389 1.00 0.00 H new ATOM 1262 N GLN D 2 1.421 -24.406 2.838 1.00 0.00 N ATOM 1263 CA GLN D 2 0.306 -23.480 2.731 1.00 0.00 C ATOM 1264 C GLN D 2 0.727 -22.089 3.153 1.00 0.00 C ATOM 1265 O GLN D 2 1.706 -21.910 3.863 1.00 0.00 O ATOM 1266 CB GLN D 2 -0.842 -23.941 3.623 1.00 0.00 C ATOM 1267 CG GLN D 2 -0.437 -23.745 5.067 1.00 0.00 C ATOM 1268 CD GLN D 2 -1.340 -24.565 5.981 1.00 0.00 C ATOM 1269 OE1 GLN D 2 -2.315 -24.044 6.523 1.00 0.00 O ATOM 1270 NE2 GLN D 2 -1.083 -25.829 6.174 1.00 0.00 N ATOM 0 H GLN D 2 1.325 -25.103 3.576 1.00 0.00 H new ATOM 0 HA GLN D 2 -0.019 -23.458 1.691 1.00 0.00 H new ATOM 0 HB2 GLN D 2 -1.745 -23.372 3.402 1.00 0.00 H new ATOM 0 HB3 GLN D 2 -1.072 -24.989 3.433 1.00 0.00 H new ATOM 0 HG2 GLN D 2 0.602 -24.045 5.205 1.00 0.00 H new ATOM 0 HG3 GLN D 2 -0.502 -22.689 5.331 1.00 0.00 H new ATOM 0 HE21 GLN D 2 -0.275 -26.260 5.724 1.00 0.00 H new ATOM 0 HE22 GLN D 2 -1.690 -26.387 6.774 1.00 0.00 H new ATOM 1279 N ILE D 3 -0.025 -21.113 2.691 1.00 0.00 N ATOM 1280 CA ILE D 3 0.249 -19.725 2.998 1.00 0.00 C ATOM 1281 C ILE D 3 -1.056 -18.993 3.280 1.00 0.00 C ATOM 1282 O ILE D 3 -2.092 -19.308 2.702 1.00 0.00 O ATOM 1283 CB ILE D 3 0.986 -19.101 1.818 1.00 0.00 C ATOM 1284 CG1 ILE D 3 0.242 -19.475 0.528 1.00 0.00 C ATOM 1285 CG2 ILE D 3 2.417 -19.641 1.782 1.00 0.00 C ATOM 1286 CD1 ILE D 3 0.928 -18.853 -0.682 1.00 0.00 C ATOM 0 H ILE D 3 -0.840 -21.258 2.095 1.00 0.00 H new ATOM 0 HA ILE D 3 0.874 -19.649 3.887 1.00 0.00 H new ATOM 0 HB ILE D 3 1.021 -18.016 1.915 1.00 0.00 H new ATOM 0 HG12 ILE D 3 0.212 -20.559 0.419 1.00 0.00 H new ATOM 0 HG13 ILE D 3 -0.791 -19.132 0.584 1.00 0.00 H new ATOM 0 HG21 ILE D 3 2.951 -19.200 0.941 1.00 0.00 H new ATOM 0 HG22 ILE D 3 2.926 -19.384 2.711 1.00 0.00 H new ATOM 0 HG23 ILE D 3 2.394 -20.725 1.669 1.00 0.00 H new ATOM 0 HD11 ILE D 3 0.388 -19.128 -1.588 1.00 0.00 H new ATOM 0 HD12 ILE D 3 0.934 -17.768 -0.579 1.00 0.00 H new ATOM 0 HD13 ILE D 3 1.953 -19.217 -0.746 1.00 0.00 H new ATOM 1298 N PHE D 4 -1.006 -18.028 4.177 1.00 0.00 N ATOM 1299 CA PHE D 4 -2.201 -17.280 4.538 1.00 0.00 C ATOM 1300 C PHE D 4 -2.298 -16.001 3.722 1.00 0.00 C ATOM 1301 O PHE D 4 -1.402 -15.178 3.754 1.00 0.00 O ATOM 1302 CB PHE D 4 -2.144 -16.943 6.028 1.00 0.00 C ATOM 1303 CG PHE D 4 -2.301 -18.213 6.830 1.00 0.00 C ATOM 1304 CD1 PHE D 4 -1.205 -19.062 7.005 1.00 0.00 C ATOM 1305 CD2 PHE D 4 -3.536 -18.540 7.399 1.00 0.00 C ATOM 1306 CE1 PHE D 4 -1.340 -20.240 7.753 1.00 0.00 C ATOM 1307 CE2 PHE D 4 -3.672 -19.717 8.148 1.00 0.00 C ATOM 1308 CZ PHE D 4 -2.574 -20.565 8.325 1.00 0.00 C ATOM 0 H PHE D 4 -0.159 -17.742 4.668 1.00 0.00 H new ATOM 0 HA PHE D 4 -3.082 -17.887 4.328 1.00 0.00 H new ATOM 0 HB2 PHE D 4 -1.196 -16.462 6.268 1.00 0.00 H new ATOM 0 HB3 PHE D 4 -2.934 -16.237 6.284 1.00 0.00 H new ATOM 0 HD1 PHE D 4 -0.252 -18.810 6.563 1.00 0.00 H new ATOM 0 HD2 PHE D 4 -4.384 -17.886 7.261 1.00 0.00 H new ATOM 0 HE1 PHE D 4 -0.492 -20.896 7.887 1.00 0.00 H new ATOM 0 HE2 PHE D 4 -4.625 -19.969 8.589 1.00 0.00 H new ATOM 0 HZ PHE D 4 -2.679 -21.471 8.903 1.00 0.00 H new ATOM 1318 N VAL D 5 -3.390 -15.837 2.988 1.00 0.00 N ATOM 1319 CA VAL D 5 -3.556 -14.637 2.179 1.00 0.00 C ATOM 1320 C VAL D 5 -4.551 -13.689 2.834 1.00 0.00 C ATOM 1321 O VAL D 5 -5.733 -13.993 2.943 1.00 0.00 O ATOM 1322 CB VAL D 5 -4.036 -15.029 0.784 1.00 0.00 C ATOM 1323 CG1 VAL D 5 -4.331 -13.768 -0.028 1.00 0.00 C ATOM 1324 CG2 VAL D 5 -2.933 -15.841 0.098 1.00 0.00 C ATOM 0 H VAL D 5 -4.160 -16.504 2.935 1.00 0.00 H new ATOM 0 HA VAL D 5 -2.598 -14.123 2.099 1.00 0.00 H new ATOM 0 HB VAL D 5 -4.946 -15.625 0.854 1.00 0.00 H new ATOM 0 HG11 VAL D 5 -4.674 -14.048 -1.024 1.00 0.00 H new ATOM 0 HG12 VAL D 5 -5.106 -13.186 0.472 1.00 0.00 H new ATOM 0 HG13 VAL D 5 -3.424 -13.169 -0.112 1.00 0.00 H new ATOM 0 HG21 VAL D 5 -3.261 -16.129 -0.901 1.00 0.00 H new ATOM 0 HG22 VAL D 5 -2.029 -15.236 0.023 1.00 0.00 H new ATOM 0 HG23 VAL D 5 -2.723 -16.736 0.683 1.00 0.00 H new ATOM 1334 N LYS D 6 -4.062 -12.539 3.279 1.00 0.00 N ATOM 1335 CA LYS D 6 -4.931 -11.574 3.935 1.00 0.00 C ATOM 1336 C LYS D 6 -5.366 -10.484 2.955 1.00 0.00 C ATOM 1337 O LYS D 6 -4.541 -9.900 2.252 1.00 0.00 O ATOM 1338 CB LYS D 6 -4.207 -10.949 5.128 1.00 0.00 C ATOM 1339 CG LYS D 6 -5.236 -10.486 6.162 1.00 0.00 C ATOM 1340 CD LYS D 6 -4.768 -10.902 7.554 1.00 0.00 C ATOM 1341 CE LYS D 6 -3.657 -9.965 8.026 1.00 0.00 C ATOM 1342 NZ LYS D 6 -3.238 -10.349 9.403 1.00 0.00 N1+ ATOM 0 H LYS D 6 -3.085 -12.256 3.200 1.00 0.00 H new ATOM 0 HA LYS D 6 -5.822 -12.093 4.288 1.00 0.00 H new ATOM 0 HB2 LYS D 6 -3.527 -11.674 5.575 1.00 0.00 H new ATOM 0 HB3 LYS D 6 -3.601 -10.105 4.798 1.00 0.00 H new ATOM 0 HG2 LYS D 6 -5.357 -9.404 6.114 1.00 0.00 H new ATOM 0 HG3 LYS D 6 -6.210 -10.925 5.946 1.00 0.00 H new ATOM 0 HD2 LYS D 6 -5.604 -10.872 8.253 1.00 0.00 H new ATOM 0 HD3 LYS D 6 -4.406 -11.930 7.534 1.00 0.00 H new ATOM 0 HE2 LYS D 6 -2.807 -10.020 7.346 1.00 0.00 H new ATOM 0 HE3 LYS D 6 -4.007 -8.933 8.015 1.00 0.00 H new ATOM 0 HZ1 LYS D 6 -2.482 -9.712 9.726 1.00 0.00 H new ATOM 0 HZ2 LYS D 6 -4.051 -10.275 10.047 1.00 0.00 H new ATOM 0 HZ3 LYS D 6 -2.888 -11.328 9.399 1.00 0.00 H new ATOM 1356 N THR D 7 -6.668 -10.228 2.911 1.00 0.00 N ATOM 1357 CA THR D 7 -7.223 -9.219 2.016 1.00 0.00 C ATOM 1358 C THR D 7 -7.200 -7.843 2.658 1.00 0.00 C ATOM 1359 O THR D 7 -6.714 -7.669 3.775 1.00 0.00 O ATOM 1360 CB THR D 7 -8.661 -9.575 1.644 1.00 0.00 C ATOM 1361 OG1 THR D 7 -9.461 -9.597 2.817 1.00 0.00 O ATOM 1362 CG2 THR D 7 -8.693 -10.948 0.969 1.00 0.00 C ATOM 0 H THR D 7 -7.361 -10.707 3.486 1.00 0.00 H new ATOM 0 HA THR D 7 -6.605 -9.198 1.118 1.00 0.00 H new ATOM 0 HB THR D 7 -9.053 -8.828 0.954 1.00 0.00 H new ATOM 0 HG1 THR D 7 -9.188 -10.347 3.385 1.00 0.00 H new ATOM 0 HG21 THR D 7 -9.720 -11.200 0.705 1.00 0.00 H new ATOM 0 HG22 THR D 7 -8.082 -10.924 0.067 1.00 0.00 H new ATOM 0 HG23 THR D 7 -8.300 -11.699 1.654 1.00 0.00 H new ATOM 1370 N LEU D 8 -7.731 -6.866 1.940 1.00 0.00 N ATOM 1371 CA LEU D 8 -7.767 -5.504 2.439 1.00 0.00 C ATOM 1372 C LEU D 8 -8.808 -5.372 3.550 1.00 0.00 C ATOM 1373 O LEU D 8 -8.789 -4.409 4.318 1.00 0.00 O ATOM 1374 CB LEU D 8 -8.111 -4.547 1.294 1.00 0.00 C ATOM 1375 CG LEU D 8 -7.162 -4.788 0.122 1.00 0.00 C ATOM 1376 CD1 LEU D 8 -7.475 -3.797 -0.999 1.00 0.00 C ATOM 1377 CD2 LEU D 8 -5.709 -4.610 0.574 1.00 0.00 C ATOM 0 H LEU D 8 -8.141 -6.991 1.014 1.00 0.00 H new ATOM 0 HA LEU D 8 -6.787 -5.251 2.844 1.00 0.00 H new ATOM 0 HB2 LEU D 8 -9.143 -4.699 0.977 1.00 0.00 H new ATOM 0 HB3 LEU D 8 -8.031 -3.514 1.633 1.00 0.00 H new ATOM 0 HG LEU D 8 -7.297 -5.807 -0.242 1.00 0.00 H new ATOM 0 HD11 LEU D 8 -6.798 -3.969 -1.836 1.00 0.00 H new ATOM 0 HD12 LEU D 8 -8.504 -3.936 -1.330 1.00 0.00 H new ATOM 0 HD13 LEU D 8 -7.347 -2.779 -0.631 1.00 0.00 H new ATOM 0 HD21 LEU D 8 -5.041 -4.784 -0.270 1.00 0.00 H new ATOM 0 HD22 LEU D 8 -5.566 -3.596 0.947 1.00 0.00 H new ATOM 0 HD23 LEU D 8 -5.485 -5.323 1.367 1.00 0.00 H new ATOM 1389 N THR D 9 -9.713 -6.346 3.631 1.00 0.00 N ATOM 1390 CA THR D 9 -10.758 -6.330 4.649 1.00 0.00 C ATOM 1391 C THR D 9 -10.304 -7.064 5.915 1.00 0.00 C ATOM 1392 O THR D 9 -11.042 -7.126 6.899 1.00 0.00 O ATOM 1393 CB THR D 9 -12.017 -7.007 4.100 1.00 0.00 C ATOM 1394 OG1 THR D 9 -11.747 -8.381 3.867 1.00 0.00 O ATOM 1395 CG2 THR D 9 -12.430 -6.340 2.785 1.00 0.00 C ATOM 0 H THR D 9 -9.743 -7.152 3.006 1.00 0.00 H new ATOM 0 HA THR D 9 -10.970 -5.292 4.905 1.00 0.00 H new ATOM 0 HB THR D 9 -12.826 -6.909 4.824 1.00 0.00 H new ATOM 0 HG1 THR D 9 -10.849 -8.478 3.487 1.00 0.00 H new ATOM 0 HG21 THR D 9 -13.326 -6.824 2.397 1.00 0.00 H new ATOM 0 HG22 THR D 9 -12.636 -5.284 2.961 1.00 0.00 H new ATOM 0 HG23 THR D 9 -11.623 -6.436 2.059 1.00 0.00 H new ATOM 1403 N GLY D 10 -9.096 -7.628 5.886 1.00 0.00 N ATOM 1404 CA GLY D 10 -8.574 -8.358 7.037 1.00 0.00 C ATOM 1405 C GLY D 10 -8.884 -9.853 6.942 1.00 0.00 C ATOM 1406 O GLY D 10 -8.368 -10.647 7.729 1.00 0.00 O ATOM 0 H GLY D 10 -8.467 -7.593 5.084 1.00 0.00 H new ATOM 0 HA2 GLY D 10 -7.496 -8.213 7.103 1.00 0.00 H new ATOM 0 HA3 GLY D 10 -9.006 -7.953 7.952 1.00 0.00 H new ATOM 1410 N LYS D 11 -9.714 -10.237 5.971 1.00 0.00 N ATOM 1411 CA LYS D 11 -10.061 -11.645 5.795 1.00 0.00 C ATOM 1412 C LYS D 11 -8.820 -12.433 5.387 1.00 0.00 C ATOM 1413 O LYS D 11 -8.100 -12.036 4.478 1.00 0.00 O ATOM 1414 CB LYS D 11 -11.141 -11.783 4.717 1.00 0.00 C ATOM 1415 CG LYS D 11 -11.896 -13.100 4.910 1.00 0.00 C ATOM 1416 CD LYS D 11 -11.267 -14.191 4.039 1.00 0.00 C ATOM 1417 CE LYS D 11 -11.733 -15.561 4.534 1.00 0.00 C ATOM 1418 NZ LYS D 11 -13.220 -15.628 4.474 1.00 0.00 N1+ ATOM 0 H LYS D 11 -10.152 -9.602 5.304 1.00 0.00 H new ATOM 0 HA LYS D 11 -10.444 -12.040 6.736 1.00 0.00 H new ATOM 0 HB2 LYS D 11 -11.834 -10.944 4.773 1.00 0.00 H new ATOM 0 HB3 LYS D 11 -10.686 -11.755 3.727 1.00 0.00 H new ATOM 0 HG2 LYS D 11 -11.866 -13.397 5.958 1.00 0.00 H new ATOM 0 HG3 LYS D 11 -12.945 -12.970 4.645 1.00 0.00 H new ATOM 0 HD2 LYS D 11 -11.553 -14.051 2.997 1.00 0.00 H new ATOM 0 HD3 LYS D 11 -10.180 -14.126 4.082 1.00 0.00 H new ATOM 0 HE2 LYS D 11 -11.297 -16.349 3.920 1.00 0.00 H new ATOM 0 HE3 LYS D 11 -11.391 -15.727 5.556 1.00 0.00 H new ATOM 0 HZ1 LYS D 11 -13.525 -16.621 4.527 1.00 0.00 H new ATOM 0 HZ2 LYS D 11 -13.624 -15.098 5.273 1.00 0.00 H new ATOM 0 HZ3 LYS D 11 -13.550 -15.212 3.580 1.00 0.00 H new ATOM 1432 N THR D 12 -8.566 -13.546 6.067 1.00 0.00 N ATOM 1433 CA THR D 12 -7.392 -14.359 5.763 1.00 0.00 C ATOM 1434 C THR D 12 -7.798 -15.698 5.148 1.00 0.00 C ATOM 1435 O THR D 12 -8.721 -16.357 5.620 1.00 0.00 O ATOM 1436 CB THR D 12 -6.588 -14.599 7.033 1.00 0.00 C ATOM 1437 OG1 THR D 12 -6.155 -13.356 7.553 1.00 0.00 O ATOM 1438 CG2 THR D 12 -5.378 -15.477 6.719 1.00 0.00 C ATOM 0 H THR D 12 -9.149 -13.904 6.824 1.00 0.00 H new ATOM 0 HA THR D 12 -6.780 -13.820 5.040 1.00 0.00 H new ATOM 0 HB THR D 12 -7.212 -15.104 7.770 1.00 0.00 H new ATOM 0 HG1 THR D 12 -5.572 -13.510 8.326 1.00 0.00 H new ATOM 0 HG21 THR D 12 -4.805 -15.646 7.631 1.00 0.00 H new ATOM 0 HG22 THR D 12 -5.716 -16.433 6.320 1.00 0.00 H new ATOM 0 HG23 THR D 12 -4.748 -14.979 5.982 1.00 0.00 H new ATOM 1446 N ILE D 13 -7.111 -16.073 4.073 1.00 0.00 N ATOM 1447 CA ILE D 13 -7.412 -17.312 3.370 1.00 0.00 C ATOM 1448 C ILE D 13 -6.171 -18.187 3.231 1.00 0.00 C ATOM 1449 O ILE D 13 -5.265 -17.868 2.464 1.00 0.00 O ATOM 1450 CB ILE D 13 -7.925 -16.970 1.972 1.00 0.00 C ATOM 1451 CG1 ILE D 13 -8.535 -15.563 1.991 1.00 0.00 C ATOM 1452 CG2 ILE D 13 -8.982 -17.990 1.552 1.00 0.00 C ATOM 1453 CD1 ILE D 13 -9.238 -15.288 0.666 1.00 0.00 C ATOM 0 H ILE D 13 -6.343 -15.536 3.671 1.00 0.00 H new ATOM 0 HA ILE D 13 -8.161 -17.860 3.942 1.00 0.00 H new ATOM 0 HB ILE D 13 -7.101 -16.998 1.259 1.00 0.00 H new ATOM 0 HG12 ILE D 13 -9.244 -15.475 2.815 1.00 0.00 H new ATOM 0 HG13 ILE D 13 -7.755 -14.821 2.161 1.00 0.00 H new ATOM 0 HG21 ILE D 13 -9.348 -17.745 0.555 1.00 0.00 H new ATOM 0 HG22 ILE D 13 -8.542 -18.987 1.543 1.00 0.00 H new ATOM 0 HG23 ILE D 13 -9.812 -17.966 2.258 1.00 0.00 H new ATOM 0 HD11 ILE D 13 -9.670 -14.287 0.684 1.00 0.00 H new ATOM 0 HD12 ILE D 13 -8.518 -15.358 -0.149 1.00 0.00 H new ATOM 0 HD13 ILE D 13 -10.029 -16.022 0.515 1.00 0.00 H new ATOM 1465 N THR D 14 -6.136 -19.302 3.953 1.00 0.00 N ATOM 1466 CA THR D 14 -5.000 -20.204 3.870 1.00 0.00 C ATOM 1467 C THR D 14 -5.117 -21.069 2.618 1.00 0.00 C ATOM 1468 O THR D 14 -6.129 -21.739 2.406 1.00 0.00 O ATOM 1469 CB THR D 14 -4.942 -21.089 5.111 1.00 0.00 C ATOM 1470 OG1 THR D 14 -5.540 -20.407 6.201 1.00 0.00 O ATOM 1471 CG2 THR D 14 -3.486 -21.394 5.441 1.00 0.00 C ATOM 0 H THR D 14 -6.873 -19.598 4.594 1.00 0.00 H new ATOM 0 HA THR D 14 -4.084 -19.616 3.814 1.00 0.00 H new ATOM 0 HB THR D 14 -5.478 -22.020 4.925 1.00 0.00 H new ATOM 0 HG1 THR D 14 -4.901 -19.765 6.575 1.00 0.00 H new ATOM 0 HG21 THR D 14 -3.439 -22.026 6.327 1.00 0.00 H new ATOM 0 HG22 THR D 14 -3.023 -21.912 4.601 1.00 0.00 H new ATOM 0 HG23 THR D 14 -2.953 -20.462 5.631 1.00 0.00 H new ATOM 1479 N LEU D 15 -4.080 -21.038 1.793 1.00 0.00 N ATOM 1480 CA LEU D 15 -4.064 -21.809 0.558 1.00 0.00 C ATOM 1481 C LEU D 15 -2.865 -22.749 0.540 1.00 0.00 C ATOM 1482 O LEU D 15 -1.728 -22.312 0.691 1.00 0.00 O ATOM 1483 CB LEU D 15 -3.982 -20.856 -0.642 1.00 0.00 C ATOM 1484 CG LEU D 15 -5.259 -20.015 -0.724 1.00 0.00 C ATOM 1485 CD1 LEU D 15 -5.090 -18.938 -1.797 1.00 0.00 C ATOM 1486 CD2 LEU D 15 -6.440 -20.917 -1.094 1.00 0.00 C ATOM 0 H LEU D 15 -3.238 -20.486 1.957 1.00 0.00 H new ATOM 0 HA LEU D 15 -4.979 -22.398 0.498 1.00 0.00 H new ATOM 0 HB2 LEU D 15 -3.113 -20.206 -0.543 1.00 0.00 H new ATOM 0 HB3 LEU D 15 -3.851 -21.425 -1.562 1.00 0.00 H new ATOM 0 HG LEU D 15 -5.447 -19.544 0.241 1.00 0.00 H new ATOM 0 HD11 LEU D 15 -5.998 -18.338 -1.857 1.00 0.00 H new ATOM 0 HD12 LEU D 15 -4.248 -18.296 -1.539 1.00 0.00 H new ATOM 0 HD13 LEU D 15 -4.903 -19.411 -2.761 1.00 0.00 H new ATOM 0 HD21 LEU D 15 -7.350 -20.320 -1.153 1.00 0.00 H new ATOM 0 HD22 LEU D 15 -6.251 -21.386 -2.060 1.00 0.00 H new ATOM 0 HD23 LEU D 15 -6.561 -21.688 -0.333 1.00 0.00 H new ATOM 1498 N GLU D 16 -3.122 -24.038 0.348 1.00 0.00 N ATOM 1499 CA GLU D 16 -2.045 -25.017 0.309 1.00 0.00 C ATOM 1500 C GLU D 16 -1.250 -24.884 -0.977 1.00 0.00 C ATOM 1501 O GLU D 16 -1.764 -25.137 -2.066 1.00 0.00 O ATOM 1502 CB GLU D 16 -2.617 -26.422 0.386 1.00 0.00 C ATOM 1503 CG GLU D 16 -1.480 -27.441 0.345 1.00 0.00 C ATOM 1504 CD GLU D 16 -2.049 -28.851 0.469 1.00 0.00 C ATOM 1505 OE1 GLU D 16 -3.257 -28.970 0.595 1.00 0.00 O ATOM 1506 OE2 GLU D 16 -1.271 -29.791 0.434 1.00 0.00 O1- ATOM 0 H GLU D 16 -4.057 -24.425 0.218 1.00 0.00 H new ATOM 0 HA GLU D 16 -1.390 -24.835 1.161 1.00 0.00 H new ATOM 0 HB2 GLU D 16 -3.193 -26.541 1.304 1.00 0.00 H new ATOM 0 HB3 GLU D 16 -3.302 -26.593 -0.445 1.00 0.00 H new ATOM 0 HG2 GLU D 16 -0.925 -27.343 -0.588 1.00 0.00 H new ATOM 0 HG3 GLU D 16 -0.777 -27.249 1.156 1.00 0.00 H new ATOM 1513 N VAL D 17 0.006 -24.496 -0.842 1.00 0.00 N ATOM 1514 CA VAL D 17 0.873 -24.339 -2.003 1.00 0.00 C ATOM 1515 C VAL D 17 2.242 -24.959 -1.734 1.00 0.00 C ATOM 1516 O VAL D 17 2.566 -25.301 -0.595 1.00 0.00 O ATOM 1517 CB VAL D 17 1.040 -22.864 -2.342 1.00 0.00 C ATOM 1518 CG1 VAL D 17 -0.336 -22.235 -2.597 1.00 0.00 C ATOM 1519 CG2 VAL D 17 1.725 -22.167 -1.173 1.00 0.00 C ATOM 0 H VAL D 17 0.449 -24.284 0.052 1.00 0.00 H new ATOM 0 HA VAL D 17 0.410 -24.851 -2.847 1.00 0.00 H new ATOM 0 HB VAL D 17 1.647 -22.754 -3.240 1.00 0.00 H new ATOM 0 HG11 VAL D 17 -0.214 -21.179 -2.839 1.00 0.00 H new ATOM 0 HG12 VAL D 17 -0.821 -22.745 -3.430 1.00 0.00 H new ATOM 0 HG13 VAL D 17 -0.952 -22.333 -1.703 1.00 0.00 H new ATOM 0 HG21 VAL D 17 1.851 -21.109 -1.403 1.00 0.00 H new ATOM 0 HG22 VAL D 17 1.113 -22.273 -0.277 1.00 0.00 H new ATOM 0 HG23 VAL D 17 2.702 -22.619 -1.001 1.00 0.00 H new ATOM 1529 N GLU D 18 3.043 -25.095 -2.782 1.00 0.00 N ATOM 1530 CA GLU D 18 4.377 -25.668 -2.644 1.00 0.00 C ATOM 1531 C GLU D 18 5.438 -24.592 -2.845 1.00 0.00 C ATOM 1532 O GLU D 18 5.186 -23.590 -3.510 1.00 0.00 O ATOM 1533 CB GLU D 18 4.574 -26.779 -3.675 1.00 0.00 C ATOM 1534 CG GLU D 18 3.575 -27.905 -3.415 1.00 0.00 C ATOM 1535 CD GLU D 18 3.724 -28.984 -4.482 1.00 0.00 C ATOM 1536 OE1 GLU D 18 4.576 -28.824 -5.342 1.00 0.00 O ATOM 1537 OE2 GLU D 18 2.984 -29.951 -4.425 1.00 0.00 O1- ATOM 0 H GLU D 18 2.795 -24.819 -3.732 1.00 0.00 H new ATOM 0 HA GLU D 18 4.477 -26.082 -1.641 1.00 0.00 H new ATOM 0 HB2 GLU D 18 4.437 -26.383 -4.681 1.00 0.00 H new ATOM 0 HB3 GLU D 18 5.592 -27.163 -3.620 1.00 0.00 H new ATOM 0 HG2 GLU D 18 3.744 -28.332 -2.427 1.00 0.00 H new ATOM 0 HG3 GLU D 18 2.559 -27.511 -3.423 1.00 0.00 H new ATOM 1544 N PRO D 19 6.613 -24.768 -2.289 1.00 0.00 N ATOM 1545 CA PRO D 19 7.711 -23.768 -2.433 1.00 0.00 C ATOM 1546 C PRO D 19 8.042 -23.492 -3.900 1.00 0.00 C ATOM 1547 O PRO D 19 8.417 -22.377 -4.263 1.00 0.00 O ATOM 1548 CB PRO D 19 8.891 -24.422 -1.717 1.00 0.00 C ATOM 1549 CG PRO D 19 8.285 -25.402 -0.775 1.00 0.00 C ATOM 1550 CD PRO D 19 7.035 -25.920 -1.469 1.00 0.00 C ATOM 0 HA PRO D 19 7.443 -22.797 -2.016 1.00 0.00 H new ATOM 0 HB2 PRO D 19 9.556 -24.917 -2.425 1.00 0.00 H new ATOM 0 HB3 PRO D 19 9.487 -23.681 -1.184 1.00 0.00 H new ATOM 0 HG2 PRO D 19 8.977 -26.215 -0.557 1.00 0.00 H new ATOM 0 HG3 PRO D 19 8.038 -24.930 0.176 1.00 0.00 H new ATOM 0 HD2 PRO D 19 7.247 -26.796 -2.082 1.00 0.00 H new ATOM 0 HD3 PRO D 19 6.266 -26.210 -0.753 1.00 0.00 H new ATOM 1558 N SER D 20 7.900 -24.513 -4.737 1.00 0.00 N ATOM 1559 CA SER D 20 8.184 -24.365 -6.160 1.00 0.00 C ATOM 1560 C SER D 20 6.981 -23.769 -6.905 1.00 0.00 C ATOM 1561 O SER D 20 7.072 -23.466 -8.094 1.00 0.00 O ATOM 1562 CB SER D 20 8.537 -25.724 -6.765 1.00 0.00 C ATOM 1563 OG SER D 20 9.715 -26.222 -6.141 1.00 0.00 O ATOM 0 H SER D 20 7.593 -25.445 -4.459 1.00 0.00 H new ATOM 0 HA SER D 20 9.029 -23.684 -6.267 1.00 0.00 H new ATOM 0 HB2 SER D 20 7.713 -26.423 -6.624 1.00 0.00 H new ATOM 0 HB3 SER D 20 8.693 -25.628 -7.839 1.00 0.00 H new ATOM 0 HG SER D 20 9.945 -27.094 -6.524 1.00 0.00 H new ATOM 1569 N ASP D 21 5.859 -23.607 -6.202 1.00 0.00 N ATOM 1570 CA ASP D 21 4.649 -23.053 -6.806 1.00 0.00 C ATOM 1571 C ASP D 21 4.895 -21.636 -7.315 1.00 0.00 C ATOM 1572 O ASP D 21 5.650 -20.872 -6.714 1.00 0.00 O ATOM 1573 CB ASP D 21 3.521 -23.028 -5.777 1.00 0.00 C ATOM 1574 CG ASP D 21 2.193 -22.783 -6.478 1.00 0.00 C ATOM 1575 OD1 ASP D 21 2.132 -23.003 -7.676 1.00 0.00 O ATOM 1576 OD2 ASP D 21 1.257 -22.381 -5.809 1.00 0.00 O1- ATOM 0 H ASP D 21 5.764 -23.851 -5.216 1.00 0.00 H new ATOM 0 HA ASP D 21 4.369 -23.686 -7.648 1.00 0.00 H new ATOM 0 HB2 ASP D 21 3.489 -23.974 -5.236 1.00 0.00 H new ATOM 0 HB3 ASP D 21 3.705 -22.245 -5.041 1.00 0.00 H new ATOM 1581 N THR D 22 4.253 -21.292 -8.429 1.00 0.00 N ATOM 1582 CA THR D 22 4.413 -19.965 -9.009 1.00 0.00 C ATOM 1583 C THR D 22 3.386 -18.987 -8.441 1.00 0.00 C ATOM 1584 O THR D 22 2.365 -19.393 -7.884 1.00 0.00 O ATOM 1585 CB THR D 22 4.271 -20.042 -10.526 1.00 0.00 C ATOM 1586 OG1 THR D 22 2.926 -20.357 -10.863 1.00 0.00 O ATOM 1587 CG2 THR D 22 5.199 -21.132 -11.061 1.00 0.00 C ATOM 0 H THR D 22 3.623 -21.909 -8.943 1.00 0.00 H new ATOM 0 HA THR D 22 5.408 -19.600 -8.754 1.00 0.00 H new ATOM 0 HB THR D 22 4.538 -19.082 -10.968 1.00 0.00 H new ATOM 0 HG1 THR D 22 2.836 -20.405 -11.838 1.00 0.00 H new ATOM 0 HG21 THR D 22 5.102 -21.192 -12.145 1.00 0.00 H new ATOM 0 HG22 THR D 22 6.230 -20.892 -10.801 1.00 0.00 H new ATOM 0 HG23 THR D 22 4.927 -22.090 -10.619 1.00 0.00 H new ATOM 1595 N ILE D 23 3.667 -17.696 -8.590 1.00 0.00 N ATOM 1596 CA ILE D 23 2.772 -16.657 -8.088 1.00 0.00 C ATOM 1597 C ILE D 23 1.440 -16.708 -8.832 1.00 0.00 C ATOM 1598 O ILE D 23 0.377 -16.514 -8.238 1.00 0.00 O ATOM 1599 CB ILE D 23 3.412 -15.275 -8.259 1.00 0.00 C ATOM 1600 CG1 ILE D 23 4.776 -15.231 -7.549 1.00 0.00 C ATOM 1601 CG2 ILE D 23 2.494 -14.212 -7.651 1.00 0.00 C ATOM 1602 CD1 ILE D 23 4.636 -15.627 -6.074 1.00 0.00 C ATOM 0 H ILE D 23 4.505 -17.344 -9.053 1.00 0.00 H new ATOM 0 HA ILE D 23 2.594 -16.834 -7.027 1.00 0.00 H new ATOM 0 HB ILE D 23 3.555 -15.079 -9.322 1.00 0.00 H new ATOM 0 HG12 ILE D 23 5.472 -15.906 -8.047 1.00 0.00 H new ATOM 0 HG13 ILE D 23 5.197 -14.228 -7.622 1.00 0.00 H new ATOM 0 HG21 ILE D 23 2.947 -13.228 -7.771 1.00 0.00 H new ATOM 0 HG22 ILE D 23 1.529 -14.232 -8.158 1.00 0.00 H new ATOM 0 HG23 ILE D 23 2.351 -14.418 -6.590 1.00 0.00 H new ATOM 0 HD11 ILE D 23 5.613 -15.589 -5.593 1.00 0.00 H new ATOM 0 HD12 ILE D 23 3.958 -14.935 -5.574 1.00 0.00 H new ATOM 0 HD13 ILE D 23 4.237 -16.639 -6.005 1.00 0.00 H new ATOM 1614 N GLU D 24 1.508 -16.969 -10.133 1.00 0.00 N ATOM 1615 CA GLU D 24 0.303 -17.046 -10.953 1.00 0.00 C ATOM 1616 C GLU D 24 -0.624 -18.131 -10.420 1.00 0.00 C ATOM 1617 O GLU D 24 -1.838 -17.940 -10.336 1.00 0.00 O ATOM 1618 CB GLU D 24 0.683 -17.369 -12.403 1.00 0.00 C ATOM 1619 CG GLU D 24 -0.575 -17.425 -13.272 1.00 0.00 C ATOM 1620 CD GLU D 24 -0.195 -17.717 -14.719 1.00 0.00 C ATOM 1621 OE1 GLU D 24 0.989 -17.853 -14.984 1.00 0.00 O ATOM 1622 OE2 GLU D 24 -1.091 -17.801 -15.543 1.00 0.00 O1- ATOM 0 H GLU D 24 2.378 -17.130 -10.640 1.00 0.00 H new ATOM 0 HA GLU D 24 -0.210 -16.085 -10.916 1.00 0.00 H new ATOM 0 HB2 GLU D 24 1.367 -16.611 -12.786 1.00 0.00 H new ATOM 0 HB3 GLU D 24 1.208 -18.323 -12.446 1.00 0.00 H new ATOM 0 HG2 GLU D 24 -1.249 -18.197 -12.901 1.00 0.00 H new ATOM 0 HG3 GLU D 24 -1.111 -16.478 -13.212 1.00 0.00 H new ATOM 1629 N ASN D 25 -0.045 -19.269 -10.057 1.00 0.00 N ATOM 1630 CA ASN D 25 -0.828 -20.378 -9.528 1.00 0.00 C ATOM 1631 C ASN D 25 -1.501 -19.976 -8.228 1.00 0.00 C ATOM 1632 O ASN D 25 -2.655 -20.320 -7.977 1.00 0.00 O ATOM 1633 CB ASN D 25 0.065 -21.584 -9.266 1.00 0.00 C ATOM 1634 CG ASN D 25 -0.798 -22.832 -9.115 1.00 0.00 C ATOM 1635 OD1 ASN D 25 -1.830 -22.953 -9.777 1.00 0.00 O ATOM 1636 ND2 ASN D 25 -0.445 -23.771 -8.282 1.00 0.00 N ATOM 0 H ASN D 25 0.957 -19.447 -10.119 1.00 0.00 H new ATOM 0 HA ASN D 25 -1.585 -20.639 -10.268 1.00 0.00 H new ATOM 0 HB2 ASN D 25 0.770 -21.713 -10.087 1.00 0.00 H new ATOM 0 HB3 ASN D 25 0.654 -21.425 -8.363 1.00 0.00 H new ATOM 0 HD21 ASN D 25 -1.023 -24.605 -8.179 1.00 0.00 H new ATOM 0 HD22 ASN D 25 0.409 -23.672 -7.734 1.00 0.00 H new ATOM 1643 N VAL D 26 -0.767 -19.249 -7.403 1.00 0.00 N ATOM 1644 CA VAL D 26 -1.293 -18.801 -6.123 1.00 0.00 C ATOM 1645 C VAL D 26 -2.505 -17.887 -6.328 1.00 0.00 C ATOM 1646 O VAL D 26 -3.512 -18.007 -5.630 1.00 0.00 O ATOM 1647 CB VAL D 26 -0.197 -18.069 -5.357 1.00 0.00 C ATOM 1648 CG1 VAL D 26 -0.795 -17.408 -4.116 1.00 0.00 C ATOM 1649 CG2 VAL D 26 0.876 -19.075 -4.935 1.00 0.00 C ATOM 0 H VAL D 26 0.191 -18.957 -7.595 1.00 0.00 H new ATOM 0 HA VAL D 26 -1.619 -19.667 -5.547 1.00 0.00 H new ATOM 0 HB VAL D 26 0.247 -17.303 -5.993 1.00 0.00 H new ATOM 0 HG11 VAL D 26 -0.011 -16.885 -3.569 1.00 0.00 H new ATOM 0 HG12 VAL D 26 -1.564 -16.696 -4.417 1.00 0.00 H new ATOM 0 HG13 VAL D 26 -1.238 -18.171 -3.475 1.00 0.00 H new ATOM 0 HG21 VAL D 26 1.664 -18.558 -4.386 1.00 0.00 H new ATOM 0 HG22 VAL D 26 0.429 -19.837 -4.297 1.00 0.00 H new ATOM 0 HG23 VAL D 26 1.301 -19.547 -5.821 1.00 0.00 H new ATOM 1659 N LYS D 27 -2.408 -16.978 -7.294 1.00 0.00 N ATOM 1660 CA LYS D 27 -3.515 -16.065 -7.575 1.00 0.00 C ATOM 1661 C LYS D 27 -4.748 -16.856 -7.992 1.00 0.00 C ATOM 1662 O LYS D 27 -5.870 -16.539 -7.602 1.00 0.00 O ATOM 1663 CB LYS D 27 -3.122 -15.086 -8.687 1.00 0.00 C ATOM 1664 CG LYS D 27 -2.084 -14.106 -8.143 1.00 0.00 C ATOM 1665 CD LYS D 27 -1.786 -13.021 -9.181 1.00 0.00 C ATOM 1666 CE LYS D 27 -1.000 -13.620 -10.351 1.00 0.00 C ATOM 1667 NZ LYS D 27 -0.631 -12.533 -11.302 1.00 0.00 N1+ ATOM 0 H LYS D 27 -1.588 -16.853 -7.888 1.00 0.00 H new ATOM 0 HA LYS D 27 -3.743 -15.500 -6.671 1.00 0.00 H new ATOM 0 HB2 LYS D 27 -2.716 -15.629 -9.541 1.00 0.00 H new ATOM 0 HB3 LYS D 27 -4.000 -14.546 -9.041 1.00 0.00 H new ATOM 0 HG2 LYS D 27 -2.451 -13.649 -7.224 1.00 0.00 H new ATOM 0 HG3 LYS D 27 -1.167 -14.639 -7.890 1.00 0.00 H new ATOM 0 HD2 LYS D 27 -2.718 -12.586 -9.542 1.00 0.00 H new ATOM 0 HD3 LYS D 27 -1.214 -12.214 -8.723 1.00 0.00 H new ATOM 0 HE2 LYS D 27 -0.103 -14.119 -9.984 1.00 0.00 H new ATOM 0 HE3 LYS D 27 -1.600 -14.375 -10.859 1.00 0.00 H new ATOM 0 HZ1 LYS D 27 -0.097 -12.935 -12.099 1.00 0.00 H new ATOM 0 HZ2 LYS D 27 -1.494 -12.077 -11.659 1.00 0.00 H new ATOM 0 HZ3 LYS D 27 -0.044 -11.828 -10.812 1.00 0.00 H new ATOM 1681 N ALA D 28 -4.533 -17.900 -8.776 1.00 0.00 N ATOM 1682 CA ALA D 28 -5.634 -18.739 -9.214 1.00 0.00 C ATOM 1683 C ALA D 28 -6.307 -19.372 -8.007 1.00 0.00 C ATOM 1684 O ALA D 28 -7.529 -19.481 -7.954 1.00 0.00 O ATOM 1685 CB ALA D 28 -5.119 -19.838 -10.132 1.00 0.00 C ATOM 0 H ALA D 28 -3.615 -18.184 -9.119 1.00 0.00 H new ATOM 0 HA ALA D 28 -6.352 -18.123 -9.755 1.00 0.00 H new ATOM 0 HB1 ALA D 28 -5.952 -20.462 -10.455 1.00 0.00 H new ATOM 0 HB2 ALA D 28 -4.642 -19.390 -11.004 1.00 0.00 H new ATOM 0 HB3 ALA D 28 -4.394 -20.450 -9.596 1.00 0.00 H new ATOM 1691 N LYS D 29 -5.502 -19.779 -7.031 1.00 0.00 N ATOM 1692 CA LYS D 29 -6.048 -20.386 -5.828 1.00 0.00 C ATOM 1693 C LYS D 29 -6.972 -19.390 -5.159 1.00 0.00 C ATOM 1694 O LYS D 29 -8.025 -19.750 -4.649 1.00 0.00 O ATOM 1695 CB LYS D 29 -4.940 -20.799 -4.860 1.00 0.00 C ATOM 1696 CG LYS D 29 -4.190 -21.988 -5.443 1.00 0.00 C ATOM 1697 CD LYS D 29 -3.066 -22.396 -4.500 1.00 0.00 C ATOM 1698 CE LYS D 29 -2.338 -23.583 -5.108 1.00 0.00 C ATOM 1699 NZ LYS D 29 -3.216 -24.783 -5.046 1.00 0.00 N1+ ATOM 0 H LYS D 29 -4.485 -19.700 -7.050 1.00 0.00 H new ATOM 0 HA LYS D 29 -6.597 -21.286 -6.105 1.00 0.00 H new ATOM 0 HB2 LYS D 29 -4.256 -19.967 -4.694 1.00 0.00 H new ATOM 0 HB3 LYS D 29 -5.365 -21.060 -3.891 1.00 0.00 H new ATOM 0 HG2 LYS D 29 -4.874 -22.824 -5.593 1.00 0.00 H new ATOM 0 HG3 LYS D 29 -3.782 -21.730 -6.420 1.00 0.00 H new ATOM 0 HD2 LYS D 29 -2.377 -21.565 -4.349 1.00 0.00 H new ATOM 0 HD3 LYS D 29 -3.468 -22.658 -3.521 1.00 0.00 H new ATOM 0 HE2 LYS D 29 -2.069 -23.368 -6.142 1.00 0.00 H new ATOM 0 HE3 LYS D 29 -1.409 -23.770 -4.569 1.00 0.00 H new ATOM 0 HZ1 LYS D 29 -2.637 -25.642 -5.134 1.00 0.00 H new ATOM 0 HZ2 LYS D 29 -3.720 -24.798 -4.137 1.00 0.00 H new ATOM 0 HZ3 LYS D 29 -3.906 -24.749 -5.824 1.00 0.00 H new ATOM 1713 N ILE D 30 -6.581 -18.123 -5.193 1.00 0.00 N ATOM 1714 CA ILE D 30 -7.415 -17.076 -4.609 1.00 0.00 C ATOM 1715 C ILE D 30 -8.744 -16.997 -5.349 1.00 0.00 C ATOM 1716 O ILE D 30 -9.808 -16.846 -4.747 1.00 0.00 O ATOM 1717 CB ILE D 30 -6.704 -15.715 -4.640 1.00 0.00 C ATOM 1718 CG1 ILE D 30 -5.616 -15.699 -3.571 1.00 0.00 C ATOM 1719 CG2 ILE D 30 -7.714 -14.593 -4.356 1.00 0.00 C ATOM 1720 CD1 ILE D 30 -6.254 -15.421 -2.213 1.00 0.00 C ATOM 0 H ILE D 30 -5.709 -17.797 -5.610 1.00 0.00 H new ATOM 0 HA ILE D 30 -7.601 -17.331 -3.566 1.00 0.00 H new ATOM 0 HB ILE D 30 -6.262 -15.557 -5.624 1.00 0.00 H new ATOM 0 HG12 ILE D 30 -5.093 -16.655 -3.552 1.00 0.00 H new ATOM 0 HG13 ILE D 30 -4.874 -14.935 -3.801 1.00 0.00 H new ATOM 0 HG21 ILE D 30 -7.204 -13.630 -4.379 1.00 0.00 H new ATOM 0 HG22 ILE D 30 -8.497 -14.608 -5.114 1.00 0.00 H new ATOM 0 HG23 ILE D 30 -8.159 -14.744 -3.372 1.00 0.00 H new ATOM 0 HD11 ILE D 30 -5.482 -15.408 -1.444 1.00 0.00 H new ATOM 0 HD12 ILE D 30 -6.757 -14.454 -2.238 1.00 0.00 H new ATOM 0 HD13 ILE D 30 -6.980 -16.202 -1.985 1.00 0.00 H new ATOM 1732 N GLN D 31 -8.679 -17.095 -6.662 1.00 0.00 N ATOM 1733 CA GLN D 31 -9.887 -17.032 -7.464 1.00 0.00 C ATOM 1734 C GLN D 31 -10.838 -18.188 -7.117 1.00 0.00 C ATOM 1735 O GLN D 31 -12.034 -17.993 -6.963 1.00 0.00 O ATOM 1736 CB GLN D 31 -9.524 -17.083 -8.947 1.00 0.00 C ATOM 1737 CG GLN D 31 -10.795 -16.943 -9.780 1.00 0.00 C ATOM 1738 CD GLN D 31 -10.445 -16.818 -11.256 1.00 0.00 C ATOM 1739 OE1 GLN D 31 -9.426 -17.343 -11.701 1.00 0.00 O ATOM 1740 NE2 GLN D 31 -11.237 -16.146 -12.046 1.00 0.00 N ATOM 0 H GLN D 31 -7.816 -17.217 -7.192 1.00 0.00 H new ATOM 0 HA GLN D 31 -10.397 -16.094 -7.246 1.00 0.00 H new ATOM 0 HB2 GLN D 31 -8.825 -16.282 -9.190 1.00 0.00 H new ATOM 0 HB3 GLN D 31 -9.024 -18.024 -9.179 1.00 0.00 H new ATOM 0 HG2 GLN D 31 -11.438 -17.809 -9.623 1.00 0.00 H new ATOM 0 HG3 GLN D 31 -11.356 -16.066 -9.456 1.00 0.00 H new ATOM 0 HE21 GLN D 31 -12.081 -15.712 -11.673 1.00 0.00 H new ATOM 0 HE22 GLN D 31 -11.012 -16.055 -13.037 1.00 0.00 H new ATOM 1749 N ASP D 32 -10.300 -19.390 -6.994 1.00 0.00 N ATOM 1750 CA ASP D 32 -11.124 -20.558 -6.678 1.00 0.00 C ATOM 1751 C ASP D 32 -11.632 -20.530 -5.230 1.00 0.00 C ATOM 1752 O ASP D 32 -12.602 -21.210 -4.896 1.00 0.00 O ATOM 1753 CB ASP D 32 -10.314 -21.830 -6.928 1.00 0.00 C ATOM 1754 CG ASP D 32 -10.104 -22.008 -8.429 1.00 0.00 C ATOM 1755 OD1 ASP D 32 -10.805 -21.355 -9.185 1.00 0.00 O ATOM 1756 OD2 ASP D 32 -9.244 -22.788 -8.800 1.00 0.00 O1- ATOM 0 H ASP D 32 -9.306 -19.588 -7.106 1.00 0.00 H new ATOM 0 HA ASP D 32 -12.000 -20.540 -7.327 1.00 0.00 H new ATOM 0 HB2 ASP D 32 -9.352 -21.768 -6.420 1.00 0.00 H new ATOM 0 HB3 ASP D 32 -10.836 -22.694 -6.517 1.00 0.00 H new ATOM 1761 N LYS D 33 -10.967 -19.757 -4.376 1.00 0.00 N ATOM 1762 CA LYS D 33 -11.357 -19.665 -2.966 1.00 0.00 C ATOM 1763 C LYS D 33 -12.142 -18.385 -2.662 1.00 0.00 C ATOM 1764 O LYS D 33 -12.627 -18.212 -1.545 1.00 0.00 O ATOM 1765 CB LYS D 33 -10.112 -19.683 -2.080 1.00 0.00 C ATOM 1766 CG LYS D 33 -9.793 -21.109 -1.631 1.00 0.00 C ATOM 1767 CD LYS D 33 -9.543 -21.104 -0.123 1.00 0.00 C ATOM 1768 CE LYS D 33 -9.210 -22.519 0.345 1.00 0.00 C ATOM 1769 NZ LYS D 33 -10.456 -23.337 0.381 1.00 0.00 N1+ ATOM 0 H LYS D 33 -10.160 -19.187 -4.630 1.00 0.00 H new ATOM 0 HA LYS D 33 -11.997 -20.522 -2.759 1.00 0.00 H new ATOM 0 HB2 LYS D 33 -9.264 -19.269 -2.626 1.00 0.00 H new ATOM 0 HB3 LYS D 33 -10.270 -19.048 -1.208 1.00 0.00 H new ATOM 0 HG2 LYS D 33 -10.620 -21.776 -1.875 1.00 0.00 H new ATOM 0 HG3 LYS D 33 -8.916 -21.484 -2.158 1.00 0.00 H new ATOM 0 HD2 LYS D 33 -8.723 -20.428 0.118 1.00 0.00 H new ATOM 0 HD3 LYS D 33 -10.425 -20.735 0.401 1.00 0.00 H new ATOM 0 HE2 LYS D 33 -8.483 -22.974 -0.327 1.00 0.00 H new ATOM 0 HE3 LYS D 33 -8.754 -22.488 1.334 1.00 0.00 H new ATOM 0 HZ1 LYS D 33 -10.260 -24.249 0.841 1.00 0.00 H new ATOM 0 HZ2 LYS D 33 -11.189 -22.830 0.916 1.00 0.00 H new ATOM 0 HZ3 LYS D 33 -10.790 -23.504 -0.590 1.00 0.00 H new ATOM 1783 N GLU D 34 -12.259 -17.489 -3.636 1.00 0.00 N ATOM 1784 CA GLU D 34 -12.983 -16.238 -3.414 1.00 0.00 C ATOM 1785 C GLU D 34 -13.704 -15.819 -4.678 1.00 0.00 C ATOM 1786 O GLU D 34 -14.863 -15.401 -4.645 1.00 0.00 O ATOM 1787 CB GLU D 34 -12.010 -15.136 -3.007 1.00 0.00 C ATOM 1788 CG GLU D 34 -11.636 -15.299 -1.538 1.00 0.00 C ATOM 1789 CD GLU D 34 -12.833 -14.956 -0.658 1.00 0.00 C ATOM 1790 OE1 GLU D 34 -13.764 -14.356 -1.168 1.00 0.00 O ATOM 1791 OE2 GLU D 34 -12.800 -15.299 0.512 1.00 0.00 O1- ATOM 0 H GLU D 34 -11.870 -17.600 -4.572 1.00 0.00 H new ATOM 0 HA GLU D 34 -13.710 -16.397 -2.618 1.00 0.00 H new ATOM 0 HB2 GLU D 34 -11.115 -15.180 -3.627 1.00 0.00 H new ATOM 0 HB3 GLU D 34 -12.463 -14.158 -3.171 1.00 0.00 H new ATOM 0 HG2 GLU D 34 -11.314 -16.323 -1.347 1.00 0.00 H new ATOM 0 HG3 GLU D 34 -10.795 -14.650 -1.293 1.00 0.00 H new ATOM 1798 N GLY D 35 -13.003 -15.937 -5.792 1.00 0.00 N ATOM 1799 CA GLY D 35 -13.574 -15.568 -7.078 1.00 0.00 C ATOM 1800 C GLY D 35 -12.904 -14.324 -7.639 1.00 0.00 C ATOM 1801 O GLY D 35 -13.415 -13.704 -8.570 1.00 0.00 O ATOM 0 H GLY D 35 -12.044 -16.283 -5.834 1.00 0.00 H new ATOM 0 HA2 GLY D 35 -13.460 -16.394 -7.780 1.00 0.00 H new ATOM 0 HA3 GLY D 35 -14.644 -15.390 -6.967 1.00 0.00 H new ATOM 1805 N ILE D 36 -11.764 -13.950 -7.067 1.00 0.00 N ATOM 1806 CA ILE D 36 -11.066 -12.769 -7.536 1.00 0.00 C ATOM 1807 C ILE D 36 -10.107 -13.132 -8.686 1.00 0.00 C ATOM 1808 O ILE D 36 -9.190 -13.925 -8.480 1.00 0.00 O ATOM 1809 CB ILE D 36 -10.259 -12.146 -6.401 1.00 0.00 C ATOM 1810 CG1 ILE D 36 -11.188 -11.891 -5.207 1.00 0.00 C ATOM 1811 CG2 ILE D 36 -9.678 -10.826 -6.912 1.00 0.00 C ATOM 1812 CD1 ILE D 36 -10.386 -11.358 -4.023 1.00 0.00 C ATOM 0 H ILE D 36 -11.315 -14.440 -6.293 1.00 0.00 H new ATOM 0 HA ILE D 36 -11.810 -12.056 -7.892 1.00 0.00 H new ATOM 0 HB ILE D 36 -9.454 -12.808 -6.081 1.00 0.00 H new ATOM 0 HG12 ILE D 36 -11.961 -11.175 -5.484 1.00 0.00 H new ATOM 0 HG13 ILE D 36 -11.695 -12.814 -4.927 1.00 0.00 H new ATOM 0 HG21 ILE D 36 -9.094 -10.355 -6.121 1.00 0.00 H new ATOM 0 HG22 ILE D 36 -9.036 -11.020 -7.771 1.00 0.00 H new ATOM 0 HG23 ILE D 36 -10.490 -10.162 -7.208 1.00 0.00 H new ATOM 0 HD11 ILE D 36 -11.055 -11.180 -3.181 1.00 0.00 H new ATOM 0 HD12 ILE D 36 -9.629 -12.089 -3.738 1.00 0.00 H new ATOM 0 HD13 ILE D 36 -9.900 -10.424 -4.304 1.00 0.00 H new ATOM 1824 N PRO D 37 -10.275 -12.582 -9.872 1.00 0.00 N ATOM 1825 CA PRO D 37 -9.368 -12.889 -11.018 1.00 0.00 C ATOM 1826 C PRO D 37 -7.998 -12.223 -10.858 1.00 0.00 C ATOM 1827 O PRO D 37 -7.857 -11.268 -10.094 1.00 0.00 O ATOM 1828 CB PRO D 37 -10.120 -12.340 -12.230 1.00 0.00 C ATOM 1829 CG PRO D 37 -10.951 -11.227 -11.691 1.00 0.00 C ATOM 1830 CD PRO D 37 -11.323 -11.620 -10.259 1.00 0.00 C ATOM 0 HA PRO D 37 -9.150 -13.954 -11.102 1.00 0.00 H new ATOM 0 HB2 PRO D 37 -9.430 -11.984 -12.995 1.00 0.00 H new ATOM 0 HB3 PRO D 37 -10.740 -13.108 -12.692 1.00 0.00 H new ATOM 0 HG2 PRO D 37 -10.398 -10.288 -11.705 1.00 0.00 H new ATOM 0 HG3 PRO D 37 -11.844 -11.080 -12.298 1.00 0.00 H new ATOM 0 HD2 PRO D 37 -11.335 -10.754 -9.597 1.00 0.00 H new ATOM 0 HD3 PRO D 37 -12.315 -12.070 -10.213 1.00 0.00 H new ATOM 1838 N PRO D 38 -6.993 -12.702 -11.548 1.00 0.00 N ATOM 1839 CA PRO D 38 -5.613 -12.132 -11.456 1.00 0.00 C ATOM 1840 C PRO D 38 -5.573 -10.653 -11.833 1.00 0.00 C ATOM 1841 O PRO D 38 -4.654 -9.930 -11.449 1.00 0.00 O ATOM 1842 CB PRO D 38 -4.794 -12.973 -12.442 1.00 0.00 C ATOM 1843 CG PRO D 38 -5.581 -14.221 -12.652 1.00 0.00 C ATOM 1844 CD PRO D 38 -7.045 -13.832 -12.493 1.00 0.00 C ATOM 0 HA PRO D 38 -5.226 -12.174 -10.438 1.00 0.00 H new ATOM 0 HB2 PRO D 38 -4.644 -12.441 -13.381 1.00 0.00 H new ATOM 0 HB3 PRO D 38 -3.805 -13.196 -12.041 1.00 0.00 H new ATOM 0 HG2 PRO D 38 -5.394 -14.637 -13.642 1.00 0.00 H new ATOM 0 HG3 PRO D 38 -5.300 -14.985 -11.927 1.00 0.00 H new ATOM 0 HD2 PRO D 38 -7.490 -13.541 -13.445 1.00 0.00 H new ATOM 0 HD3 PRO D 38 -7.641 -14.657 -12.102 1.00 0.00 H new ATOM 1852 N ASP D 39 -6.570 -10.212 -12.594 1.00 0.00 N ATOM 1853 CA ASP D 39 -6.634 -8.817 -13.024 1.00 0.00 C ATOM 1854 C ASP D 39 -7.354 -7.943 -11.988 1.00 0.00 C ATOM 1855 O ASP D 39 -7.522 -6.742 -12.196 1.00 0.00 O ATOM 1856 CB ASP D 39 -7.354 -8.722 -14.370 1.00 0.00 C ATOM 1857 CG ASP D 39 -6.480 -9.325 -15.467 1.00 0.00 C ATOM 1858 OD1 ASP D 39 -5.303 -9.522 -15.217 1.00 0.00 O ATOM 1859 OD2 ASP D 39 -7.003 -9.585 -16.539 1.00 0.00 O1- ATOM 0 H ASP D 39 -7.340 -10.794 -12.924 1.00 0.00 H new ATOM 0 HA ASP D 39 -5.613 -8.449 -13.126 1.00 0.00 H new ATOM 0 HB2 ASP D 39 -8.307 -9.249 -14.321 1.00 0.00 H new ATOM 0 HB3 ASP D 39 -7.577 -7.680 -14.601 1.00 0.00 H new ATOM 1864 N GLN D 40 -7.777 -8.545 -10.875 1.00 0.00 N ATOM 1865 CA GLN D 40 -8.469 -7.799 -9.826 1.00 0.00 C ATOM 1866 C GLN D 40 -7.787 -8.010 -8.480 1.00 0.00 C ATOM 1867 O GLN D 40 -8.395 -7.810 -7.429 1.00 0.00 O ATOM 1868 CB GLN D 40 -9.923 -8.262 -9.743 1.00 0.00 C ATOM 1869 CG GLN D 40 -10.781 -7.178 -9.089 1.00 0.00 C ATOM 1870 CD GLN D 40 -12.257 -7.551 -9.205 1.00 0.00 C ATOM 1871 OE1 GLN D 40 -12.591 -8.732 -9.294 1.00 0.00 O ATOM 1872 NE2 GLN D 40 -13.163 -6.611 -9.217 1.00 0.00 N ATOM 0 H GLN D 40 -7.653 -9.538 -10.679 1.00 0.00 H new ATOM 0 HA GLN D 40 -8.435 -6.737 -10.071 1.00 0.00 H new ATOM 0 HB2 GLN D 40 -10.300 -8.483 -10.741 1.00 0.00 H new ATOM 0 HB3 GLN D 40 -9.987 -9.185 -9.167 1.00 0.00 H new ATOM 0 HG2 GLN D 40 -10.506 -7.066 -8.040 1.00 0.00 H new ATOM 0 HG3 GLN D 40 -10.600 -6.217 -9.571 1.00 0.00 H new ATOM 0 HE21 GLN D 40 -12.884 -5.633 -9.143 1.00 0.00 H new ATOM 0 HE22 GLN D 40 -14.150 -6.855 -9.300 1.00 0.00 H new ATOM 1881 N GLN D 41 -6.520 -8.415 -8.516 1.00 0.00 N ATOM 1882 CA GLN D 41 -5.780 -8.642 -7.286 1.00 0.00 C ATOM 1883 C GLN D 41 -4.282 -8.673 -7.543 1.00 0.00 C ATOM 1884 O GLN D 41 -3.832 -8.991 -8.643 1.00 0.00 O ATOM 1885 CB GLN D 41 -6.197 -9.965 -6.667 1.00 0.00 C ATOM 1886 CG GLN D 41 -5.806 -11.087 -7.615 1.00 0.00 C ATOM 1887 CD GLN D 41 -6.420 -12.402 -7.159 1.00 0.00 C ATOM 1888 OE1 GLN D 41 -6.986 -12.476 -6.070 1.00 0.00 O ATOM 1889 NE2 GLN D 41 -6.344 -13.449 -7.933 1.00 0.00 N ATOM 0 H GLN D 41 -5.994 -8.590 -9.372 1.00 0.00 H new ATOM 0 HA GLN D 41 -6.005 -7.820 -6.606 1.00 0.00 H new ATOM 0 HB2 GLN D 41 -5.712 -10.100 -5.700 1.00 0.00 H new ATOM 0 HB3 GLN D 41 -7.272 -9.977 -6.489 1.00 0.00 H new ATOM 0 HG2 GLN D 41 -6.142 -10.852 -8.625 1.00 0.00 H new ATOM 0 HG3 GLN D 41 -4.721 -11.178 -7.653 1.00 0.00 H new ATOM 0 HE21 GLN D 41 -5.874 -13.383 -8.836 1.00 0.00 H new ATOM 0 HE22 GLN D 41 -6.755 -14.334 -7.636 1.00 0.00 H new ATOM 1898 N ARG D 42 -3.519 -8.359 -6.509 1.00 0.00 N ATOM 1899 CA ARG D 42 -2.071 -8.370 -6.606 1.00 0.00 C ATOM 1900 C ARG D 42 -1.480 -9.032 -5.370 1.00 0.00 C ATOM 1901 O ARG D 42 -1.862 -8.711 -4.240 1.00 0.00 O ATOM 1902 CB ARG D 42 -1.539 -6.940 -6.740 1.00 0.00 C ATOM 1903 CG ARG D 42 -1.938 -6.370 -8.104 1.00 0.00 C ATOM 1904 CD ARG D 42 -1.455 -4.920 -8.222 1.00 0.00 C ATOM 1905 NE ARG D 42 -1.812 -4.376 -9.530 1.00 0.00 N ATOM 1906 CZ ARG D 42 -1.520 -3.117 -9.872 1.00 0.00 C ATOM 1907 NH1 ARG D 42 -0.916 -2.316 -9.029 1.00 0.00 N1+ ATOM 1908 NH2 ARG D 42 -1.832 -2.682 -11.064 1.00 0.00 N ATOM 0 H ARG D 42 -3.880 -8.093 -5.593 1.00 0.00 H new ATOM 0 HA ARG D 42 -1.778 -8.936 -7.491 1.00 0.00 H new ATOM 0 HB2 ARG D 42 -1.940 -6.315 -5.942 1.00 0.00 H new ATOM 0 HB3 ARG D 42 -0.454 -6.933 -6.635 1.00 0.00 H new ATOM 0 HG2 ARG D 42 -1.504 -6.973 -8.902 1.00 0.00 H new ATOM 0 HG3 ARG D 42 -3.021 -6.413 -8.224 1.00 0.00 H new ATOM 0 HD2 ARG D 42 -1.902 -4.314 -7.434 1.00 0.00 H new ATOM 0 HD3 ARG D 42 -0.375 -4.876 -8.084 1.00 0.00 H new ATOM 0 HE ARG D 42 -2.297 -4.973 -10.200 1.00 0.00 H new ATOM 0 HH11 ARG D 42 -0.663 -2.651 -8.099 1.00 0.00 H new ATOM 0 HH12 ARG D 42 -0.699 -1.358 -9.302 1.00 0.00 H new ATOM 0 HH21 ARG D 42 -2.296 -3.302 -11.728 1.00 0.00 H new ATOM 0 HH22 ARG D 42 -1.612 -1.722 -11.331 1.00 0.00 H new ATOM 1922 N LEU D 43 -0.548 -9.948 -5.593 1.00 0.00 N ATOM 1923 CA LEU D 43 0.104 -10.655 -4.498 1.00 0.00 C ATOM 1924 C LEU D 43 1.365 -9.904 -4.085 1.00 0.00 C ATOM 1925 O LEU D 43 2.247 -9.671 -4.908 1.00 0.00 O ATOM 1926 CB LEU D 43 0.471 -12.069 -4.956 1.00 0.00 C ATOM 1927 CG LEU D 43 -0.637 -13.051 -4.565 1.00 0.00 C ATOM 1928 CD1 LEU D 43 -2.002 -12.485 -4.958 1.00 0.00 C ATOM 1929 CD2 LEU D 43 -0.416 -14.379 -5.292 1.00 0.00 C ATOM 0 H LEU D 43 -0.226 -10.219 -6.522 1.00 0.00 H new ATOM 0 HA LEU D 43 -0.573 -10.714 -3.646 1.00 0.00 H new ATOM 0 HB2 LEU D 43 0.617 -12.084 -6.036 1.00 0.00 H new ATOM 0 HB3 LEU D 43 1.414 -12.373 -4.503 1.00 0.00 H new ATOM 0 HG LEU D 43 -0.610 -13.208 -3.487 1.00 0.00 H new ATOM 0 HD11 LEU D 43 -2.783 -13.191 -4.676 1.00 0.00 H new ATOM 0 HD12 LEU D 43 -2.165 -11.538 -4.443 1.00 0.00 H new ATOM 0 HD13 LEU D 43 -2.032 -12.322 -6.035 1.00 0.00 H new ATOM 0 HD21 LEU D 43 -1.203 -15.080 -5.016 1.00 0.00 H new ATOM 0 HD22 LEU D 43 -0.440 -14.213 -6.369 1.00 0.00 H new ATOM 0 HD23 LEU D 43 0.553 -14.791 -5.010 1.00 0.00 H new ATOM 1941 N ILE D 44 1.447 -9.510 -2.816 1.00 0.00 N ATOM 1942 CA ILE D 44 2.616 -8.775 -2.336 1.00 0.00 C ATOM 1943 C ILE D 44 3.181 -9.421 -1.069 1.00 0.00 C ATOM 1944 O ILE D 44 2.438 -9.738 -0.142 1.00 0.00 O ATOM 1945 CB ILE D 44 2.246 -7.316 -2.056 1.00 0.00 C ATOM 1946 CG1 ILE D 44 1.660 -6.685 -3.329 1.00 0.00 C ATOM 1947 CG2 ILE D 44 3.509 -6.558 -1.645 1.00 0.00 C ATOM 1948 CD1 ILE D 44 1.160 -5.273 -3.025 1.00 0.00 C ATOM 0 H ILE D 44 0.731 -9.683 -2.111 1.00 0.00 H new ATOM 0 HA ILE D 44 3.380 -8.807 -3.112 1.00 0.00 H new ATOM 0 HB ILE D 44 1.507 -7.266 -1.256 1.00 0.00 H new ATOM 0 HG12 ILE D 44 2.418 -6.651 -4.111 1.00 0.00 H new ATOM 0 HG13 ILE D 44 0.841 -7.297 -3.705 1.00 0.00 H new ATOM 0 HG21 ILE D 44 3.259 -5.517 -1.443 1.00 0.00 H new ATOM 0 HG22 ILE D 44 3.929 -7.011 -0.747 1.00 0.00 H new ATOM 0 HG23 ILE D 44 4.240 -6.605 -2.452 1.00 0.00 H new ATOM 0 HD11 ILE D 44 0.746 -4.831 -3.931 1.00 0.00 H new ATOM 0 HD12 ILE D 44 0.388 -5.318 -2.257 1.00 0.00 H new ATOM 0 HD13 ILE D 44 1.990 -4.662 -2.670 1.00 0.00 H new ATOM 1960 N PHE D 45 4.500 -9.626 -1.036 1.00 0.00 N ATOM 1961 CA PHE D 45 5.130 -10.247 0.129 1.00 0.00 C ATOM 1962 C PHE D 45 6.582 -9.785 0.291 1.00 0.00 C ATOM 1963 O PHE D 45 7.224 -9.369 -0.673 1.00 0.00 O ATOM 1964 CB PHE D 45 5.082 -11.768 -0.006 1.00 0.00 C ATOM 1965 CG PHE D 45 5.681 -12.403 1.224 1.00 0.00 C ATOM 1966 CD1 PHE D 45 4.935 -12.484 2.408 1.00 0.00 C ATOM 1967 CD2 PHE D 45 6.986 -12.905 1.187 1.00 0.00 C ATOM 1968 CE1 PHE D 45 5.494 -13.068 3.548 1.00 0.00 C ATOM 1969 CE2 PHE D 45 7.545 -13.491 2.327 1.00 0.00 C ATOM 1970 CZ PHE D 45 6.800 -13.574 3.508 1.00 0.00 C ATOM 0 H PHE D 45 5.142 -9.376 -1.788 1.00 0.00 H new ATOM 0 HA PHE D 45 4.577 -9.940 1.017 1.00 0.00 H new ATOM 0 HB2 PHE D 45 4.052 -12.100 -0.134 1.00 0.00 H new ATOM 0 HB3 PHE D 45 5.631 -12.082 -0.894 1.00 0.00 H new ATOM 0 HD1 PHE D 45 3.928 -12.095 2.439 1.00 0.00 H new ATOM 0 HD2 PHE D 45 7.563 -12.840 0.276 1.00 0.00 H new ATOM 0 HE1 PHE D 45 4.919 -13.129 4.460 1.00 0.00 H new ATOM 0 HE2 PHE D 45 8.552 -13.880 2.296 1.00 0.00 H new ATOM 0 HZ PHE D 45 7.231 -14.028 4.388 1.00 0.00 H new ATOM 1980 N ALA D 46 7.083 -9.849 1.528 1.00 0.00 N ATOM 1981 CA ALA D 46 8.451 -9.429 1.829 1.00 0.00 C ATOM 1982 C ALA D 46 8.588 -7.916 1.703 1.00 0.00 C ATOM 1983 O ALA D 46 9.697 -7.389 1.610 1.00 0.00 O ATOM 1984 CB ALA D 46 9.440 -10.117 0.884 1.00 0.00 C ATOM 0 H ALA D 46 6.560 -10.188 2.336 1.00 0.00 H new ATOM 0 HA ALA D 46 8.677 -9.719 2.855 1.00 0.00 H new ATOM 0 HB1 ALA D 46 10.454 -9.794 1.121 1.00 0.00 H new ATOM 0 HB2 ALA D 46 9.366 -11.198 1.004 1.00 0.00 H new ATOM 0 HB3 ALA D 46 9.205 -9.849 -0.146 1.00 0.00 H new ATOM 1990 N GLY D 47 7.454 -7.221 1.698 1.00 0.00 N ATOM 1991 CA GLY D 47 7.459 -5.770 1.583 1.00 0.00 C ATOM 1992 C GLY D 47 7.459 -5.344 0.120 1.00 0.00 C ATOM 1993 O GLY D 47 7.220 -4.183 -0.192 1.00 0.00 O ATOM 0 H GLY D 47 6.526 -7.638 1.772 1.00 0.00 H new ATOM 0 HA2 GLY D 47 6.585 -5.358 2.087 1.00 0.00 H new ATOM 0 HA3 GLY D 47 8.337 -5.364 2.085 1.00 0.00 H new ATOM 1997 N ARG D 48 7.715 -6.288 -0.776 1.00 0.00 N ATOM 1998 CA ARG D 48 7.739 -5.981 -2.194 1.00 0.00 C ATOM 1999 C ARG D 48 6.694 -6.797 -2.929 1.00 0.00 C ATOM 2000 O ARG D 48 6.401 -7.935 -2.562 1.00 0.00 O ATOM 2001 CB ARG D 48 9.122 -6.279 -2.764 1.00 0.00 C ATOM 2002 CG ARG D 48 9.442 -7.757 -2.573 1.00 0.00 C ATOM 2003 CD ARG D 48 10.836 -8.036 -3.118 1.00 0.00 C ATOM 2004 NE ARG D 48 11.185 -9.438 -2.913 1.00 0.00 N ATOM 2005 CZ ARG D 48 12.365 -9.930 -3.290 1.00 0.00 C ATOM 2006 NH1 ARG D 48 13.252 -9.166 -3.879 1.00 0.00 N1+ ATOM 2007 NH2 ARG D 48 12.641 -11.184 -3.062 1.00 0.00 N ATOM 0 H ARG D 48 7.907 -7.263 -0.546 1.00 0.00 H new ATOM 0 HA ARG D 48 7.514 -4.923 -2.327 1.00 0.00 H new ATOM 0 HB2 ARG D 48 9.154 -6.023 -3.823 1.00 0.00 H new ATOM 0 HB3 ARG D 48 9.873 -5.666 -2.265 1.00 0.00 H new ATOM 0 HG2 ARG D 48 9.391 -8.020 -1.516 1.00 0.00 H new ATOM 0 HG3 ARG D 48 8.705 -8.372 -3.090 1.00 0.00 H new ATOM 0 HD2 ARG D 48 10.874 -7.796 -4.180 1.00 0.00 H new ATOM 0 HD3 ARG D 48 11.564 -7.396 -2.620 1.00 0.00 H new ATOM 0 HE ARG D 48 10.508 -10.058 -2.469 1.00 0.00 H new ATOM 0 HH11 ARG D 48 13.043 -8.183 -4.054 1.00 0.00 H new ATOM 0 HH12 ARG D 48 14.151 -9.554 -4.163 1.00 0.00 H new ATOM 0 HH21 ARG D 48 11.956 -11.781 -2.598 1.00 0.00 H new ATOM 0 HH22 ARG D 48 13.542 -11.568 -3.347 1.00 0.00 H new ATOM 2021 N GLN D 49 6.129 -6.202 -3.966 1.00 0.00 N ATOM 2022 CA GLN D 49 5.112 -6.879 -4.738 1.00 0.00 C ATOM 2023 C GLN D 49 5.711 -8.093 -5.437 1.00 0.00 C ATOM 2024 O GLN D 49 6.860 -8.069 -5.880 1.00 0.00 O ATOM 2025 CB GLN D 49 4.501 -5.906 -5.752 1.00 0.00 C ATOM 2026 CG GLN D 49 5.536 -5.573 -6.829 1.00 0.00 C ATOM 2027 CD GLN D 49 4.979 -4.538 -7.800 1.00 0.00 C ATOM 2028 OE1 GLN D 49 3.900 -4.727 -8.362 1.00 0.00 O ATOM 2029 NE2 GLN D 49 5.659 -3.449 -8.039 1.00 0.00 N ATOM 0 H GLN D 49 6.357 -5.261 -4.287 1.00 0.00 H new ATOM 0 HA GLN D 49 4.321 -7.226 -4.074 1.00 0.00 H new ATOM 0 HB2 GLN D 49 3.615 -6.348 -6.208 1.00 0.00 H new ATOM 0 HB3 GLN D 49 4.179 -4.995 -5.249 1.00 0.00 H new ATOM 0 HG2 GLN D 49 6.445 -5.192 -6.363 1.00 0.00 H new ATOM 0 HG3 GLN D 49 5.811 -6.478 -7.371 1.00 0.00 H new ATOM 0 HE21 GLN D 49 6.553 -3.293 -7.573 1.00 0.00 H new ATOM 0 HE22 GLN D 49 5.296 -2.754 -8.692 1.00 0.00 H new ATOM 2038 N LEU D 50 4.928 -9.160 -5.508 1.00 0.00 N ATOM 2039 CA LEU D 50 5.381 -10.397 -6.126 1.00 0.00 C ATOM 2040 C LEU D 50 5.175 -10.344 -7.632 1.00 0.00 C ATOM 2041 O LEU D 50 4.044 -10.297 -8.114 1.00 0.00 O ATOM 2042 CB LEU D 50 4.581 -11.570 -5.553 1.00 0.00 C ATOM 2043 CG LEU D 50 4.704 -11.590 -4.027 1.00 0.00 C ATOM 2044 CD1 LEU D 50 3.859 -12.732 -3.463 1.00 0.00 C ATOM 2045 CD2 LEU D 50 6.164 -11.802 -3.633 1.00 0.00 C ATOM 0 H LEU D 50 3.975 -9.194 -5.145 1.00 0.00 H new ATOM 0 HA LEU D 50 6.443 -10.527 -5.917 1.00 0.00 H new ATOM 0 HB2 LEU D 50 3.533 -11.482 -5.841 1.00 0.00 H new ATOM 0 HB3 LEU D 50 4.948 -12.509 -5.968 1.00 0.00 H new ATOM 0 HG LEU D 50 4.353 -10.640 -3.625 1.00 0.00 H new ATOM 0 HD11 LEU D 50 3.946 -12.747 -2.377 1.00 0.00 H new ATOM 0 HD12 LEU D 50 2.816 -12.584 -3.741 1.00 0.00 H new ATOM 0 HD13 LEU D 50 4.212 -13.680 -3.868 1.00 0.00 H new ATOM 0 HD21 LEU D 50 6.249 -11.816 -2.546 1.00 0.00 H new ATOM 0 HD22 LEU D 50 6.516 -12.751 -4.037 1.00 0.00 H new ATOM 0 HD23 LEU D 50 6.771 -10.990 -4.034 1.00 0.00 H new ATOM 2057 N GLU D 51 6.274 -10.361 -8.373 1.00 0.00 N ATOM 2058 CA GLU D 51 6.194 -10.322 -9.825 1.00 0.00 C ATOM 2059 C GLU D 51 5.763 -11.681 -10.366 1.00 0.00 C ATOM 2060 O GLU D 51 6.057 -12.716 -9.769 1.00 0.00 O ATOM 2061 CB GLU D 51 7.551 -9.935 -10.413 1.00 0.00 C ATOM 2062 CG GLU D 51 7.954 -8.556 -9.887 1.00 0.00 C ATOM 2063 CD GLU D 51 6.985 -7.500 -10.409 1.00 0.00 C ATOM 2064 OE1 GLU D 51 6.332 -7.763 -11.405 1.00 0.00 O ATOM 2065 OE2 GLU D 51 6.909 -6.443 -9.804 1.00 0.00 O1- ATOM 0 H GLU D 51 7.221 -10.401 -7.997 1.00 0.00 H new ATOM 0 HA GLU D 51 5.454 -9.576 -10.115 1.00 0.00 H new ATOM 0 HB2 GLU D 51 8.303 -10.675 -10.140 1.00 0.00 H new ATOM 0 HB3 GLU D 51 7.498 -9.921 -11.502 1.00 0.00 H new ATOM 0 HG2 GLU D 51 7.952 -8.558 -8.797 1.00 0.00 H new ATOM 0 HG3 GLU D 51 8.970 -8.319 -10.203 1.00 0.00 H new ATOM 2072 N ASP D 52 5.066 -11.674 -11.496 1.00 0.00 N ATOM 2073 CA ASP D 52 4.606 -12.916 -12.102 1.00 0.00 C ATOM 2074 C ASP D 52 5.789 -13.683 -12.689 1.00 0.00 C ATOM 2075 O ASP D 52 6.873 -13.127 -12.855 1.00 0.00 O ATOM 2076 CB ASP D 52 3.588 -12.603 -13.203 1.00 0.00 C ATOM 2077 CG ASP D 52 4.228 -11.724 -14.275 1.00 0.00 C ATOM 2078 OD1 ASP D 52 5.397 -11.402 -14.132 1.00 0.00 O ATOM 2079 OD2 ASP D 52 3.539 -11.381 -15.221 1.00 0.00 O1- ATOM 0 H ASP D 52 4.809 -10.830 -12.007 1.00 0.00 H new ATOM 0 HA ASP D 52 4.133 -13.533 -11.338 1.00 0.00 H new ATOM 0 HB2 ASP D 52 3.227 -13.530 -13.649 1.00 0.00 H new ATOM 0 HB3 ASP D 52 2.723 -12.097 -12.776 1.00 0.00 H new ATOM 2084 N GLY D 53 5.578 -14.959 -12.998 1.00 0.00 N ATOM 2085 CA GLY D 53 6.646 -15.779 -13.559 1.00 0.00 C ATOM 2086 C GLY D 53 7.719 -16.054 -12.508 1.00 0.00 C ATOM 2087 O GLY D 53 8.885 -16.269 -12.839 1.00 0.00 O ATOM 0 H GLY D 53 4.689 -15.443 -12.871 1.00 0.00 H new ATOM 0 HA2 GLY D 53 6.236 -16.721 -13.923 1.00 0.00 H new ATOM 0 HA3 GLY D 53 7.090 -15.272 -14.416 1.00 0.00 H new ATOM 2091 N ARG D 54 7.315 -16.037 -11.242 1.00 0.00 N ATOM 2092 CA ARG D 54 8.244 -16.279 -10.144 1.00 0.00 C ATOM 2093 C ARG D 54 7.716 -17.365 -9.216 1.00 0.00 C ATOM 2094 O ARG D 54 6.513 -17.622 -9.163 1.00 0.00 O ATOM 2095 CB ARG D 54 8.448 -15.003 -9.335 1.00 0.00 C ATOM 2096 CG ARG D 54 9.048 -13.899 -10.209 1.00 0.00 C ATOM 2097 CD ARG D 54 10.527 -14.189 -10.467 1.00 0.00 C ATOM 2098 NE ARG D 54 11.112 -13.149 -11.310 1.00 0.00 N ATOM 2099 CZ ARG D 54 12.399 -13.178 -11.673 1.00 0.00 C ATOM 2100 NH1 ARG D 54 13.183 -14.149 -11.278 1.00 0.00 N1+ ATOM 2101 NH2 ARG D 54 12.880 -12.231 -12.432 1.00 0.00 N ATOM 0 H ARG D 54 6.354 -15.859 -10.951 1.00 0.00 H new ATOM 0 HA ARG D 54 9.191 -16.602 -10.576 1.00 0.00 H new ATOM 0 HB2 ARG D 54 7.495 -14.671 -8.924 1.00 0.00 H new ATOM 0 HB3 ARG D 54 9.107 -15.203 -8.490 1.00 0.00 H new ATOM 0 HG2 ARG D 54 8.510 -13.838 -11.155 1.00 0.00 H new ATOM 0 HG3 ARG D 54 8.938 -12.933 -9.717 1.00 0.00 H new ATOM 0 HD2 ARG D 54 11.064 -14.243 -9.520 1.00 0.00 H new ATOM 0 HD3 ARG D 54 10.635 -15.160 -10.950 1.00 0.00 H new ATOM 0 HE ARG D 54 10.523 -12.380 -11.630 1.00 0.00 H new ATOM 0 HH11 ARG D 54 12.814 -14.894 -10.687 1.00 0.00 H new ATOM 0 HH12 ARG D 54 14.163 -14.161 -11.561 1.00 0.00 H new ATOM 0 HH21 ARG D 54 12.275 -11.472 -12.746 1.00 0.00 H new ATOM 0 HH22 ARG D 54 13.861 -12.250 -12.711 1.00 0.00 H new ATOM 2115 N THR D 55 8.628 -17.996 -8.482 1.00 0.00 N ATOM 2116 CA THR D 55 8.246 -19.050 -7.553 1.00 0.00 C ATOM 2117 C THR D 55 8.208 -18.510 -6.128 1.00 0.00 C ATOM 2118 O THR D 55 8.799 -17.472 -5.834 1.00 0.00 O ATOM 2119 CB THR D 55 9.246 -20.204 -7.636 1.00 0.00 C ATOM 2120 OG1 THR D 55 10.491 -19.788 -7.087 1.00 0.00 O ATOM 2121 CG2 THR D 55 9.443 -20.604 -9.097 1.00 0.00 C ATOM 0 H THR D 55 9.628 -17.797 -8.513 1.00 0.00 H new ATOM 0 HA THR D 55 7.253 -19.410 -7.823 1.00 0.00 H new ATOM 0 HB THR D 55 8.865 -21.057 -7.075 1.00 0.00 H new ATOM 0 HG1 THR D 55 10.720 -20.360 -6.325 1.00 0.00 H new ATOM 0 HG21 THR D 55 10.156 -21.427 -9.156 1.00 0.00 H new ATOM 0 HG22 THR D 55 8.489 -20.919 -9.520 1.00 0.00 H new ATOM 0 HG23 THR D 55 9.825 -19.752 -9.659 1.00 0.00 H new ATOM 2129 N LEU D 56 7.512 -19.220 -5.246 1.00 0.00 N ATOM 2130 CA LEU D 56 7.409 -18.797 -3.853 1.00 0.00 C ATOM 2131 C LEU D 56 8.777 -18.785 -3.188 1.00 0.00 C ATOM 2132 O LEU D 56 9.093 -17.879 -2.418 1.00 0.00 O ATOM 2133 CB LEU D 56 6.478 -19.733 -3.088 1.00 0.00 C ATOM 2134 CG LEU D 56 5.075 -19.135 -3.063 1.00 0.00 C ATOM 2135 CD1 LEU D 56 4.504 -19.110 -4.481 1.00 0.00 C ATOM 2136 CD2 LEU D 56 4.189 -19.980 -2.147 1.00 0.00 C ATOM 0 H LEU D 56 7.015 -20.083 -5.467 1.00 0.00 H new ATOM 0 HA LEU D 56 7.003 -17.786 -3.835 1.00 0.00 H new ATOM 0 HB2 LEU D 56 6.460 -20.714 -3.562 1.00 0.00 H new ATOM 0 HB3 LEU D 56 6.843 -19.877 -2.071 1.00 0.00 H new ATOM 0 HG LEU D 56 5.111 -18.114 -2.684 1.00 0.00 H new ATOM 0 HD11 LEU D 56 3.501 -18.683 -4.462 1.00 0.00 H new ATOM 0 HD12 LEU D 56 5.145 -18.503 -5.121 1.00 0.00 H new ATOM 0 HD13 LEU D 56 4.458 -20.126 -4.873 1.00 0.00 H new ATOM 0 HD21 LEU D 56 3.184 -19.559 -2.124 1.00 0.00 H new ATOM 0 HD22 LEU D 56 4.146 -21.002 -2.524 1.00 0.00 H new ATOM 0 HD23 LEU D 56 4.605 -19.982 -1.139 1.00 0.00 H new ATOM 2148 N SER D 57 9.583 -19.793 -3.490 1.00 0.00 N ATOM 2149 CA SER D 57 10.915 -19.885 -2.914 1.00 0.00 C ATOM 2150 C SER D 57 11.761 -18.692 -3.350 1.00 0.00 C ATOM 2151 O SER D 57 12.720 -18.321 -2.675 1.00 0.00 O ATOM 2152 CB SER D 57 11.582 -21.184 -3.358 1.00 0.00 C ATOM 2153 OG SER D 57 11.771 -21.157 -4.767 1.00 0.00 O ATOM 0 H SER D 57 9.340 -20.553 -4.126 1.00 0.00 H new ATOM 0 HA SER D 57 10.831 -19.878 -1.827 1.00 0.00 H new ATOM 0 HB2 SER D 57 12.540 -21.305 -2.853 1.00 0.00 H new ATOM 0 HB3 SER D 57 10.964 -22.038 -3.079 1.00 0.00 H new ATOM 0 HG SER D 57 12.201 -21.989 -5.055 1.00 0.00 H new ATOM 2159 N ASP D 58 11.392 -18.089 -4.477 1.00 0.00 N ATOM 2160 CA ASP D 58 12.119 -16.933 -4.983 1.00 0.00 C ATOM 2161 C ASP D 58 12.019 -15.783 -3.991 1.00 0.00 C ATOM 2162 O ASP D 58 12.977 -15.039 -3.781 1.00 0.00 O ATOM 2163 CB ASP D 58 11.562 -16.506 -6.339 1.00 0.00 C ATOM 2164 CG ASP D 58 12.499 -15.487 -6.982 1.00 0.00 C ATOM 2165 OD1 ASP D 58 13.257 -14.865 -6.256 1.00 0.00 O ATOM 2166 OD2 ASP D 58 12.460 -15.359 -8.191 1.00 0.00 O1- ATOM 0 H ASP D 58 10.601 -18.380 -5.051 1.00 0.00 H new ATOM 0 HA ASP D 58 13.167 -17.205 -5.108 1.00 0.00 H new ATOM 0 HB2 ASP D 58 11.453 -17.375 -6.988 1.00 0.00 H new ATOM 0 HB3 ASP D 58 10.569 -16.074 -6.215 1.00 0.00 H new ATOM 2171 N TYR D 59 10.849 -15.651 -3.386 1.00 0.00 N ATOM 2172 CA TYR D 59 10.603 -14.593 -2.415 1.00 0.00 C ATOM 2173 C TYR D 59 10.749 -15.108 -0.986 1.00 0.00 C ATOM 2174 O TYR D 59 10.338 -14.444 -0.034 1.00 0.00 O ATOM 2175 CB TYR D 59 9.198 -14.044 -2.624 1.00 0.00 C ATOM 2176 CG TYR D 59 9.160 -13.298 -3.932 1.00 0.00 C ATOM 2177 CD1 TYR D 59 9.000 -13.997 -5.136 1.00 0.00 C ATOM 2178 CD2 TYR D 59 9.279 -11.905 -3.943 1.00 0.00 C ATOM 2179 CE1 TYR D 59 8.961 -13.303 -6.338 1.00 0.00 C ATOM 2180 CE2 TYR D 59 9.238 -11.209 -5.155 1.00 0.00 C ATOM 2181 CZ TYR D 59 9.079 -11.909 -6.355 1.00 0.00 C ATOM 2182 OH TYR D 59 9.036 -11.227 -7.552 1.00 0.00 O ATOM 0 H TYR D 59 10.051 -16.265 -3.550 1.00 0.00 H new ATOM 0 HA TYR D 59 11.341 -13.805 -2.564 1.00 0.00 H new ATOM 0 HB2 TYR D 59 8.472 -14.857 -2.632 1.00 0.00 H new ATOM 0 HB3 TYR D 59 8.925 -13.381 -1.803 1.00 0.00 H new ATOM 0 HD1 TYR D 59 8.907 -15.073 -5.129 1.00 0.00 H new ATOM 0 HD2 TYR D 59 9.403 -11.366 -3.015 1.00 0.00 H new ATOM 0 HE1 TYR D 59 8.839 -13.843 -7.266 1.00 0.00 H new ATOM 0 HE2 TYR D 59 9.329 -10.133 -5.164 1.00 0.00 H new ATOM 0 HH TYR D 59 9.131 -10.266 -7.385 1.00 0.00 H new ATOM 2192 N ASN D 60 11.334 -16.292 -0.840 1.00 0.00 N ATOM 2193 CA ASN D 60 11.522 -16.879 0.477 1.00 0.00 C ATOM 2194 C ASN D 60 10.185 -17.011 1.201 1.00 0.00 C ATOM 2195 O ASN D 60 10.094 -16.768 2.406 1.00 0.00 O ATOM 2196 CB ASN D 60 12.477 -16.013 1.304 1.00 0.00 C ATOM 2197 CG ASN D 60 13.835 -15.931 0.612 1.00 0.00 C ATOM 2198 OD1 ASN D 60 14.321 -16.928 0.081 1.00 0.00 O ATOM 2199 ND2 ASN D 60 14.480 -14.797 0.589 1.00 0.00 N ATOM 0 H ASN D 60 11.683 -16.859 -1.613 1.00 0.00 H new ATOM 0 HA ASN D 60 11.952 -17.873 0.355 1.00 0.00 H new ATOM 0 HB2 ASN D 60 12.061 -15.013 1.427 1.00 0.00 H new ATOM 0 HB3 ASN D 60 12.593 -16.435 2.302 1.00 0.00 H new ATOM 0 HD21 ASN D 60 15.389 -14.736 0.130 1.00 0.00 H new ATOM 0 HD22 ASN D 60 14.075 -13.971 1.030 1.00 0.00 H new ATOM 2206 N ILE D 61 9.152 -17.405 0.460 1.00 0.00 N ATOM 2207 CA ILE D 61 7.827 -17.575 1.047 1.00 0.00 C ATOM 2208 C ILE D 61 7.697 -18.970 1.644 1.00 0.00 C ATOM 2209 O ILE D 61 7.432 -19.943 0.937 1.00 0.00 O ATOM 2210 CB ILE D 61 6.752 -17.344 -0.021 1.00 0.00 C ATOM 2211 CG1 ILE D 61 6.849 -15.884 -0.487 1.00 0.00 C ATOM 2212 CG2 ILE D 61 5.373 -17.607 0.592 1.00 0.00 C ATOM 2213 CD1 ILE D 61 6.147 -15.697 -1.833 1.00 0.00 C ATOM 0 H ILE D 61 9.206 -17.610 -0.538 1.00 0.00 H new ATOM 0 HA ILE D 61 7.690 -16.844 1.844 1.00 0.00 H new ATOM 0 HB ILE D 61 6.897 -18.015 -0.868 1.00 0.00 H new ATOM 0 HG12 ILE D 61 6.398 -15.229 0.258 1.00 0.00 H new ATOM 0 HG13 ILE D 61 7.896 -15.594 -0.574 1.00 0.00 H new ATOM 0 HG21 ILE D 61 4.603 -17.445 -0.162 1.00 0.00 H new ATOM 0 HG22 ILE D 61 5.323 -18.637 0.946 1.00 0.00 H new ATOM 0 HG23 ILE D 61 5.211 -16.927 1.428 1.00 0.00 H new ATOM 0 HD11 ILE D 61 6.228 -14.655 -2.144 1.00 0.00 H new ATOM 0 HD12 ILE D 61 6.617 -16.336 -2.580 1.00 0.00 H new ATOM 0 HD13 ILE D 61 5.095 -15.966 -1.735 1.00 0.00 H new ATOM 2225 N GLN D 62 7.890 -19.052 2.958 1.00 0.00 N ATOM 2226 CA GLN D 62 7.801 -20.322 3.663 1.00 0.00 C ATOM 2227 C GLN D 62 6.360 -20.608 4.052 1.00 0.00 C ATOM 2228 O GLN D 62 5.464 -19.808 3.784 1.00 0.00 O ATOM 2229 CB GLN D 62 8.671 -20.302 4.923 1.00 0.00 C ATOM 2230 CG GLN D 62 10.146 -20.174 4.538 1.00 0.00 C ATOM 2231 CD GLN D 62 11.013 -20.184 5.794 1.00 0.00 C ATOM 2232 OE1 GLN D 62 10.769 -20.969 6.710 1.00 0.00 O ATOM 2233 NE2 GLN D 62 12.018 -19.356 5.891 1.00 0.00 N ATOM 0 H GLN D 62 8.109 -18.253 3.553 1.00 0.00 H new ATOM 0 HA GLN D 62 8.159 -21.106 2.995 1.00 0.00 H new ATOM 0 HB2 GLN D 62 8.380 -19.469 5.563 1.00 0.00 H new ATOM 0 HB3 GLN D 62 8.514 -21.215 5.498 1.00 0.00 H new ATOM 0 HG2 GLN D 62 10.432 -20.996 3.881 1.00 0.00 H new ATOM 0 HG3 GLN D 62 10.307 -19.251 3.982 1.00 0.00 H new ATOM 0 HE21 GLN D 62 12.219 -18.706 5.131 1.00 0.00 H new ATOM 0 HE22 GLN D 62 12.602 -19.359 6.727 1.00 0.00 H new ATOM 2242 N LYS D 63 6.144 -21.755 4.672 1.00 0.00 N ATOM 2243 CA LYS D 63 4.804 -22.142 5.084 1.00 0.00 C ATOM 2244 C LYS D 63 4.238 -21.122 6.074 1.00 0.00 C ATOM 2245 O LYS D 63 4.982 -20.471 6.809 1.00 0.00 O ATOM 2246 CB LYS D 63 4.826 -23.517 5.757 1.00 0.00 C ATOM 2247 CG LYS D 63 3.406 -24.083 5.794 1.00 0.00 C ATOM 2248 CD LYS D 63 3.430 -25.457 6.465 1.00 0.00 C ATOM 2249 CE LYS D 63 2.017 -26.038 6.492 1.00 0.00 C ATOM 2250 NZ LYS D 63 2.043 -27.382 7.137 1.00 0.00 N1+ ATOM 0 H LYS D 63 6.873 -22.431 4.900 1.00 0.00 H new ATOM 0 HA LYS D 63 4.177 -22.180 4.193 1.00 0.00 H new ATOM 0 HB2 LYS D 63 5.485 -24.192 5.211 1.00 0.00 H new ATOM 0 HB3 LYS D 63 5.223 -23.433 6.769 1.00 0.00 H new ATOM 0 HG2 LYS D 63 2.747 -23.409 6.342 1.00 0.00 H new ATOM 0 HG3 LYS D 63 3.008 -24.166 4.783 1.00 0.00 H new ATOM 0 HD2 LYS D 63 4.099 -26.126 5.924 1.00 0.00 H new ATOM 0 HD3 LYS D 63 3.818 -25.371 7.480 1.00 0.00 H new ATOM 0 HE2 LYS D 63 1.350 -25.373 7.040 1.00 0.00 H new ATOM 0 HE3 LYS D 63 1.626 -26.117 5.478 1.00 0.00 H new ATOM 0 HZ1 LYS D 63 1.081 -27.777 7.155 1.00 0.00 H new ATOM 0 HZ2 LYS D 63 2.667 -28.015 6.596 1.00 0.00 H new ATOM 0 HZ3 LYS D 63 2.399 -27.293 8.110 1.00 0.00 H new ATOM 2264 N GLU D 64 2.918 -20.996 6.085 1.00 0.00 N ATOM 2265 CA GLU D 64 2.237 -20.066 6.974 1.00 0.00 C ATOM 2266 C GLU D 64 2.735 -18.643 6.763 1.00 0.00 C ATOM 2267 O GLU D 64 2.983 -17.907 7.717 1.00 0.00 O ATOM 2268 CB GLU D 64 2.437 -20.479 8.432 1.00 0.00 C ATOM 2269 CG GLU D 64 2.023 -21.939 8.601 1.00 0.00 C ATOM 2270 CD GLU D 64 1.819 -22.252 10.078 1.00 0.00 C ATOM 2271 OE1 GLU D 64 0.814 -21.825 10.622 1.00 0.00 O ATOM 2272 OE2 GLU D 64 2.672 -22.915 10.646 1.00 0.00 O1- ATOM 0 H GLU D 64 2.293 -21.532 5.482 1.00 0.00 H new ATOM 0 HA GLU D 64 1.173 -20.096 6.739 1.00 0.00 H new ATOM 0 HB2 GLU D 64 3.480 -20.349 8.720 1.00 0.00 H new ATOM 0 HB3 GLU D 64 1.844 -19.842 9.088 1.00 0.00 H new ATOM 0 HG2 GLU D 64 1.103 -22.132 8.049 1.00 0.00 H new ATOM 0 HG3 GLU D 64 2.788 -22.594 8.184 1.00 0.00 H new ATOM 2279 N SER D 65 2.866 -18.263 5.500 1.00 0.00 N ATOM 2280 CA SER D 65 3.320 -16.926 5.149 1.00 0.00 C ATOM 2281 C SER D 65 2.121 -16.018 4.913 1.00 0.00 C ATOM 2282 O SER D 65 1.264 -16.312 4.082 1.00 0.00 O ATOM 2283 CB SER D 65 4.173 -16.992 3.885 1.00 0.00 C ATOM 2284 OG SER D 65 4.455 -15.676 3.443 1.00 0.00 O ATOM 0 H SER D 65 2.664 -18.863 4.700 1.00 0.00 H new ATOM 0 HA SER D 65 3.916 -16.523 5.967 1.00 0.00 H new ATOM 0 HB2 SER D 65 5.101 -17.527 4.086 1.00 0.00 H new ATOM 0 HB3 SER D 65 3.648 -17.545 3.106 1.00 0.00 H new ATOM 0 HG SER D 65 5.168 -15.292 3.994 1.00 0.00 H new ATOM 2290 N THR D 66 2.059 -14.915 5.649 1.00 0.00 N ATOM 2291 CA THR D 66 0.946 -13.991 5.501 1.00 0.00 C ATOM 2292 C THR D 66 1.184 -13.071 4.307 1.00 0.00 C ATOM 2293 O THR D 66 1.872 -12.055 4.416 1.00 0.00 O ATOM 2294 CB THR D 66 0.788 -13.158 6.775 1.00 0.00 C ATOM 2295 OG1 THR D 66 0.924 -14.004 7.907 1.00 0.00 O ATOM 2296 CG2 THR D 66 -0.598 -12.511 6.796 1.00 0.00 C ATOM 0 H THR D 66 2.755 -14.643 6.343 1.00 0.00 H new ATOM 0 HA THR D 66 0.033 -14.562 5.332 1.00 0.00 H new ATOM 0 HB THR D 66 1.553 -12.382 6.798 1.00 0.00 H new ATOM 0 HG1 THR D 66 0.825 -13.474 8.725 1.00 0.00 H new ATOM 0 HG21 THR D 66 -0.709 -11.918 7.704 1.00 0.00 H new ATOM 0 HG22 THR D 66 -0.711 -11.866 5.925 1.00 0.00 H new ATOM 0 HG23 THR D 66 -1.362 -13.288 6.774 1.00 0.00 H new ATOM 2304 N LEU D 67 0.599 -13.436 3.173 1.00 0.00 N ATOM 2305 CA LEU D 67 0.734 -12.655 1.955 1.00 0.00 C ATOM 2306 C LEU D 67 -0.288 -11.529 1.942 1.00 0.00 C ATOM 2307 O LEU D 67 -1.357 -11.643 2.546 1.00 0.00 O ATOM 2308 CB LEU D 67 0.519 -13.551 0.733 1.00 0.00 C ATOM 2309 CG LEU D 67 1.833 -14.238 0.368 1.00 0.00 C ATOM 2310 CD1 LEU D 67 2.164 -15.299 1.418 1.00 0.00 C ATOM 2311 CD2 LEU D 67 1.694 -14.903 -1.003 1.00 0.00 C ATOM 0 H LEU D 67 0.024 -14.273 3.074 1.00 0.00 H new ATOM 0 HA LEU D 67 1.738 -12.231 1.920 1.00 0.00 H new ATOM 0 HB2 LEU D 67 -0.247 -14.297 0.946 1.00 0.00 H new ATOM 0 HB3 LEU D 67 0.161 -12.957 -0.108 1.00 0.00 H new ATOM 0 HG LEU D 67 2.633 -13.499 0.336 1.00 0.00 H new ATOM 0 HD11 LEU D 67 3.102 -15.789 1.157 1.00 0.00 H new ATOM 0 HD12 LEU D 67 2.261 -14.826 2.395 1.00 0.00 H new ATOM 0 HD13 LEU D 67 1.365 -16.039 1.451 1.00 0.00 H new ATOM 0 HD21 LEU D 67 2.631 -15.394 -1.266 1.00 0.00 H new ATOM 0 HD22 LEU D 67 0.894 -15.642 -0.969 1.00 0.00 H new ATOM 0 HD23 LEU D 67 1.458 -14.147 -1.752 1.00 0.00 H new ATOM 2323 N HIS D 68 0.041 -10.446 1.251 1.00 0.00 N ATOM 2324 CA HIS D 68 -0.865 -9.313 1.172 1.00 0.00 C ATOM 2325 C HIS D 68 -1.590 -9.308 -0.169 1.00 0.00 C ATOM 2326 O HIS D 68 -0.962 -9.278 -1.228 1.00 0.00 O ATOM 2327 CB HIS D 68 -0.085 -8.007 1.340 1.00 0.00 C ATOM 2328 CG HIS D 68 0.654 -8.031 2.651 1.00 0.00 C ATOM 2329 ND1 HIS D 68 -0.002 -8.029 3.873 1.00 0.00 N ATOM 2330 CD2 HIS D 68 1.994 -8.051 2.946 1.00 0.00 C ATOM 2331 CE1 HIS D 68 0.937 -8.046 4.836 1.00 0.00 C ATOM 2332 NE2 HIS D 68 2.171 -8.060 4.326 1.00 0.00 N ATOM 0 H HIS D 68 0.918 -10.330 0.743 1.00 0.00 H new ATOM 0 HA HIS D 68 -1.600 -9.399 1.972 1.00 0.00 H new ATOM 0 HB2 HIS D 68 0.618 -7.882 0.516 1.00 0.00 H new ATOM 0 HB3 HIS D 68 -0.767 -7.157 1.310 1.00 0.00 H new ATOM 0 HD1 HIS D 68 -1.012 -8.017 4.015 1.00 0.00 H new ATOM 0 HD2 HIS D 68 2.791 -8.059 2.217 1.00 0.00 H new ATOM 0 HE1 HIS D 68 0.719 -8.048 5.894 1.00 0.00 H new ATOM 2340 N LEU D 69 -2.917 -9.337 -0.111 1.00 0.00 N ATOM 2341 CA LEU D 69 -3.729 -9.331 -1.320 1.00 0.00 C ATOM 2342 C LEU D 69 -4.316 -7.939 -1.528 1.00 0.00 C ATOM 2343 O LEU D 69 -5.135 -7.478 -0.731 1.00 0.00 O ATOM 2344 CB LEU D 69 -4.856 -10.359 -1.186 1.00 0.00 C ATOM 2345 CG LEU D 69 -5.626 -10.457 -2.499 1.00 0.00 C ATOM 2346 CD1 LEU D 69 -4.736 -11.105 -3.558 1.00 0.00 C ATOM 2347 CD2 LEU D 69 -6.883 -11.305 -2.303 1.00 0.00 C ATOM 0 H LEU D 69 -3.451 -9.365 0.758 1.00 0.00 H new ATOM 0 HA LEU D 69 -3.110 -9.592 -2.178 1.00 0.00 H new ATOM 0 HB2 LEU D 69 -4.443 -11.333 -0.923 1.00 0.00 H new ATOM 0 HB3 LEU D 69 -5.530 -10.070 -0.379 1.00 0.00 H new ATOM 0 HG LEU D 69 -5.916 -9.457 -2.822 1.00 0.00 H new ATOM 0 HD11 LEU D 69 -5.283 -11.177 -4.498 1.00 0.00 H new ATOM 0 HD12 LEU D 69 -3.842 -10.498 -3.703 1.00 0.00 H new ATOM 0 HD13 LEU D 69 -4.447 -12.103 -3.229 1.00 0.00 H new ATOM 0 HD21 LEU D 69 -7.428 -11.371 -3.245 1.00 0.00 H new ATOM 0 HD22 LEU D 69 -6.600 -12.306 -1.977 1.00 0.00 H new ATOM 0 HD23 LEU D 69 -7.519 -10.844 -1.547 1.00 0.00 H new ATOM 2359 N VAL D 70 -3.894 -7.270 -2.594 1.00 0.00 N ATOM 2360 CA VAL D 70 -4.390 -5.929 -2.883 1.00 0.00 C ATOM 2361 C VAL D 70 -5.351 -5.987 -4.056 1.00 0.00 C ATOM 2362 O VAL D 70 -4.986 -6.415 -5.144 1.00 0.00 O ATOM 2363 CB VAL D 70 -3.223 -4.996 -3.219 1.00 0.00 C ATOM 2364 CG1 VAL D 70 -3.758 -3.594 -3.523 1.00 0.00 C ATOM 2365 CG2 VAL D 70 -2.268 -4.924 -2.025 1.00 0.00 C ATOM 0 H VAL D 70 -3.217 -7.629 -3.267 1.00 0.00 H new ATOM 0 HA VAL D 70 -4.908 -5.544 -2.005 1.00 0.00 H new ATOM 0 HB VAL D 70 -2.693 -5.381 -4.090 1.00 0.00 H new ATOM 0 HG11 VAL D 70 -2.926 -2.931 -3.762 1.00 0.00 H new ATOM 0 HG12 VAL D 70 -4.440 -3.641 -4.372 1.00 0.00 H new ATOM 0 HG13 VAL D 70 -4.289 -3.210 -2.652 1.00 0.00 H new ATOM 0 HG21 VAL D 70 -1.437 -4.260 -2.263 1.00 0.00 H new ATOM 0 HG22 VAL D 70 -2.801 -4.540 -1.155 1.00 0.00 H new ATOM 0 HG23 VAL D 70 -1.885 -5.920 -1.805 1.00 0.00 H new ATOM 2375 N LEU D 71 -6.583 -5.571 -3.820 1.00 0.00 N ATOM 2376 CA LEU D 71 -7.597 -5.603 -4.861 1.00 0.00 C ATOM 2377 C LEU D 71 -7.482 -4.383 -5.766 1.00 0.00 C ATOM 2378 O LEU D 71 -7.113 -3.296 -5.318 1.00 0.00 O ATOM 2379 CB LEU D 71 -8.979 -5.645 -4.216 1.00 0.00 C ATOM 2380 CG LEU D 71 -9.039 -6.817 -3.233 1.00 0.00 C ATOM 2381 CD1 LEU D 71 -10.412 -6.842 -2.563 1.00 0.00 C ATOM 2382 CD2 LEU D 71 -8.805 -8.136 -3.979 1.00 0.00 C ATOM 0 H LEU D 71 -6.905 -5.209 -2.922 1.00 0.00 H new ATOM 0 HA LEU D 71 -7.448 -6.494 -5.471 1.00 0.00 H new ATOM 0 HB2 LEU D 71 -9.180 -4.708 -3.696 1.00 0.00 H new ATOM 0 HB3 LEU D 71 -9.747 -5.756 -4.981 1.00 0.00 H new ATOM 0 HG LEU D 71 -8.264 -6.695 -2.476 1.00 0.00 H new ATOM 0 HD11 LEU D 71 -10.460 -7.675 -1.862 1.00 0.00 H new ATOM 0 HD12 LEU D 71 -10.572 -5.907 -2.027 1.00 0.00 H new ATOM 0 HD13 LEU D 71 -11.185 -6.962 -3.322 1.00 0.00 H new ATOM 0 HD21 LEU D 71 -8.849 -8.966 -3.274 1.00 0.00 H new ATOM 0 HD22 LEU D 71 -9.575 -8.265 -4.740 1.00 0.00 H new ATOM 0 HD23 LEU D 71 -7.825 -8.116 -4.455 1.00 0.00 H new ATOM 2490 N LYS A 21 0.953 11.579 -1.692 1.00 0.00 N ATOM 2491 CA LYS A 21 1.513 12.404 -0.633 1.00 0.00 C ATOM 2492 C LYS A 21 2.566 11.620 0.137 1.00 0.00 C ATOM 2493 O LYS A 21 2.495 10.388 0.231 1.00 0.00 O ATOM 2494 CB LYS A 21 0.409 12.858 0.325 1.00 0.00 C ATOM 2495 CG LYS A 21 -0.357 11.641 0.849 1.00 0.00 C ATOM 2496 CD LYS A 21 -1.314 12.073 1.963 1.00 0.00 C ATOM 2497 CE LYS A 21 -2.414 12.962 1.382 1.00 0.00 C ATOM 2498 NZ LYS A 21 -3.381 13.320 2.458 1.00 0.00 N1+ ATOM 0 HA LYS A 21 1.976 13.282 -1.084 1.00 0.00 H new ATOM 0 HB2 LYS A 21 0.843 13.412 1.158 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -0.274 13.536 -0.188 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -0.915 11.174 0.038 1.00 0.00 H new ATOM 0 HG3 LYS A 21 0.342 10.894 1.226 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -1.755 11.196 2.437 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -0.767 12.613 2.736 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -1.979 13.865 0.954 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -2.928 12.442 0.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -4.130 13.925 2.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -3.804 12.453 2.847 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -2.884 13.832 3.215 1.00 0.00 H new ATOM 2512 N TYR A 22 3.537 12.336 0.693 1.00 0.00 N ATOM 2513 CA TYR A 22 4.591 11.698 1.452 1.00 0.00 C ATOM 2514 C TYR A 22 4.243 11.720 2.927 1.00 0.00 C ATOM 2515 O TYR A 22 4.152 12.782 3.543 1.00 0.00 O ATOM 2516 CB TYR A 22 5.918 12.419 1.226 1.00 0.00 C ATOM 2517 CG TYR A 22 6.541 11.975 -0.081 1.00 0.00 C ATOM 2518 CD1 TYR A 22 5.746 11.444 -1.112 1.00 0.00 C ATOM 2519 CD2 TYR A 22 7.920 12.102 -0.262 1.00 0.00 C ATOM 2520 CE1 TYR A 22 6.338 11.047 -2.316 1.00 0.00 C ATOM 2521 CE2 TYR A 22 8.511 11.702 -1.466 1.00 0.00 C ATOM 2522 CZ TYR A 22 7.720 11.177 -2.493 1.00 0.00 C ATOM 2523 OH TYR A 22 8.302 10.787 -3.682 1.00 0.00 O ATOM 0 H TYR A 22 3.611 13.351 0.630 1.00 0.00 H new ATOM 0 HA TYR A 22 4.690 10.665 1.117 1.00 0.00 H new ATOM 0 HB2 TYR A 22 5.756 13.497 1.212 1.00 0.00 H new ATOM 0 HB3 TYR A 22 6.599 12.209 2.051 1.00 0.00 H new ATOM 0 HD1 TYR A 22 4.680 11.343 -0.975 1.00 0.00 H new ATOM 0 HD2 TYR A 22 8.532 12.510 0.529 1.00 0.00 H new ATOM 0 HE1 TYR A 22 5.728 10.640 -3.109 1.00 0.00 H new ATOM 0 HE2 TYR A 22 9.578 11.799 -1.602 1.00 0.00 H new ATOM 0 HH TYR A 22 8.841 9.982 -3.534 1.00 0.00 H new ATOM 2533 N LEU A 23 4.045 10.541 3.481 1.00 0.00 N ATOM 2534 CA LEU A 23 3.702 10.416 4.875 1.00 0.00 C ATOM 2535 C LEU A 23 4.873 10.829 5.756 1.00 0.00 C ATOM 2536 O LEU A 23 4.682 11.439 6.809 1.00 0.00 O ATOM 2537 CB LEU A 23 3.296 8.977 5.179 1.00 0.00 C ATOM 2538 CG LEU A 23 2.058 8.595 4.362 1.00 0.00 C ATOM 2539 CD1 LEU A 23 1.706 7.137 4.649 1.00 0.00 C ATOM 2540 CD2 LEU A 23 0.870 9.482 4.745 1.00 0.00 C ATOM 0 H LEU A 23 4.117 9.655 2.981 1.00 0.00 H new ATOM 0 HA LEU A 23 2.863 11.078 5.089 1.00 0.00 H new ATOM 0 HB2 LEU A 23 4.119 8.302 4.944 1.00 0.00 H new ATOM 0 HB3 LEU A 23 3.087 8.867 6.243 1.00 0.00 H new ATOM 0 HG LEU A 23 2.274 8.733 3.303 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.825 6.855 4.072 1.00 0.00 H new ATOM 0 HD12 LEU A 23 2.544 6.498 4.368 1.00 0.00 H new ATOM 0 HD13 LEU A 23 1.497 7.016 5.712 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -0.001 9.198 4.155 1.00 0.00 H new ATOM 0 HD22 LEU A 23 0.648 9.355 5.805 1.00 0.00 H new ATOM 0 HD23 LEU A 23 1.116 10.525 4.548 1.00 0.00 H new ATOM 2552 N VAL A 24 6.085 10.503 5.321 1.00 0.00 N ATOM 2553 CA VAL A 24 7.272 10.869 6.099 1.00 0.00 C ATOM 2554 C VAL A 24 8.449 11.083 5.170 1.00 0.00 C ATOM 2555 O VAL A 24 8.437 10.636 4.028 1.00 0.00 O ATOM 2556 CB VAL A 24 7.626 9.787 7.124 1.00 0.00 C ATOM 2557 CG1 VAL A 24 8.504 8.720 6.467 1.00 0.00 C ATOM 2558 CG2 VAL A 24 8.391 10.427 8.291 1.00 0.00 C ATOM 0 H VAL A 24 6.274 9.998 4.455 1.00 0.00 H new ATOM 0 HA VAL A 24 7.048 11.790 6.636 1.00 0.00 H new ATOM 0 HB VAL A 24 6.711 9.324 7.492 1.00 0.00 H new ATOM 0 HG11 VAL A 24 8.753 7.952 7.200 1.00 0.00 H new ATOM 0 HG12 VAL A 24 7.965 8.266 5.635 1.00 0.00 H new ATOM 0 HG13 VAL A 24 9.420 9.180 6.097 1.00 0.00 H new ATOM 0 HG21 VAL A 24 8.645 9.661 9.023 1.00 0.00 H new ATOM 0 HG22 VAL A 24 9.305 10.889 7.917 1.00 0.00 H new ATOM 0 HG23 VAL A 24 7.767 11.186 8.762 1.00 0.00 H new ATOM 2568 N GLU A 25 9.466 11.762 5.665 1.00 0.00 N ATOM 2569 CA GLU A 25 10.647 12.019 4.861 1.00 0.00 C ATOM 2570 C GLU A 25 11.741 12.661 5.689 1.00 0.00 C ATOM 2571 O GLU A 25 11.560 13.732 6.267 1.00 0.00 O ATOM 2572 CB GLU A 25 10.299 12.945 3.693 1.00 0.00 C ATOM 2573 CG GLU A 25 9.179 13.907 4.106 1.00 0.00 C ATOM 2574 CD GLU A 25 9.158 15.112 3.170 1.00 0.00 C ATOM 2575 OE1 GLU A 25 10.114 15.868 3.189 1.00 0.00 O ATOM 2576 OE2 GLU A 25 8.185 15.260 2.450 1.00 0.00 O1- ATOM 0 H GLU A 25 9.500 12.143 6.611 1.00 0.00 H new ATOM 0 HA GLU A 25 11.005 11.062 4.482 1.00 0.00 H new ATOM 0 HB2 GLU A 25 11.181 13.509 3.389 1.00 0.00 H new ATOM 0 HB3 GLU A 25 9.985 12.356 2.831 1.00 0.00 H new ATOM 0 HG2 GLU A 25 8.218 13.394 4.075 1.00 0.00 H new ATOM 0 HG3 GLU A 25 9.331 14.236 5.134 1.00 0.00 H new ATOM 2583 N PHE A 26 12.885 12.004 5.721 1.00 0.00 N ATOM 2584 CA PHE A 26 14.026 12.527 6.460 1.00 0.00 C ATOM 2585 C PHE A 26 15.332 11.976 5.905 1.00 0.00 C ATOM 2586 O PHE A 26 15.346 10.946 5.237 1.00 0.00 O ATOM 2587 CB PHE A 26 13.888 12.197 7.945 1.00 0.00 C ATOM 2588 CG PHE A 26 13.787 10.707 8.141 1.00 0.00 C ATOM 2589 CD1 PHE A 26 14.941 9.945 8.334 1.00 0.00 C ATOM 2590 CD2 PHE A 26 12.531 10.091 8.147 1.00 0.00 C ATOM 2591 CE1 PHE A 26 14.843 8.565 8.537 1.00 0.00 C ATOM 2592 CE2 PHE A 26 12.427 8.713 8.348 1.00 0.00 C ATOM 2593 CZ PHE A 26 13.585 7.946 8.543 1.00 0.00 C ATOM 0 H PHE A 26 13.052 11.115 5.250 1.00 0.00 H new ATOM 0 HA PHE A 26 14.044 13.611 6.344 1.00 0.00 H new ATOM 0 HB2 PHE A 26 14.747 12.585 8.492 1.00 0.00 H new ATOM 0 HB3 PHE A 26 13.003 12.685 8.353 1.00 0.00 H new ATOM 0 HD1 PHE A 26 15.910 10.422 8.326 1.00 0.00 H new ATOM 0 HD2 PHE A 26 11.640 10.682 7.996 1.00 0.00 H new ATOM 0 HE1 PHE A 26 15.736 7.976 8.689 1.00 0.00 H new ATOM 0 HE2 PHE A 26 11.457 8.239 8.353 1.00 0.00 H new ATOM 0 HZ PHE A 26 13.508 6.880 8.698 1.00 0.00 H new ATOM 2603 N ARG A 27 16.430 12.675 6.170 1.00 0.00 N ATOM 2604 CA ARG A 27 17.726 12.239 5.669 1.00 0.00 C ATOM 2605 C ARG A 27 18.261 11.086 6.502 1.00 0.00 C ATOM 2606 O ARG A 27 18.435 11.208 7.715 1.00 0.00 O ATOM 2607 CB ARG A 27 18.724 13.397 5.716 1.00 0.00 C ATOM 2608 CG ARG A 27 18.306 14.478 4.716 1.00 0.00 C ATOM 2609 CD ARG A 27 19.217 15.701 4.867 1.00 0.00 C ATOM 2610 NE ARG A 27 18.830 16.738 3.914 1.00 0.00 N ATOM 2611 CZ ARG A 27 17.800 17.555 4.148 1.00 0.00 C ATOM 2612 NH1 ARG A 27 17.093 17.445 5.246 1.00 0.00 N1+ ATOM 2613 NH2 ARG A 27 17.498 18.479 3.277 1.00 0.00 N ATOM 0 H ARG A 27 16.449 13.533 6.721 1.00 0.00 H new ATOM 0 HA ARG A 27 17.598 11.907 4.639 1.00 0.00 H new ATOM 0 HB2 ARG A 27 18.764 13.815 6.722 1.00 0.00 H new ATOM 0 HB3 ARG A 27 19.725 13.037 5.480 1.00 0.00 H new ATOM 0 HG2 ARG A 27 18.368 14.090 3.699 1.00 0.00 H new ATOM 0 HG3 ARG A 27 17.268 14.763 4.886 1.00 0.00 H new ATOM 0 HD2 ARG A 27 19.152 16.089 5.884 1.00 0.00 H new ATOM 0 HD3 ARG A 27 20.255 15.413 4.701 1.00 0.00 H new ATOM 0 HE ARG A 27 19.360 16.841 3.048 1.00 0.00 H new ATOM 0 HH11 ARG A 27 17.327 16.729 5.934 1.00 0.00 H new ATOM 0 HH12 ARG A 27 16.309 18.075 5.413 1.00 0.00 H new ATOM 0 HH21 ARG A 27 18.048 18.574 2.423 1.00 0.00 H new ATOM 0 HH22 ARG A 27 16.712 19.106 3.450 1.00 0.00 H new ATOM 2627 N ALA A 28 18.546 9.977 5.838 1.00 0.00 N ATOM 2628 CA ALA A 28 19.090 8.816 6.526 1.00 0.00 C ATOM 2629 C ALA A 28 19.887 7.961 5.561 1.00 0.00 C ATOM 2630 O ALA A 28 19.555 7.854 4.380 1.00 0.00 O ATOM 2631 CB ALA A 28 17.975 7.971 7.152 1.00 0.00 C ATOM 0 H ALA A 28 18.412 9.856 4.834 1.00 0.00 H new ATOM 0 HA ALA A 28 19.743 9.176 7.321 1.00 0.00 H new ATOM 0 HB1 ALA A 28 18.412 7.111 7.659 1.00 0.00 H new ATOM 0 HB2 ALA A 28 17.422 8.574 7.872 1.00 0.00 H new ATOM 0 HB3 ALA A 28 17.297 7.626 6.371 1.00 0.00 H new ATOM 2637 N GLY A 29 20.934 7.347 6.077 1.00 0.00 N ATOM 2638 CA GLY A 29 21.777 6.487 5.266 1.00 0.00 C ATOM 2639 C GLY A 29 21.561 5.033 5.655 1.00 0.00 C ATOM 2640 O GLY A 29 21.205 4.735 6.794 1.00 0.00 O ATOM 0 H GLY A 29 21.222 7.427 7.052 1.00 0.00 H new ATOM 0 HA2 GLY A 29 21.546 6.628 4.210 1.00 0.00 H new ATOM 0 HA3 GLY A 29 22.824 6.757 5.402 1.00 0.00 H new ATOM 2644 N LYS A 30 21.762 4.130 4.710 1.00 0.00 N ATOM 2645 CA LYS A 30 21.568 2.715 4.984 1.00 0.00 C ATOM 2646 C LYS A 30 22.859 2.072 5.490 1.00 0.00 C ATOM 2647 O LYS A 30 23.915 2.700 5.500 1.00 0.00 O ATOM 2648 CB LYS A 30 21.094 1.983 3.725 1.00 0.00 C ATOM 2649 CG LYS A 30 22.065 2.251 2.580 1.00 0.00 C ATOM 2650 CD LYS A 30 21.800 1.265 1.443 1.00 0.00 C ATOM 2651 CE LYS A 30 20.402 1.498 0.869 1.00 0.00 C ATOM 2652 NZ LYS A 30 20.197 0.610 -0.310 1.00 0.00 N1+ ATOM 0 H LYS A 30 22.056 4.347 3.758 1.00 0.00 H new ATOM 0 HA LYS A 30 20.806 2.630 5.759 1.00 0.00 H new ATOM 0 HB2 LYS A 30 21.030 0.912 3.917 1.00 0.00 H new ATOM 0 HB3 LYS A 30 20.093 2.318 3.452 1.00 0.00 H new ATOM 0 HG2 LYS A 30 21.948 3.274 2.223 1.00 0.00 H new ATOM 0 HG3 LYS A 30 23.092 2.151 2.930 1.00 0.00 H new ATOM 0 HD2 LYS A 30 22.549 1.388 0.661 1.00 0.00 H new ATOM 0 HD3 LYS A 30 21.887 0.242 1.809 1.00 0.00 H new ATOM 0 HE2 LYS A 30 19.647 1.294 1.628 1.00 0.00 H new ATOM 0 HE3 LYS A 30 20.286 2.542 0.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 19.206 0.666 -0.619 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 20.819 0.914 -1.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 20.423 -0.371 -0.049 1.00 0.00 H new ATOM 2666 N MET A 31 22.758 0.815 5.920 1.00 0.00 N ATOM 2667 CA MET A 31 23.922 0.088 6.430 1.00 0.00 C ATOM 2668 C MET A 31 23.906 -1.350 5.902 1.00 0.00 C ATOM 2669 O MET A 31 22.941 -1.764 5.255 1.00 0.00 O ATOM 2670 CB MET A 31 23.912 0.058 7.961 1.00 0.00 C ATOM 2671 CG MET A 31 23.424 1.401 8.517 1.00 0.00 C ATOM 2672 SD MET A 31 23.423 1.346 10.329 1.00 0.00 S ATOM 2673 CE MET A 31 25.205 1.545 10.579 1.00 0.00 C ATOM 0 H MET A 31 21.889 0.281 5.926 1.00 0.00 H new ATOM 0 HA MET A 31 24.822 0.600 6.090 1.00 0.00 H new ATOM 0 HB2 MET A 31 23.264 -0.745 8.311 1.00 0.00 H new ATOM 0 HB3 MET A 31 24.914 -0.155 8.334 1.00 0.00 H new ATOM 0 HG2 MET A 31 24.070 2.207 8.168 1.00 0.00 H new ATOM 0 HG3 MET A 31 22.421 1.615 8.149 1.00 0.00 H new ATOM 0 HE1 MET A 31 25.534 0.893 11.389 1.00 0.00 H new ATOM 0 HE2 MET A 31 25.733 1.280 9.663 1.00 0.00 H new ATOM 0 HE3 MET A 31 25.423 2.582 10.836 1.00 0.00 H new ATOM 2683 N SER A 32 24.965 -2.112 6.183 1.00 0.00 N ATOM 2684 CA SER A 32 25.038 -3.498 5.735 1.00 0.00 C ATOM 2685 C SER A 32 25.274 -4.416 6.922 1.00 0.00 C ATOM 2686 O SER A 32 26.217 -4.214 7.687 1.00 0.00 O ATOM 2687 CB SER A 32 26.189 -3.683 4.741 1.00 0.00 C ATOM 2688 OG SER A 32 25.929 -2.926 3.564 1.00 0.00 O ATOM 0 H SER A 32 25.776 -1.794 6.714 1.00 0.00 H new ATOM 0 HA SER A 32 24.094 -3.746 5.250 1.00 0.00 H new ATOM 0 HB2 SER A 32 27.128 -3.362 5.192 1.00 0.00 H new ATOM 0 HB3 SER A 32 26.300 -4.738 4.490 1.00 0.00 H new ATOM 0 HG SER A 32 26.667 -3.044 2.930 1.00 0.00 H new ATOM 2694 N LEU A 33 24.433 -5.431 7.067 1.00 0.00 N ATOM 2695 CA LEU A 33 24.595 -6.370 8.161 1.00 0.00 C ATOM 2696 C LEU A 33 25.104 -7.703 7.637 1.00 0.00 C ATOM 2697 O LEU A 33 24.432 -8.379 6.859 1.00 0.00 O ATOM 2698 CB LEU A 33 23.264 -6.569 8.901 1.00 0.00 C ATOM 2699 CG LEU A 33 23.375 -7.740 9.890 1.00 0.00 C ATOM 2700 CD1 LEU A 33 24.496 -7.476 10.895 1.00 0.00 C ATOM 2701 CD2 LEU A 33 22.052 -7.881 10.646 1.00 0.00 C ATOM 0 H LEU A 33 23.644 -5.621 6.449 1.00 0.00 H new ATOM 0 HA LEU A 33 25.325 -5.963 8.861 1.00 0.00 H new ATOM 0 HB2 LEU A 33 22.997 -5.657 9.435 1.00 0.00 H new ATOM 0 HB3 LEU A 33 22.467 -6.764 8.184 1.00 0.00 H new ATOM 0 HG LEU A 33 23.596 -8.654 9.339 1.00 0.00 H new ATOM 0 HD11 LEU A 33 24.565 -8.312 11.591 1.00 0.00 H new ATOM 0 HD12 LEU A 33 25.442 -7.366 10.364 1.00 0.00 H new ATOM 0 HD13 LEU A 33 24.281 -6.561 11.448 1.00 0.00 H new ATOM 0 HD21 LEU A 33 22.122 -8.710 11.350 1.00 0.00 H new ATOM 0 HD22 LEU A 33 21.844 -6.960 11.190 1.00 0.00 H new ATOM 0 HD23 LEU A 33 21.247 -8.074 9.937 1.00 0.00 H new ATOM 2713 N LYS A 34 26.294 -8.074 8.083 1.00 0.00 N ATOM 2714 CA LYS A 34 26.893 -9.335 7.673 1.00 0.00 C ATOM 2715 C LYS A 34 27.141 -10.210 8.894 1.00 0.00 C ATOM 2716 O LYS A 34 27.999 -9.904 9.724 1.00 0.00 O ATOM 2717 CB LYS A 34 28.204 -9.071 6.931 1.00 0.00 C ATOM 2718 CG LYS A 34 27.911 -8.451 5.564 1.00 0.00 C ATOM 2719 CD LYS A 34 29.231 -8.206 4.827 1.00 0.00 C ATOM 2720 CE LYS A 34 28.948 -7.595 3.455 1.00 0.00 C ATOM 2721 NZ LYS A 34 30.237 -7.356 2.745 1.00 0.00 N1+ ATOM 0 H LYS A 34 26.862 -7.523 8.726 1.00 0.00 H new ATOM 0 HA LYS A 34 26.211 -9.856 7.002 1.00 0.00 H new ATOM 0 HB2 LYS A 34 28.835 -8.402 7.516 1.00 0.00 H new ATOM 0 HB3 LYS A 34 28.756 -10.003 6.807 1.00 0.00 H new ATOM 0 HG2 LYS A 34 27.273 -9.114 4.980 1.00 0.00 H new ATOM 0 HG3 LYS A 34 27.369 -7.513 5.686 1.00 0.00 H new ATOM 0 HD2 LYS A 34 29.866 -7.538 5.410 1.00 0.00 H new ATOM 0 HD3 LYS A 34 29.775 -9.144 4.713 1.00 0.00 H new ATOM 0 HE2 LYS A 34 28.316 -8.263 2.870 1.00 0.00 H new ATOM 0 HE3 LYS A 34 28.403 -6.658 3.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 30.047 -6.940 1.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 30.824 -6.703 3.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 30.740 -8.258 2.626 1.00 0.00 H new ATOM 2735 N GLY A 35 26.374 -11.290 9.006 1.00 0.00 N ATOM 2736 CA GLY A 35 26.505 -12.196 10.141 1.00 0.00 C ATOM 2737 C GLY A 35 25.935 -11.549 11.398 1.00 0.00 C ATOM 2738 O GLY A 35 24.783 -11.780 11.761 1.00 0.00 O ATOM 0 H GLY A 35 25.660 -11.558 8.329 1.00 0.00 H new ATOM 0 HA2 GLY A 35 25.981 -13.129 9.934 1.00 0.00 H new ATOM 0 HA3 GLY A 35 27.554 -12.447 10.296 1.00 0.00 H new ATOM 2742 N THR A 36 26.750 -10.725 12.049 1.00 0.00 N ATOM 2743 CA THR A 36 26.320 -10.026 13.255 1.00 0.00 C ATOM 2744 C THR A 36 27.007 -8.666 13.362 1.00 0.00 C ATOM 2745 O THR A 36 27.053 -8.072 14.437 1.00 0.00 O ATOM 2746 CB THR A 36 26.625 -10.865 14.497 1.00 0.00 C ATOM 2747 OG1 THR A 36 27.860 -11.544 14.318 1.00 0.00 O ATOM 2748 CG2 THR A 36 25.499 -11.874 14.717 1.00 0.00 C ATOM 0 H THR A 36 27.709 -10.525 11.763 1.00 0.00 H new ATOM 0 HA THR A 36 25.243 -9.869 13.192 1.00 0.00 H new ATOM 0 HB THR A 36 26.699 -10.217 15.370 1.00 0.00 H new ATOM 0 HG1 THR A 36 28.057 -12.080 15.114 1.00 0.00 H new ATOM 0 HG21 THR A 36 25.715 -12.473 15.602 1.00 0.00 H new ATOM 0 HG22 THR A 36 24.557 -11.343 14.859 1.00 0.00 H new ATOM 0 HG23 THR A 36 25.420 -12.527 13.848 1.00 0.00 H new ATOM 2756 N THR A 37 27.534 -8.177 12.241 1.00 0.00 N ATOM 2757 CA THR A 37 28.208 -6.884 12.226 1.00 0.00 C ATOM 2758 C THR A 37 27.492 -5.934 11.274 1.00 0.00 C ATOM 2759 O THR A 37 27.216 -6.282 10.126 1.00 0.00 O ATOM 2760 CB THR A 37 29.667 -7.047 11.789 1.00 0.00 C ATOM 2761 OG1 THR A 37 30.336 -7.923 12.685 1.00 0.00 O ATOM 2762 CG2 THR A 37 30.360 -5.681 11.802 1.00 0.00 C ATOM 0 H THR A 37 27.507 -8.653 11.339 1.00 0.00 H new ATOM 0 HA THR A 37 28.185 -6.470 13.234 1.00 0.00 H new ATOM 0 HB THR A 37 29.699 -7.463 10.782 1.00 0.00 H new ATOM 0 HG1 THR A 37 31.269 -8.028 12.404 1.00 0.00 H new ATOM 0 HG21 THR A 37 31.398 -5.797 11.491 1.00 0.00 H new ATOM 0 HG22 THR A 37 29.848 -5.007 11.115 1.00 0.00 H new ATOM 0 HG23 THR A 37 30.327 -5.266 12.809 1.00 0.00 H new ATOM 2770 N VAL A 38 27.198 -4.737 11.762 1.00 0.00 N ATOM 2771 CA VAL A 38 26.514 -3.732 10.961 1.00 0.00 C ATOM 2772 C VAL A 38 27.484 -2.614 10.594 1.00 0.00 C ATOM 2773 O VAL A 38 28.078 -1.991 11.474 1.00 0.00 O ATOM 2774 CB VAL A 38 25.353 -3.135 11.761 1.00 0.00 C ATOM 2775 CG1 VAL A 38 24.643 -2.079 10.914 1.00 0.00 C ATOM 2776 CG2 VAL A 38 24.363 -4.236 12.152 1.00 0.00 C ATOM 0 H VAL A 38 27.423 -4.438 12.711 1.00 0.00 H new ATOM 0 HA VAL A 38 26.135 -4.204 10.054 1.00 0.00 H new ATOM 0 HB VAL A 38 25.743 -2.673 12.668 1.00 0.00 H new ATOM 0 HG11 VAL A 38 23.816 -1.653 11.482 1.00 0.00 H new ATOM 0 HG12 VAL A 38 25.347 -1.290 10.651 1.00 0.00 H new ATOM 0 HG13 VAL A 38 24.259 -2.540 10.004 1.00 0.00 H new ATOM 0 HG21 VAL A 38 23.541 -3.801 12.721 1.00 0.00 H new ATOM 0 HG22 VAL A 38 23.971 -4.709 11.252 1.00 0.00 H new ATOM 0 HG23 VAL A 38 24.871 -4.982 12.762 1.00 0.00 H new ATOM 2786 N THR A 39 27.642 -2.361 9.300 1.00 0.00 N ATOM 2787 CA THR A 39 28.542 -1.308 8.853 1.00 0.00 C ATOM 2788 C THR A 39 27.746 -0.200 8.145 1.00 0.00 C ATOM 2789 O THR A 39 26.915 -0.501 7.296 1.00 0.00 O ATOM 2790 CB THR A 39 29.559 -1.902 7.882 1.00 0.00 C ATOM 2791 OG1 THR A 39 28.876 -2.549 6.816 1.00 0.00 O ATOM 2792 CG2 THR A 39 30.444 -2.913 8.611 1.00 0.00 C ATOM 0 H THR A 39 27.165 -2.864 8.552 1.00 0.00 H new ATOM 0 HA THR A 39 29.055 -0.881 9.715 1.00 0.00 H new ATOM 0 HB THR A 39 30.183 -1.103 7.483 1.00 0.00 H new ATOM 0 HG1 THR A 39 28.113 -2.001 6.536 1.00 0.00 H new ATOM 0 HG21 THR A 39 31.168 -3.333 7.913 1.00 0.00 H new ATOM 0 HG22 THR A 39 30.972 -2.415 9.424 1.00 0.00 H new ATOM 0 HG23 THR A 39 29.825 -3.713 9.017 1.00 0.00 H new ATOM 2800 N PRO A 40 27.965 1.062 8.458 1.00 0.00 N ATOM 2801 CA PRO A 40 27.210 2.173 7.802 1.00 0.00 C ATOM 2802 C PRO A 40 27.610 2.392 6.348 1.00 0.00 C ATOM 2803 O PRO A 40 28.770 2.216 5.975 1.00 0.00 O ATOM 2804 CB PRO A 40 27.548 3.395 8.650 1.00 0.00 C ATOM 2805 CG PRO A 40 28.869 3.092 9.265 1.00 0.00 C ATOM 2806 CD PRO A 40 28.930 1.576 9.450 1.00 0.00 C ATOM 0 HA PRO A 40 26.143 1.955 7.758 1.00 0.00 H new ATOM 0 HB2 PRO A 40 27.596 4.297 8.039 1.00 0.00 H new ATOM 0 HB3 PRO A 40 26.789 3.567 9.413 1.00 0.00 H new ATOM 0 HG2 PRO A 40 29.682 3.437 8.626 1.00 0.00 H new ATOM 0 HG3 PRO A 40 28.977 3.603 10.222 1.00 0.00 H new ATOM 0 HD2 PRO A 40 29.933 1.191 9.269 1.00 0.00 H new ATOM 0 HD3 PRO A 40 28.655 1.285 10.464 1.00 0.00 H new ATOM 2814 N ASP A 41 26.634 2.794 5.543 1.00 0.00 N ATOM 2815 CA ASP A 41 26.872 3.060 4.135 1.00 0.00 C ATOM 2816 C ASP A 41 26.992 4.561 3.916 1.00 0.00 C ATOM 2817 O ASP A 41 26.077 5.321 4.239 1.00 0.00 O ATOM 2818 CB ASP A 41 25.727 2.511 3.280 1.00 0.00 C ATOM 2819 CG ASP A 41 26.106 2.581 1.804 1.00 0.00 C ATOM 2820 OD1 ASP A 41 27.075 3.254 1.494 1.00 0.00 O ATOM 2821 OD2 ASP A 41 25.425 1.957 1.007 1.00 0.00 O1- ATOM 0 H ASP A 41 25.671 2.942 5.844 1.00 0.00 H new ATOM 0 HA ASP A 41 27.797 2.566 3.839 1.00 0.00 H new ATOM 0 HB2 ASP A 41 25.512 1.480 3.561 1.00 0.00 H new ATOM 0 HB3 ASP A 41 24.819 3.086 3.459 1.00 0.00 H new ATOM 2826 N LYS A 42 28.126 4.983 3.385 1.00 0.00 N ATOM 2827 CA LYS A 42 28.365 6.395 3.142 1.00 0.00 C ATOM 2828 C LYS A 42 27.353 6.947 2.137 1.00 0.00 C ATOM 2829 O LYS A 42 27.213 8.160 2.003 1.00 0.00 O ATOM 2830 CB LYS A 42 29.782 6.598 2.599 1.00 0.00 C ATOM 2831 CG LYS A 42 30.813 6.059 3.598 1.00 0.00 C ATOM 2832 CD LYS A 42 30.775 6.867 4.897 1.00 0.00 C ATOM 2833 CE LYS A 42 31.938 6.430 5.792 1.00 0.00 C ATOM 2834 NZ LYS A 42 31.766 4.999 6.174 1.00 0.00 N1+ ATOM 0 H LYS A 42 28.895 4.370 3.114 1.00 0.00 H new ATOM 0 HA LYS A 42 28.254 6.930 4.085 1.00 0.00 H new ATOM 0 HB2 LYS A 42 29.890 6.087 1.642 1.00 0.00 H new ATOM 0 HB3 LYS A 42 29.961 7.658 2.416 1.00 0.00 H new ATOM 0 HG2 LYS A 42 30.609 5.009 3.810 1.00 0.00 H new ATOM 0 HG3 LYS A 42 31.811 6.108 3.162 1.00 0.00 H new ATOM 0 HD2 LYS A 42 30.848 7.933 4.679 1.00 0.00 H new ATOM 0 HD3 LYS A 42 29.826 6.710 5.410 1.00 0.00 H new ATOM 0 HE2 LYS A 42 32.884 6.566 5.268 1.00 0.00 H new ATOM 0 HE3 LYS A 42 31.976 7.053 6.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 32.409 4.769 6.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 30.783 4.835 6.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 31.985 4.393 5.358 1.00 0.00 H new ATOM 2848 N ARG A 43 26.644 6.059 1.430 1.00 0.00 N ATOM 2849 CA ARG A 43 25.658 6.508 0.461 1.00 0.00 C ATOM 2850 C ARG A 43 24.466 7.091 1.202 1.00 0.00 C ATOM 2851 O ARG A 43 23.450 6.425 1.395 1.00 0.00 O ATOM 2852 CB ARG A 43 25.195 5.340 -0.420 1.00 0.00 C ATOM 2853 CG ARG A 43 26.344 4.896 -1.331 1.00 0.00 C ATOM 2854 CD ARG A 43 25.817 3.914 -2.382 1.00 0.00 C ATOM 2855 NE ARG A 43 25.335 2.695 -1.744 1.00 0.00 N ATOM 2856 CZ ARG A 43 24.702 1.743 -2.435 1.00 0.00 C ATOM 2857 NH1 ARG A 43 24.481 1.880 -3.719 1.00 0.00 N1+ ATOM 2858 NH2 ARG A 43 24.302 0.662 -1.824 1.00 0.00 N ATOM 0 H ARG A 43 26.737 5.047 1.513 1.00 0.00 H new ATOM 0 HA ARG A 43 26.108 7.266 -0.180 1.00 0.00 H new ATOM 0 HB2 ARG A 43 24.870 4.507 0.204 1.00 0.00 H new ATOM 0 HB3 ARG A 43 24.337 5.642 -1.021 1.00 0.00 H new ATOM 0 HG2 ARG A 43 26.790 5.762 -1.820 1.00 0.00 H new ATOM 0 HG3 ARG A 43 27.129 4.425 -0.740 1.00 0.00 H new ATOM 0 HD2 ARG A 43 25.010 4.378 -2.950 1.00 0.00 H new ATOM 0 HD3 ARG A 43 26.608 3.672 -3.092 1.00 0.00 H new ATOM 0 HE ARG A 43 25.485 2.566 -0.743 1.00 0.00 H new ATOM 0 HH11 ARG A 43 24.794 2.722 -4.203 1.00 0.00 H new ATOM 0 HH12 ARG A 43 23.996 1.145 -4.234 1.00 0.00 H new ATOM 0 HH21 ARG A 43 24.473 0.548 -0.825 1.00 0.00 H new ATOM 0 HH22 ARG A 43 23.818 -0.069 -2.345 1.00 0.00 H new ATOM 2872 N LYS A 44 24.612 8.340 1.631 1.00 0.00 N ATOM 2873 CA LYS A 44 23.558 9.013 2.369 1.00 0.00 C ATOM 2874 C LYS A 44 22.340 9.179 1.481 1.00 0.00 C ATOM 2875 O LYS A 44 22.454 9.642 0.349 1.00 0.00 O ATOM 2876 CB LYS A 44 24.045 10.389 2.816 1.00 0.00 C ATOM 2877 CG LYS A 44 25.288 10.221 3.689 1.00 0.00 C ATOM 2878 CD LYS A 44 25.673 11.564 4.307 1.00 0.00 C ATOM 2879 CE LYS A 44 26.128 12.533 3.212 1.00 0.00 C ATOM 2880 NZ LYS A 44 26.566 13.812 3.839 1.00 0.00 N1+ ATOM 0 H LYS A 44 25.449 8.903 1.479 1.00 0.00 H new ATOM 0 HA LYS A 44 23.295 8.416 3.242 1.00 0.00 H new ATOM 0 HB2 LYS A 44 24.276 11.006 1.948 1.00 0.00 H new ATOM 0 HB3 LYS A 44 23.261 10.903 3.373 1.00 0.00 H new ATOM 0 HG2 LYS A 44 25.095 9.491 4.475 1.00 0.00 H new ATOM 0 HG3 LYS A 44 26.114 9.836 3.091 1.00 0.00 H new ATOM 0 HD2 LYS A 44 24.823 11.983 4.845 1.00 0.00 H new ATOM 0 HD3 LYS A 44 26.472 11.423 5.035 1.00 0.00 H new ATOM 0 HE2 LYS A 44 26.946 12.096 2.640 1.00 0.00 H new ATOM 0 HE3 LYS A 44 25.313 12.718 2.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 26.730 14.523 3.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 25.827 14.152 4.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 27.447 13.655 4.370 1.00 0.00 H new ATOM 2894 N GLY A 45 21.181 8.796 1.994 1.00 0.00 N ATOM 2895 CA GLY A 45 19.958 8.910 1.220 1.00 0.00 C ATOM 2896 C GLY A 45 18.883 9.644 1.993 1.00 0.00 C ATOM 2897 O GLY A 45 19.162 10.440 2.891 1.00 0.00 O ATOM 0 H GLY A 45 21.063 8.409 2.930 1.00 0.00 H new ATOM 0 HA2 GLY A 45 20.163 9.437 0.288 1.00 0.00 H new ATOM 0 HA3 GLY A 45 19.601 7.916 0.952 1.00 0.00 H new ATOM 2901 N LEU A 46 17.649 9.351 1.632 1.00 0.00 N ATOM 2902 CA LEU A 46 16.498 9.948 2.271 1.00 0.00 C ATOM 2903 C LEU A 46 15.454 8.873 2.478 1.00 0.00 C ATOM 2904 O LEU A 46 15.072 8.184 1.533 1.00 0.00 O ATOM 2905 CB LEU A 46 15.900 11.044 1.390 1.00 0.00 C ATOM 2906 CG LEU A 46 14.982 11.937 2.226 1.00 0.00 C ATOM 2907 CD1 LEU A 46 15.788 13.092 2.820 1.00 0.00 C ATOM 2908 CD2 LEU A 46 13.868 12.491 1.335 1.00 0.00 C ATOM 0 H LEU A 46 17.419 8.693 0.888 1.00 0.00 H new ATOM 0 HA LEU A 46 16.805 10.386 3.221 1.00 0.00 H new ATOM 0 HB2 LEU A 46 16.696 11.641 0.945 1.00 0.00 H new ATOM 0 HB3 LEU A 46 15.339 10.598 0.569 1.00 0.00 H new ATOM 0 HG LEU A 46 14.545 11.353 3.036 1.00 0.00 H new ATOM 0 HD11 LEU A 46 15.131 13.726 3.415 1.00 0.00 H new ATOM 0 HD12 LEU A 46 16.580 12.694 3.454 1.00 0.00 H new ATOM 0 HD13 LEU A 46 16.228 13.680 2.015 1.00 0.00 H new ATOM 0 HD21 LEU A 46 13.211 13.128 1.927 1.00 0.00 H new ATOM 0 HD22 LEU A 46 14.306 13.074 0.525 1.00 0.00 H new ATOM 0 HD23 LEU A 46 13.292 11.665 0.917 1.00 0.00 H new ATOM 2920 N VAL A 47 14.979 8.738 3.696 1.00 0.00 N ATOM 2921 CA VAL A 47 13.963 7.754 3.971 1.00 0.00 C ATOM 2922 C VAL A 47 12.617 8.425 3.986 1.00 0.00 C ATOM 2923 O VAL A 47 12.323 9.213 4.887 1.00 0.00 O ATOM 2924 CB VAL A 47 14.199 7.085 5.320 1.00 0.00 C ATOM 2925 CG1 VAL A 47 12.943 6.309 5.716 1.00 0.00 C ATOM 2926 CG2 VAL A 47 15.374 6.115 5.205 1.00 0.00 C ATOM 0 H VAL A 47 15.276 9.290 4.500 1.00 0.00 H new ATOM 0 HA VAL A 47 14.002 6.992 3.193 1.00 0.00 H new ATOM 0 HB VAL A 47 14.422 7.841 6.073 1.00 0.00 H new ATOM 0 HG11 VAL A 47 13.102 5.827 6.680 1.00 0.00 H new ATOM 0 HG12 VAL A 47 12.099 6.995 5.788 1.00 0.00 H new ATOM 0 HG13 VAL A 47 12.731 5.551 4.962 1.00 0.00 H new ATOM 0 HG21 VAL A 47 15.545 5.635 6.169 1.00 0.00 H new ATOM 0 HG22 VAL A 47 15.147 5.356 4.457 1.00 0.00 H new ATOM 0 HG23 VAL A 47 16.269 6.661 4.908 1.00 0.00 H new ATOM 2936 N TYR A 48 11.797 8.127 2.991 1.00 0.00 N ATOM 2937 CA TYR A 48 10.482 8.744 2.946 1.00 0.00 C ATOM 2938 C TYR A 48 9.400 7.714 2.638 1.00 0.00 C ATOM 2939 O TYR A 48 9.654 6.666 2.042 1.00 0.00 O ATOM 2940 CB TYR A 48 10.454 9.874 1.918 1.00 0.00 C ATOM 2941 CG TYR A 48 10.555 9.326 0.521 1.00 0.00 C ATOM 2942 CD1 TYR A 48 9.387 8.965 -0.155 1.00 0.00 C ATOM 2943 CD2 TYR A 48 11.802 9.207 -0.112 1.00 0.00 C ATOM 2944 CE1 TYR A 48 9.459 8.484 -1.465 1.00 0.00 C ATOM 2945 CE2 TYR A 48 11.876 8.723 -1.423 1.00 0.00 C ATOM 2946 CZ TYR A 48 10.705 8.365 -2.101 1.00 0.00 C ATOM 2947 OH TYR A 48 10.773 7.888 -3.390 1.00 0.00 O ATOM 0 H TYR A 48 12.008 7.484 2.228 1.00 0.00 H new ATOM 0 HA TYR A 48 10.275 9.164 3.930 1.00 0.00 H new ATOM 0 HB2 TYR A 48 9.532 10.445 2.024 1.00 0.00 H new ATOM 0 HB3 TYR A 48 11.279 10.562 2.104 1.00 0.00 H new ATOM 0 HD1 TYR A 48 8.429 9.058 0.335 1.00 0.00 H new ATOM 0 HD2 TYR A 48 12.703 9.489 0.412 1.00 0.00 H new ATOM 0 HE1 TYR A 48 8.557 8.204 -1.988 1.00 0.00 H new ATOM 0 HE2 TYR A 48 12.835 8.626 -1.911 1.00 0.00 H new ATOM 0 HH TYR A 48 10.547 8.607 -4.017 1.00 0.00 H new ATOM 2957 N ILE A 49 8.189 8.028 3.078 1.00 0.00 N ATOM 2958 CA ILE A 49 7.050 7.155 2.893 1.00 0.00 C ATOM 2959 C ILE A 49 5.975 7.859 2.099 1.00 0.00 C ATOM 2960 O ILE A 49 5.727 9.037 2.317 1.00 0.00 O ATOM 2961 CB ILE A 49 6.514 6.742 4.251 1.00 0.00 C ATOM 2962 CG1 ILE A 49 7.569 5.893 4.967 1.00 0.00 C ATOM 2963 CG2 ILE A 49 5.240 5.935 4.053 1.00 0.00 C ATOM 2964 CD1 ILE A 49 7.124 5.636 6.404 1.00 0.00 C ATOM 0 H ILE A 49 7.974 8.894 3.572 1.00 0.00 H new ATOM 0 HA ILE A 49 7.359 6.268 2.340 1.00 0.00 H new ATOM 0 HB ILE A 49 6.293 7.622 4.855 1.00 0.00 H new ATOM 0 HG12 ILE A 49 7.707 4.947 4.443 1.00 0.00 H new ATOM 0 HG13 ILE A 49 8.531 6.406 4.959 1.00 0.00 H new ATOM 0 HG21 ILE A 49 4.846 5.633 5.023 1.00 0.00 H new ATOM 0 HG22 ILE A 49 4.500 6.545 3.535 1.00 0.00 H new ATOM 0 HG23 ILE A 49 5.460 5.048 3.459 1.00 0.00 H new ATOM 0 HD11 ILE A 49 7.874 5.032 6.915 1.00 0.00 H new ATOM 0 HD12 ILE A 49 7.008 6.587 6.924 1.00 0.00 H new ATOM 0 HD13 ILE A 49 6.172 5.106 6.401 1.00 0.00 H new ATOM 2976 N GLN A 50 5.358 7.133 1.171 1.00 0.00 N ATOM 2977 CA GLN A 50 4.307 7.699 0.337 1.00 0.00 C ATOM 2978 C GLN A 50 3.145 6.728 0.234 1.00 0.00 C ATOM 2979 O GLN A 50 3.338 5.552 -0.038 1.00 0.00 O ATOM 2980 CB GLN A 50 4.836 7.982 -1.068 1.00 0.00 C ATOM 2981 CG GLN A 50 3.705 8.565 -1.919 1.00 0.00 C ATOM 2982 CD GLN A 50 3.416 7.663 -3.112 1.00 0.00 C ATOM 2983 OE1 GLN A 50 2.257 7.373 -3.403 1.00 0.00 O ATOM 2984 NE2 GLN A 50 4.402 7.200 -3.826 1.00 0.00 N ATOM 0 H GLN A 50 5.568 6.154 0.979 1.00 0.00 H new ATOM 0 HA GLN A 50 3.973 8.630 0.795 1.00 0.00 H new ATOM 0 HB2 GLN A 50 5.671 8.681 -1.022 1.00 0.00 H new ATOM 0 HB3 GLN A 50 5.213 7.065 -1.520 1.00 0.00 H new ATOM 0 HG2 GLN A 50 2.806 8.676 -1.313 1.00 0.00 H new ATOM 0 HG3 GLN A 50 3.980 9.561 -2.267 1.00 0.00 H new ATOM 0 HE21 GLN A 50 5.363 7.441 -3.585 1.00 0.00 H new ATOM 0 HE22 GLN A 50 4.213 6.597 -4.627 1.00 0.00 H new ATOM 2993 N GLN A 51 1.937 7.222 0.427 1.00 0.00 N ATOM 2994 CA GLN A 51 0.768 6.375 0.332 1.00 0.00 C ATOM 2995 C GLN A 51 0.076 6.591 -0.997 1.00 0.00 C ATOM 2996 O GLN A 51 -0.271 7.715 -1.357 1.00 0.00 O ATOM 2997 CB GLN A 51 -0.191 6.677 1.472 1.00 0.00 C ATOM 2998 CG GLN A 51 -1.462 5.851 1.304 1.00 0.00 C ATOM 2999 CD GLN A 51 -2.399 6.127 2.466 1.00 0.00 C ATOM 3000 OE1 GLN A 51 -2.805 7.269 2.685 1.00 0.00 O ATOM 3001 NE2 GLN A 51 -2.760 5.143 3.229 1.00 0.00 N ATOM 0 H GLN A 51 1.742 8.198 0.649 1.00 0.00 H new ATOM 0 HA GLN A 51 1.083 5.334 0.402 1.00 0.00 H new ATOM 0 HB2 GLN A 51 0.280 6.447 2.428 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -0.435 7.739 1.484 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -1.950 6.101 0.362 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -1.217 4.790 1.264 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -2.419 4.200 3.041 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -3.385 5.312 4.017 1.00 0.00 H new ATOM 3010 N THR A 52 -0.121 5.505 -1.723 1.00 0.00 N ATOM 3011 CA THR A 52 -0.773 5.588 -3.015 1.00 0.00 C ATOM 3012 C THR A 52 -2.276 5.558 -2.889 1.00 0.00 C ATOM 3013 O THR A 52 -2.827 5.314 -1.816 1.00 0.00 O ATOM 3014 CB THR A 52 -0.279 4.480 -3.929 1.00 0.00 C ATOM 3015 OG1 THR A 52 -0.257 3.243 -3.227 1.00 0.00 O ATOM 3016 CG2 THR A 52 1.119 4.864 -4.399 1.00 0.00 C ATOM 0 H THR A 52 0.158 4.565 -1.443 1.00 0.00 H new ATOM 0 HA THR A 52 -0.510 6.548 -3.459 1.00 0.00 H new ATOM 0 HB THR A 52 -0.941 4.358 -4.786 1.00 0.00 H new ATOM 0 HG1 THR A 52 0.512 2.713 -3.523 1.00 0.00 H new ATOM 0 HG21 THR A 52 1.507 4.088 -5.060 1.00 0.00 H new ATOM 0 HG22 THR A 52 1.075 5.811 -4.938 1.00 0.00 H new ATOM 0 HG23 THR A 52 1.777 4.968 -3.536 1.00 0.00 H new ATOM 3024 N ASP A 53 -2.942 5.800 -4.007 1.00 0.00 N ATOM 3025 CA ASP A 53 -4.390 5.785 -4.022 1.00 0.00 C ATOM 3026 C ASP A 53 -4.889 4.378 -3.716 1.00 0.00 C ATOM 3027 O ASP A 53 -6.079 4.172 -3.478 1.00 0.00 O ATOM 3028 CB ASP A 53 -4.918 6.238 -5.386 1.00 0.00 C ATOM 3029 CG ASP A 53 -4.699 7.738 -5.567 1.00 0.00 C ATOM 3030 OD1 ASP A 53 -4.384 8.393 -4.586 1.00 0.00 O ATOM 3031 OD2 ASP A 53 -4.856 8.209 -6.681 1.00 0.00 O1- ATOM 0 H ASP A 53 -2.506 6.007 -4.905 1.00 0.00 H new ATOM 0 HA ASP A 53 -4.756 6.475 -3.262 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -4.410 5.691 -6.180 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -5.980 6.006 -5.468 1.00 0.00 H new ATOM 3036 N ASP A 54 -3.972 3.404 -3.708 1.00 0.00 N ATOM 3037 CA ASP A 54 -4.349 2.031 -3.413 1.00 0.00 C ATOM 3038 C ASP A 54 -4.243 1.759 -1.910 1.00 0.00 C ATOM 3039 O ASP A 54 -4.422 0.625 -1.469 1.00 0.00 O ATOM 3040 CB ASP A 54 -3.456 1.057 -4.190 1.00 0.00 C ATOM 3041 CG ASP A 54 -3.793 1.122 -5.677 1.00 0.00 C ATOM 3042 OD1 ASP A 54 -4.827 1.683 -6.006 1.00 0.00 O ATOM 3043 OD2 ASP A 54 -3.016 0.610 -6.464 1.00 0.00 O1- ATOM 0 H ASP A 54 -2.980 3.544 -3.900 1.00 0.00 H new ATOM 0 HA ASP A 54 -5.384 1.882 -3.722 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -2.407 1.308 -4.034 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -3.600 0.042 -3.819 1.00 0.00 H new ATOM 3048 N SER A 55 -3.948 2.811 -1.134 1.00 0.00 N ATOM 3049 CA SER A 55 -3.815 2.698 0.310 1.00 0.00 C ATOM 3050 C SER A 55 -2.647 1.798 0.670 1.00 0.00 C ATOM 3051 O SER A 55 -2.589 1.220 1.756 1.00 0.00 O ATOM 3052 CB SER A 55 -5.102 2.162 0.917 1.00 0.00 C ATOM 3053 OG SER A 55 -6.174 3.038 0.589 1.00 0.00 O ATOM 0 H SER A 55 -3.797 3.754 -1.494 1.00 0.00 H new ATOM 0 HA SER A 55 -3.622 3.690 0.718 1.00 0.00 H new ATOM 0 HB2 SER A 55 -5.307 1.160 0.539 1.00 0.00 H new ATOM 0 HB3 SER A 55 -5.001 2.080 1.999 1.00 0.00 H new ATOM 0 HG SER A 55 -7.006 2.696 0.977 1.00 0.00 H new ATOM 3059 N LEU A 56 -1.704 1.721 -0.246 1.00 0.00 N ATOM 3060 CA LEU A 56 -0.513 0.946 -0.054 1.00 0.00 C ATOM 3061 C LEU A 56 0.600 1.898 0.310 1.00 0.00 C ATOM 3062 O LEU A 56 0.886 2.847 -0.420 1.00 0.00 O ATOM 3063 CB LEU A 56 -0.183 0.200 -1.339 1.00 0.00 C ATOM 3064 CG LEU A 56 -1.378 -0.663 -1.736 1.00 0.00 C ATOM 3065 CD1 LEU A 56 -1.060 -1.405 -3.031 1.00 0.00 C ATOM 3066 CD2 LEU A 56 -1.675 -1.673 -0.626 1.00 0.00 C ATOM 0 H LEU A 56 -1.750 2.199 -1.146 1.00 0.00 H new ATOM 0 HA LEU A 56 -0.646 0.212 0.740 1.00 0.00 H new ATOM 0 HB2 LEU A 56 0.051 0.907 -2.135 1.00 0.00 H new ATOM 0 HB3 LEU A 56 0.700 -0.423 -1.196 1.00 0.00 H new ATOM 0 HG LEU A 56 -2.250 -0.027 -1.886 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -1.912 -2.022 -3.316 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -0.853 -0.684 -3.822 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -0.187 -2.040 -2.882 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -2.528 -2.288 -0.912 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -0.804 -2.310 -0.472 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -1.904 -1.142 0.298 1.00 0.00 H new ATOM 3078 N ILE A 57 1.202 1.658 1.451 1.00 0.00 N ATOM 3079 CA ILE A 57 2.263 2.513 1.910 1.00 0.00 C ATOM 3080 C ILE A 57 3.546 2.127 1.219 1.00 0.00 C ATOM 3081 O ILE A 57 3.964 0.978 1.268 1.00 0.00 O ATOM 3082 CB ILE A 57 2.411 2.375 3.424 1.00 0.00 C ATOM 3083 CG1 ILE A 57 1.085 2.742 4.095 1.00 0.00 C ATOM 3084 CG2 ILE A 57 3.529 3.277 3.935 1.00 0.00 C ATOM 3085 CD1 ILE A 57 0.678 4.175 3.730 1.00 0.00 C ATOM 0 H ILE A 57 0.975 0.882 2.073 1.00 0.00 H new ATOM 0 HA ILE A 57 2.031 3.552 1.674 1.00 0.00 H new ATOM 0 HB ILE A 57 2.668 1.344 3.667 1.00 0.00 H new ATOM 0 HG12 ILE A 57 0.307 2.046 3.782 1.00 0.00 H new ATOM 0 HG13 ILE A 57 1.180 2.649 5.177 1.00 0.00 H new ATOM 0 HG21 ILE A 57 3.621 3.166 5.015 1.00 0.00 H new ATOM 0 HG22 ILE A 57 4.469 2.996 3.460 1.00 0.00 H new ATOM 0 HG23 ILE A 57 3.298 4.315 3.695 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -0.267 4.420 4.215 1.00 0.00 H new ATOM 0 HD12 ILE A 57 1.449 4.869 4.066 1.00 0.00 H new ATOM 0 HD13 ILE A 57 0.562 4.256 2.649 1.00 0.00 H new ATOM 3097 N HIS A 58 4.148 3.092 0.557 1.00 0.00 N ATOM 3098 CA HIS A 58 5.376 2.844 -0.172 1.00 0.00 C ATOM 3099 C HIS A 58 6.587 3.297 0.636 1.00 0.00 C ATOM 3100 O HIS A 58 6.761 4.486 0.896 1.00 0.00 O ATOM 3101 CB HIS A 58 5.321 3.590 -1.508 1.00 0.00 C ATOM 3102 CG HIS A 58 4.247 2.984 -2.382 1.00 0.00 C ATOM 3103 ND1 HIS A 58 4.540 2.091 -3.401 1.00 0.00 N ATOM 3104 CD2 HIS A 58 2.877 3.131 -2.399 1.00 0.00 C ATOM 3105 CE1 HIS A 58 3.375 1.741 -3.980 1.00 0.00 C ATOM 3106 NE2 HIS A 58 2.336 2.341 -3.407 1.00 0.00 N ATOM 0 H HIS A 58 3.809 4.053 0.508 1.00 0.00 H new ATOM 0 HA HIS A 58 5.476 1.774 -0.352 1.00 0.00 H new ATOM 0 HB2 HIS A 58 5.113 4.646 -1.338 1.00 0.00 H new ATOM 0 HB3 HIS A 58 6.287 3.532 -2.009 1.00 0.00 H new ATOM 0 HD1 HIS A 58 5.468 1.760 -3.664 1.00 0.00 H new ATOM 0 HD2 HIS A 58 2.310 3.763 -1.731 1.00 0.00 H new ATOM 0 HE1 HIS A 58 3.295 1.055 -4.810 1.00 0.00 H new ATOM 3114 N PHE A 59 7.431 2.341 1.010 1.00 0.00 N ATOM 3115 CA PHE A 59 8.636 2.659 1.760 1.00 0.00 C ATOM 3116 C PHE A 59 9.781 2.806 0.777 1.00 0.00 C ATOM 3117 O PHE A 59 10.218 1.821 0.179 1.00 0.00 O ATOM 3118 CB PHE A 59 8.971 1.545 2.758 1.00 0.00 C ATOM 3119 CG PHE A 59 10.197 1.923 3.562 1.00 0.00 C ATOM 3120 CD1 PHE A 59 10.050 2.559 4.803 1.00 0.00 C ATOM 3121 CD2 PHE A 59 11.476 1.632 3.071 1.00 0.00 C ATOM 3122 CE1 PHE A 59 11.184 2.902 5.552 1.00 0.00 C ATOM 3123 CE2 PHE A 59 12.609 1.978 3.820 1.00 0.00 C ATOM 3124 CZ PHE A 59 12.461 2.612 5.059 1.00 0.00 C ATOM 0 H PHE A 59 7.303 1.350 0.808 1.00 0.00 H new ATOM 0 HA PHE A 59 8.478 3.582 2.318 1.00 0.00 H new ATOM 0 HB2 PHE A 59 8.126 1.377 3.425 1.00 0.00 H new ATOM 0 HB3 PHE A 59 9.148 0.610 2.226 1.00 0.00 H new ATOM 0 HD1 PHE A 59 9.064 2.784 5.181 1.00 0.00 H new ATOM 0 HD2 PHE A 59 11.589 1.141 2.116 1.00 0.00 H new ATOM 0 HE1 PHE A 59 11.072 3.390 6.509 1.00 0.00 H new ATOM 0 HE2 PHE A 59 13.596 1.756 3.441 1.00 0.00 H new ATOM 0 HZ PHE A 59 13.334 2.878 5.636 1.00 0.00 H new ATOM 3134 N CYS A 60 10.237 4.033 0.580 1.00 0.00 N ATOM 3135 CA CYS A 60 11.301 4.271 -0.377 1.00 0.00 C ATOM 3136 C CYS A 60 12.515 4.951 0.237 1.00 0.00 C ATOM 3137 O CYS A 60 12.406 5.799 1.127 1.00 0.00 O ATOM 3138 CB CYS A 60 10.768 5.128 -1.517 1.00 0.00 C ATOM 3139 SG CYS A 60 9.455 4.243 -2.401 1.00 0.00 S ATOM 0 H CYS A 60 9.894 4.864 1.061 1.00 0.00 H new ATOM 0 HA CYS A 60 11.630 3.297 -0.739 1.00 0.00 H new ATOM 0 HB2 CYS A 60 10.383 6.069 -1.125 1.00 0.00 H new ATOM 0 HB3 CYS A 60 11.577 5.376 -2.205 1.00 0.00 H new ATOM 0 HG CYS A 60 9.575 4.451 -3.679 1.00 0.00 H new ATOM 3145 N TRP A 61 13.671 4.578 -0.294 1.00 0.00 N ATOM 3146 CA TRP A 61 14.943 5.138 0.126 1.00 0.00 C ATOM 3147 C TRP A 61 15.643 5.666 -1.110 1.00 0.00 C ATOM 3148 O TRP A 61 15.985 4.912 -2.027 1.00 0.00 O ATOM 3149 CB TRP A 61 15.809 4.072 0.804 1.00 0.00 C ATOM 3150 CG TRP A 61 17.105 4.664 1.238 1.00 0.00 C ATOM 3151 CD1 TRP A 61 17.337 5.266 2.423 1.00 0.00 C ATOM 3152 CD2 TRP A 61 18.358 4.704 0.507 1.00 0.00 C ATOM 3153 NE1 TRP A 61 18.659 5.672 2.468 1.00 0.00 N ATOM 3154 CE2 TRP A 61 19.326 5.351 1.305 1.00 0.00 C ATOM 3155 CE3 TRP A 61 18.737 4.246 -0.760 1.00 0.00 C ATOM 3156 CZ2 TRP A 61 20.632 5.538 0.856 1.00 0.00 C ATOM 3157 CZ3 TRP A 61 20.050 4.425 -1.220 1.00 0.00 C ATOM 3158 CH2 TRP A 61 21.003 5.074 -0.411 1.00 0.00 C ATOM 0 H TRP A 61 13.751 3.876 -1.030 1.00 0.00 H new ATOM 0 HA TRP A 61 14.778 5.938 0.848 1.00 0.00 H new ATOM 0 HB2 TRP A 61 15.283 3.659 1.665 1.00 0.00 H new ATOM 0 HB3 TRP A 61 15.990 3.247 0.115 1.00 0.00 H new ATOM 0 HD1 TRP A 61 16.609 5.408 3.208 1.00 0.00 H new ATOM 0 HE1 TRP A 61 19.086 6.149 3.262 1.00 0.00 H new ATOM 0 HE3 TRP A 61 18.012 3.750 -1.389 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 21.355 6.039 1.483 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 20.331 4.064 -2.198 1.00 0.00 H new ATOM 0 HH2 TRP A 61 22.013 5.213 -0.766 1.00 0.00 H new ATOM 3169 N LYS A 62 15.820 6.967 -1.147 1.00 0.00 N ATOM 3170 CA LYS A 62 16.448 7.611 -2.279 1.00 0.00 C ATOM 3171 C LYS A 62 17.853 8.058 -1.926 1.00 0.00 C ATOM 3172 O LYS A 62 18.078 8.669 -0.885 1.00 0.00 O ATOM 3173 CB LYS A 62 15.590 8.805 -2.704 1.00 0.00 C ATOM 3174 CG LYS A 62 16.465 9.955 -3.207 1.00 0.00 C ATOM 3175 CD LYS A 62 15.566 11.063 -3.753 1.00 0.00 C ATOM 3176 CE LYS A 62 14.868 11.767 -2.597 1.00 0.00 C ATOM 3177 NZ LYS A 62 14.119 12.947 -3.115 1.00 0.00 N1+ ATOM 0 H LYS A 62 15.536 7.603 -0.402 1.00 0.00 H new ATOM 0 HA LYS A 62 16.524 6.905 -3.106 1.00 0.00 H new ATOM 0 HB2 LYS A 62 14.898 8.499 -3.489 1.00 0.00 H new ATOM 0 HB3 LYS A 62 14.987 9.143 -1.861 1.00 0.00 H new ATOM 0 HG2 LYS A 62 17.085 10.338 -2.397 1.00 0.00 H new ATOM 0 HG3 LYS A 62 17.141 9.601 -3.985 1.00 0.00 H new ATOM 0 HD2 LYS A 62 16.158 11.778 -4.324 1.00 0.00 H new ATOM 0 HD3 LYS A 62 14.828 10.643 -4.436 1.00 0.00 H new ATOM 0 HE2 LYS A 62 14.185 11.080 -2.097 1.00 0.00 H new ATOM 0 HE3 LYS A 62 15.600 12.085 -1.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 13.642 13.429 -2.326 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 14.782 13.605 -3.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 13.410 12.632 -3.808 1.00 0.00 H new ATOM 3191 N ASP A 63 18.799 7.755 -2.798 1.00 0.00 N ATOM 3192 CA ASP A 63 20.176 8.149 -2.553 1.00 0.00 C ATOM 3193 C ASP A 63 20.316 9.644 -2.798 1.00 0.00 C ATOM 3194 O ASP A 63 19.821 10.159 -3.795 1.00 0.00 O ATOM 3195 CB ASP A 63 21.127 7.377 -3.465 1.00 0.00 C ATOM 3196 CG ASP A 63 22.569 7.630 -3.038 1.00 0.00 C ATOM 3197 OD1 ASP A 63 22.764 8.373 -2.091 1.00 0.00 O ATOM 3198 OD2 ASP A 63 23.458 7.078 -3.666 1.00 0.00 O1- ATOM 0 H ASP A 63 18.644 7.246 -3.668 1.00 0.00 H new ATOM 0 HA ASP A 63 20.436 7.919 -1.520 1.00 0.00 H new ATOM 0 HB2 ASP A 63 20.906 6.311 -3.418 1.00 0.00 H new ATOM 0 HB3 ASP A 63 20.985 7.687 -4.500 1.00 0.00 H new ATOM 3203 N ARG A 64 20.984 10.343 -1.890 1.00 0.00 N ATOM 3204 CA ARG A 64 21.162 11.781 -2.050 1.00 0.00 C ATOM 3205 C ARG A 64 22.222 12.079 -3.108 1.00 0.00 C ATOM 3206 O ARG A 64 22.316 13.199 -3.608 1.00 0.00 O ATOM 3207 CB ARG A 64 21.562 12.445 -0.727 1.00 0.00 C ATOM 3208 CG ARG A 64 20.374 12.455 0.238 1.00 0.00 C ATOM 3209 CD ARG A 64 20.598 13.537 1.296 1.00 0.00 C ATOM 3210 NE ARG A 64 20.519 14.856 0.670 1.00 0.00 N ATOM 3211 CZ ARG A 64 20.896 15.967 1.306 1.00 0.00 C ATOM 3212 NH1 ARG A 64 21.357 15.918 2.529 1.00 0.00 N1+ ATOM 3213 NH2 ARG A 64 20.801 17.117 0.697 1.00 0.00 N ATOM 0 H ARG A 64 21.405 9.947 -1.049 1.00 0.00 H new ATOM 0 HA ARG A 64 20.205 12.193 -2.371 1.00 0.00 H new ATOM 0 HB2 ARG A 64 22.399 11.908 -0.280 1.00 0.00 H new ATOM 0 HB3 ARG A 64 21.900 13.465 -0.911 1.00 0.00 H new ATOM 0 HG2 ARG A 64 19.449 12.647 -0.306 1.00 0.00 H new ATOM 0 HG3 ARG A 64 20.268 11.480 0.714 1.00 0.00 H new ATOM 0 HD2 ARG A 64 19.849 13.451 2.083 1.00 0.00 H new ATOM 0 HD3 ARG A 64 21.572 13.404 1.767 1.00 0.00 H new ATOM 0 HE ARG A 64 20.164 14.929 -0.284 1.00 0.00 H new ATOM 0 HH11 ARG A 64 21.432 15.022 3.010 1.00 0.00 H new ATOM 0 HH12 ARG A 64 21.641 16.776 3.002 1.00 0.00 H new ATOM 0 HH21 ARG A 64 20.441 17.161 -0.256 1.00 0.00 H new ATOM 0 HH22 ARG A 64 21.086 17.972 1.174 1.00 0.00 H new ATOM 3227 N THR A 65 23.017 11.069 -3.438 1.00 0.00 N ATOM 3228 CA THR A 65 24.069 11.217 -4.424 1.00 0.00 C ATOM 3229 C THR A 65 23.514 11.616 -5.787 1.00 0.00 C ATOM 3230 O THR A 65 24.041 12.512 -6.445 1.00 0.00 O ATOM 3231 CB THR A 65 24.815 9.895 -4.542 1.00 0.00 C ATOM 3232 OG1 THR A 65 25.509 9.629 -3.329 1.00 0.00 O ATOM 3233 CG2 THR A 65 25.788 9.962 -5.706 1.00 0.00 C ATOM 0 H THR A 65 22.949 10.136 -3.032 1.00 0.00 H new ATOM 0 HA THR A 65 24.741 12.011 -4.098 1.00 0.00 H new ATOM 0 HB THR A 65 24.105 9.088 -4.724 1.00 0.00 H new ATOM 0 HG1 THR A 65 24.894 9.226 -2.682 1.00 0.00 H new ATOM 0 HG21 THR A 65 26.321 9.015 -5.789 1.00 0.00 H new ATOM 0 HG22 THR A 65 25.239 10.152 -6.628 1.00 0.00 H new ATOM 0 HG23 THR A 65 26.503 10.767 -5.537 1.00 0.00 H new ATOM 3241 N SER A 66 22.445 10.955 -6.193 1.00 0.00 N ATOM 3242 CA SER A 66 21.815 11.252 -7.470 1.00 0.00 C ATOM 3243 C SER A 66 20.403 11.770 -7.239 1.00 0.00 C ATOM 3244 O SER A 66 19.796 12.373 -8.123 1.00 0.00 O ATOM 3245 CB SER A 66 21.772 9.993 -8.334 1.00 0.00 C ATOM 3246 OG SER A 66 21.034 8.983 -7.657 1.00 0.00 O ATOM 0 H SER A 66 21.995 10.211 -5.660 1.00 0.00 H new ATOM 0 HA SER A 66 22.396 12.016 -7.986 1.00 0.00 H new ATOM 0 HB2 SER A 66 21.310 10.214 -9.296 1.00 0.00 H new ATOM 0 HB3 SER A 66 22.784 9.644 -8.539 1.00 0.00 H new ATOM 0 HG SER A 66 21.373 8.101 -7.916 1.00 0.00 H new ATOM 3252 N GLY A 67 19.887 11.523 -6.039 1.00 0.00 N ATOM 3253 CA GLY A 67 18.544 11.957 -5.690 1.00 0.00 C ATOM 3254 C GLY A 67 17.501 11.051 -6.332 1.00 0.00 C ATOM 3255 O GLY A 67 16.347 11.440 -6.516 1.00 0.00 O ATOM 0 H GLY A 67 20.379 11.026 -5.296 1.00 0.00 H new ATOM 0 HA2 GLY A 67 18.424 11.948 -4.607 1.00 0.00 H new ATOM 0 HA3 GLY A 67 18.392 12.985 -6.019 1.00 0.00 H new ATOM 3259 N ASN A 68 17.916 9.839 -6.677 1.00 0.00 N ATOM 3260 CA ASN A 68 17.015 8.881 -7.294 1.00 0.00 C ATOM 3261 C ASN A 68 16.544 7.859 -6.266 1.00 0.00 C ATOM 3262 O ASN A 68 17.241 7.583 -5.288 1.00 0.00 O ATOM 3263 CB ASN A 68 17.724 8.175 -8.445 1.00 0.00 C ATOM 3264 CG ASN A 68 18.789 7.232 -7.905 1.00 0.00 C ATOM 3265 OD1 ASN A 68 19.252 7.395 -6.775 1.00 0.00 O ATOM 3266 ND2 ASN A 68 19.209 6.245 -8.648 1.00 0.00 N ATOM 0 H ASN A 68 18.868 9.499 -6.540 1.00 0.00 H new ATOM 0 HA ASN A 68 16.145 9.412 -7.680 1.00 0.00 H new ATOM 0 HB2 ASN A 68 17.001 7.617 -9.040 1.00 0.00 H new ATOM 0 HB3 ASN A 68 18.181 8.911 -9.107 1.00 0.00 H new ATOM 0 HD21 ASN A 68 19.922 5.607 -8.293 1.00 0.00 H new ATOM 0 HD22 ASN A 68 18.825 6.111 -9.583 1.00 0.00 H new ATOM 3273 N VAL A 69 15.364 7.294 -6.484 1.00 0.00 N ATOM 3274 CA VAL A 69 14.836 6.309 -5.553 1.00 0.00 C ATOM 3275 C VAL A 69 15.482 4.954 -5.799 1.00 0.00 C ATOM 3276 O VAL A 69 15.127 4.242 -6.737 1.00 0.00 O ATOM 3277 CB VAL A 69 13.326 6.195 -5.726 1.00 0.00 C ATOM 3278 CG1 VAL A 69 12.777 5.144 -4.756 1.00 0.00 C ATOM 3279 CG2 VAL A 69 12.690 7.554 -5.427 1.00 0.00 C ATOM 0 H VAL A 69 14.764 7.497 -7.283 1.00 0.00 H new ATOM 0 HA VAL A 69 15.062 6.629 -4.536 1.00 0.00 H new ATOM 0 HB VAL A 69 13.091 5.895 -6.747 1.00 0.00 H new ATOM 0 HG11 VAL A 69 11.697 5.063 -4.880 1.00 0.00 H new ATOM 0 HG12 VAL A 69 13.240 4.179 -4.965 1.00 0.00 H new ATOM 0 HG13 VAL A 69 13.003 5.441 -3.732 1.00 0.00 H new ATOM 0 HG21 VAL A 69 11.609 7.484 -5.548 1.00 0.00 H new ATOM 0 HG22 VAL A 69 12.923 7.847 -4.403 1.00 0.00 H new ATOM 0 HG23 VAL A 69 13.085 8.300 -6.117 1.00 0.00 H new ATOM 3289 N GLU A 70 16.432 4.609 -4.937 1.00 0.00 N ATOM 3290 CA GLU A 70 17.129 3.337 -5.056 1.00 0.00 C ATOM 3291 C GLU A 70 16.264 2.190 -4.543 1.00 0.00 C ATOM 3292 O GLU A 70 16.356 1.068 -5.041 1.00 0.00 O ATOM 3293 CB GLU A 70 18.453 3.380 -4.293 1.00 0.00 C ATOM 3294 CG GLU A 70 19.203 2.061 -4.490 1.00 0.00 C ATOM 3295 CD GLU A 70 19.547 1.873 -5.965 1.00 0.00 C ATOM 3296 OE1 GLU A 70 19.558 2.860 -6.682 1.00 0.00 O ATOM 3297 OE2 GLU A 70 19.797 0.744 -6.356 1.00 0.00 O1- ATOM 0 H GLU A 70 16.734 5.189 -4.154 1.00 0.00 H new ATOM 0 HA GLU A 70 17.336 3.164 -6.112 1.00 0.00 H new ATOM 0 HB2 GLU A 70 19.061 4.212 -4.647 1.00 0.00 H new ATOM 0 HB3 GLU A 70 18.268 3.549 -3.232 1.00 0.00 H new ATOM 0 HG2 GLU A 70 20.114 2.058 -3.892 1.00 0.00 H new ATOM 0 HG3 GLU A 70 18.591 1.229 -4.142 1.00 0.00 H new ATOM 3304 N ASP A 71 15.438 2.469 -3.532 1.00 0.00 N ATOM 3305 CA ASP A 71 14.586 1.422 -2.959 1.00 0.00 C ATOM 3306 C ASP A 71 13.111 1.837 -2.951 1.00 0.00 C ATOM 3307 O ASP A 71 12.787 3.008 -2.751 1.00 0.00 O ATOM 3308 CB ASP A 71 15.012 1.123 -1.521 1.00 0.00 C ATOM 3309 CG ASP A 71 16.496 0.773 -1.470 1.00 0.00 C ATOM 3310 OD1 ASP A 71 16.913 -0.073 -2.245 1.00 0.00 O ATOM 3311 OD2 ASP A 71 17.192 1.354 -0.656 1.00 0.00 O1- ATOM 0 H ASP A 71 15.340 3.388 -3.101 1.00 0.00 H new ATOM 0 HA ASP A 71 14.702 0.535 -3.582 1.00 0.00 H new ATOM 0 HB2 ASP A 71 14.814 1.988 -0.888 1.00 0.00 H new ATOM 0 HB3 ASP A 71 14.423 0.296 -1.124 1.00 0.00 H new ATOM 3316 N ASP A 72 12.224 0.863 -3.165 1.00 0.00 N ATOM 3317 CA ASP A 72 10.783 1.125 -3.179 1.00 0.00 C ATOM 3318 C ASP A 72 10.004 -0.155 -2.883 1.00 0.00 C ATOM 3319 O ASP A 72 9.805 -0.988 -3.770 1.00 0.00 O ATOM 3320 CB ASP A 72 10.379 1.674 -4.550 1.00 0.00 C ATOM 3321 CG ASP A 72 8.893 2.017 -4.574 1.00 0.00 C ATOM 3322 OD1 ASP A 72 8.239 1.815 -3.565 1.00 0.00 O ATOM 3323 OD2 ASP A 72 8.429 2.475 -5.606 1.00 0.00 O1- ATOM 0 H ASP A 72 12.477 -0.111 -3.330 1.00 0.00 H new ATOM 0 HA ASP A 72 10.549 1.859 -2.408 1.00 0.00 H new ATOM 0 HB2 ASP A 72 10.967 2.563 -4.779 1.00 0.00 H new ATOM 0 HB3 ASP A 72 10.600 0.937 -5.322 1.00 0.00 H new ATOM 3328 N LEU A 73 9.569 -0.313 -1.634 1.00 0.00 N ATOM 3329 CA LEU A 73 8.823 -1.506 -1.241 1.00 0.00 C ATOM 3330 C LEU A 73 7.555 -1.130 -0.495 1.00 0.00 C ATOM 3331 O LEU A 73 7.582 -0.306 0.412 1.00 0.00 O ATOM 3332 CB LEU A 73 9.692 -2.379 -0.326 1.00 0.00 C ATOM 3333 CG LEU A 73 11.072 -2.586 -0.941 1.00 0.00 C ATOM 3334 CD1 LEU A 73 11.913 -3.444 0.005 1.00 0.00 C ATOM 3335 CD2 LEU A 73 10.946 -3.296 -2.292 1.00 0.00 C ATOM 0 H LEU A 73 9.718 0.362 -0.884 1.00 0.00 H new ATOM 0 HA LEU A 73 8.556 -2.053 -2.145 1.00 0.00 H new ATOM 0 HB2 LEU A 73 9.790 -1.907 0.652 1.00 0.00 H new ATOM 0 HB3 LEU A 73 9.209 -3.343 -0.167 1.00 0.00 H new ATOM 0 HG LEU A 73 11.548 -1.617 -1.093 1.00 0.00 H new ATOM 0 HD11 LEU A 73 12.902 -3.598 -0.426 1.00 0.00 H new ATOM 0 HD12 LEU A 73 12.010 -2.938 0.966 1.00 0.00 H new ATOM 0 HD13 LEU A 73 11.427 -4.409 0.151 1.00 0.00 H new ATOM 0 HD21 LEU A 73 11.937 -3.439 -2.722 1.00 0.00 H new ATOM 0 HD22 LEU A 73 10.469 -4.266 -2.150 1.00 0.00 H new ATOM 0 HD23 LEU A 73 10.342 -2.690 -2.967 1.00 0.00 H new ATOM 3347 N ILE A 74 6.448 -1.756 -0.864 1.00 0.00 N ATOM 3348 CA ILE A 74 5.185 -1.487 -0.209 1.00 0.00 C ATOM 3349 C ILE A 74 5.115 -2.217 1.121 1.00 0.00 C ATOM 3350 O ILE A 74 5.309 -3.429 1.185 1.00 0.00 O ATOM 3351 CB ILE A 74 4.050 -1.938 -1.117 1.00 0.00 C ATOM 3352 CG1 ILE A 74 4.071 -1.091 -2.383 1.00 0.00 C ATOM 3353 CG2 ILE A 74 2.708 -1.773 -0.417 1.00 0.00 C ATOM 3354 CD1 ILE A 74 3.103 -1.685 -3.392 1.00 0.00 C ATOM 0 H ILE A 74 6.402 -2.450 -1.610 1.00 0.00 H new ATOM 0 HA ILE A 74 5.096 -0.418 -0.017 1.00 0.00 H new ATOM 0 HB ILE A 74 4.184 -2.991 -1.364 1.00 0.00 H new ATOM 0 HG12 ILE A 74 3.791 -0.063 -2.153 1.00 0.00 H new ATOM 0 HG13 ILE A 74 5.078 -1.061 -2.800 1.00 0.00 H new ATOM 0 HG21 ILE A 74 1.908 -2.100 -1.081 1.00 0.00 H new ATOM 0 HG22 ILE A 74 2.695 -2.376 0.491 1.00 0.00 H new ATOM 0 HG23 ILE A 74 2.559 -0.725 -0.159 1.00 0.00 H new ATOM 0 HD11 ILE A 74 3.112 -1.085 -4.302 1.00 0.00 H new ATOM 0 HD12 ILE A 74 3.404 -2.706 -3.628 1.00 0.00 H new ATOM 0 HD13 ILE A 74 2.097 -1.692 -2.971 1.00 0.00 H new ATOM 3366 N ILE A 75 4.851 -1.472 2.184 1.00 0.00 N ATOM 3367 CA ILE A 75 4.784 -2.074 3.500 1.00 0.00 C ATOM 3368 C ILE A 75 3.352 -2.064 4.032 1.00 0.00 C ATOM 3369 O ILE A 75 2.698 -1.022 4.085 1.00 0.00 O ATOM 3370 CB ILE A 75 5.684 -1.314 4.457 1.00 0.00 C ATOM 3371 CG1 ILE A 75 7.044 -1.062 3.799 1.00 0.00 C ATOM 3372 CG2 ILE A 75 5.879 -2.140 5.726 1.00 0.00 C ATOM 3373 CD1 ILE A 75 7.635 -2.365 3.259 1.00 0.00 C ATOM 0 H ILE A 75 4.683 -0.466 2.160 1.00 0.00 H new ATOM 0 HA ILE A 75 5.118 -3.108 3.421 1.00 0.00 H new ATOM 0 HB ILE A 75 5.223 -0.358 4.706 1.00 0.00 H new ATOM 0 HG12 ILE A 75 6.933 -0.344 2.987 1.00 0.00 H new ATOM 0 HG13 ILE A 75 7.728 -0.620 4.524 1.00 0.00 H new ATOM 0 HG21 ILE A 75 6.525 -1.598 6.417 1.00 0.00 H new ATOM 0 HG22 ILE A 75 4.912 -2.318 6.197 1.00 0.00 H new ATOM 0 HG23 ILE A 75 6.339 -3.095 5.472 1.00 0.00 H new ATOM 0 HD11 ILE A 75 8.601 -2.162 2.796 1.00 0.00 H new ATOM 0 HD12 ILE A 75 7.767 -3.072 4.078 1.00 0.00 H new ATOM 0 HD13 ILE A 75 6.959 -2.791 2.517 1.00 0.00 H new ATOM 3385 N PHE A 76 2.879 -3.240 4.420 1.00 0.00 N ATOM 3386 CA PHE A 76 1.522 -3.396 4.950 1.00 0.00 C ATOM 3387 C PHE A 76 1.499 -3.253 6.468 1.00 0.00 C ATOM 3388 O PHE A 76 2.532 -3.359 7.127 1.00 0.00 O ATOM 3389 CB PHE A 76 0.975 -4.766 4.556 1.00 0.00 C ATOM 3390 CG PHE A 76 0.651 -4.753 3.086 1.00 0.00 C ATOM 3391 CD1 PHE A 76 1.666 -4.928 2.139 1.00 0.00 C ATOM 3392 CD2 PHE A 76 -0.668 -4.549 2.674 1.00 0.00 C ATOM 3393 CE1 PHE A 76 1.355 -4.900 0.775 1.00 0.00 C ATOM 3394 CE2 PHE A 76 -0.978 -4.525 1.312 1.00 0.00 C ATOM 3395 CZ PHE A 76 0.033 -4.699 0.361 1.00 0.00 C ATOM 0 H PHE A 76 3.414 -4.107 4.379 1.00 0.00 H new ATOM 0 HA PHE A 76 0.898 -2.609 4.526 1.00 0.00 H new ATOM 0 HB2 PHE A 76 1.708 -5.542 4.774 1.00 0.00 H new ATOM 0 HB3 PHE A 76 0.083 -4.998 5.137 1.00 0.00 H new ATOM 0 HD1 PHE A 76 2.685 -5.084 2.460 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -1.448 -4.410 3.408 1.00 0.00 H new ATOM 0 HE1 PHE A 76 2.136 -5.034 0.041 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -1.998 -4.372 0.993 1.00 0.00 H new ATOM 0 HZ PHE A 76 -0.206 -4.678 -0.692 1.00 0.00 H new ATOM 3405 N PRO A 77 0.350 -3.014 7.045 1.00 0.00 N ATOM 3406 CA PRO A 77 0.228 -2.870 8.524 1.00 0.00 C ATOM 3407 C PRO A 77 0.770 -4.099 9.245 1.00 0.00 C ATOM 3408 O PRO A 77 0.547 -5.232 8.819 1.00 0.00 O ATOM 3409 CB PRO A 77 -1.278 -2.720 8.749 1.00 0.00 C ATOM 3410 CG PRO A 77 -1.792 -2.179 7.463 1.00 0.00 C ATOM 3411 CD PRO A 77 -0.954 -2.845 6.379 1.00 0.00 C ATOM 0 HA PRO A 77 0.800 -2.028 8.913 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -1.741 -3.677 8.991 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -1.491 -2.044 9.578 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -2.850 -2.406 7.336 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -1.692 -1.094 7.425 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -1.378 -3.800 6.067 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -0.877 -2.224 5.486 1.00 0.00 H new ATOM 3419 N ASP A 78 1.486 -3.861 10.332 1.00 0.00 N ATOM 3420 CA ASP A 78 2.065 -4.950 11.114 1.00 0.00 C ATOM 3421 C ASP A 78 3.025 -5.804 10.275 1.00 0.00 C ATOM 3422 O ASP A 78 3.437 -6.881 10.703 1.00 0.00 O ATOM 3423 CB ASP A 78 0.944 -5.835 11.659 1.00 0.00 C ATOM 3424 CG ASP A 78 1.446 -6.654 12.844 1.00 0.00 C ATOM 3425 OD1 ASP A 78 2.450 -6.276 13.423 1.00 0.00 O ATOM 3426 OD2 ASP A 78 0.816 -7.652 13.155 1.00 0.00 O1- ATOM 0 H ASP A 78 1.682 -2.928 10.695 1.00 0.00 H new ATOM 0 HA ASP A 78 2.634 -4.510 11.933 1.00 0.00 H new ATOM 0 HB2 ASP A 78 0.100 -5.217 11.966 1.00 0.00 H new ATOM 0 HB3 ASP A 78 0.583 -6.501 10.875 1.00 0.00 H new ATOM 3431 N ASP A 79 3.384 -5.326 9.083 1.00 0.00 N ATOM 3432 CA ASP A 79 4.299 -6.070 8.220 1.00 0.00 C ATOM 3433 C ASP A 79 5.742 -5.853 8.655 1.00 0.00 C ATOM 3434 O ASP A 79 6.595 -6.710 8.433 1.00 0.00 O ATOM 3435 CB ASP A 79 4.124 -5.646 6.760 1.00 0.00 C ATOM 3436 CG ASP A 79 4.841 -6.623 5.831 1.00 0.00 C ATOM 3437 OD1 ASP A 79 5.512 -7.509 6.331 1.00 0.00 O ATOM 3438 OD2 ASP A 79 4.704 -6.470 4.627 1.00 0.00 O1- ATOM 0 H ASP A 79 3.060 -4.439 8.698 1.00 0.00 H new ATOM 0 HA ASP A 79 4.062 -7.130 8.309 1.00 0.00 H new ATOM 0 HB2 ASP A 79 3.064 -5.609 6.510 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.521 -4.641 6.617 1.00 0.00 H new ATOM 3443 N CYS A 80 6.008 -4.709 9.276 1.00 0.00 N ATOM 3444 CA CYS A 80 7.355 -4.409 9.740 1.00 0.00 C ATOM 3445 C CYS A 80 7.316 -3.490 10.945 1.00 0.00 C ATOM 3446 O CYS A 80 6.285 -2.918 11.281 1.00 0.00 O ATOM 3447 CB CYS A 80 8.164 -3.728 8.640 1.00 0.00 C ATOM 3448 SG CYS A 80 7.531 -2.055 8.446 1.00 0.00 S ATOM 0 H CYS A 80 5.317 -3.983 9.467 1.00 0.00 H new ATOM 0 HA CYS A 80 7.825 -5.354 10.013 1.00 0.00 H new ATOM 0 HB2 CYS A 80 9.222 -3.708 8.901 1.00 0.00 H new ATOM 0 HB3 CYS A 80 8.077 -4.280 7.704 1.00 0.00 H new ATOM 0 HG CYS A 80 6.234 -2.068 8.537 1.00 0.00 H new ATOM 3454 N GLU A 81 8.452 -3.379 11.593 1.00 0.00 N ATOM 3455 CA GLU A 81 8.574 -2.556 12.775 1.00 0.00 C ATOM 3456 C GLU A 81 9.816 -1.671 12.708 1.00 0.00 C ATOM 3457 O GLU A 81 10.911 -2.135 12.396 1.00 0.00 O ATOM 3458 CB GLU A 81 8.604 -3.486 13.989 1.00 0.00 C ATOM 3459 CG GLU A 81 9.423 -2.893 15.126 1.00 0.00 C ATOM 3460 CD GLU A 81 8.847 -1.542 15.538 1.00 0.00 C ATOM 3461 OE1 GLU A 81 7.717 -1.266 15.172 1.00 0.00 O ATOM 3462 OE2 GLU A 81 9.539 -0.810 16.222 1.00 0.00 O1- ATOM 0 H GLU A 81 9.313 -3.853 11.319 1.00 0.00 H new ATOM 0 HA GLU A 81 7.724 -1.878 12.852 1.00 0.00 H new ATOM 0 HB2 GLU A 81 7.586 -3.672 14.331 1.00 0.00 H new ATOM 0 HB3 GLU A 81 9.024 -4.449 13.700 1.00 0.00 H new ATOM 0 HG2 GLU A 81 9.422 -3.573 15.978 1.00 0.00 H new ATOM 0 HG3 GLU A 81 10.461 -2.775 14.814 1.00 0.00 H new ATOM 3469 N PHE A 82 9.635 -0.387 13.010 1.00 0.00 N ATOM 3470 CA PHE A 82 10.745 0.562 12.994 1.00 0.00 C ATOM 3471 C PHE A 82 11.149 0.864 14.428 1.00 0.00 C ATOM 3472 O PHE A 82 10.342 1.351 15.218 1.00 0.00 O ATOM 3473 CB PHE A 82 10.331 1.861 12.281 1.00 0.00 C ATOM 3474 CG PHE A 82 11.566 2.637 11.884 1.00 0.00 C ATOM 3475 CD1 PHE A 82 12.446 2.090 10.944 1.00 0.00 C ATOM 3476 CD2 PHE A 82 11.837 3.892 12.451 1.00 0.00 C ATOM 3477 CE1 PHE A 82 13.596 2.790 10.572 1.00 0.00 C ATOM 3478 CE2 PHE A 82 12.989 4.592 12.074 1.00 0.00 C ATOM 3479 CZ PHE A 82 13.870 4.041 11.137 1.00 0.00 C ATOM 0 H PHE A 82 8.735 0.018 13.267 1.00 0.00 H new ATOM 0 HA PHE A 82 11.586 0.129 12.453 1.00 0.00 H new ATOM 0 HB2 PHE A 82 9.735 1.629 11.398 1.00 0.00 H new ATOM 0 HB3 PHE A 82 9.705 2.465 12.938 1.00 0.00 H new ATOM 0 HD1 PHE A 82 12.236 1.126 10.506 1.00 0.00 H new ATOM 0 HD2 PHE A 82 11.159 4.316 13.176 1.00 0.00 H new ATOM 0 HE1 PHE A 82 14.275 2.365 9.847 1.00 0.00 H new ATOM 0 HE2 PHE A 82 13.198 5.559 12.507 1.00 0.00 H new ATOM 0 HZ PHE A 82 14.761 4.580 10.850 1.00 0.00 H new ATOM 3489 N LYS A 83 12.387 0.539 14.773 1.00 0.00 N ATOM 3490 CA LYS A 83 12.852 0.753 16.140 1.00 0.00 C ATOM 3491 C LYS A 83 14.300 1.212 16.176 1.00 0.00 C ATOM 3492 O LYS A 83 15.008 1.134 15.185 1.00 0.00 O ATOM 3493 CB LYS A 83 12.714 -0.547 16.932 1.00 0.00 C ATOM 3494 CG LYS A 83 13.789 -1.547 16.501 1.00 0.00 C ATOM 3495 CD LYS A 83 13.529 -2.896 17.183 1.00 0.00 C ATOM 3496 CE LYS A 83 13.816 -2.778 18.683 1.00 0.00 C ATOM 3497 NZ LYS A 83 13.642 -4.111 19.328 1.00 0.00 N1+ ATOM 0 H LYS A 83 13.077 0.134 14.141 1.00 0.00 H new ATOM 0 HA LYS A 83 12.239 1.537 16.585 1.00 0.00 H new ATOM 0 HB2 LYS A 83 12.805 -0.342 17.999 1.00 0.00 H new ATOM 0 HB3 LYS A 83 11.724 -0.975 16.772 1.00 0.00 H new ATOM 0 HG2 LYS A 83 13.778 -1.666 15.418 1.00 0.00 H new ATOM 0 HG3 LYS A 83 14.777 -1.175 16.771 1.00 0.00 H new ATOM 0 HD2 LYS A 83 12.495 -3.202 17.023 1.00 0.00 H new ATOM 0 HD3 LYS A 83 14.161 -3.666 16.741 1.00 0.00 H new ATOM 0 HE2 LYS A 83 14.831 -2.415 18.843 1.00 0.00 H new ATOM 0 HE3 LYS A 83 13.142 -2.051 19.137 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 13.837 -4.032 20.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 12.666 -4.440 19.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 14.302 -4.792 18.901 1.00 0.00 H new ATOM 3511 N ARG A 84 14.734 1.691 17.334 1.00 0.00 N ATOM 3512 CA ARG A 84 16.105 2.146 17.484 1.00 0.00 C ATOM 3513 C ARG A 84 17.006 0.972 17.851 1.00 0.00 C ATOM 3514 O ARG A 84 16.533 -0.059 18.329 1.00 0.00 O ATOM 3515 CB ARG A 84 16.191 3.237 18.555 1.00 0.00 C ATOM 3516 CG ARG A 84 15.840 2.651 19.921 1.00 0.00 C ATOM 3517 CD ARG A 84 15.901 3.761 20.970 1.00 0.00 C ATOM 3518 NE ARG A 84 15.579 3.229 22.288 1.00 0.00 N ATOM 3519 CZ ARG A 84 15.552 4.007 23.368 1.00 0.00 C ATOM 3520 NH1 ARG A 84 15.819 5.286 23.280 1.00 0.00 N1+ ATOM 3521 NH2 ARG A 84 15.254 3.487 24.528 1.00 0.00 N ATOM 0 H ARG A 84 14.161 1.773 18.174 1.00 0.00 H new ATOM 0 HA ARG A 84 16.441 2.566 16.536 1.00 0.00 H new ATOM 0 HB2 ARG A 84 17.196 3.659 18.577 1.00 0.00 H new ATOM 0 HB3 ARG A 84 15.509 4.052 18.313 1.00 0.00 H new ATOM 0 HG2 ARG A 84 14.843 2.211 19.897 1.00 0.00 H new ATOM 0 HG3 ARG A 84 16.535 1.852 20.178 1.00 0.00 H new ATOM 0 HD2 ARG A 84 16.897 4.205 20.983 1.00 0.00 H new ATOM 0 HD3 ARG A 84 15.201 4.555 20.710 1.00 0.00 H new ATOM 0 HE ARG A 84 15.369 2.236 22.385 1.00 0.00 H new ATOM 0 HH11 ARG A 84 16.051 5.697 22.376 1.00 0.00 H new ATOM 0 HH12 ARG A 84 15.795 5.871 24.115 1.00 0.00 H new ATOM 0 HH21 ARG A 84 15.044 2.492 24.602 1.00 0.00 H new ATOM 0 HH22 ARG A 84 15.231 4.076 25.360 1.00 0.00 H new ATOM 3535 N VAL A 85 18.304 1.129 17.624 1.00 0.00 N ATOM 3536 CA VAL A 85 19.253 0.067 17.934 1.00 0.00 C ATOM 3537 C VAL A 85 20.200 0.519 19.044 1.00 0.00 C ATOM 3538 O VAL A 85 21.261 1.077 18.763 1.00 0.00 O ATOM 3539 CB VAL A 85 20.089 -0.264 16.694 1.00 0.00 C ATOM 3540 CG1 VAL A 85 20.948 -1.501 16.968 1.00 0.00 C ATOM 3541 CG2 VAL A 85 19.165 -0.536 15.503 1.00 0.00 C ATOM 0 H VAL A 85 18.721 1.973 17.230 1.00 0.00 H new ATOM 0 HA VAL A 85 18.694 -0.812 18.255 1.00 0.00 H new ATOM 0 HB VAL A 85 20.735 0.582 16.462 1.00 0.00 H new ATOM 0 HG11 VAL A 85 21.542 -1.735 16.084 1.00 0.00 H new ATOM 0 HG12 VAL A 85 21.612 -1.304 17.810 1.00 0.00 H new ATOM 0 HG13 VAL A 85 20.303 -2.347 17.205 1.00 0.00 H new ATOM 0 HG21 VAL A 85 19.765 -0.771 14.624 1.00 0.00 H new ATOM 0 HG22 VAL A 85 18.513 -1.379 15.733 1.00 0.00 H new ATOM 0 HG23 VAL A 85 18.559 0.348 15.303 1.00 0.00 H new ATOM 3551 N PRO A 86 19.856 0.295 20.290 1.00 0.00 N ATOM 3552 CA PRO A 86 20.722 0.699 21.426 1.00 0.00 C ATOM 3553 C PRO A 86 21.833 -0.312 21.690 1.00 0.00 C ATOM 3554 O PRO A 86 21.922 -0.886 22.776 1.00 0.00 O ATOM 3555 CB PRO A 86 19.743 0.769 22.594 1.00 0.00 C ATOM 3556 CG PRO A 86 18.689 -0.242 22.282 1.00 0.00 C ATOM 3557 CD PRO A 86 18.617 -0.354 20.756 1.00 0.00 C ATOM 0 HA PRO A 86 21.246 1.637 21.243 1.00 0.00 H new ATOM 0 HB2 PRO A 86 20.239 0.542 23.538 1.00 0.00 H new ATOM 0 HB3 PRO A 86 19.315 1.767 22.690 1.00 0.00 H new ATOM 0 HG2 PRO A 86 18.934 -1.206 22.729 1.00 0.00 H new ATOM 0 HG3 PRO A 86 17.727 0.064 22.692 1.00 0.00 H new ATOM 0 HD2 PRO A 86 18.566 -1.394 20.434 1.00 0.00 H new ATOM 0 HD3 PRO A 86 17.732 0.145 20.361 1.00 0.00 H new ATOM 3565 N GLN A 87 22.682 -0.517 20.688 1.00 0.00 N ATOM 3566 CA GLN A 87 23.794 -1.449 20.821 1.00 0.00 C ATOM 3567 C GLN A 87 25.120 -0.701 20.773 1.00 0.00 C ATOM 3568 O GLN A 87 26.032 -0.980 21.551 1.00 0.00 O ATOM 3569 CB GLN A 87 23.743 -2.489 19.702 1.00 0.00 C ATOM 3570 CG GLN A 87 22.677 -3.531 20.031 1.00 0.00 C ATOM 3571 CD GLN A 87 23.218 -4.507 21.069 1.00 0.00 C ATOM 3572 OE1 GLN A 87 24.286 -4.281 21.639 1.00 0.00 O ATOM 3573 NE2 GLN A 87 22.547 -5.589 21.343 1.00 0.00 N ATOM 0 H GLN A 87 22.622 -0.054 19.781 1.00 0.00 H new ATOM 0 HA GLN A 87 23.711 -1.956 21.783 1.00 0.00 H new ATOM 0 HB2 GLN A 87 23.515 -2.007 18.751 1.00 0.00 H new ATOM 0 HB3 GLN A 87 24.715 -2.969 19.591 1.00 0.00 H new ATOM 0 HG2 GLN A 87 21.780 -3.041 20.411 1.00 0.00 H new ATOM 0 HG3 GLN A 87 22.388 -4.068 19.128 1.00 0.00 H new ATOM 0 HE21 GLN A 87 21.663 -5.774 20.870 1.00 0.00 H new ATOM 0 HE22 GLN A 87 22.906 -6.251 22.031 1.00 0.00 H new ATOM 3582 N CYS A 88 25.217 0.252 19.853 1.00 0.00 N ATOM 3583 CA CYS A 88 26.437 1.039 19.702 1.00 0.00 C ATOM 3584 C CYS A 88 26.160 2.529 19.917 1.00 0.00 C ATOM 3585 O CYS A 88 25.733 3.212 18.987 1.00 0.00 O ATOM 3586 CB CYS A 88 26.991 0.841 18.289 1.00 0.00 C ATOM 3587 SG CYS A 88 28.539 1.760 18.099 1.00 0.00 S ATOM 0 H CYS A 88 24.470 0.498 19.203 1.00 0.00 H new ATOM 0 HA CYS A 88 27.157 0.704 20.449 1.00 0.00 H new ATOM 0 HB2 CYS A 88 27.162 -0.219 18.101 1.00 0.00 H new ATOM 0 HB3 CYS A 88 26.263 1.182 17.553 1.00 0.00 H new ATOM 0 HG CYS A 88 28.282 3.032 18.023 1.00 0.00 H new ATOM 3593 N PRO A 89 26.395 3.058 21.098 1.00 0.00 N ATOM 3594 CA PRO A 89 26.153 4.502 21.355 1.00 0.00 C ATOM 3595 C PRO A 89 27.182 5.376 20.645 1.00 0.00 C ATOM 3596 O PRO A 89 28.387 5.131 20.741 1.00 0.00 O ATOM 3597 CB PRO A 89 26.274 4.627 22.873 1.00 0.00 C ATOM 3598 CG PRO A 89 27.164 3.505 23.287 1.00 0.00 C ATOM 3599 CD PRO A 89 26.905 2.368 22.299 1.00 0.00 C ATOM 0 HA PRO A 89 25.186 4.836 20.980 1.00 0.00 H new ATOM 0 HB2 PRO A 89 26.697 5.591 23.156 1.00 0.00 H new ATOM 0 HB3 PRO A 89 25.298 4.554 23.353 1.00 0.00 H new ATOM 0 HG2 PRO A 89 28.210 3.810 23.264 1.00 0.00 H new ATOM 0 HG3 PRO A 89 26.945 3.191 24.308 1.00 0.00 H new ATOM 0 HD2 PRO A 89 27.816 1.809 22.083 1.00 0.00 H new ATOM 0 HD3 PRO A 89 26.179 1.655 22.690 1.00 0.00 H new ATOM 3607 N SER A 90 26.687 6.390 19.940 1.00 0.00 N ATOM 3608 CA SER A 90 27.543 7.320 19.204 1.00 0.00 C ATOM 3609 C SER A 90 26.698 8.179 18.272 1.00 0.00 C ATOM 3610 O SER A 90 27.036 9.331 17.997 1.00 0.00 O ATOM 3611 CB SER A 90 28.584 6.567 18.370 1.00 0.00 C ATOM 3612 OG SER A 90 28.010 5.366 17.874 1.00 0.00 O ATOM 0 H SER A 90 25.690 6.590 19.862 1.00 0.00 H new ATOM 0 HA SER A 90 28.056 7.948 19.932 1.00 0.00 H new ATOM 0 HB2 SER A 90 28.923 7.190 17.542 1.00 0.00 H new ATOM 0 HB3 SER A 90 29.460 6.341 18.979 1.00 0.00 H new ATOM 0 HG SER A 90 28.674 4.883 17.339 1.00 0.00 H new ATOM 3618 N GLY A 91 25.603 7.606 17.774 1.00 0.00 N ATOM 3619 CA GLY A 91 24.733 8.337 16.857 1.00 0.00 C ATOM 3620 C GLY A 91 23.328 7.743 16.824 1.00 0.00 C ATOM 3621 O GLY A 91 23.009 6.835 17.591 1.00 0.00 O ATOM 0 H GLY A 91 25.302 6.655 17.986 1.00 0.00 H new ATOM 0 HA2 GLY A 91 24.680 9.383 17.160 1.00 0.00 H new ATOM 0 HA3 GLY A 91 25.161 8.317 15.855 1.00 0.00 H new ATOM 3625 N ARG A 92 22.489 8.266 15.929 1.00 0.00 N ATOM 3626 CA ARG A 92 21.117 7.783 15.809 1.00 0.00 C ATOM 3627 C ARG A 92 21.045 6.620 14.827 1.00 0.00 C ATOM 3628 O ARG A 92 21.257 6.791 13.625 1.00 0.00 O ATOM 3629 CB ARG A 92 20.196 8.910 15.326 1.00 0.00 C ATOM 3630 CG ARG A 92 20.480 10.196 16.110 1.00 0.00 C ATOM 3631 CD ARG A 92 21.226 11.188 15.213 1.00 0.00 C ATOM 3632 NE ARG A 92 21.536 12.410 15.951 1.00 0.00 N ATOM 3633 CZ ARG A 92 22.539 12.465 16.829 1.00 0.00 C ATOM 3634 NH1 ARG A 92 23.285 11.412 17.061 1.00 0.00 N1+ ATOM 3635 NH2 ARG A 92 22.781 13.579 17.464 1.00 0.00 N ATOM 0 H ARG A 92 22.734 9.017 15.283 1.00 0.00 H new ATOM 0 HA ARG A 92 20.790 7.444 16.792 1.00 0.00 H new ATOM 0 HB2 ARG A 92 20.349 9.083 14.261 1.00 0.00 H new ATOM 0 HB3 ARG A 92 19.154 8.619 15.455 1.00 0.00 H new ATOM 0 HG2 ARG A 92 19.545 10.636 16.458 1.00 0.00 H new ATOM 0 HG3 ARG A 92 21.075 9.971 16.995 1.00 0.00 H new ATOM 0 HD2 ARG A 92 22.146 10.734 14.846 1.00 0.00 H new ATOM 0 HD3 ARG A 92 20.618 11.427 14.340 1.00 0.00 H new ATOM 0 HE ARG A 92 20.970 13.244 15.791 1.00 0.00 H new ATOM 0 HH11 ARG A 92 23.101 10.538 16.568 1.00 0.00 H new ATOM 0 HH12 ARG A 92 24.049 11.467 17.735 1.00 0.00 H new ATOM 0 HH21 ARG A 92 22.205 14.402 17.288 1.00 0.00 H new ATOM 0 HH22 ARG A 92 23.547 13.627 18.136 1.00 0.00 H new ATOM 3649 N VAL A 93 20.742 5.435 15.348 1.00 0.00 N ATOM 3650 CA VAL A 93 20.643 4.243 14.514 1.00 0.00 C ATOM 3651 C VAL A 93 19.298 3.550 14.713 1.00 0.00 C ATOM 3652 O VAL A 93 18.886 3.276 15.840 1.00 0.00 O ATOM 3653 CB VAL A 93 21.780 3.278 14.853 1.00 0.00 C ATOM 3654 CG1 VAL A 93 21.636 2.007 14.015 1.00 0.00 C ATOM 3655 CG2 VAL A 93 23.124 3.942 14.537 1.00 0.00 C ATOM 0 H VAL A 93 20.562 5.275 16.339 1.00 0.00 H new ATOM 0 HA VAL A 93 20.722 4.545 13.470 1.00 0.00 H new ATOM 0 HB VAL A 93 21.737 3.025 15.912 1.00 0.00 H new ATOM 0 HG11 VAL A 93 22.446 1.319 14.256 1.00 0.00 H new ATOM 0 HG12 VAL A 93 20.679 1.533 14.235 1.00 0.00 H new ATOM 0 HG13 VAL A 93 21.680 2.262 12.956 1.00 0.00 H new ATOM 0 HG21 VAL A 93 23.935 3.255 14.778 1.00 0.00 H new ATOM 0 HG22 VAL A 93 23.165 4.194 13.477 1.00 0.00 H new ATOM 0 HG23 VAL A 93 23.229 4.850 15.130 1.00 0.00 H new ATOM 3665 N TYR A 94 18.625 3.275 13.602 1.00 0.00 N ATOM 3666 CA TYR A 94 17.328 2.615 13.633 1.00 0.00 C ATOM 3667 C TYR A 94 17.340 1.381 12.741 1.00 0.00 C ATOM 3668 O TYR A 94 18.100 1.304 11.781 1.00 0.00 O ATOM 3669 CB TYR A 94 16.236 3.578 13.162 1.00 0.00 C ATOM 3670 CG TYR A 94 16.157 4.754 14.105 1.00 0.00 C ATOM 3671 CD1 TYR A 94 16.903 5.911 13.848 1.00 0.00 C ATOM 3672 CD2 TYR A 94 15.332 4.691 15.235 1.00 0.00 C ATOM 3673 CE1 TYR A 94 16.824 7.004 14.719 1.00 0.00 C ATOM 3674 CE2 TYR A 94 15.255 5.783 16.107 1.00 0.00 C ATOM 3675 CZ TYR A 94 16.000 6.939 15.850 1.00 0.00 C ATOM 3676 OH TYR A 94 15.922 8.017 16.708 1.00 0.00 O ATOM 0 H TYR A 94 18.959 3.501 12.665 1.00 0.00 H new ATOM 0 HA TYR A 94 17.120 2.310 14.659 1.00 0.00 H new ATOM 0 HB2 TYR A 94 16.453 3.923 12.151 1.00 0.00 H new ATOM 0 HB3 TYR A 94 15.275 3.064 13.124 1.00 0.00 H new ATOM 0 HD1 TYR A 94 17.540 5.960 12.977 1.00 0.00 H new ATOM 0 HD2 TYR A 94 14.755 3.800 15.433 1.00 0.00 H new ATOM 0 HE1 TYR A 94 17.398 7.897 14.519 1.00 0.00 H new ATOM 0 HE2 TYR A 94 14.620 5.733 16.979 1.00 0.00 H new ATOM 0 HH TYR A 94 15.306 7.808 17.441 1.00 0.00 H new ATOM 3686 N VAL A 95 16.499 0.410 13.068 1.00 0.00 N ATOM 3687 CA VAL A 95 16.431 -0.816 12.295 1.00 0.00 C ATOM 3688 C VAL A 95 14.986 -1.140 11.946 1.00 0.00 C ATOM 3689 O VAL A 95 14.090 -1.037 12.784 1.00 0.00 O ATOM 3690 CB VAL A 95 17.034 -1.960 13.113 1.00 0.00 C ATOM 3691 CG1 VAL A 95 16.175 -2.197 14.360 1.00 0.00 C ATOM 3692 CG2 VAL A 95 17.082 -3.247 12.279 1.00 0.00 C ATOM 0 H VAL A 95 15.858 0.449 13.860 1.00 0.00 H new ATOM 0 HA VAL A 95 16.993 -0.688 11.370 1.00 0.00 H new ATOM 0 HB VAL A 95 18.049 -1.690 13.404 1.00 0.00 H new ATOM 0 HG11 VAL A 95 16.601 -3.011 14.946 1.00 0.00 H new ATOM 0 HG12 VAL A 95 16.151 -1.290 14.963 1.00 0.00 H new ATOM 0 HG13 VAL A 95 15.161 -2.459 14.059 1.00 0.00 H new ATOM 0 HG21 VAL A 95 17.513 -4.051 12.875 1.00 0.00 H new ATOM 0 HG22 VAL A 95 16.072 -3.522 11.976 1.00 0.00 H new ATOM 0 HG23 VAL A 95 17.695 -3.084 11.393 1.00 0.00 H new ATOM 3702 N LEU A 96 14.772 -1.544 10.702 1.00 0.00 N ATOM 3703 CA LEU A 96 13.444 -1.903 10.243 1.00 0.00 C ATOM 3704 C LEU A 96 13.368 -3.414 10.177 1.00 0.00 C ATOM 3705 O LEU A 96 14.153 -4.046 9.478 1.00 0.00 O ATOM 3706 CB LEU A 96 13.200 -1.289 8.859 1.00 0.00 C ATOM 3707 CG LEU A 96 11.840 -1.720 8.311 1.00 0.00 C ATOM 3708 CD1 LEU A 96 10.724 -1.248 9.247 1.00 0.00 C ATOM 3709 CD2 LEU A 96 11.645 -1.089 6.928 1.00 0.00 C ATOM 0 H LEU A 96 15.502 -1.630 9.995 1.00 0.00 H new ATOM 0 HA LEU A 96 12.681 -1.525 10.923 1.00 0.00 H new ATOM 0 HB2 LEU A 96 13.244 -0.202 8.925 1.00 0.00 H new ATOM 0 HB3 LEU A 96 13.989 -1.599 8.174 1.00 0.00 H new ATOM 0 HG LEU A 96 11.803 -2.807 8.238 1.00 0.00 H new ATOM 0 HD11 LEU A 96 9.759 -1.560 8.848 1.00 0.00 H new ATOM 0 HD12 LEU A 96 10.868 -1.687 10.234 1.00 0.00 H new ATOM 0 HD13 LEU A 96 10.750 -0.161 9.325 1.00 0.00 H new ATOM 0 HD21 LEU A 96 10.678 -1.388 6.525 1.00 0.00 H new ATOM 0 HD22 LEU A 96 11.682 -0.003 7.015 1.00 0.00 H new ATOM 0 HD23 LEU A 96 12.437 -1.426 6.259 1.00 0.00 H new ATOM 3721 N LYS A 97 12.441 -3.996 10.918 1.00 0.00 N ATOM 3722 CA LYS A 97 12.309 -5.444 10.933 1.00 0.00 C ATOM 3723 C LYS A 97 10.961 -5.850 10.380 1.00 0.00 C ATOM 3724 O LYS A 97 9.926 -5.477 10.913 1.00 0.00 O ATOM 3725 CB LYS A 97 12.466 -5.990 12.351 1.00 0.00 C ATOM 3726 CG LYS A 97 12.069 -4.936 13.380 1.00 0.00 C ATOM 3727 CD LYS A 97 12.145 -5.553 14.771 1.00 0.00 C ATOM 3728 CE LYS A 97 10.965 -6.505 14.983 1.00 0.00 C ATOM 3729 NZ LYS A 97 10.939 -6.948 16.406 1.00 0.00 N1+ ATOM 0 H LYS A 97 11.777 -3.497 11.510 1.00 0.00 H new ATOM 0 HA LYS A 97 13.098 -5.862 10.308 1.00 0.00 H new ATOM 0 HB2 LYS A 97 11.847 -6.878 12.475 1.00 0.00 H new ATOM 0 HB3 LYS A 97 13.499 -6.296 12.516 1.00 0.00 H new ATOM 0 HG2 LYS A 97 12.733 -4.074 13.313 1.00 0.00 H new ATOM 0 HG3 LYS A 97 11.059 -4.577 13.181 1.00 0.00 H new ATOM 0 HD2 LYS A 97 13.085 -6.093 14.888 1.00 0.00 H new ATOM 0 HD3 LYS A 97 12.131 -4.769 15.528 1.00 0.00 H new ATOM 0 HE2 LYS A 97 10.030 -6.006 14.728 1.00 0.00 H new ATOM 0 HE3 LYS A 97 11.056 -7.368 14.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 10.138 -7.595 16.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 11.827 -7.439 16.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 10.833 -6.119 17.026 1.00 0.00 H new ATOM 3743 N PHE A 98 10.982 -6.623 9.313 1.00 0.00 N ATOM 3744 CA PHE A 98 9.754 -7.074 8.699 1.00 0.00 C ATOM 3745 C PHE A 98 9.198 -8.233 9.498 1.00 0.00 C ATOM 3746 O PHE A 98 9.797 -9.309 9.563 1.00 0.00 O ATOM 3747 CB PHE A 98 10.034 -7.497 7.261 1.00 0.00 C ATOM 3748 CG PHE A 98 10.340 -6.278 6.427 1.00 0.00 C ATOM 3749 CD1 PHE A 98 11.584 -5.647 6.545 1.00 0.00 C ATOM 3750 CD2 PHE A 98 9.392 -5.793 5.522 1.00 0.00 C ATOM 3751 CE1 PHE A 98 11.878 -4.530 5.760 1.00 0.00 C ATOM 3752 CE2 PHE A 98 9.685 -4.673 4.736 1.00 0.00 C ATOM 3753 CZ PHE A 98 10.930 -4.041 4.854 1.00 0.00 C ATOM 0 H PHE A 98 11.833 -6.950 8.856 1.00 0.00 H new ATOM 0 HA PHE A 98 9.020 -6.268 8.688 1.00 0.00 H new ATOM 0 HB2 PHE A 98 10.874 -8.190 7.232 1.00 0.00 H new ATOM 0 HB3 PHE A 98 9.172 -8.024 6.851 1.00 0.00 H new ATOM 0 HD1 PHE A 98 12.317 -6.024 7.243 1.00 0.00 H new ATOM 0 HD2 PHE A 98 8.434 -6.282 5.429 1.00 0.00 H new ATOM 0 HE1 PHE A 98 12.838 -4.043 5.852 1.00 0.00 H new ATOM 0 HE2 PHE A 98 8.952 -4.296 4.039 1.00 0.00 H new ATOM 0 HZ PHE A 98 11.158 -3.178 4.247 1.00 0.00 H new ATOM 3763 N LYS A 99 8.053 -8.002 10.114 1.00 0.00 N ATOM 3764 CA LYS A 99 7.426 -9.024 10.919 1.00 0.00 C ATOM 3765 C LYS A 99 7.089 -10.226 10.062 1.00 0.00 C ATOM 3766 O LYS A 99 7.215 -11.366 10.509 1.00 0.00 O ATOM 3767 CB LYS A 99 6.155 -8.483 11.576 1.00 0.00 C ATOM 3768 CG LYS A 99 6.542 -7.472 12.650 1.00 0.00 C ATOM 3769 CD LYS A 99 5.279 -6.931 13.328 1.00 0.00 C ATOM 3770 CE LYS A 99 5.670 -5.912 14.396 1.00 0.00 C ATOM 3771 NZ LYS A 99 4.439 -5.387 15.052 1.00 0.00 N1+ ATOM 0 H LYS A 99 7.544 -7.119 10.070 1.00 0.00 H new ATOM 0 HA LYS A 99 8.124 -9.325 11.701 1.00 0.00 H new ATOM 0 HB2 LYS A 99 5.516 -8.012 10.829 1.00 0.00 H new ATOM 0 HB3 LYS A 99 5.582 -9.299 12.016 1.00 0.00 H new ATOM 0 HG2 LYS A 99 7.190 -7.942 13.389 1.00 0.00 H new ATOM 0 HG3 LYS A 99 7.107 -6.653 12.205 1.00 0.00 H new ATOM 0 HD2 LYS A 99 4.627 -6.466 12.588 1.00 0.00 H new ATOM 0 HD3 LYS A 99 4.717 -7.749 13.779 1.00 0.00 H new ATOM 0 HE2 LYS A 99 6.321 -6.377 15.137 1.00 0.00 H new ATOM 0 HE3 LYS A 99 6.233 -5.094 13.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 4.514 -4.355 15.156 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 3.610 -5.617 14.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 4.333 -5.822 15.991 1.00 0.00 H new ATOM 3785 N ALA A 100 6.662 -9.972 8.831 1.00 0.00 N ATOM 3786 CA ALA A 100 6.314 -11.078 7.940 1.00 0.00 C ATOM 3787 C ALA A 100 7.365 -11.272 6.848 1.00 0.00 C ATOM 3788 O ALA A 100 7.484 -12.355 6.274 1.00 0.00 O ATOM 3789 CB ALA A 100 4.944 -10.840 7.301 1.00 0.00 C ATOM 0 H ALA A 100 6.550 -9.040 8.433 1.00 0.00 H new ATOM 0 HA ALA A 100 6.279 -11.985 8.544 1.00 0.00 H new ATOM 0 HB1 ALA A 100 4.701 -11.673 6.641 1.00 0.00 H new ATOM 0 HB2 ALA A 100 4.187 -10.762 8.081 1.00 0.00 H new ATOM 0 HB3 ALA A 100 4.967 -9.915 6.725 1.00 0.00 H new ATOM 3795 N GLY A 101 8.116 -10.218 6.560 1.00 0.00 N ATOM 3796 CA GLY A 101 9.147 -10.285 5.523 1.00 0.00 C ATOM 3797 C GLY A 101 10.378 -11.071 5.979 1.00 0.00 C ATOM 3798 O GLY A 101 11.190 -11.494 5.159 1.00 0.00 O ATOM 0 H GLY A 101 8.036 -9.312 7.023 1.00 0.00 H new ATOM 0 HA2 GLY A 101 8.731 -10.751 4.630 1.00 0.00 H new ATOM 0 HA3 GLY A 101 9.446 -9.274 5.245 1.00 0.00 H new ATOM 3802 N SER A 102 10.515 -11.262 7.288 1.00 0.00 N ATOM 3803 CA SER A 102 11.657 -11.998 7.832 1.00 0.00 C ATOM 3804 C SER A 102 12.980 -11.342 7.429 1.00 0.00 C ATOM 3805 O SER A 102 14.030 -11.981 7.447 1.00 0.00 O ATOM 3806 CB SER A 102 11.636 -13.441 7.326 1.00 0.00 C ATOM 3807 OG SER A 102 10.406 -14.050 7.690 1.00 0.00 O ATOM 0 H SER A 102 9.857 -10.921 7.989 1.00 0.00 H new ATOM 0 HA SER A 102 11.578 -11.984 8.919 1.00 0.00 H new ATOM 0 HB2 SER A 102 11.758 -13.460 6.243 1.00 0.00 H new ATOM 0 HB3 SER A 102 12.471 -13.999 7.750 1.00 0.00 H new ATOM 0 HG SER A 102 10.390 -14.974 7.365 1.00 0.00 H new ATOM 3813 N LYS A 103 12.919 -10.063 7.073 1.00 0.00 N ATOM 3814 CA LYS A 103 14.107 -9.320 6.672 1.00 0.00 C ATOM 3815 C LYS A 103 14.333 -8.146 7.615 1.00 0.00 C ATOM 3816 O LYS A 103 13.385 -7.607 8.178 1.00 0.00 O ATOM 3817 CB LYS A 103 13.936 -8.787 5.251 1.00 0.00 C ATOM 3818 CG LYS A 103 15.309 -8.507 4.644 1.00 0.00 C ATOM 3819 CD LYS A 103 15.336 -7.080 4.102 1.00 0.00 C ATOM 3820 CE LYS A 103 14.574 -7.014 2.779 1.00 0.00 C ATOM 3821 NZ LYS A 103 14.984 -5.792 2.032 1.00 0.00 N1+ ATOM 0 H LYS A 103 12.057 -9.519 7.054 1.00 0.00 H new ATOM 0 HA LYS A 103 14.964 -9.992 6.712 1.00 0.00 H new ATOM 0 HB2 LYS A 103 13.398 -9.513 4.641 1.00 0.00 H new ATOM 0 HB3 LYS A 103 13.339 -7.875 5.262 1.00 0.00 H new ATOM 0 HG2 LYS A 103 16.086 -8.638 5.397 1.00 0.00 H new ATOM 0 HG3 LYS A 103 15.518 -9.217 3.844 1.00 0.00 H new ATOM 0 HD2 LYS A 103 14.888 -6.398 4.825 1.00 0.00 H new ATOM 0 HD3 LYS A 103 16.366 -6.756 3.955 1.00 0.00 H new ATOM 0 HE2 LYS A 103 14.779 -7.904 2.184 1.00 0.00 H new ATOM 0 HE3 LYS A 103 13.500 -6.996 2.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 14.614 -5.838 1.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 14.603 -4.950 2.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 16.022 -5.734 2.004 1.00 0.00 H new ATOM 3835 N ARG A 104 15.588 -7.744 7.778 1.00 0.00 N ATOM 3836 CA ARG A 104 15.901 -6.619 8.650 1.00 0.00 C ATOM 3837 C ARG A 104 16.829 -5.627 7.947 1.00 0.00 C ATOM 3838 O ARG A 104 17.768 -6.019 7.254 1.00 0.00 O ATOM 3839 CB ARG A 104 16.549 -7.111 9.943 1.00 0.00 C ATOM 3840 CG ARG A 104 15.527 -7.919 10.753 1.00 0.00 C ATOM 3841 CD ARG A 104 16.182 -8.411 12.040 1.00 0.00 C ATOM 3842 NE ARG A 104 15.252 -9.228 12.817 1.00 0.00 N ATOM 3843 CZ ARG A 104 15.615 -9.785 13.977 1.00 0.00 C ATOM 3844 NH1 ARG A 104 16.827 -9.621 14.446 1.00 0.00 N1+ ATOM 3845 NH2 ARG A 104 14.754 -10.499 14.651 1.00 0.00 N ATOM 0 H ARG A 104 16.395 -8.173 7.325 1.00 0.00 H new ATOM 0 HA ARG A 104 14.968 -6.110 8.892 1.00 0.00 H new ATOM 0 HB2 ARG A 104 17.418 -7.728 9.715 1.00 0.00 H new ATOM 0 HB3 ARG A 104 16.905 -6.264 10.529 1.00 0.00 H new ATOM 0 HG2 ARG A 104 14.659 -7.301 10.986 1.00 0.00 H new ATOM 0 HG3 ARG A 104 15.168 -8.765 10.167 1.00 0.00 H new ATOM 0 HD2 ARG A 104 17.072 -8.993 11.801 1.00 0.00 H new ATOM 0 HD3 ARG A 104 16.509 -7.559 12.636 1.00 0.00 H new ATOM 0 HE ARG A 104 14.306 -9.376 12.467 1.00 0.00 H new ATOM 0 HH11 ARG A 104 17.504 -9.064 13.925 1.00 0.00 H new ATOM 0 HH12 ARG A 104 17.093 -10.050 15.332 1.00 0.00 H new ATOM 0 HH21 ARG A 104 13.808 -10.630 14.292 1.00 0.00 H new ATOM 0 HH22 ARG A 104 15.027 -10.926 15.536 1.00 0.00 H new ATOM 3859 N LEU A 105 16.543 -4.340 8.134 1.00 0.00 N ATOM 3860 CA LEU A 105 17.337 -3.279 7.522 1.00 0.00 C ATOM 3861 C LEU A 105 17.870 -2.338 8.594 1.00 0.00 C ATOM 3862 O LEU A 105 17.269 -2.196 9.656 1.00 0.00 O ATOM 3863 CB LEU A 105 16.478 -2.480 6.542 1.00 0.00 C ATOM 3864 CG LEU A 105 15.782 -3.438 5.579 1.00 0.00 C ATOM 3865 CD1 LEU A 105 14.935 -2.642 4.586 1.00 0.00 C ATOM 3866 CD2 LEU A 105 16.828 -4.257 4.818 1.00 0.00 C ATOM 0 H LEU A 105 15.766 -4.007 8.705 1.00 0.00 H new ATOM 0 HA LEU A 105 18.171 -3.736 6.990 1.00 0.00 H new ATOM 0 HB2 LEU A 105 15.738 -1.892 7.086 1.00 0.00 H new ATOM 0 HB3 LEU A 105 17.099 -1.777 5.987 1.00 0.00 H new ATOM 0 HG LEU A 105 15.139 -4.112 6.145 1.00 0.00 H new ATOM 0 HD11 LEU A 105 14.439 -3.328 3.899 1.00 0.00 H new ATOM 0 HD12 LEU A 105 14.185 -2.065 5.128 1.00 0.00 H new ATOM 0 HD13 LEU A 105 15.576 -1.965 4.022 1.00 0.00 H new ATOM 0 HD21 LEU A 105 16.327 -4.940 4.132 1.00 0.00 H new ATOM 0 HD22 LEU A 105 17.476 -3.586 4.254 1.00 0.00 H new ATOM 0 HD23 LEU A 105 17.427 -4.830 5.526 1.00 0.00 H new ATOM 3878 N PHE A 106 18.995 -1.697 8.312 1.00 0.00 N ATOM 3879 CA PHE A 106 19.593 -0.775 9.268 1.00 0.00 C ATOM 3880 C PHE A 106 19.801 0.598 8.635 1.00 0.00 C ATOM 3881 O PHE A 106 20.276 0.706 7.502 1.00 0.00 O ATOM 3882 CB PHE A 106 20.932 -1.332 9.725 1.00 0.00 C ATOM 3883 CG PHE A 106 20.730 -2.632 10.454 1.00 0.00 C ATOM 3884 CD1 PHE A 106 20.757 -3.834 9.741 1.00 0.00 C ATOM 3885 CD2 PHE A 106 20.526 -2.640 11.838 1.00 0.00 C ATOM 3886 CE1 PHE A 106 20.581 -5.048 10.410 1.00 0.00 C ATOM 3887 CE2 PHE A 106 20.348 -3.854 12.510 1.00 0.00 C ATOM 3888 CZ PHE A 106 20.377 -5.060 11.796 1.00 0.00 C ATOM 0 H PHE A 106 19.509 -1.797 7.437 1.00 0.00 H new ATOM 0 HA PHE A 106 18.922 -0.665 10.120 1.00 0.00 H new ATOM 0 HB2 PHE A 106 21.583 -1.486 8.865 1.00 0.00 H new ATOM 0 HB3 PHE A 106 21.430 -0.614 10.377 1.00 0.00 H new ATOM 0 HD1 PHE A 106 20.914 -3.824 8.673 1.00 0.00 H new ATOM 0 HD2 PHE A 106 20.506 -1.710 12.387 1.00 0.00 H new ATOM 0 HE1 PHE A 106 20.602 -5.977 9.859 1.00 0.00 H new ATOM 0 HE2 PHE A 106 20.188 -3.862 13.578 1.00 0.00 H new ATOM 0 HZ PHE A 106 20.242 -5.998 12.314 1.00 0.00 H new ATOM 3898 N PHE A 107 19.454 1.646 9.375 1.00 0.00 N ATOM 3899 CA PHE A 107 19.612 3.002 8.885 1.00 0.00 C ATOM 3900 C PHE A 107 20.112 3.919 9.970 1.00 0.00 C ATOM 3901 O PHE A 107 19.919 3.668 11.157 1.00 0.00 O ATOM 3902 CB PHE A 107 18.286 3.545 8.377 1.00 0.00 C ATOM 3903 CG PHE A 107 17.863 2.771 7.168 1.00 0.00 C ATOM 3904 CD1 PHE A 107 17.069 1.631 7.311 1.00 0.00 C ATOM 3905 CD2 PHE A 107 18.265 3.198 5.900 1.00 0.00 C ATOM 3906 CE1 PHE A 107 16.670 0.916 6.182 1.00 0.00 C ATOM 3907 CE2 PHE A 107 17.868 2.485 4.772 1.00 0.00 C ATOM 3908 CZ PHE A 107 17.066 1.340 4.910 1.00 0.00 C ATOM 0 H PHE A 107 19.062 1.578 10.314 1.00 0.00 H new ATOM 0 HA PHE A 107 20.339 2.967 8.074 1.00 0.00 H new ATOM 0 HB2 PHE A 107 17.527 3.469 9.155 1.00 0.00 H new ATOM 0 HB3 PHE A 107 18.384 4.602 8.130 1.00 0.00 H new ATOM 0 HD1 PHE A 107 16.765 1.304 8.294 1.00 0.00 H new ATOM 0 HD2 PHE A 107 18.882 4.078 5.795 1.00 0.00 H new ATOM 0 HE1 PHE A 107 16.055 0.035 6.290 1.00 0.00 H new ATOM 0 HE2 PHE A 107 18.177 2.812 3.790 1.00 0.00 H new ATOM 0 HZ PHE A 107 16.756 0.788 4.035 1.00 0.00 H new ATOM 3918 N TRP A 108 20.728 4.999 9.548 1.00 0.00 N ATOM 3919 CA TRP A 108 21.225 5.980 10.488 1.00 0.00 C ATOM 3920 C TRP A 108 20.762 7.365 10.066 1.00 0.00 C ATOM 3921 O TRP A 108 20.740 7.685 8.877 1.00 0.00 O ATOM 3922 CB TRP A 108 22.753 5.896 10.571 1.00 0.00 C ATOM 3923 CG TRP A 108 23.380 6.172 9.238 1.00 0.00 C ATOM 3924 CD1 TRP A 108 23.566 5.256 8.255 1.00 0.00 C ATOM 3925 CD2 TRP A 108 23.954 7.417 8.747 1.00 0.00 C ATOM 3926 NE1 TRP A 108 24.204 5.863 7.191 1.00 0.00 N ATOM 3927 CE2 TRP A 108 24.470 7.195 7.448 1.00 0.00 C ATOM 3928 CE3 TRP A 108 24.072 8.706 9.296 1.00 0.00 C ATOM 3929 CZ2 TRP A 108 25.085 8.215 6.722 1.00 0.00 C ATOM 3930 CZ3 TRP A 108 24.687 9.737 8.569 1.00 0.00 C ATOM 3931 CH2 TRP A 108 25.195 9.491 7.286 1.00 0.00 C ATOM 0 H TRP A 108 20.897 5.221 8.567 1.00 0.00 H new ATOM 0 HA TRP A 108 20.828 5.777 11.482 1.00 0.00 H new ATOM 0 HB2 TRP A 108 23.121 6.613 11.305 1.00 0.00 H new ATOM 0 HB3 TRP A 108 23.048 4.905 10.917 1.00 0.00 H new ATOM 0 HD1 TRP A 108 23.264 4.220 8.297 1.00 0.00 H new ATOM 0 HE1 TRP A 108 24.449 5.387 6.323 1.00 0.00 H new ATOM 0 HE3 TRP A 108 23.686 8.904 10.285 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 25.473 8.022 5.733 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 24.769 10.724 9.000 1.00 0.00 H new ATOM 0 HH2 TRP A 108 25.672 10.287 6.732 1.00 0.00 H new ATOM 3942 N MET A 109 20.358 8.174 11.041 1.00 0.00 N ATOM 3943 CA MET A 109 19.860 9.512 10.739 1.00 0.00 C ATOM 3944 C MET A 109 21.006 10.449 10.383 1.00 0.00 C ATOM 3945 O MET A 109 22.063 10.428 11.014 1.00 0.00 O ATOM 3946 CB MET A 109 19.109 10.095 11.938 1.00 0.00 C ATOM 3947 CG MET A 109 18.077 9.088 12.450 1.00 0.00 C ATOM 3948 SD MET A 109 16.864 8.727 11.152 1.00 0.00 S ATOM 3949 CE MET A 109 15.876 10.234 11.320 1.00 0.00 C ATOM 0 H MET A 109 20.365 7.932 12.032 1.00 0.00 H new ATOM 0 HA MET A 109 19.183 9.423 9.890 1.00 0.00 H new ATOM 0 HB2 MET A 109 19.813 10.343 12.733 1.00 0.00 H new ATOM 0 HB3 MET A 109 18.613 11.022 11.651 1.00 0.00 H new ATOM 0 HG2 MET A 109 18.576 8.169 12.759 1.00 0.00 H new ATOM 0 HG3 MET A 109 17.572 9.488 13.330 1.00 0.00 H new ATOM 0 HE1 MET A 109 14.850 10.033 11.011 1.00 0.00 H new ATOM 0 HE2 MET A 109 15.885 10.561 12.360 1.00 0.00 H new ATOM 0 HE3 MET A 109 16.297 11.017 10.690 1.00 0.00 H new ATOM 3959 N GLN A 110 20.777 11.279 9.378 1.00 0.00 N ATOM 3960 CA GLN A 110 21.777 12.241 8.946 1.00 0.00 C ATOM 3961 C GLN A 110 21.429 13.645 9.435 1.00 0.00 C ATOM 3962 O GLN A 110 22.130 14.604 9.122 1.00 0.00 O ATOM 3963 CB GLN A 110 21.870 12.249 7.423 1.00 0.00 C ATOM 3964 CG GLN A 110 23.290 12.620 7.006 1.00 0.00 C ATOM 3965 CD GLN A 110 23.248 13.611 5.849 1.00 0.00 C ATOM 3966 OE1 GLN A 110 24.062 14.534 5.791 1.00 0.00 O ATOM 3967 NE2 GLN A 110 22.347 13.474 4.918 1.00 0.00 N ATOM 0 H GLN A 110 19.907 11.306 8.846 1.00 0.00 H new ATOM 0 HA GLN A 110 22.736 11.946 9.373 1.00 0.00 H new ATOM 0 HB2 GLN A 110 21.607 11.269 7.026 1.00 0.00 H new ATOM 0 HB3 GLN A 110 21.159 12.963 7.008 1.00 0.00 H new ATOM 0 HG2 GLN A 110 23.824 13.056 7.850 1.00 0.00 H new ATOM 0 HG3 GLN A 110 23.837 11.725 6.710 1.00 0.00 H new ATOM 0 HE21 GLN A 110 21.674 12.709 4.968 1.00 0.00 H new ATOM 0 HE22 GLN A 110 22.315 14.132 4.139 1.00 0.00 H new ATOM 3976 N GLU A 111 20.339 13.775 10.187 1.00 0.00 N ATOM 3977 CA GLU A 111 19.931 15.090 10.683 1.00 0.00 C ATOM 3978 C GLU A 111 20.854 15.553 11.820 1.00 0.00 C ATOM 3979 O GLU A 111 21.334 14.729 12.598 1.00 0.00 O ATOM 3980 CB GLU A 111 18.490 15.030 11.190 1.00 0.00 C ATOM 3981 CG GLU A 111 17.554 14.759 10.012 1.00 0.00 C ATOM 3982 CD GLU A 111 17.517 15.972 9.091 1.00 0.00 C ATOM 3983 OE1 GLU A 111 17.958 17.027 9.516 1.00 0.00 O ATOM 3984 OE2 GLU A 111 17.049 15.829 7.974 1.00 0.00 O1- ATOM 0 H GLU A 111 19.732 13.004 10.463 1.00 0.00 H new ATOM 0 HA GLU A 111 20.001 15.803 9.862 1.00 0.00 H new ATOM 0 HB2 GLU A 111 18.388 14.245 11.939 1.00 0.00 H new ATOM 0 HB3 GLU A 111 18.223 15.969 11.674 1.00 0.00 H new ATOM 0 HG2 GLU A 111 17.894 13.883 9.460 1.00 0.00 H new ATOM 0 HG3 GLU A 111 16.551 14.537 10.376 1.00 0.00 H new ATOM 3991 N PRO A 112 21.116 16.838 11.943 1.00 0.00 N ATOM 3992 CA PRO A 112 22.003 17.364 13.020 1.00 0.00 C ATOM 3993 C PRO A 112 21.351 17.301 14.401 1.00 0.00 C ATOM 3994 O PRO A 112 22.039 17.198 15.415 1.00 0.00 O ATOM 3995 CB PRO A 112 22.269 18.810 12.603 1.00 0.00 C ATOM 3996 CG PRO A 112 21.094 19.199 11.771 1.00 0.00 C ATOM 3997 CD PRO A 112 20.602 17.923 11.085 1.00 0.00 C ATOM 0 HA PRO A 112 22.912 16.771 13.118 1.00 0.00 H new ATOM 0 HB2 PRO A 112 22.368 19.459 13.473 1.00 0.00 H new ATOM 0 HB3 PRO A 112 23.197 18.892 12.037 1.00 0.00 H new ATOM 0 HG2 PRO A 112 20.309 19.634 12.389 1.00 0.00 H new ATOM 0 HG3 PRO A 112 21.373 19.952 11.034 1.00 0.00 H new ATOM 0 HD2 PRO A 112 19.514 17.899 11.019 1.00 0.00 H new ATOM 0 HD3 PRO A 112 20.985 17.843 10.068 1.00 0.00 H new ATOM 4005 N LYS A 113 20.022 17.369 14.433 1.00 0.00 N ATOM 4006 CA LYS A 113 19.293 17.325 15.694 1.00 0.00 C ATOM 4007 C LYS A 113 18.333 16.144 15.709 1.00 0.00 C ATOM 4008 O LYS A 113 17.743 15.796 14.686 1.00 0.00 O ATOM 4009 CB LYS A 113 18.501 18.623 15.880 1.00 0.00 C ATOM 4010 CG LYS A 113 19.440 19.830 15.793 1.00 0.00 C ATOM 4011 CD LYS A 113 20.480 19.776 16.914 1.00 0.00 C ATOM 4012 CE LYS A 113 21.368 21.015 16.827 1.00 0.00 C ATOM 4013 NZ LYS A 113 22.396 20.975 17.907 1.00 0.00 N1+ ATOM 0 H LYS A 113 19.433 17.454 13.605 1.00 0.00 H new ATOM 0 HA LYS A 113 20.010 17.212 16.507 1.00 0.00 H new ATOM 0 HB2 LYS A 113 17.727 18.699 15.116 1.00 0.00 H new ATOM 0 HB3 LYS A 113 17.996 18.615 16.846 1.00 0.00 H new ATOM 0 HG2 LYS A 113 19.940 19.841 14.824 1.00 0.00 H new ATOM 0 HG3 LYS A 113 18.865 20.753 15.866 1.00 0.00 H new ATOM 0 HD2 LYS A 113 19.986 19.734 17.885 1.00 0.00 H new ATOM 0 HD3 LYS A 113 21.084 18.873 16.825 1.00 0.00 H new ATOM 0 HE2 LYS A 113 21.853 21.059 15.852 1.00 0.00 H new ATOM 0 HE3 LYS A 113 20.762 21.916 16.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 22.999 21.820 17.844 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 21.925 20.954 18.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 22.982 20.123 17.797 1.00 0.00 H new ATOM 4027 N THR A 114 18.177 15.537 16.878 1.00 0.00 N ATOM 4028 CA THR A 114 17.275 14.404 17.018 1.00 0.00 C ATOM 4029 C THR A 114 15.882 14.865 17.424 1.00 0.00 C ATOM 4030 O THR A 114 14.978 14.044 17.609 1.00 0.00 O ATOM 4031 CB THR A 114 17.794 13.435 18.069 1.00 0.00 C ATOM 4032 OG1 THR A 114 17.882 14.100 19.324 1.00 0.00 O ATOM 4033 CG2 THR A 114 19.174 12.921 17.662 1.00 0.00 C ATOM 0 H THR A 114 18.659 15.808 17.735 1.00 0.00 H new ATOM 0 HA THR A 114 17.223 13.905 16.050 1.00 0.00 H new ATOM 0 HB THR A 114 17.109 12.591 18.152 1.00 0.00 H new ATOM 0 HG1 THR A 114 18.215 13.476 20.002 1.00 0.00 H new ATOM 0 HG21 THR A 114 19.541 12.227 18.418 1.00 0.00 H new ATOM 0 HG22 THR A 114 19.103 12.408 16.703 1.00 0.00 H new ATOM 0 HG23 THR A 114 19.864 13.761 17.574 1.00 0.00 H new ATOM 4041 N ASP A 115 15.714 16.176 17.556 1.00 0.00 N ATOM 4042 CA ASP A 115 14.432 16.737 17.941 1.00 0.00 C ATOM 4043 C ASP A 115 13.357 16.344 16.937 1.00 0.00 C ATOM 4044 O ASP A 115 12.165 16.398 17.239 1.00 0.00 O ATOM 4045 CB ASP A 115 14.542 18.260 18.008 1.00 0.00 C ATOM 4046 CG ASP A 115 15.350 18.668 19.234 1.00 0.00 C ATOM 4047 OD1 ASP A 115 15.578 17.817 20.078 1.00 0.00 O ATOM 4048 OD2 ASP A 115 15.728 19.826 19.313 1.00 0.00 O1- ATOM 0 H ASP A 115 16.450 16.866 17.402 1.00 0.00 H new ATOM 0 HA ASP A 115 14.155 16.346 18.920 1.00 0.00 H new ATOM 0 HB2 ASP A 115 15.019 18.639 17.104 1.00 0.00 H new ATOM 0 HB3 ASP A 115 13.547 18.704 18.053 1.00 0.00 H new ATOM 4053 N GLN A 116 13.785 15.948 15.743 1.00 0.00 N ATOM 4054 CA GLN A 116 12.843 15.547 14.706 1.00 0.00 C ATOM 4055 C GLN A 116 13.061 14.093 14.307 1.00 0.00 C ATOM 4056 O GLN A 116 12.176 13.460 13.731 1.00 0.00 O ATOM 4057 CB GLN A 116 13.018 16.428 13.474 1.00 0.00 C ATOM 4058 CG GLN A 116 12.807 17.894 13.853 1.00 0.00 C ATOM 4059 CD GLN A 116 11.412 18.088 14.434 1.00 0.00 C ATOM 4060 OE1 GLN A 116 10.418 17.766 13.784 1.00 0.00 O ATOM 4061 NE2 GLN A 116 11.278 18.599 15.627 1.00 0.00 N ATOM 0 H GLN A 116 14.767 15.896 15.472 1.00 0.00 H new ATOM 0 HA GLN A 116 11.835 15.660 15.105 1.00 0.00 H new ATOM 0 HB2 GLN A 116 14.015 16.291 13.056 1.00 0.00 H new ATOM 0 HB3 GLN A 116 12.306 16.136 12.702 1.00 0.00 H new ATOM 0 HG2 GLN A 116 13.558 18.202 14.580 1.00 0.00 H new ATOM 0 HG3 GLN A 116 12.935 18.527 12.975 1.00 0.00 H new ATOM 0 HE21 GLN A 116 12.104 18.865 16.164 1.00 0.00 H new ATOM 0 HE22 GLN A 116 10.348 18.732 16.023 1.00 0.00 H new ATOM 4070 N ASP A 117 14.246 13.566 14.601 1.00 0.00 N ATOM 4071 CA ASP A 117 14.555 12.188 14.247 1.00 0.00 C ATOM 4072 C ASP A 117 13.609 11.237 14.959 1.00 0.00 C ATOM 4073 O ASP A 117 13.130 10.267 14.375 1.00 0.00 O ATOM 4074 CB ASP A 117 15.992 11.854 14.642 1.00 0.00 C ATOM 4075 CG ASP A 117 16.968 12.592 13.732 1.00 0.00 C ATOM 4076 OD1 ASP A 117 16.532 13.091 12.709 1.00 0.00 O ATOM 4077 OD2 ASP A 117 18.139 12.648 14.074 1.00 0.00 O1- ATOM 0 H ASP A 117 14.997 14.065 15.077 1.00 0.00 H new ATOM 0 HA ASP A 117 14.438 12.075 13.169 1.00 0.00 H new ATOM 0 HB2 ASP A 117 16.167 12.135 15.681 1.00 0.00 H new ATOM 0 HB3 ASP A 117 16.157 10.779 14.570 1.00 0.00 H new ATOM 4082 N GLU A 118 13.344 11.520 16.226 1.00 0.00 N ATOM 4083 CA GLU A 118 12.455 10.674 17.009 1.00 0.00 C ATOM 4084 C GLU A 118 11.043 10.701 16.455 1.00 0.00 C ATOM 4085 O GLU A 118 10.366 9.677 16.389 1.00 0.00 O ATOM 4086 CB GLU A 118 12.434 11.156 18.448 1.00 0.00 C ATOM 4087 CG GLU A 118 13.783 10.851 19.093 1.00 0.00 C ATOM 4088 CD GLU A 118 13.832 11.419 20.506 1.00 0.00 C ATOM 4089 OE1 GLU A 118 12.935 12.168 20.854 1.00 0.00 O ATOM 4090 OE2 GLU A 118 14.766 11.095 21.221 1.00 0.00 O1- ATOM 0 H GLU A 118 13.727 12.320 16.730 1.00 0.00 H new ATOM 0 HA GLU A 118 12.828 9.651 16.959 1.00 0.00 H new ATOM 0 HB2 GLU A 118 12.233 12.227 18.484 1.00 0.00 H new ATOM 0 HB3 GLU A 118 11.633 10.663 18.999 1.00 0.00 H new ATOM 0 HG2 GLU A 118 13.946 9.774 19.121 1.00 0.00 H new ATOM 0 HG3 GLU A 118 14.586 11.279 18.493 1.00 0.00 H new ATOM 4097 N GLU A 119 10.601 11.880 16.059 1.00 0.00 N ATOM 4098 CA GLU A 119 9.276 12.039 15.515 1.00 0.00 C ATOM 4099 C GLU A 119 9.151 11.293 14.198 1.00 0.00 C ATOM 4100 O GLU A 119 8.151 10.632 13.937 1.00 0.00 O ATOM 4101 CB GLU A 119 9.012 13.519 15.299 1.00 0.00 C ATOM 4102 CG GLU A 119 7.600 13.705 14.781 1.00 0.00 C ATOM 4103 CD GLU A 119 7.299 15.190 14.616 1.00 0.00 C ATOM 4104 OE1 GLU A 119 8.171 15.987 14.918 1.00 0.00 O ATOM 4105 OE2 GLU A 119 6.202 15.506 14.189 1.00 0.00 O1- ATOM 0 H GLU A 119 11.146 12.741 16.106 1.00 0.00 H new ATOM 0 HA GLU A 119 8.545 11.628 16.211 1.00 0.00 H new ATOM 0 HB2 GLU A 119 9.144 14.064 16.234 1.00 0.00 H new ATOM 0 HB3 GLU A 119 9.730 13.928 14.588 1.00 0.00 H new ATOM 0 HG2 GLU A 119 7.483 13.193 13.826 1.00 0.00 H new ATOM 0 HG3 GLU A 119 6.888 13.255 15.473 1.00 0.00 H new ATOM 4112 N HIS A 120 10.180 11.403 13.374 1.00 0.00 N ATOM 4113 CA HIS A 120 10.186 10.742 12.089 1.00 0.00 C ATOM 4114 C HIS A 120 10.170 9.258 12.295 1.00 0.00 C ATOM 4115 O HIS A 120 9.484 8.520 11.600 1.00 0.00 O ATOM 4116 CB HIS A 120 11.444 11.145 11.344 1.00 0.00 C ATOM 4117 CG HIS A 120 11.331 12.600 11.070 1.00 0.00 C ATOM 4118 ND1 HIS A 120 12.367 13.362 10.570 1.00 0.00 N ATOM 4119 CD2 HIS A 120 10.287 13.451 11.267 1.00 0.00 C ATOM 4120 CE1 HIS A 120 11.925 14.630 10.488 1.00 0.00 C ATOM 4121 NE2 HIS A 120 10.659 14.739 10.900 1.00 0.00 N ATOM 0 H HIS A 120 11.020 11.945 13.576 1.00 0.00 H new ATOM 0 HA HIS A 120 9.308 11.030 11.512 1.00 0.00 H new ATOM 0 HB2 HIS A 120 12.332 10.931 11.940 1.00 0.00 H new ATOM 0 HB3 HIS A 120 11.540 10.583 10.415 1.00 0.00 H new ATOM 0 HD2 HIS A 120 9.318 13.169 11.650 1.00 0.00 H new ATOM 0 HE1 HIS A 120 12.521 15.458 10.133 1.00 0.00 H new ATOM 0 HE2 HIS A 120 10.089 15.584 10.937 1.00 0.00 H new ATOM 4129 N CYS A 121 10.924 8.843 13.284 1.00 0.00 N ATOM 4130 CA CYS A 121 11.005 7.450 13.625 1.00 0.00 C ATOM 4131 C CYS A 121 9.629 6.945 14.024 1.00 0.00 C ATOM 4132 O CYS A 121 9.186 5.877 13.581 1.00 0.00 O ATOM 4133 CB CYS A 121 11.977 7.274 14.788 1.00 0.00 C ATOM 4134 SG CYS A 121 12.106 5.517 15.197 1.00 0.00 S ATOM 0 H CYS A 121 11.492 9.457 13.868 1.00 0.00 H new ATOM 0 HA CYS A 121 11.360 6.881 12.766 1.00 0.00 H new ATOM 0 HB2 CYS A 121 12.957 7.670 14.521 1.00 0.00 H new ATOM 0 HB3 CYS A 121 11.631 7.837 15.655 1.00 0.00 H new ATOM 0 HG CYS A 121 12.491 4.854 14.147 1.00 0.00 H new ATOM 4140 N ARG A 122 8.949 7.725 14.862 1.00 0.00 N ATOM 4141 CA ARG A 122 7.623 7.339 15.313 1.00 0.00 C ATOM 4142 C ARG A 122 6.663 7.282 14.132 1.00 0.00 C ATOM 4143 O ARG A 122 5.869 6.354 14.006 1.00 0.00 O ATOM 4144 CB ARG A 122 7.117 8.328 16.359 1.00 0.00 C ATOM 4145 CG ARG A 122 5.755 7.865 16.871 1.00 0.00 C ATOM 4146 CD ARG A 122 5.329 8.749 18.037 1.00 0.00 C ATOM 4147 NE ARG A 122 6.175 8.498 19.199 1.00 0.00 N ATOM 4148 CZ ARG A 122 6.053 9.206 20.324 1.00 0.00 C ATOM 4149 NH1 ARG A 122 5.161 10.160 20.424 1.00 0.00 N1+ ATOM 4150 NH2 ARG A 122 6.832 8.943 21.338 1.00 0.00 N ATOM 0 H ARG A 122 9.290 8.611 15.234 1.00 0.00 H new ATOM 0 HA ARG A 122 7.679 6.349 15.765 1.00 0.00 H new ATOM 0 HB2 ARG A 122 7.825 8.396 17.185 1.00 0.00 H new ATOM 0 HB3 ARG A 122 7.036 9.325 15.925 1.00 0.00 H new ATOM 0 HG2 ARG A 122 5.016 7.917 16.071 1.00 0.00 H new ATOM 0 HG3 ARG A 122 5.808 6.824 17.189 1.00 0.00 H new ATOM 0 HD2 ARG A 122 5.396 9.798 17.750 1.00 0.00 H new ATOM 0 HD3 ARG A 122 4.287 8.553 18.289 1.00 0.00 H new ATOM 0 HE ARG A 122 6.879 7.761 19.150 1.00 0.00 H new ATOM 0 HH11 ARG A 122 4.548 10.370 19.636 1.00 0.00 H new ATOM 0 HH12 ARG A 122 5.079 10.693 21.290 1.00 0.00 H new ATOM 0 HH21 ARG A 122 7.528 8.201 21.267 1.00 0.00 H new ATOM 0 HH22 ARG A 122 6.745 9.480 22.201 1.00 0.00 H new ATOM 4164 N LYS A 123 6.755 8.279 13.264 1.00 0.00 N ATOM 4165 CA LYS A 123 5.903 8.344 12.086 1.00 0.00 C ATOM 4166 C LYS A 123 6.204 7.198 11.127 1.00 0.00 C ATOM 4167 O LYS A 123 5.301 6.675 10.482 1.00 0.00 O ATOM 4168 CB LYS A 123 6.093 9.686 11.375 1.00 0.00 C ATOM 4169 CG LYS A 123 4.993 10.651 11.822 1.00 0.00 C ATOM 4170 CD LYS A 123 4.919 10.686 13.349 1.00 0.00 C ATOM 4171 CE LYS A 123 4.417 12.056 13.799 1.00 0.00 C ATOM 4172 NZ LYS A 123 3.086 12.315 13.187 1.00 0.00 N1+ ATOM 0 H LYS A 123 7.412 9.054 13.354 1.00 0.00 H new ATOM 0 HA LYS A 123 4.867 8.252 12.411 1.00 0.00 H new ATOM 0 HB2 LYS A 123 7.074 10.100 11.609 1.00 0.00 H new ATOM 0 HB3 LYS A 123 6.055 9.548 10.294 1.00 0.00 H new ATOM 0 HG2 LYS A 123 5.195 11.650 11.436 1.00 0.00 H new ATOM 0 HG3 LYS A 123 4.034 10.338 11.410 1.00 0.00 H new ATOM 0 HD2 LYS A 123 4.250 9.904 13.710 1.00 0.00 H new ATOM 0 HD3 LYS A 123 5.902 10.488 13.777 1.00 0.00 H new ATOM 0 HE2 LYS A 123 4.344 12.091 14.886 1.00 0.00 H new ATOM 0 HE3 LYS A 123 5.124 12.831 13.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 2.593 13.053 13.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 3.211 12.632 12.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 2.522 11.441 13.200 1.00 0.00 H new ATOM 4186 N VAL A 124 7.468 6.809 11.034 1.00 0.00 N ATOM 4187 CA VAL A 124 7.852 5.723 10.138 1.00 0.00 C ATOM 4188 C VAL A 124 7.106 4.439 10.485 1.00 0.00 C ATOM 4189 O VAL A 124 6.553 3.790 9.602 1.00 0.00 O ATOM 4190 CB VAL A 124 9.348 5.451 10.260 1.00 0.00 C ATOM 4191 CG1 VAL A 124 9.692 4.157 9.514 1.00 0.00 C ATOM 4192 CG2 VAL A 124 10.140 6.611 9.656 1.00 0.00 C ATOM 0 H VAL A 124 8.238 7.222 11.560 1.00 0.00 H new ATOM 0 HA VAL A 124 7.600 6.027 9.122 1.00 0.00 H new ATOM 0 HB VAL A 124 9.609 5.349 11.313 1.00 0.00 H new ATOM 0 HG11 VAL A 124 10.761 3.961 9.600 1.00 0.00 H new ATOM 0 HG12 VAL A 124 9.135 3.327 9.949 1.00 0.00 H new ATOM 0 HG13 VAL A 124 9.426 4.262 8.462 1.00 0.00 H new ATOM 0 HG21 VAL A 124 11.207 6.409 9.747 1.00 0.00 H new ATOM 0 HG22 VAL A 124 9.880 6.720 8.603 1.00 0.00 H new ATOM 0 HG23 VAL A 124 9.898 7.532 10.187 1.00 0.00 H new ATOM 4202 N ASN A 125 7.084 4.064 11.762 1.00 0.00 N ATOM 4203 CA ASN A 125 6.382 2.840 12.143 1.00 0.00 C ATOM 4204 C ASN A 125 4.893 3.067 12.179 1.00 0.00 C ATOM 4205 O ASN A 125 4.108 2.149 11.947 1.00 0.00 O ATOM 4206 CB ASN A 125 6.857 2.311 13.501 1.00 0.00 C ATOM 4207 CG ASN A 125 6.940 3.427 14.532 1.00 0.00 C ATOM 4208 OD1 ASN A 125 5.925 4.020 14.895 1.00 0.00 O ATOM 4209 ND2 ASN A 125 8.103 3.740 15.030 1.00 0.00 N ATOM 0 H ASN A 125 7.528 4.570 12.528 1.00 0.00 H new ATOM 0 HA ASN A 125 6.613 2.090 11.386 1.00 0.00 H new ATOM 0 HB2 ASN A 125 6.172 1.539 13.852 1.00 0.00 H new ATOM 0 HB3 ASN A 125 7.835 1.843 13.389 1.00 0.00 H new ATOM 0 HD21 ASN A 125 8.177 4.482 15.726 1.00 0.00 H new ATOM 0 HD22 ASN A 125 8.939 3.243 14.723 1.00 0.00 H new ATOM 4216 N GLU A 126 4.504 4.288 12.465 1.00 0.00 N ATOM 4217 CA GLU A 126 3.102 4.612 12.528 1.00 0.00 C ATOM 4218 C GLU A 126 2.457 4.582 11.146 1.00 0.00 C ATOM 4219 O GLU A 126 1.297 4.217 11.007 1.00 0.00 O ATOM 4220 CB GLU A 126 2.929 5.977 13.170 1.00 0.00 C ATOM 4221 CG GLU A 126 1.726 6.682 12.560 1.00 0.00 C ATOM 4222 CD GLU A 126 1.363 7.903 13.394 1.00 0.00 C ATOM 4223 OE1 GLU A 126 0.777 7.723 14.449 1.00 0.00 O ATOM 4224 OE2 GLU A 126 1.681 9.001 12.969 1.00 0.00 O1- ATOM 0 H GLU A 126 5.135 5.066 12.656 1.00 0.00 H new ATOM 0 HA GLU A 126 2.599 3.859 13.135 1.00 0.00 H new ATOM 0 HB2 GLU A 126 2.792 5.869 14.246 1.00 0.00 H new ATOM 0 HB3 GLU A 126 3.828 6.576 13.022 1.00 0.00 H new ATOM 0 HG2 GLU A 126 1.950 6.983 11.537 1.00 0.00 H new ATOM 0 HG3 GLU A 126 0.878 5.998 12.512 1.00 0.00 H new ATOM 4231 N TYR A 127 3.196 4.982 10.128 1.00 0.00 N ATOM 4232 CA TYR A 127 2.646 4.988 8.780 1.00 0.00 C ATOM 4233 C TYR A 127 2.725 3.596 8.165 1.00 0.00 C ATOM 4234 O TYR A 127 1.882 3.216 7.351 1.00 0.00 O ATOM 4235 CB TYR A 127 3.405 5.991 7.905 1.00 0.00 C ATOM 4236 CG TYR A 127 3.078 7.409 8.329 1.00 0.00 C ATOM 4237 CD1 TYR A 127 4.110 8.332 8.546 1.00 0.00 C ATOM 4238 CD2 TYR A 127 1.743 7.807 8.497 1.00 0.00 C ATOM 4239 CE1 TYR A 127 3.809 9.644 8.927 1.00 0.00 C ATOM 4240 CE2 TYR A 127 1.443 9.118 8.881 1.00 0.00 C ATOM 4241 CZ TYR A 127 2.477 10.038 9.096 1.00 0.00 C ATOM 4242 OH TYR A 127 2.182 11.334 9.471 1.00 0.00 O ATOM 0 H TYR A 127 4.162 5.302 10.202 1.00 0.00 H new ATOM 0 HA TYR A 127 1.599 5.286 8.835 1.00 0.00 H new ATOM 0 HB2 TYR A 127 4.478 5.817 7.987 1.00 0.00 H new ATOM 0 HB3 TYR A 127 3.138 5.846 6.858 1.00 0.00 H new ATOM 0 HD1 TYR A 127 5.139 8.030 8.419 1.00 0.00 H new ATOM 0 HD2 TYR A 127 0.945 7.099 8.329 1.00 0.00 H new ATOM 0 HE1 TYR A 127 4.606 10.354 9.091 1.00 0.00 H new ATOM 0 HE2 TYR A 127 0.415 9.421 9.012 1.00 0.00 H new ATOM 0 HH TYR A 127 1.210 11.441 9.543 1.00 0.00 H new ATOM 4252 N LEU A 128 3.746 2.843 8.554 1.00 0.00 N ATOM 4253 CA LEU A 128 3.936 1.496 8.035 1.00 0.00 C ATOM 4254 C LEU A 128 3.055 0.498 8.772 1.00 0.00 C ATOM 4255 O LEU A 128 2.685 -0.540 8.222 1.00 0.00 O ATOM 4256 CB LEU A 128 5.401 1.102 8.202 1.00 0.00 C ATOM 4257 CG LEU A 128 6.281 2.048 7.383 1.00 0.00 C ATOM 4258 CD1 LEU A 128 7.740 1.874 7.809 1.00 0.00 C ATOM 4259 CD2 LEU A 128 6.168 1.721 5.891 1.00 0.00 C ATOM 0 H LEU A 128 4.453 3.142 9.225 1.00 0.00 H new ATOM 0 HA LEU A 128 3.658 1.484 6.981 1.00 0.00 H new ATOM 0 HB2 LEU A 128 5.683 1.146 9.254 1.00 0.00 H new ATOM 0 HB3 LEU A 128 5.551 0.073 7.874 1.00 0.00 H new ATOM 0 HG LEU A 128 5.951 3.072 7.557 1.00 0.00 H new ATOM 0 HD11 LEU A 128 8.371 2.546 7.228 1.00 0.00 H new ATOM 0 HD12 LEU A 128 7.840 2.108 8.869 1.00 0.00 H new ATOM 0 HD13 LEU A 128 8.050 0.844 7.634 1.00 0.00 H new ATOM 0 HD21 LEU A 128 6.799 2.402 5.320 1.00 0.00 H new ATOM 0 HD22 LEU A 128 6.492 0.695 5.718 1.00 0.00 H new ATOM 0 HD23 LEU A 128 5.132 1.833 5.571 1.00 0.00 H new ATOM 4271 N ASN A 129 2.718 0.806 10.022 1.00 0.00 N ATOM 4272 CA ASN A 129 1.880 -0.090 10.804 1.00 0.00 C ATOM 4273 C ASN A 129 0.484 0.476 10.941 1.00 0.00 C ATOM 4274 O ASN A 129 -0.484 -0.266 11.110 1.00 0.00 O ATOM 4275 CB ASN A 129 2.474 -0.286 12.197 1.00 0.00 C ATOM 4276 CG ASN A 129 3.872 -0.863 12.076 1.00 0.00 C ATOM 4277 OD1 ASN A 129 4.074 -1.840 11.361 1.00 0.00 O ATOM 4278 ND2 ASN A 129 4.850 -0.306 12.730 1.00 0.00 N ATOM 0 H ASN A 129 3.008 1.656 10.506 1.00 0.00 H new ATOM 0 HA ASN A 129 1.833 -1.048 10.287 1.00 0.00 H new ATOM 0 HB2 ASN A 129 2.507 0.666 12.727 1.00 0.00 H new ATOM 0 HB3 ASN A 129 1.843 -0.955 12.782 1.00 0.00 H new ATOM 0 HD21 ASN A 129 5.795 -0.681 12.651 1.00 0.00 H new ATOM 0 HD22 ASN A 129 4.671 0.506 13.321 1.00 0.00 H new ATOM 4285 N ASN A 130 0.385 1.796 10.869 1.00 0.00 N ATOM 4286 CA ASN A 130 -0.916 2.446 10.993 1.00 0.00 C ATOM 4287 C ASN A 130 -1.104 3.501 9.906 1.00 0.00 C ATOM 4288 O ASN A 130 -1.039 4.700 10.175 1.00 0.00 O ATOM 4289 CB ASN A 130 -1.075 3.081 12.383 1.00 0.00 C ATOM 4290 CG ASN A 130 -0.967 2.015 13.472 1.00 0.00 C ATOM 4291 OD1 ASN A 130 -1.229 0.839 13.223 1.00 0.00 O ATOM 4292 ND2 ASN A 130 -0.596 2.362 14.675 1.00 0.00 N ATOM 0 H ASN A 130 1.172 2.429 10.728 1.00 0.00 H new ATOM 0 HA ASN A 130 -1.685 1.684 10.869 1.00 0.00 H new ATOM 0 HB2 ASN A 130 -0.308 3.841 12.532 1.00 0.00 H new ATOM 0 HB3 ASN A 130 -2.040 3.584 12.452 1.00 0.00 H new ATOM 0 HD21 ASN A 130 -0.523 1.658 15.409 1.00 0.00 H new ATOM 0 HD22 ASN A 130 -0.379 3.337 14.880 1.00 0.00 H new ATOM 4299 N PRO A 131 -1.330 3.079 8.690 1.00 0.00 N ATOM 4300 CA PRO A 131 -1.527 4.006 7.529 1.00 0.00 C ATOM 4301 C PRO A 131 -2.726 4.941 7.738 1.00 0.00 C ATOM 4302 O PRO A 131 -3.679 4.582 8.433 1.00 0.00 O ATOM 4303 CB PRO A 131 -1.780 3.060 6.349 1.00 0.00 C ATOM 4304 CG PRO A 131 -1.214 1.746 6.771 1.00 0.00 C ATOM 4305 CD PRO A 131 -1.419 1.670 8.277 1.00 0.00 C ATOM 0 HA PRO A 131 -0.671 4.664 7.380 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -2.845 2.978 6.132 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -1.297 3.424 5.442 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -1.719 0.923 6.266 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -0.156 1.676 6.516 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -2.385 1.234 8.532 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -0.656 1.058 8.759 1.00 0.00 H new ATOM 4313 N PRO A 132 -2.706 6.123 7.164 1.00 0.00 N ATOM 4314 CA PRO A 132 -3.821 7.101 7.311 1.00 0.00 C ATOM 4315 C PRO A 132 -5.012 6.751 6.422 1.00 0.00 C ATOM 4316 O PRO A 132 -4.938 7.019 5.235 1.00 0.00 O ATOM 4317 CB PRO A 132 -3.201 8.430 6.886 1.00 0.00 C ATOM 4318 CG PRO A 132 -2.087 8.075 5.957 1.00 0.00 C ATOM 4319 CD PRO A 132 -1.628 6.657 6.313 1.00 0.00 C ATOM 0 HA PRO A 132 -4.217 7.117 8.326 1.00 0.00 H new ATOM 0 HB2 PRO A 132 -3.936 9.065 6.392 1.00 0.00 H new ATOM 0 HB3 PRO A 132 -2.830 8.983 7.749 1.00 0.00 H new ATOM 0 HG2 PRO A 132 -2.422 8.121 4.921 1.00 0.00 H new ATOM 0 HG3 PRO A 132 -1.263 8.782 6.058 1.00 0.00 H new ATOM 0 HD2 PRO A 132 -1.490 6.049 5.419 1.00 0.00 H new ATOM 0 HD3 PRO A 132 -0.675 6.669 6.841 1.00 0.00 H new ATOM 4328 N GLN B 940 26.624 20.172 7.528 1.00 0.00 N ATOM 4329 CA GLN B 940 25.692 20.490 8.650 1.00 0.00 C ATOM 4330 C GLN B 940 25.004 19.211 9.131 1.00 0.00 C ATOM 4331 O GLN B 940 23.898 19.260 9.666 1.00 0.00 O ATOM 4332 CB GLN B 940 24.641 21.492 8.169 1.00 0.00 C ATOM 4333 CG GLN B 940 25.151 22.919 8.384 1.00 0.00 C ATOM 4334 CD GLN B 940 26.291 23.215 7.415 1.00 0.00 C ATOM 4335 OE1 GLN B 940 26.148 23.020 6.208 1.00 0.00 O ATOM 4336 NE2 GLN B 940 27.422 23.674 7.875 1.00 0.00 N ATOM 0 HA GLN B 940 26.255 20.923 9.476 1.00 0.00 H new ATOM 0 HB2 GLN B 940 24.425 21.328 7.113 1.00 0.00 H new ATOM 0 HB3 GLN B 940 23.708 21.343 8.712 1.00 0.00 H new ATOM 0 HG2 GLN B 940 24.340 23.631 8.233 1.00 0.00 H new ATOM 0 HG3 GLN B 940 25.495 23.041 9.411 1.00 0.00 H new ATOM 0 HE21 GLN B 940 27.538 23.835 8.876 1.00 0.00 H new ATOM 0 HE22 GLN B 940 28.190 23.872 7.234 1.00 0.00 H new ATOM 4345 N GLU B 941 25.659 18.069 8.937 1.00 0.00 N ATOM 4346 CA GLU B 941 25.082 16.794 9.357 1.00 0.00 C ATOM 4347 C GLU B 941 26.120 15.937 10.091 1.00 0.00 C ATOM 4348 O GLU B 941 27.321 16.091 9.870 1.00 0.00 O ATOM 4349 CB GLU B 941 24.562 16.033 8.134 1.00 0.00 C ATOM 4350 CG GLU B 941 23.369 16.782 7.530 1.00 0.00 C ATOM 4351 CD GLU B 941 23.850 17.959 6.684 1.00 0.00 C ATOM 4352 OE1 GLU B 941 25.032 18.009 6.387 1.00 0.00 O ATOM 4353 OE2 GLU B 941 23.027 18.795 6.348 1.00 0.00 O1- ATOM 0 H GLU B 941 26.577 17.999 8.498 1.00 0.00 H new ATOM 0 HA GLU B 941 24.258 17.000 10.040 1.00 0.00 H new ATOM 0 HB2 GLU B 941 25.354 15.932 7.392 1.00 0.00 H new ATOM 0 HB3 GLU B 941 24.264 15.025 8.421 1.00 0.00 H new ATOM 0 HG2 GLU B 941 22.778 16.102 6.916 1.00 0.00 H new ATOM 0 HG3 GLU B 941 22.717 17.141 8.326 1.00 0.00 H new ATOM 4360 N PRO B 942 25.695 15.033 10.952 1.00 0.00 N ATOM 4361 CA PRO B 942 26.635 14.142 11.706 1.00 0.00 C ATOM 4362 C PRO B 942 27.471 13.281 10.762 1.00 0.00 C ATOM 4363 O PRO B 942 26.988 12.850 9.715 1.00 0.00 O ATOM 4364 CB PRO B 942 25.712 13.262 12.560 1.00 0.00 C ATOM 4365 CG PRO B 942 24.422 14.003 12.635 1.00 0.00 C ATOM 4366 CD PRO B 942 24.293 14.747 11.311 1.00 0.00 C ATOM 0 HA PRO B 942 27.350 14.712 12.299 1.00 0.00 H new ATOM 0 HB2 PRO B 942 25.576 12.280 12.108 1.00 0.00 H new ATOM 0 HB3 PRO B 942 26.131 13.100 13.553 1.00 0.00 H new ATOM 0 HG2 PRO B 942 23.586 13.319 12.782 1.00 0.00 H new ATOM 0 HG3 PRO B 942 24.418 14.697 13.476 1.00 0.00 H new ATOM 0 HD2 PRO B 942 23.798 14.139 10.553 1.00 0.00 H new ATOM 0 HD3 PRO B 942 23.709 15.661 11.417 1.00 0.00 H new ATOM 4374 N GLU B 943 28.722 13.027 11.135 1.00 0.00 N ATOM 4375 CA GLU B 943 29.600 12.205 10.307 1.00 0.00 C ATOM 4376 C GLU B 943 29.188 10.734 10.407 1.00 0.00 C ATOM 4377 O GLU B 943 28.524 10.341 11.366 1.00 0.00 O ATOM 4378 CB GLU B 943 31.053 12.379 10.765 1.00 0.00 C ATOM 4379 CG GLU B 943 31.209 11.855 12.194 1.00 0.00 C ATOM 4380 CD GLU B 943 32.653 12.021 12.654 1.00 0.00 C ATOM 4381 OE1 GLU B 943 33.461 12.463 11.855 1.00 0.00 O ATOM 4382 OE2 GLU B 943 32.927 11.704 13.800 1.00 0.00 O1- ATOM 0 H GLU B 943 29.147 13.374 11.995 1.00 0.00 H new ATOM 0 HA GLU B 943 29.514 12.523 9.268 1.00 0.00 H new ATOM 0 HB2 GLU B 943 31.723 11.840 10.095 1.00 0.00 H new ATOM 0 HB3 GLU B 943 31.335 13.431 10.720 1.00 0.00 H new ATOM 0 HG2 GLU B 943 30.541 12.396 12.864 1.00 0.00 H new ATOM 0 HG3 GLU B 943 30.923 10.804 12.238 1.00 0.00 H new ATOM 4389 N PRO B 944 29.558 9.916 9.453 1.00 0.00 N ATOM 4390 CA PRO B 944 29.203 8.458 9.461 1.00 0.00 C ATOM 4391 C PRO B 944 29.651 7.757 10.758 1.00 0.00 C ATOM 4392 O PRO B 944 30.737 8.040 11.262 1.00 0.00 O ATOM 4393 CB PRO B 944 29.981 7.905 8.260 1.00 0.00 C ATOM 4394 CG PRO B 944 30.157 9.068 7.348 1.00 0.00 C ATOM 4395 CD PRO B 944 30.345 10.277 8.257 1.00 0.00 C ATOM 0 HA PRO B 944 28.127 8.295 9.405 1.00 0.00 H new ATOM 0 HB2 PRO B 944 30.943 7.495 8.568 1.00 0.00 H new ATOM 0 HB3 PRO B 944 29.433 7.099 7.771 1.00 0.00 H new ATOM 0 HG2 PRO B 944 31.020 8.929 6.697 1.00 0.00 H new ATOM 0 HG3 PRO B 944 29.288 9.195 6.702 1.00 0.00 H new ATOM 0 HD2 PRO B 944 31.395 10.441 8.499 1.00 0.00 H new ATOM 0 HD3 PRO B 944 29.978 11.192 7.793 1.00 0.00 H new ATOM 4403 N PRO B 945 28.859 6.851 11.303 1.00 0.00 N ATOM 4404 CA PRO B 945 29.224 6.116 12.553 1.00 0.00 C ATOM 4405 C PRO B 945 30.258 5.018 12.287 1.00 0.00 C ATOM 4406 O PRO B 945 30.619 4.762 11.139 1.00 0.00 O ATOM 4407 CB PRO B 945 27.893 5.526 13.019 1.00 0.00 C ATOM 4408 CG PRO B 945 27.108 5.319 11.771 1.00 0.00 C ATOM 4409 CD PRO B 945 27.534 6.423 10.800 1.00 0.00 C ATOM 0 HA PRO B 945 29.689 6.762 13.298 1.00 0.00 H new ATOM 0 HB2 PRO B 945 28.042 4.587 13.552 1.00 0.00 H new ATOM 0 HB3 PRO B 945 27.379 6.202 13.702 1.00 0.00 H new ATOM 0 HG2 PRO B 945 27.305 4.334 11.348 1.00 0.00 H new ATOM 0 HG3 PRO B 945 26.038 5.372 11.973 1.00 0.00 H new ATOM 0 HD2 PRO B 945 27.596 6.052 9.777 1.00 0.00 H new ATOM 0 HD3 PRO B 945 26.822 7.249 10.797 1.00 0.00 H new ATOM 4417 N GLU B 946 30.742 4.383 13.353 1.00 0.00 N ATOM 4418 CA GLU B 946 31.738 3.317 13.216 1.00 0.00 C ATOM 4419 C GLU B 946 31.056 1.939 13.243 1.00 0.00 C ATOM 4420 O GLU B 946 29.975 1.799 13.814 1.00 0.00 O ATOM 4421 CB GLU B 946 32.754 3.410 14.356 1.00 0.00 C ATOM 4422 CG GLU B 946 33.519 4.729 14.249 1.00 0.00 C ATOM 4423 CD GLU B 946 34.439 4.698 13.034 1.00 0.00 C ATOM 4424 OE1 GLU B 946 34.638 3.622 12.494 1.00 0.00 O ATOM 4425 OE2 GLU B 946 34.933 5.749 12.662 1.00 0.00 O1- ATOM 0 H GLU B 946 30.465 4.584 14.314 1.00 0.00 H new ATOM 0 HA GLU B 946 32.250 3.437 12.261 1.00 0.00 H new ATOM 0 HB2 GLU B 946 32.244 3.350 15.318 1.00 0.00 H new ATOM 0 HB3 GLU B 946 33.447 2.570 14.309 1.00 0.00 H new ATOM 0 HG2 GLU B 946 32.819 5.560 14.165 1.00 0.00 H new ATOM 0 HG3 GLU B 946 34.103 4.895 15.154 1.00 0.00 H new ATOM 4432 N PRO B 947 31.651 0.924 12.649 1.00 0.00 N ATOM 4433 CA PRO B 947 31.060 -0.456 12.627 1.00 0.00 C ATOM 4434 C PRO B 947 30.830 -1.005 14.033 1.00 0.00 C ATOM 4435 O PRO B 947 31.593 -0.712 14.953 1.00 0.00 O ATOM 4436 CB PRO B 947 32.115 -1.298 11.905 1.00 0.00 C ATOM 4437 CG PRO B 947 32.904 -0.324 11.106 1.00 0.00 C ATOM 4438 CD PRO B 947 32.940 0.959 11.932 1.00 0.00 C ATOM 0 HA PRO B 947 30.084 -0.466 12.141 1.00 0.00 H new ATOM 0 HB2 PRO B 947 32.748 -1.831 12.615 1.00 0.00 H new ATOM 0 HB3 PRO B 947 31.651 -2.049 11.266 1.00 0.00 H new ATOM 0 HG2 PRO B 947 33.911 -0.697 10.919 1.00 0.00 H new ATOM 0 HG3 PRO B 947 32.442 -0.150 10.134 1.00 0.00 H new ATOM 0 HD2 PRO B 947 33.785 0.973 12.620 1.00 0.00 H new ATOM 0 HD3 PRO B 947 33.028 1.844 11.301 1.00 0.00 H new ATOM 4446 N PHE B 948 29.783 -1.807 14.193 1.00 0.00 N ATOM 4447 CA PHE B 948 29.482 -2.394 15.496 1.00 0.00 C ATOM 4448 C PHE B 948 28.744 -3.716 15.337 1.00 0.00 C ATOM 4449 O PHE B 948 28.179 -3.997 14.283 1.00 0.00 O ATOM 4450 CB PHE B 948 28.629 -1.434 16.326 1.00 0.00 C ATOM 4451 CG PHE B 948 27.284 -1.251 15.667 1.00 0.00 C ATOM 4452 CD1 PHE B 948 26.208 -2.079 16.020 1.00 0.00 C ATOM 4453 CD2 PHE B 948 27.112 -0.253 14.705 1.00 0.00 C ATOM 4454 CE1 PHE B 948 24.961 -1.903 15.407 1.00 0.00 C ATOM 4455 CE2 PHE B 948 25.866 -0.078 14.092 1.00 0.00 C ATOM 4456 CZ PHE B 948 24.790 -0.902 14.443 1.00 0.00 C ATOM 0 H PHE B 948 29.135 -2.064 13.448 1.00 0.00 H new ATOM 0 HA PHE B 948 30.427 -2.576 16.008 1.00 0.00 H new ATOM 0 HB2 PHE B 948 28.500 -1.826 17.335 1.00 0.00 H new ATOM 0 HB3 PHE B 948 29.133 -0.472 16.420 1.00 0.00 H new ATOM 0 HD1 PHE B 948 26.341 -2.851 16.763 1.00 0.00 H new ATOM 0 HD2 PHE B 948 27.941 0.384 14.434 1.00 0.00 H new ATOM 0 HE1 PHE B 948 24.131 -2.539 15.678 1.00 0.00 H new ATOM 0 HE2 PHE B 948 25.734 0.693 13.348 1.00 0.00 H new ATOM 0 HZ PHE B 948 23.828 -0.766 13.970 1.00 0.00 H new ATOM 4466 N GLU B 949 28.748 -4.525 16.388 1.00 0.00 N ATOM 4467 CA GLU B 949 28.069 -5.812 16.342 1.00 0.00 C ATOM 4468 C GLU B 949 26.629 -5.676 16.827 1.00 0.00 C ATOM 4469 O GLU B 949 26.359 -5.020 17.833 1.00 0.00 O ATOM 4470 CB GLU B 949 28.810 -6.832 17.209 1.00 0.00 C ATOM 4471 CG GLU B 949 30.172 -7.138 16.580 1.00 0.00 C ATOM 4472 CD GLU B 949 30.967 -8.079 17.480 1.00 0.00 C ATOM 4473 OE1 GLU B 949 30.527 -8.317 18.593 1.00 0.00 O ATOM 4474 OE2 GLU B 949 32.005 -8.548 17.043 1.00 0.00 O1- ATOM 0 H GLU B 949 29.209 -4.316 17.274 1.00 0.00 H new ATOM 0 HA GLU B 949 28.061 -6.158 15.308 1.00 0.00 H new ATOM 0 HB2 GLU B 949 28.942 -6.441 18.218 1.00 0.00 H new ATOM 0 HB3 GLU B 949 28.223 -7.747 17.296 1.00 0.00 H new ATOM 0 HG2 GLU B 949 30.034 -7.592 15.598 1.00 0.00 H new ATOM 0 HG3 GLU B 949 30.727 -6.212 16.428 1.00 0.00 H new ATOM 4481 N TYR B 950 25.711 -6.311 16.105 1.00 0.00 N ATOM 4482 CA TYR B 950 24.301 -6.273 16.464 1.00 0.00 C ATOM 4483 C TYR B 950 23.803 -7.671 16.757 1.00 0.00 C ATOM 4484 O TYR B 950 23.921 -8.575 15.930 1.00 0.00 O ATOM 4485 CB TYR B 950 23.477 -5.666 15.332 1.00 0.00 C ATOM 4486 CG TYR B 950 22.034 -6.097 15.469 1.00 0.00 C ATOM 4487 CD1 TYR B 950 21.334 -5.861 16.659 1.00 0.00 C ATOM 4488 CD2 TYR B 950 21.389 -6.723 14.395 1.00 0.00 C ATOM 4489 CE1 TYR B 950 19.992 -6.247 16.773 1.00 0.00 C ATOM 4490 CE2 TYR B 950 20.049 -7.112 14.511 1.00 0.00 C ATOM 4491 CZ TYR B 950 19.350 -6.873 15.699 1.00 0.00 C ATOM 4492 OH TYR B 950 18.027 -7.247 15.808 1.00 0.00 O ATOM 0 H TYR B 950 25.920 -6.857 15.269 1.00 0.00 H new ATOM 0 HA TYR B 950 24.189 -5.654 17.354 1.00 0.00 H new ATOM 0 HB2 TYR B 950 23.547 -4.579 15.360 1.00 0.00 H new ATOM 0 HB3 TYR B 950 23.873 -5.986 14.368 1.00 0.00 H new ATOM 0 HD1 TYR B 950 21.829 -5.381 17.490 1.00 0.00 H new ATOM 0 HD2 TYR B 950 21.926 -6.906 13.476 1.00 0.00 H new ATOM 0 HE1 TYR B 950 19.453 -6.061 17.690 1.00 0.00 H new ATOM 0 HE2 TYR B 950 19.554 -7.597 13.682 1.00 0.00 H new ATOM 0 HH TYR B 950 17.603 -7.210 14.925 1.00 0.00 H new ATOM 4502 N ILE B 951 23.241 -7.837 17.939 1.00 0.00 N ATOM 4503 CA ILE B 951 22.717 -9.125 18.341 1.00 0.00 C ATOM 4504 C ILE B 951 21.310 -8.954 18.872 1.00 0.00 C ATOM 4505 O ILE B 951 21.084 -8.194 19.813 1.00 0.00 O ATOM 4506 CB ILE B 951 23.599 -9.742 19.424 1.00 0.00 C ATOM 4507 CG1 ILE B 951 25.066 -9.459 19.111 1.00 0.00 C ATOM 4508 CG2 ILE B 951 23.381 -11.254 19.448 1.00 0.00 C ATOM 4509 CD1 ILE B 951 25.510 -8.174 19.811 1.00 0.00 C ATOM 0 H ILE B 951 23.136 -7.098 18.634 1.00 0.00 H new ATOM 0 HA ILE B 951 22.706 -9.787 17.475 1.00 0.00 H new ATOM 0 HB ILE B 951 23.340 -9.311 20.391 1.00 0.00 H new ATOM 0 HG12 ILE B 951 25.684 -10.294 19.439 1.00 0.00 H new ATOM 0 HG13 ILE B 951 25.205 -9.363 18.034 1.00 0.00 H new ATOM 0 HG21 ILE B 951 24.009 -11.700 20.220 1.00 0.00 H new ATOM 0 HG22 ILE B 951 22.334 -11.467 19.664 1.00 0.00 H new ATOM 0 HG23 ILE B 951 23.645 -11.675 18.478 1.00 0.00 H new ATOM 0 HD11 ILE B 951 26.558 -7.979 19.583 1.00 0.00 H new ATOM 0 HD12 ILE B 951 24.901 -7.340 19.461 1.00 0.00 H new ATOM 0 HD13 ILE B 951 25.388 -8.286 20.888 1.00 0.00 H new ATOM 4521 N ASP B 952 20.363 -9.653 18.273 1.00 0.00 N ATOM 4522 CA ASP B 952 18.992 -9.542 18.727 1.00 0.00 C ATOM 4523 C ASP B 952 18.770 -10.444 19.932 1.00 0.00 C ATOM 4524 O ASP B 952 18.293 -11.571 19.802 1.00 0.00 O ATOM 4525 CB ASP B 952 18.031 -9.937 17.602 1.00 0.00 C ATOM 4526 CG ASP B 952 16.585 -9.711 18.039 1.00 0.00 C ATOM 4527 OD1 ASP B 952 16.377 -9.374 19.193 1.00 0.00 O ATOM 4528 OD2 ASP B 952 15.705 -9.878 17.210 1.00 0.00 O1- ATOM 0 H ASP B 952 20.513 -10.289 17.490 1.00 0.00 H new ATOM 0 HA ASP B 952 18.799 -8.508 19.013 1.00 0.00 H new ATOM 0 HB2 ASP B 952 18.244 -9.350 16.709 1.00 0.00 H new ATOM 0 HB3 ASP B 952 18.179 -10.984 17.338 1.00 0.00 H new ATOM 4533 N ASP B 953 19.118 -9.932 21.108 1.00 0.00 N ATOM 4534 CA ASP B 953 18.945 -10.696 22.340 1.00 0.00 C ATOM 4535 C ASP B 953 17.489 -11.115 22.511 1.00 0.00 C ATOM 4536 O ASP B 953 17.237 -12.009 23.302 1.00 0.00 O ATOM 4537 CB ASP B 953 19.384 -9.860 23.547 1.00 0.00 C ATOM 4538 CG ASP B 953 18.548 -8.586 23.639 1.00 0.00 C ATOM 4539 OD1 ASP B 953 17.686 -8.402 22.796 1.00 0.00 O ATOM 4540 OD2 ASP B 953 18.784 -7.813 24.553 1.00 0.00 O1- ATOM 4541 OXT ASP B 953 16.643 -10.534 21.849 1.00 0.00 O ATOM 0 H ASP B 953 19.517 -9.002 21.235 1.00 0.00 H new ATOM 0 HA ASP B 953 19.565 -11.591 22.277 1.00 0.00 H new ATOM 0 HB2 ASP B 953 19.274 -10.443 24.462 1.00 0.00 H new ATOM 0 HB3 ASP B 953 20.440 -9.605 23.457 1.00 0.00 H new