USER MOD reduce.3.24.130724 H: found=0, std=0, add=1298, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1298 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 74 ASN : amide:sc= -0.0119 K(o=1.1,f=-2.4) USER MOD Set 1.2: A 78 HIS : no HD1:sc= 1.16 K(o=1.1,f=-2.4!) USER MOD Set 2.1: A 47 SER OG : rot -168:sc= 0.785 USER MOD Set 2.2: A 50 HIS : no HE2:sc= -0.142 X(o=0.64,f=0.26) USER MOD Set 3.1: A 21 ASN : amide:sc= -0.114 K(o=3.3,f=-3.1) USER MOD Set 3.2: A 27 LYS NZ :NH3+ -149:sc= 3.43 (180deg=1.8) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -173:sc= 0 (180deg=-0.117) USER MOD Single : A 2 LYS NZ :NH3+ 166:sc= -0.0488 (180deg=-0.408) USER MOD Single : A 3 LYS NZ :NH3+ 166:sc= -0.0481 (180deg=-0.267) USER MOD Single : A 4 MET CE :methyl -166:sc= -0.123 (180deg=-0.459) USER MOD Single : A 8 THR OG1 : rot 180:sc= -0.0277 USER MOD Single : A 14 HIS : no HD1:sc= -0.0835 X(o=-0.083,f=-0.12) USER MOD Single : A 17 THR OG1 : rot -70:sc= 1.2 USER MOD Single : A 19 SER OG : rot 176:sc= -1.54! USER MOD Single : A 23 LYS NZ :NH3+ 140:sc= -0.247 (180deg=-0.973) USER MOD Single : A 26 THR OG1 : rot 127:sc= 1.23 USER MOD Single : A 30 ASN : amide:sc= 0.00766 K(o=0.0077,f=-0.82) USER MOD Single : A 33 SER OG : rot 92:sc= 1.56 USER MOD Single : A 35 ASN :FLIP amide:sc= -1.61 F(o=-2.4,f=-1.6) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot -90:sc= 0.207 USER MOD Single : A 52 LYS NZ :NH3+ 163:sc= -0.0178 (180deg=-0.182) USER MOD Single : A 53 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ -163:sc= -0.0266 (180deg=-0.28) USER MOD Single : A 58 THR OG1 : rot -31:sc= 1.21 USER MOD Single : A 60 SER OG : rot 159:sc= 1.43 USER MOD Single : A 61 ASN : amide:sc= 0.0277 K(o=0.028,f=-5!) USER MOD Single : A 65 GLN :FLIP amide:sc= -0.0284 F(o=-2.3!,f=-0.028) USER MOD Single : A 66 THR OG1 : rot 61:sc= 0.185 USER MOD Single : A 67 MET CE :methyl -126:sc= -0.204 (180deg=-2.12) USER MOD Single : A 72 LYS NZ :NH3+ -167:sc= -3.52! (180deg=-4.42!) USER MOD Single : A 77 HIS : no HD1:sc= -0.167 X(o=-0.17,f=-0.14) USER MOD Single : A 79 HIS : no HD1:sc= -0.037 X(o=-0.037,f=0) USER MOD Single : A 80 HIS : no HD1:sc= 0 X(o=0,f=-0.065) USER MOD Single : A 81 HIS : no HE2:sc= 0.685 K(o=0.68,f=-4.3!) USER MOD Single : A 82 HIS : no HD1:sc=-0.000272 X(o=-0.00027,f=-0.005) USER MOD Single : B 1 MET CE :methyl -163:sc= -0.0709 (180deg=-0.466) USER MOD Single : B 1 MET N :NH3+ -176:sc= 0 (180deg=-0.029) USER MOD Single : B 2 LYS NZ :NH3+ -136:sc= -1.31 (180deg=-3.85!) USER MOD Single : B 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 8 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 HIS : no HD1:sc= -0.0788 X(o=-0.079,f=-0.079) USER MOD Single : B 17 THR OG1 : rot -43:sc= 1.3 USER MOD Single : B 19 SER OG : rot 180:sc= -0.0237 USER MOD Single : B 21 ASN : amide:sc= 0 X(o=0,f=0.14) USER MOD Single : B 23 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00153) USER MOD Single : B 26 THR OG1 : rot -116:sc= 0.971 USER MOD Single : B 27 LYS NZ :NH3+ -148:sc=-0.00878 (180deg=-0.0973) USER MOD Single : B 30 ASN :FLIP amide:sc= -0.503 F(o=-3.2!,f=-0.5) USER MOD Single : B 33 SER OG : rot 58:sc= 1.22 USER MOD Single : B 35 ASN : amide:sc=-0.00893 X(o=-0.0089,f=-0.0089) USER MOD Single : B 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 47 SER OG : rot -103:sc= 1.65 USER MOD Single : B 50 HIS : no HE2:sc= 1.04 K(o=1,f=-5.8!) USER MOD Single : B 51 THR OG1 : rot 180:sc= 0 USER MOD Single : B 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 53 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 58 THR OG1 : rot -68:sc= 1.22 USER MOD Single : B 60 SER OG : rot 76:sc= 0.482 USER MOD Single : B 61 ASN : amide:sc= -0.201 K(o=-0.2,f=-3.4!) USER MOD Single : B 65 GLN : amide:sc= -2.87! C(o=-2.9!,f=-6.3!) USER MOD Single : B 66 THR OG1 : rot 101:sc= 1.24 USER MOD Single : B 67 MET CE :methyl -140:sc=-0.00694 (180deg=-1.81!) USER MOD Single : B 72 LYS NZ :NH3+ -179:sc= 1.22 (180deg=1.22) USER MOD Single : B 74 ASN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : B 77 HIS : no HE2:sc= 0.0346 X(o=0.035,f=-0.43) USER MOD Single : B 78 HIS : no HD1:sc= -0.0111 X(o=-0.011,f=-0.018) USER MOD Single : B 79 HIS : no HD1:sc= 1.05 K(o=1,f=-5.5!) USER MOD Single : B 80 HIS : no HD1:sc=-0.00693 X(o=-0.0069,f=-0.0069) USER MOD Single : B 81 HIS : no HD1:sc= -0.657 X(o=-0.66,f=-1) USER MOD Single : B 82 HIS : no HD1:sc= -0.312 X(o=-0.31,f=-0.76) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 22.196 18.542 -21.531 1.00 0.00 N ATOM 2 CA MET A 1 22.149 20.014 -21.691 1.00 0.00 C ATOM 3 C MET A 1 20.744 20.453 -22.075 1.00 0.00 C ATOM 4 O MET A 1 20.099 21.206 -21.347 1.00 0.00 O ATOM 5 CB MET A 1 23.143 20.478 -22.761 1.00 0.00 C ATOM 6 CG MET A 1 24.581 20.079 -22.480 1.00 0.00 C ATOM 7 SD MET A 1 25.179 20.702 -20.897 1.00 0.00 S ATOM 8 CE MET A 1 26.861 20.086 -20.905 1.00 0.00 C ATOM 0 H1 MET A 1 23.125 18.263 -21.155 1.00 0.00 H new ATOM 0 H2 MET A 1 21.450 18.241 -20.872 1.00 0.00 H new ATOM 0 H3 MET A 1 22.046 18.087 -22.454 1.00 0.00 H new ATOM 0 HA MET A 1 22.424 20.468 -20.739 1.00 0.00 H new ATOM 0 HB2 MET A 1 22.843 20.065 -23.724 1.00 0.00 H new ATOM 0 HB3 MET A 1 23.088 21.563 -22.848 1.00 0.00 H new ATOM 0 HG2 MET A 1 24.661 18.992 -22.492 1.00 0.00 H new ATOM 0 HG3 MET A 1 25.221 20.454 -23.279 1.00 0.00 H new ATOM 0 HE1 MET A 1 27.364 20.390 -19.987 1.00 0.00 H new ATOM 0 HE2 MET A 1 26.850 18.998 -20.969 1.00 0.00 H new ATOM 0 HE3 MET A 1 27.394 20.494 -21.764 1.00 0.00 H new ATOM 20 N LYS A 2 20.265 19.965 -23.213 1.00 0.00 N ATOM 21 CA LYS A 2 18.934 20.311 -23.691 1.00 0.00 C ATOM 22 C LYS A 2 17.879 19.484 -22.975 1.00 0.00 C ATOM 23 O LYS A 2 18.154 18.370 -22.523 1.00 0.00 O ATOM 24 CB LYS A 2 18.838 20.110 -25.202 1.00 0.00 C ATOM 25 CG LYS A 2 19.741 21.049 -25.978 1.00 0.00 C ATOM 26 CD LYS A 2 19.720 20.757 -27.465 1.00 0.00 C ATOM 27 CE LYS A 2 20.644 21.696 -28.223 1.00 0.00 C ATOM 28 NZ LYS A 2 22.041 21.643 -27.710 1.00 0.00 N ATOM 0 H LYS A 2 20.780 19.328 -23.821 1.00 0.00 H new ATOM 0 HA LYS A 2 18.753 21.363 -23.472 1.00 0.00 H new ATOM 0 HB2 LYS A 2 19.099 19.080 -25.444 1.00 0.00 H new ATOM 0 HB3 LYS A 2 17.806 20.261 -25.519 1.00 0.00 H new ATOM 0 HG2 LYS A 2 19.427 22.079 -25.806 1.00 0.00 H new ATOM 0 HG3 LYS A 2 20.762 20.961 -25.606 1.00 0.00 H new ATOM 0 HD2 LYS A 2 20.023 19.725 -27.640 1.00 0.00 H new ATOM 0 HD3 LYS A 2 18.703 20.859 -27.844 1.00 0.00 H new ATOM 0 HE2 LYS A 2 20.637 21.435 -29.281 1.00 0.00 H new ATOM 0 HE3 LYS A 2 20.268 22.716 -28.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 22.678 22.105 -28.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 22.094 22.135 -26.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 22.328 20.651 -27.586 1.00 0.00 H new ATOM 42 N LYS A 3 16.678 20.036 -22.878 1.00 0.00 N ATOM 43 CA LYS A 3 15.596 19.407 -22.138 1.00 0.00 C ATOM 44 C LYS A 3 15.116 18.135 -22.819 1.00 0.00 C ATOM 45 O LYS A 3 14.683 18.157 -23.973 1.00 0.00 O ATOM 46 CB LYS A 3 14.436 20.386 -21.976 1.00 0.00 C ATOM 47 CG LYS A 3 14.804 21.631 -21.190 1.00 0.00 C ATOM 48 CD LYS A 3 15.281 21.284 -19.791 1.00 0.00 C ATOM 49 CE LYS A 3 15.577 22.530 -18.971 1.00 0.00 C ATOM 50 NZ LYS A 3 14.372 23.379 -18.788 1.00 0.00 N ATOM 0 H LYS A 3 16.428 20.927 -23.307 1.00 0.00 H new ATOM 0 HA LYS A 3 15.979 19.133 -21.155 1.00 0.00 H new ATOM 0 HB2 LYS A 3 14.078 20.681 -22.963 1.00 0.00 H new ATOM 0 HB3 LYS A 3 13.610 19.880 -21.476 1.00 0.00 H new ATOM 0 HG2 LYS A 3 15.586 22.178 -21.717 1.00 0.00 H new ATOM 0 HG3 LYS A 3 13.940 22.292 -21.127 1.00 0.00 H new ATOM 0 HD2 LYS A 3 14.521 20.688 -19.285 1.00 0.00 H new ATOM 0 HD3 LYS A 3 16.179 20.669 -19.855 1.00 0.00 H new ATOM 0 HE2 LYS A 3 15.965 22.237 -17.995 1.00 0.00 H new ATOM 0 HE3 LYS A 3 16.357 23.110 -19.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 14.551 24.080 -18.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 14.155 23.871 -19.678 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 13.565 22.782 -18.517 1.00 0.00 H new ATOM 64 N MET A 4 15.205 17.035 -22.088 1.00 0.00 N ATOM 65 CA MET A 4 14.747 15.734 -22.556 1.00 0.00 C ATOM 66 C MET A 4 14.741 14.740 -21.406 1.00 0.00 C ATOM 67 O MET A 4 15.753 14.562 -20.723 1.00 0.00 O ATOM 68 CB MET A 4 15.639 15.206 -23.680 1.00 0.00 C ATOM 69 CG MET A 4 14.901 15.021 -24.992 1.00 0.00 C ATOM 70 SD MET A 4 13.462 13.942 -24.835 1.00 0.00 S ATOM 71 CE MET A 4 14.229 12.404 -24.327 1.00 0.00 C ATOM 0 H MET A 4 15.599 17.018 -21.147 1.00 0.00 H new ATOM 0 HA MET A 4 13.735 15.854 -22.944 1.00 0.00 H new ATOM 0 HB2 MET A 4 16.469 15.897 -23.832 1.00 0.00 H new ATOM 0 HB3 MET A 4 16.070 14.252 -23.375 1.00 0.00 H new ATOM 0 HG2 MET A 4 14.582 15.994 -25.365 1.00 0.00 H new ATOM 0 HG3 MET A 4 15.584 14.604 -25.733 1.00 0.00 H new ATOM 0 HE1 MET A 4 13.513 11.589 -24.430 1.00 0.00 H new ATOM 0 HE2 MET A 4 15.098 12.206 -24.955 1.00 0.00 H new ATOM 0 HE3 MET A 4 14.544 12.481 -23.286 1.00 0.00 H new ATOM 81 N ALA A 5 13.603 14.096 -21.189 1.00 0.00 N ATOM 82 CA ALA A 5 13.477 13.117 -20.123 1.00 0.00 C ATOM 83 C ALA A 5 14.065 11.780 -20.548 1.00 0.00 C ATOM 84 O ALA A 5 13.344 10.864 -20.943 1.00 0.00 O ATOM 85 CB ALA A 5 12.024 12.957 -19.707 1.00 0.00 C ATOM 0 H ALA A 5 12.755 14.235 -21.738 1.00 0.00 H new ATOM 0 HA ALA A 5 14.039 13.478 -19.262 1.00 0.00 H new ATOM 0 HB1 ALA A 5 11.953 12.219 -18.908 1.00 0.00 H new ATOM 0 HB2 ALA A 5 11.639 13.913 -19.353 1.00 0.00 H new ATOM 0 HB3 ALA A 5 11.435 12.623 -20.562 1.00 0.00 H new ATOM 91 N GLU A 6 15.384 11.686 -20.502 1.00 0.00 N ATOM 92 CA GLU A 6 16.074 10.450 -20.838 1.00 0.00 C ATOM 93 C GLU A 6 17.119 10.120 -19.781 1.00 0.00 C ATOM 94 O GLU A 6 18.105 9.432 -20.051 1.00 0.00 O ATOM 95 CB GLU A 6 16.728 10.546 -22.216 1.00 0.00 C ATOM 96 CG GLU A 6 17.744 11.666 -22.350 1.00 0.00 C ATOM 97 CD GLU A 6 18.525 11.567 -23.640 1.00 0.00 C ATOM 98 OE1 GLU A 6 19.519 10.813 -23.679 1.00 0.00 O ATOM 99 OE2 GLU A 6 18.137 12.223 -24.631 1.00 0.00 O ATOM 0 H GLU A 6 16.000 12.453 -20.234 1.00 0.00 H new ATOM 0 HA GLU A 6 15.336 9.648 -20.865 1.00 0.00 H new ATOM 0 HB2 GLU A 6 17.218 9.598 -22.439 1.00 0.00 H new ATOM 0 HB3 GLU A 6 15.949 10.686 -22.966 1.00 0.00 H new ATOM 0 HG2 GLU A 6 17.232 12.627 -22.308 1.00 0.00 H new ATOM 0 HG3 GLU A 6 18.432 11.635 -21.505 1.00 0.00 H new ATOM 106 N PHE A 7 16.890 10.606 -18.575 1.00 0.00 N ATOM 107 CA PHE A 7 17.772 10.310 -17.458 1.00 0.00 C ATOM 108 C PHE A 7 17.440 8.913 -16.916 1.00 0.00 C ATOM 109 O PHE A 7 17.132 8.004 -17.687 1.00 0.00 O ATOM 110 CB PHE A 7 17.621 11.388 -16.378 1.00 0.00 C ATOM 111 CG PHE A 7 18.795 11.498 -15.447 1.00 0.00 C ATOM 112 CD1 PHE A 7 20.048 11.844 -15.930 1.00 0.00 C ATOM 113 CD2 PHE A 7 18.647 11.262 -14.091 1.00 0.00 C ATOM 114 CE1 PHE A 7 21.130 11.953 -15.077 1.00 0.00 C ATOM 115 CE2 PHE A 7 19.723 11.370 -13.235 1.00 0.00 C ATOM 116 CZ PHE A 7 20.966 11.716 -13.727 1.00 0.00 C ATOM 0 H PHE A 7 16.100 11.208 -18.342 1.00 0.00 H new ATOM 0 HA PHE A 7 18.812 10.314 -17.784 1.00 0.00 H new ATOM 0 HB2 PHE A 7 17.465 12.352 -16.862 1.00 0.00 H new ATOM 0 HB3 PHE A 7 16.726 11.177 -15.793 1.00 0.00 H new ATOM 0 HD1 PHE A 7 20.180 12.031 -16.986 1.00 0.00 H new ATOM 0 HD2 PHE A 7 17.678 10.990 -13.699 1.00 0.00 H new ATOM 0 HE1 PHE A 7 22.101 12.223 -15.465 1.00 0.00 H new ATOM 0 HE2 PHE A 7 19.593 11.184 -12.179 1.00 0.00 H new ATOM 0 HZ PHE A 7 21.809 11.801 -13.057 1.00 0.00 H new ATOM 126 N THR A 8 17.493 8.727 -15.610 1.00 0.00 N ATOM 127 CA THR A 8 17.184 7.432 -15.035 1.00 0.00 C ATOM 128 C THR A 8 16.209 7.570 -13.868 1.00 0.00 C ATOM 129 O THR A 8 16.023 8.662 -13.319 1.00 0.00 O ATOM 130 CB THR A 8 18.463 6.699 -14.565 1.00 0.00 C ATOM 131 OG1 THR A 8 18.150 5.345 -14.210 1.00 0.00 O ATOM 132 CG2 THR A 8 19.103 7.409 -13.376 1.00 0.00 C ATOM 0 H THR A 8 17.744 9.448 -14.934 1.00 0.00 H new ATOM 0 HA THR A 8 16.716 6.837 -15.819 1.00 0.00 H new ATOM 0 HB THR A 8 19.176 6.705 -15.389 1.00 0.00 H new ATOM 0 HG1 THR A 8 18.965 4.887 -13.915 1.00 0.00 H new ATOM 0 HG21 THR A 8 19.999 6.870 -13.069 1.00 0.00 H new ATOM 0 HG22 THR A 8 19.371 8.426 -13.661 1.00 0.00 H new ATOM 0 HG23 THR A 8 18.396 7.439 -12.547 1.00 0.00 H new ATOM 140 N PHE A 9 15.565 6.467 -13.525 1.00 0.00 N ATOM 141 CA PHE A 9 14.725 6.403 -12.344 1.00 0.00 C ATOM 142 C PHE A 9 15.432 5.554 -11.297 1.00 0.00 C ATOM 143 O PHE A 9 15.857 4.432 -11.576 1.00 0.00 O ATOM 144 CB PHE A 9 13.332 5.842 -12.679 1.00 0.00 C ATOM 145 CG PHE A 9 13.331 4.462 -13.282 1.00 0.00 C ATOM 146 CD1 PHE A 9 13.625 4.276 -14.625 1.00 0.00 C ATOM 147 CD2 PHE A 9 13.031 3.350 -12.508 1.00 0.00 C ATOM 148 CE1 PHE A 9 13.621 3.010 -15.182 1.00 0.00 C ATOM 149 CE2 PHE A 9 13.025 2.084 -13.059 1.00 0.00 C ATOM 150 CZ PHE A 9 13.321 1.913 -14.399 1.00 0.00 C ATOM 0 H PHE A 9 15.610 5.596 -14.055 1.00 0.00 H new ATOM 0 HA PHE A 9 14.567 7.407 -11.951 1.00 0.00 H new ATOM 0 HB2 PHE A 9 12.735 5.824 -11.767 1.00 0.00 H new ATOM 0 HB3 PHE A 9 12.838 6.525 -13.370 1.00 0.00 H new ATOM 0 HD1 PHE A 9 13.860 5.130 -15.243 1.00 0.00 H new ATOM 0 HD2 PHE A 9 12.799 3.476 -11.461 1.00 0.00 H new ATOM 0 HE1 PHE A 9 13.852 2.880 -16.229 1.00 0.00 H new ATOM 0 HE2 PHE A 9 12.789 1.228 -12.444 1.00 0.00 H new ATOM 0 HZ PHE A 9 13.318 0.924 -14.832 1.00 0.00 H new ATOM 160 N GLU A 10 15.597 6.103 -10.108 1.00 0.00 N ATOM 161 CA GLU A 10 16.395 5.441 -9.090 1.00 0.00 C ATOM 162 C GLU A 10 15.638 5.335 -7.778 1.00 0.00 C ATOM 163 O GLU A 10 14.939 6.264 -7.371 1.00 0.00 O ATOM 164 CB GLU A 10 17.707 6.199 -8.881 1.00 0.00 C ATOM 165 CG GLU A 10 18.946 5.316 -8.944 1.00 0.00 C ATOM 166 CD GLU A 10 18.996 4.274 -7.842 1.00 0.00 C ATOM 167 OE1 GLU A 10 18.357 3.212 -7.991 1.00 0.00 O ATOM 168 OE2 GLU A 10 19.688 4.505 -6.829 1.00 0.00 O ATOM 0 H GLU A 10 15.194 6.996 -9.824 1.00 0.00 H new ATOM 0 HA GLU A 10 16.613 4.430 -9.434 1.00 0.00 H new ATOM 0 HB2 GLU A 10 17.789 6.979 -9.638 1.00 0.00 H new ATOM 0 HB3 GLU A 10 17.677 6.698 -7.912 1.00 0.00 H new ATOM 0 HG2 GLU A 10 18.977 4.814 -9.911 1.00 0.00 H new ATOM 0 HG3 GLU A 10 19.835 5.944 -8.882 1.00 0.00 H new ATOM 175 N ILE A 11 15.780 4.191 -7.129 1.00 0.00 N ATOM 176 CA ILE A 11 15.215 3.987 -5.808 1.00 0.00 C ATOM 177 C ILE A 11 16.229 4.457 -4.774 1.00 0.00 C ATOM 178 O ILE A 11 17.177 3.741 -4.443 1.00 0.00 O ATOM 179 CB ILE A 11 14.842 2.502 -5.538 1.00 0.00 C ATOM 180 CG1 ILE A 11 13.738 2.019 -6.493 1.00 0.00 C ATOM 181 CG2 ILE A 11 14.395 2.316 -4.092 1.00 0.00 C ATOM 182 CD1 ILE A 11 14.211 1.738 -7.904 1.00 0.00 C ATOM 0 H ILE A 11 16.285 3.386 -7.499 1.00 0.00 H new ATOM 0 HA ILE A 11 14.290 4.561 -5.743 1.00 0.00 H new ATOM 0 HB ILE A 11 15.734 1.902 -5.716 1.00 0.00 H new ATOM 0 HG12 ILE A 11 13.292 1.112 -6.085 1.00 0.00 H new ATOM 0 HG13 ILE A 11 12.951 2.772 -6.530 1.00 0.00 H new ATOM 0 HG21 ILE A 11 14.138 1.270 -3.922 1.00 0.00 H new ATOM 0 HG22 ILE A 11 15.204 2.604 -3.421 1.00 0.00 H new ATOM 0 HG23 ILE A 11 13.523 2.940 -3.898 1.00 0.00 H new ATOM 0 HD11 ILE A 11 13.369 1.402 -8.510 1.00 0.00 H new ATOM 0 HD12 ILE A 11 14.629 2.647 -8.336 1.00 0.00 H new ATOM 0 HD13 ILE A 11 14.976 0.961 -7.884 1.00 0.00 H new ATOM 194 N GLU A 12 16.054 5.679 -4.304 1.00 0.00 N ATOM 195 CA GLU A 12 17.006 6.286 -3.388 1.00 0.00 C ATOM 196 C GLU A 12 16.680 5.937 -1.944 1.00 0.00 C ATOM 197 O GLU A 12 17.572 5.843 -1.098 1.00 0.00 O ATOM 198 CB GLU A 12 17.021 7.805 -3.569 1.00 0.00 C ATOM 199 CG GLU A 12 15.651 8.451 -3.430 1.00 0.00 C ATOM 200 CD GLU A 12 15.716 9.962 -3.407 1.00 0.00 C ATOM 201 OE1 GLU A 12 15.903 10.571 -4.478 1.00 0.00 O ATOM 202 OE2 GLU A 12 15.582 10.549 -2.316 1.00 0.00 O ATOM 0 H GLU A 12 15.260 6.273 -4.542 1.00 0.00 H new ATOM 0 HA GLU A 12 17.994 5.888 -3.619 1.00 0.00 H new ATOM 0 HB2 GLU A 12 17.696 8.243 -2.833 1.00 0.00 H new ATOM 0 HB3 GLU A 12 17.426 8.041 -4.553 1.00 0.00 H new ATOM 0 HG2 GLU A 12 15.018 8.132 -4.258 1.00 0.00 H new ATOM 0 HG3 GLU A 12 15.179 8.098 -2.513 1.00 0.00 H new ATOM 209 N GLU A 13 15.405 5.730 -1.665 1.00 0.00 N ATOM 210 CA GLU A 13 14.971 5.493 -0.304 1.00 0.00 C ATOM 211 C GLU A 13 14.184 4.197 -0.193 1.00 0.00 C ATOM 212 O GLU A 13 13.379 3.868 -1.064 1.00 0.00 O ATOM 213 CB GLU A 13 14.122 6.661 0.192 1.00 0.00 C ATOM 214 CG GLU A 13 13.728 6.538 1.650 1.00 0.00 C ATOM 215 CD GLU A 13 14.932 6.423 2.562 1.00 0.00 C ATOM 216 OE1 GLU A 13 15.427 5.295 2.761 1.00 0.00 O ATOM 217 OE2 GLU A 13 15.394 7.462 3.072 1.00 0.00 O ATOM 0 H GLU A 13 14.658 5.722 -2.359 1.00 0.00 H new ATOM 0 HA GLU A 13 15.861 5.405 0.319 1.00 0.00 H new ATOM 0 HB2 GLU A 13 14.675 7.590 0.049 1.00 0.00 H new ATOM 0 HB3 GLU A 13 13.220 6.730 -0.416 1.00 0.00 H new ATOM 0 HG2 GLU A 13 13.137 7.407 1.939 1.00 0.00 H new ATOM 0 HG3 GLU A 13 13.092 5.663 1.780 1.00 0.00 H new ATOM 224 N HIS A 14 14.414 3.482 0.896 1.00 0.00 N ATOM 225 CA HIS A 14 13.700 2.252 1.172 1.00 0.00 C ATOM 226 C HIS A 14 12.915 2.403 2.465 1.00 0.00 C ATOM 227 O HIS A 14 13.479 2.712 3.514 1.00 0.00 O ATOM 228 CB HIS A 14 14.665 1.054 1.249 1.00 0.00 C ATOM 229 CG HIS A 14 15.681 1.125 2.359 1.00 0.00 C ATOM 230 ND1 HIS A 14 16.842 1.862 2.275 1.00 0.00 N ATOM 231 CD2 HIS A 14 15.700 0.542 3.583 1.00 0.00 C ATOM 232 CE1 HIS A 14 17.531 1.724 3.391 1.00 0.00 C ATOM 233 NE2 HIS A 14 16.862 0.927 4.203 1.00 0.00 N ATOM 0 H HIS A 14 15.098 3.738 1.608 1.00 0.00 H new ATOM 0 HA HIS A 14 13.006 2.056 0.355 1.00 0.00 H new ATOM 0 HB2 HIS A 14 14.080 0.143 1.370 1.00 0.00 H new ATOM 0 HB3 HIS A 14 15.192 0.970 0.299 1.00 0.00 H new ATOM 0 HD2 HIS A 14 14.940 -0.106 3.994 1.00 0.00 H new ATOM 0 HE1 HIS A 14 18.484 2.186 3.605 1.00 0.00 H new ATOM 0 HE2 HIS A 14 17.159 0.644 5.137 1.00 0.00 H new ATOM 242 N LEU A 15 11.612 2.225 2.381 1.00 0.00 N ATOM 243 CA LEU A 15 10.766 2.330 3.554 1.00 0.00 C ATOM 244 C LEU A 15 10.820 1.027 4.331 1.00 0.00 C ATOM 245 O LEU A 15 11.167 1.011 5.514 1.00 0.00 O ATOM 246 CB LEU A 15 9.335 2.667 3.135 1.00 0.00 C ATOM 247 CG LEU A 15 9.206 3.934 2.284 1.00 0.00 C ATOM 248 CD1 LEU A 15 7.814 4.042 1.703 1.00 0.00 C ATOM 249 CD2 LEU A 15 9.531 5.173 3.104 1.00 0.00 C ATOM 0 H LEU A 15 11.117 2.008 1.516 1.00 0.00 H new ATOM 0 HA LEU A 15 11.124 3.132 4.199 1.00 0.00 H new ATOM 0 HB2 LEU A 15 8.925 1.826 2.576 1.00 0.00 H new ATOM 0 HB3 LEU A 15 8.725 2.782 4.031 1.00 0.00 H new ATOM 0 HG LEU A 15 9.923 3.866 1.466 1.00 0.00 H new ATOM 0 HD11 LEU A 15 7.740 4.948 1.101 1.00 0.00 H new ATOM 0 HD12 LEU A 15 7.613 3.173 1.077 1.00 0.00 H new ATOM 0 HD13 LEU A 15 7.084 4.083 2.512 1.00 0.00 H new ATOM 0 HD21 LEU A 15 9.432 6.060 2.478 1.00 0.00 H new ATOM 0 HD22 LEU A 15 8.841 5.244 3.945 1.00 0.00 H new ATOM 0 HD23 LEU A 15 10.553 5.104 3.478 1.00 0.00 H new ATOM 261 N LEU A 16 10.492 -0.066 3.652 1.00 0.00 N ATOM 262 CA LEU A 16 10.646 -1.402 4.210 1.00 0.00 C ATOM 263 C LEU A 16 10.348 -2.453 3.155 1.00 0.00 C ATOM 264 O LEU A 16 9.601 -2.199 2.203 1.00 0.00 O ATOM 265 CB LEU A 16 9.718 -1.633 5.407 1.00 0.00 C ATOM 266 CG LEU A 16 8.229 -1.740 5.069 1.00 0.00 C ATOM 267 CD1 LEU A 16 7.538 -2.702 6.021 1.00 0.00 C ATOM 268 CD2 LEU A 16 7.569 -0.374 5.137 1.00 0.00 C ATOM 0 H LEU A 16 10.114 -0.051 2.705 1.00 0.00 H new ATOM 0 HA LEU A 16 11.679 -1.487 4.548 1.00 0.00 H new ATOM 0 HB2 LEU A 16 10.026 -2.548 5.913 1.00 0.00 H new ATOM 0 HB3 LEU A 16 9.855 -0.816 6.115 1.00 0.00 H new ATOM 0 HG LEU A 16 8.134 -2.123 4.053 1.00 0.00 H new ATOM 0 HD11 LEU A 16 6.480 -2.767 5.768 1.00 0.00 H new ATOM 0 HD12 LEU A 16 7.993 -3.689 5.935 1.00 0.00 H new ATOM 0 HD13 LEU A 16 7.645 -2.341 7.044 1.00 0.00 H new ATOM 0 HD21 LEU A 16 6.511 -0.469 4.894 1.00 0.00 H new ATOM 0 HD22 LEU A 16 7.675 0.032 6.143 1.00 0.00 H new ATOM 0 HD23 LEU A 16 8.047 0.297 4.423 1.00 0.00 H new ATOM 280 N THR A 17 10.930 -3.624 3.327 1.00 0.00 N ATOM 281 CA THR A 17 10.585 -4.772 2.517 1.00 0.00 C ATOM 282 C THR A 17 9.612 -5.653 3.294 1.00 0.00 C ATOM 283 O THR A 17 9.967 -6.222 4.327 1.00 0.00 O ATOM 284 CB THR A 17 11.841 -5.574 2.126 1.00 0.00 C ATOM 285 OG1 THR A 17 12.803 -4.696 1.514 1.00 0.00 O ATOM 286 CG2 THR A 17 11.493 -6.704 1.167 1.00 0.00 C ATOM 0 H THR A 17 11.650 -3.804 4.027 1.00 0.00 H new ATOM 0 HA THR A 17 10.115 -4.428 1.596 1.00 0.00 H new ATOM 0 HB THR A 17 12.264 -6.012 3.030 1.00 0.00 H new ATOM 0 HG1 THR A 17 12.478 -4.419 0.632 1.00 0.00 H new ATOM 0 HG21 THR A 17 12.398 -7.253 0.908 1.00 0.00 H new ATOM 0 HG22 THR A 17 10.783 -7.380 1.643 1.00 0.00 H new ATOM 0 HG23 THR A 17 11.049 -6.289 0.262 1.00 0.00 H new ATOM 294 N LEU A 18 8.378 -5.726 2.812 1.00 0.00 N ATOM 295 CA LEU A 18 7.310 -6.425 3.517 1.00 0.00 C ATOM 296 C LEU A 18 7.646 -7.903 3.662 1.00 0.00 C ATOM 297 O LEU A 18 7.955 -8.371 4.758 1.00 0.00 O ATOM 298 CB LEU A 18 5.985 -6.250 2.771 1.00 0.00 C ATOM 299 CG LEU A 18 5.607 -4.798 2.455 1.00 0.00 C ATOM 300 CD1 LEU A 18 4.400 -4.734 1.536 1.00 0.00 C ATOM 301 CD2 LEU A 18 5.328 -4.033 3.735 1.00 0.00 C ATOM 0 H LEU A 18 8.090 -5.306 1.928 1.00 0.00 H new ATOM 0 HA LEU A 18 7.210 -5.996 4.514 1.00 0.00 H new ATOM 0 HB2 LEU A 18 6.035 -6.808 1.836 1.00 0.00 H new ATOM 0 HB3 LEU A 18 5.188 -6.696 3.366 1.00 0.00 H new ATOM 0 HG LEU A 18 6.451 -4.336 1.943 1.00 0.00 H new ATOM 0 HD11 LEU A 18 4.155 -3.692 1.329 1.00 0.00 H new ATOM 0 HD12 LEU A 18 4.627 -5.246 0.601 1.00 0.00 H new ATOM 0 HD13 LEU A 18 3.550 -5.218 2.017 1.00 0.00 H new ATOM 0 HD21 LEU A 18 5.061 -3.004 3.493 1.00 0.00 H new ATOM 0 HD22 LEU A 18 4.504 -4.506 4.269 1.00 0.00 H new ATOM 0 HD23 LEU A 18 6.218 -4.039 4.364 1.00 0.00 H new ATOM 313 N SER A 19 7.619 -8.620 2.545 1.00 0.00 N ATOM 314 CA SER A 19 7.932 -10.041 2.531 1.00 0.00 C ATOM 315 C SER A 19 8.013 -10.546 1.093 1.00 0.00 C ATOM 316 O SER A 19 7.773 -9.787 0.149 1.00 0.00 O ATOM 317 CB SER A 19 6.882 -10.833 3.318 1.00 0.00 C ATOM 318 OG SER A 19 5.573 -10.576 2.838 1.00 0.00 O ATOM 0 H SER A 19 7.381 -8.235 1.631 1.00 0.00 H new ATOM 0 HA SER A 19 8.900 -10.188 3.010 1.00 0.00 H new ATOM 0 HB2 SER A 19 7.096 -11.899 3.242 1.00 0.00 H new ATOM 0 HB3 SER A 19 6.942 -10.570 4.374 1.00 0.00 H new ATOM 0 HG SER A 19 4.932 -11.144 3.315 1.00 0.00 H new ATOM 324 N GLU A 20 8.355 -11.812 0.925 1.00 0.00 N ATOM 325 CA GLU A 20 8.466 -12.399 -0.400 1.00 0.00 C ATOM 326 C GLU A 20 7.166 -13.100 -0.786 1.00 0.00 C ATOM 327 O GLU A 20 6.591 -13.850 0.004 1.00 0.00 O ATOM 328 CB GLU A 20 9.630 -13.389 -0.451 1.00 0.00 C ATOM 329 CG GLU A 20 9.819 -14.020 -1.816 1.00 0.00 C ATOM 330 CD GLU A 20 10.844 -15.127 -1.803 1.00 0.00 C ATOM 331 OE1 GLU A 20 10.502 -16.247 -1.376 1.00 0.00 O ATOM 332 OE2 GLU A 20 11.988 -14.886 -2.229 1.00 0.00 O ATOM 0 H GLU A 20 8.561 -12.454 1.690 1.00 0.00 H new ATOM 0 HA GLU A 20 8.656 -11.597 -1.113 1.00 0.00 H new ATOM 0 HB2 GLU A 20 10.548 -12.875 -0.165 1.00 0.00 H new ATOM 0 HB3 GLU A 20 9.462 -14.175 0.285 1.00 0.00 H new ATOM 0 HG2 GLU A 20 8.865 -14.416 -2.165 1.00 0.00 H new ATOM 0 HG3 GLU A 20 10.125 -13.254 -2.528 1.00 0.00 H new ATOM 339 N ASN A 21 6.690 -12.817 -1.987 1.00 0.00 N ATOM 340 CA ASN A 21 5.507 -13.472 -2.526 1.00 0.00 C ATOM 341 C ASN A 21 5.850 -14.266 -3.778 1.00 0.00 C ATOM 342 O ASN A 21 6.832 -13.967 -4.468 1.00 0.00 O ATOM 343 CB ASN A 21 4.415 -12.447 -2.844 1.00 0.00 C ATOM 344 CG ASN A 21 3.468 -12.206 -1.681 1.00 0.00 C ATOM 345 OD1 ASN A 21 2.305 -11.848 -1.883 1.00 0.00 O ATOM 346 ND2 ASN A 21 3.950 -12.391 -0.463 1.00 0.00 N ATOM 0 H ASN A 21 7.109 -12.130 -2.614 1.00 0.00 H new ATOM 0 HA ASN A 21 5.133 -14.159 -1.767 1.00 0.00 H new ATOM 0 HB2 ASN A 21 4.882 -11.503 -3.126 1.00 0.00 H new ATOM 0 HB3 ASN A 21 3.843 -12.790 -3.706 1.00 0.00 H new ATOM 0 HD21 ASN A 21 3.354 -12.237 0.350 1.00 0.00 H new ATOM 0 HD22 ASN A 21 4.918 -12.688 -0.337 1.00 0.00 H new ATOM 353 N GLU A 22 5.048 -15.294 -4.043 1.00 0.00 N ATOM 354 CA GLU A 22 5.154 -16.093 -5.267 1.00 0.00 C ATOM 355 C GLU A 22 6.492 -16.822 -5.366 1.00 0.00 C ATOM 356 O GLU A 22 6.815 -17.383 -6.412 1.00 0.00 O ATOM 357 CB GLU A 22 4.945 -15.207 -6.500 1.00 0.00 C ATOM 358 CG GLU A 22 3.590 -14.520 -6.531 1.00 0.00 C ATOM 359 CD GLU A 22 2.444 -15.506 -6.538 1.00 0.00 C ATOM 360 OE1 GLU A 22 2.029 -15.932 -7.637 1.00 0.00 O ATOM 361 OE2 GLU A 22 1.957 -15.870 -5.448 1.00 0.00 O ATOM 0 H GLU A 22 4.304 -15.599 -3.416 1.00 0.00 H new ATOM 0 HA GLU A 22 4.371 -16.850 -5.227 1.00 0.00 H new ATOM 0 HB2 GLU A 22 5.728 -14.449 -6.530 1.00 0.00 H new ATOM 0 HB3 GLU A 22 5.055 -15.815 -7.398 1.00 0.00 H new ATOM 0 HG2 GLU A 22 3.497 -13.866 -5.664 1.00 0.00 H new ATOM 0 HG3 GLU A 22 3.527 -13.887 -7.416 1.00 0.00 H new ATOM 368 N LYS A 23 7.245 -16.831 -4.264 1.00 0.00 N ATOM 369 CA LYS A 23 8.564 -17.458 -4.215 1.00 0.00 C ATOM 370 C LYS A 23 9.495 -16.830 -5.250 1.00 0.00 C ATOM 371 O LYS A 23 9.711 -17.376 -6.335 1.00 0.00 O ATOM 372 CB LYS A 23 8.453 -18.969 -4.426 1.00 0.00 C ATOM 373 CG LYS A 23 7.506 -19.638 -3.446 1.00 0.00 C ATOM 374 CD LYS A 23 7.224 -21.078 -3.833 1.00 0.00 C ATOM 375 CE LYS A 23 6.036 -21.632 -3.064 1.00 0.00 C ATOM 376 NZ LYS A 23 4.817 -20.801 -3.258 1.00 0.00 N ATOM 0 H LYS A 23 6.957 -16.404 -3.383 1.00 0.00 H new ATOM 0 HA LYS A 23 8.990 -17.286 -3.226 1.00 0.00 H new ATOM 0 HB2 LYS A 23 8.112 -19.164 -5.443 1.00 0.00 H new ATOM 0 HB3 LYS A 23 9.442 -19.417 -4.330 1.00 0.00 H new ATOM 0 HG2 LYS A 23 7.937 -19.608 -2.445 1.00 0.00 H new ATOM 0 HG3 LYS A 23 6.570 -19.081 -3.407 1.00 0.00 H new ATOM 0 HD2 LYS A 23 7.027 -21.138 -4.903 1.00 0.00 H new ATOM 0 HD3 LYS A 23 8.105 -21.689 -3.636 1.00 0.00 H new ATOM 0 HE2 LYS A 23 5.836 -22.653 -3.390 1.00 0.00 H new ATOM 0 HE3 LYS A 23 6.279 -21.678 -2.003 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 3.987 -21.420 -3.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 4.689 -20.175 -2.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 4.922 -20.227 -4.119 1.00 0.00 H new ATOM 390 N GLY A 24 10.017 -15.663 -4.912 1.00 0.00 N ATOM 391 CA GLY A 24 10.909 -14.961 -5.803 1.00 0.00 C ATOM 392 C GLY A 24 10.663 -13.468 -5.800 1.00 0.00 C ATOM 393 O GLY A 24 11.600 -12.678 -5.688 1.00 0.00 O ATOM 0 H GLY A 24 9.836 -15.187 -4.028 1.00 0.00 H new ATOM 0 HA2 GLY A 24 11.941 -15.158 -5.511 1.00 0.00 H new ATOM 0 HA3 GLY A 24 10.785 -15.346 -6.815 1.00 0.00 H new ATOM 397 N TRP A 25 9.401 -13.077 -5.895 1.00 0.00 N ATOM 398 CA TRP A 25 9.044 -11.669 -5.999 1.00 0.00 C ATOM 399 C TRP A 25 8.939 -11.043 -4.620 1.00 0.00 C ATOM 400 O TRP A 25 8.152 -11.488 -3.791 1.00 0.00 O ATOM 401 CB TRP A 25 7.713 -11.506 -6.738 1.00 0.00 C ATOM 402 CG TRP A 25 7.791 -11.809 -8.204 1.00 0.00 C ATOM 403 CD1 TRP A 25 8.067 -13.012 -8.783 1.00 0.00 C ATOM 404 CD2 TRP A 25 7.579 -10.887 -9.281 1.00 0.00 C ATOM 405 NE1 TRP A 25 8.046 -12.895 -10.151 1.00 0.00 N ATOM 406 CE2 TRP A 25 7.748 -11.600 -10.481 1.00 0.00 C ATOM 407 CE3 TRP A 25 7.265 -9.529 -9.343 1.00 0.00 C ATOM 408 CZ2 TRP A 25 7.611 -11.000 -11.730 1.00 0.00 C ATOM 409 CZ3 TRP A 25 7.131 -8.933 -10.583 1.00 0.00 C ATOM 410 CH2 TRP A 25 7.303 -9.669 -11.762 1.00 0.00 C ATOM 0 H TRP A 25 8.606 -13.715 -5.902 1.00 0.00 H new ATOM 0 HA TRP A 25 9.828 -11.162 -6.561 1.00 0.00 H new ATOM 0 HB2 TRP A 25 6.972 -12.162 -6.280 1.00 0.00 H new ATOM 0 HB3 TRP A 25 7.359 -10.484 -6.607 1.00 0.00 H new ATOM 0 HD1 TRP A 25 8.272 -13.925 -8.244 1.00 0.00 H new ATOM 0 HE1 TRP A 25 8.224 -13.650 -10.814 1.00 0.00 H new ATOM 0 HE3 TRP A 25 7.129 -8.954 -8.439 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 7.743 -11.566 -12.640 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 6.890 -7.882 -10.644 1.00 0.00 H new ATOM 0 HH2 TRP A 25 7.190 -9.175 -12.716 1.00 0.00 H new ATOM 421 N THR A 26 9.723 -10.014 -4.365 1.00 0.00 N ATOM 422 CA THR A 26 9.646 -9.347 -3.085 1.00 0.00 C ATOM 423 C THR A 26 8.575 -8.267 -3.126 1.00 0.00 C ATOM 424 O THR A 26 8.458 -7.533 -4.100 1.00 0.00 O ATOM 425 CB THR A 26 11.003 -8.730 -2.679 1.00 0.00 C ATOM 426 OG1 THR A 26 11.548 -7.959 -3.759 1.00 0.00 O ATOM 427 CG2 THR A 26 11.989 -9.817 -2.274 1.00 0.00 C ATOM 0 H THR A 26 10.408 -9.629 -5.015 1.00 0.00 H new ATOM 0 HA THR A 26 9.383 -10.094 -2.336 1.00 0.00 H new ATOM 0 HB THR A 26 10.833 -8.074 -1.825 1.00 0.00 H new ATOM 0 HG1 THR A 26 11.762 -7.057 -3.442 1.00 0.00 H new ATOM 0 HG21 THR A 26 12.938 -9.361 -1.992 1.00 0.00 H new ATOM 0 HG22 THR A 26 11.588 -10.374 -1.427 1.00 0.00 H new ATOM 0 HG23 THR A 26 12.148 -10.495 -3.112 1.00 0.00 H new ATOM 435 N LYS A 27 7.785 -8.184 -2.076 1.00 0.00 N ATOM 436 CA LYS A 27 6.764 -7.164 -1.986 1.00 0.00 C ATOM 437 C LYS A 27 7.221 -6.120 -0.989 1.00 0.00 C ATOM 438 O LYS A 27 7.442 -6.433 0.180 1.00 0.00 O ATOM 439 CB LYS A 27 5.432 -7.782 -1.554 1.00 0.00 C ATOM 440 CG LYS A 27 4.254 -6.828 -1.644 1.00 0.00 C ATOM 441 CD LYS A 27 2.962 -7.488 -1.189 1.00 0.00 C ATOM 442 CE LYS A 27 2.580 -8.664 -2.076 1.00 0.00 C ATOM 443 NZ LYS A 27 1.332 -9.332 -1.614 1.00 0.00 N ATOM 0 H LYS A 27 7.831 -8.811 -1.273 1.00 0.00 H new ATOM 0 HA LYS A 27 6.611 -6.699 -2.960 1.00 0.00 H new ATOM 0 HB2 LYS A 27 5.229 -8.654 -2.175 1.00 0.00 H new ATOM 0 HB3 LYS A 27 5.523 -8.136 -0.527 1.00 0.00 H new ATOM 0 HG2 LYS A 27 4.450 -5.949 -1.030 1.00 0.00 H new ATOM 0 HG3 LYS A 27 4.144 -6.481 -2.671 1.00 0.00 H new ATOM 0 HD2 LYS A 27 3.073 -7.831 -0.160 1.00 0.00 H new ATOM 0 HD3 LYS A 27 2.157 -6.753 -1.195 1.00 0.00 H new ATOM 0 HE2 LYS A 27 2.447 -8.316 -3.100 1.00 0.00 H new ATOM 0 HE3 LYS A 27 3.395 -9.388 -2.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 1.373 -10.344 -1.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 1.239 -9.219 -0.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 0.512 -8.900 -2.085 1.00 0.00 H new ATOM 457 N GLU A 28 7.395 -4.893 -1.446 1.00 0.00 N ATOM 458 CA GLU A 28 7.972 -3.861 -0.604 1.00 0.00 C ATOM 459 C GLU A 28 7.574 -2.470 -1.073 1.00 0.00 C ATOM 460 O GLU A 28 6.992 -2.302 -2.150 1.00 0.00 O ATOM 461 CB GLU A 28 9.494 -4.010 -0.578 1.00 0.00 C ATOM 462 CG GLU A 28 10.141 -3.971 -1.952 1.00 0.00 C ATOM 463 CD GLU A 28 11.542 -4.545 -1.945 1.00 0.00 C ATOM 464 OE1 GLU A 28 12.370 -4.095 -1.123 1.00 0.00 O ATOM 465 OE2 GLU A 28 11.813 -5.463 -2.751 1.00 0.00 O ATOM 0 H GLU A 28 7.147 -4.588 -2.387 1.00 0.00 H new ATOM 0 HA GLU A 28 7.582 -3.984 0.407 1.00 0.00 H new ATOM 0 HB2 GLU A 28 9.917 -3.213 0.034 1.00 0.00 H new ATOM 0 HB3 GLU A 28 9.749 -4.953 -0.094 1.00 0.00 H new ATOM 0 HG2 GLU A 28 9.525 -4.530 -2.657 1.00 0.00 H new ATOM 0 HG3 GLU A 28 10.175 -2.941 -2.306 1.00 0.00 H new ATOM 472 N ILE A 29 7.893 -1.478 -0.253 1.00 0.00 N ATOM 473 CA ILE A 29 7.535 -0.100 -0.536 1.00 0.00 C ATOM 474 C ILE A 29 8.770 0.788 -0.433 1.00 0.00 C ATOM 475 O ILE A 29 9.530 0.701 0.537 1.00 0.00 O ATOM 476 CB ILE A 29 6.455 0.413 0.438 1.00 0.00 C ATOM 477 CG1 ILE A 29 5.345 -0.634 0.596 1.00 0.00 C ATOM 478 CG2 ILE A 29 5.877 1.727 -0.068 1.00 0.00 C ATOM 479 CD1 ILE A 29 4.284 -0.265 1.612 1.00 0.00 C ATOM 0 H ILE A 29 8.404 -1.607 0.621 1.00 0.00 H new ATOM 0 HA ILE A 29 7.132 -0.061 -1.548 1.00 0.00 H new ATOM 0 HB ILE A 29 6.911 0.585 1.413 1.00 0.00 H new ATOM 0 HG12 ILE A 29 4.867 -0.790 -0.371 1.00 0.00 H new ATOM 0 HG13 ILE A 29 5.795 -1.584 0.886 1.00 0.00 H new ATOM 0 HG21 ILE A 29 5.115 2.081 0.627 1.00 0.00 H new ATOM 0 HG22 ILE A 29 6.672 2.469 -0.144 1.00 0.00 H new ATOM 0 HG23 ILE A 29 5.429 1.573 -1.050 1.00 0.00 H new ATOM 0 HD11 ILE A 29 3.537 -1.058 1.663 1.00 0.00 H new ATOM 0 HD12 ILE A 29 4.746 -0.139 2.591 1.00 0.00 H new ATOM 0 HD13 ILE A 29 3.804 0.667 1.315 1.00 0.00 H new ATOM 491 N ASN A 30 8.970 1.634 -1.428 1.00 0.00 N ATOM 492 CA ASN A 30 10.157 2.479 -1.486 1.00 0.00 C ATOM 493 C ASN A 30 9.810 3.838 -2.082 1.00 0.00 C ATOM 494 O ASN A 30 8.648 4.101 -2.384 1.00 0.00 O ATOM 495 CB ASN A 30 11.241 1.794 -2.327 1.00 0.00 C ATOM 496 CG ASN A 30 10.828 1.607 -3.777 1.00 0.00 C ATOM 497 OD1 ASN A 30 11.055 2.476 -4.610 1.00 0.00 O ATOM 498 ND2 ASN A 30 10.227 0.467 -4.086 1.00 0.00 N ATOM 0 H ASN A 30 8.326 1.757 -2.210 1.00 0.00 H new ATOM 0 HA ASN A 30 10.533 2.630 -0.474 1.00 0.00 H new ATOM 0 HB2 ASN A 30 12.155 2.387 -2.287 1.00 0.00 H new ATOM 0 HB3 ASN A 30 11.473 0.822 -1.891 1.00 0.00 H new ATOM 0 HD21 ASN A 30 9.935 0.288 -5.047 1.00 0.00 H new ATOM 0 HD22 ASN A 30 10.056 -0.232 -3.363 1.00 0.00 H new ATOM 505 N ARG A 31 10.809 4.705 -2.227 1.00 0.00 N ATOM 506 CA ARG A 31 10.608 5.991 -2.882 1.00 0.00 C ATOM 507 C ARG A 31 11.459 6.081 -4.141 1.00 0.00 C ATOM 508 O ARG A 31 12.685 5.931 -4.084 1.00 0.00 O ATOM 509 CB ARG A 31 10.939 7.165 -1.953 1.00 0.00 C ATOM 510 CG ARG A 31 10.027 7.277 -0.741 1.00 0.00 C ATOM 511 CD ARG A 31 10.049 8.683 -0.156 1.00 0.00 C ATOM 512 NE ARG A 31 11.380 9.087 0.311 1.00 0.00 N ATOM 513 CZ ARG A 31 11.984 10.226 -0.051 1.00 0.00 C ATOM 514 NH1 ARG A 31 11.404 11.043 -0.921 1.00 0.00 N ATOM 515 NH2 ARG A 31 13.166 10.544 0.461 1.00 0.00 N ATOM 0 H ARG A 31 11.761 4.540 -1.901 1.00 0.00 H new ATOM 0 HA ARG A 31 9.553 6.058 -3.146 1.00 0.00 H new ATOM 0 HB2 ARG A 31 11.969 7.064 -1.611 1.00 0.00 H new ATOM 0 HB3 ARG A 31 10.882 8.092 -2.523 1.00 0.00 H new ATOM 0 HG2 ARG A 31 9.008 7.016 -1.026 1.00 0.00 H new ATOM 0 HG3 ARG A 31 10.339 6.560 0.019 1.00 0.00 H new ATOM 0 HD2 ARG A 31 9.704 9.390 -0.910 1.00 0.00 H new ATOM 0 HD3 ARG A 31 9.346 8.736 0.676 1.00 0.00 H new ATOM 0 HE ARG A 31 11.874 8.463 0.949 1.00 0.00 H new ATOM 0 HH11 ARG A 31 10.495 10.804 -1.317 1.00 0.00 H new ATOM 0 HH12 ARG A 31 11.867 11.910 -1.194 1.00 0.00 H new ATOM 0 HH21 ARG A 31 13.616 9.921 1.131 1.00 0.00 H new ATOM 0 HH22 ARG A 31 13.625 11.412 0.184 1.00 0.00 H new ATOM 529 N VAL A 32 10.808 6.328 -5.268 1.00 0.00 N ATOM 530 CA VAL A 32 11.491 6.388 -6.554 1.00 0.00 C ATOM 531 C VAL A 32 11.676 7.836 -7.004 1.00 0.00 C ATOM 532 O VAL A 32 10.739 8.638 -6.952 1.00 0.00 O ATOM 533 CB VAL A 32 10.708 5.619 -7.644 1.00 0.00 C ATOM 534 CG1 VAL A 32 11.493 5.578 -8.947 1.00 0.00 C ATOM 535 CG2 VAL A 32 10.371 4.210 -7.182 1.00 0.00 C ATOM 0 H VAL A 32 9.802 6.491 -5.319 1.00 0.00 H new ATOM 0 HA VAL A 32 12.466 5.920 -6.421 1.00 0.00 H new ATOM 0 HB VAL A 32 9.774 6.152 -7.822 1.00 0.00 H new ATOM 0 HG11 VAL A 32 10.922 5.032 -9.698 1.00 0.00 H new ATOM 0 HG12 VAL A 32 11.673 6.595 -9.296 1.00 0.00 H new ATOM 0 HG13 VAL A 32 12.447 5.077 -8.781 1.00 0.00 H new ATOM 0 HG21 VAL A 32 9.821 3.692 -7.967 1.00 0.00 H new ATOM 0 HG22 VAL A 32 11.292 3.668 -6.966 1.00 0.00 H new ATOM 0 HG23 VAL A 32 9.759 4.259 -6.282 1.00 0.00 H new ATOM 545 N SER A 33 12.890 8.162 -7.430 1.00 0.00 N ATOM 546 CA SER A 33 13.187 9.477 -7.973 1.00 0.00 C ATOM 547 C SER A 33 13.208 9.407 -9.495 1.00 0.00 C ATOM 548 O SER A 33 13.903 8.570 -10.078 1.00 0.00 O ATOM 549 CB SER A 33 14.533 9.981 -7.447 1.00 0.00 C ATOM 550 OG SER A 33 14.792 11.306 -7.882 1.00 0.00 O ATOM 0 H SER A 33 13.688 7.527 -7.408 1.00 0.00 H new ATOM 0 HA SER A 33 12.413 10.176 -7.656 1.00 0.00 H new ATOM 0 HB2 SER A 33 14.536 9.946 -6.358 1.00 0.00 H new ATOM 0 HB3 SER A 33 15.330 9.321 -7.789 1.00 0.00 H new ATOM 0 HG SER A 33 14.455 11.941 -7.216 1.00 0.00 H new ATOM 556 N PHE A 34 12.443 10.277 -10.138 1.00 0.00 N ATOM 557 CA PHE A 34 12.331 10.267 -11.589 1.00 0.00 C ATOM 558 C PHE A 34 13.139 11.398 -12.210 1.00 0.00 C ATOM 559 O PHE A 34 12.739 12.560 -12.148 1.00 0.00 O ATOM 560 CB PHE A 34 10.864 10.384 -12.007 1.00 0.00 C ATOM 561 CG PHE A 34 10.005 9.250 -11.521 1.00 0.00 C ATOM 562 CD1 PHE A 34 9.961 8.051 -12.216 1.00 0.00 C ATOM 563 CD2 PHE A 34 9.238 9.384 -10.373 1.00 0.00 C ATOM 564 CE1 PHE A 34 9.170 7.008 -11.773 1.00 0.00 C ATOM 565 CE2 PHE A 34 8.445 8.345 -9.928 1.00 0.00 C ATOM 566 CZ PHE A 34 8.410 7.155 -10.629 1.00 0.00 C ATOM 0 H PHE A 34 11.890 11.000 -9.677 1.00 0.00 H new ATOM 0 HA PHE A 34 12.733 9.321 -11.951 1.00 0.00 H new ATOM 0 HB2 PHE A 34 10.461 11.322 -11.627 1.00 0.00 H new ATOM 0 HB3 PHE A 34 10.808 10.430 -13.095 1.00 0.00 H new ATOM 0 HD1 PHE A 34 10.551 7.931 -13.113 1.00 0.00 H new ATOM 0 HD2 PHE A 34 9.261 10.312 -9.821 1.00 0.00 H new ATOM 0 HE1 PHE A 34 9.146 6.078 -12.321 1.00 0.00 H new ATOM 0 HE2 PHE A 34 7.853 8.462 -9.033 1.00 0.00 H new ATOM 0 HZ PHE A 34 7.790 6.341 -10.283 1.00 0.00 H new ATOM 576 N ASN A 35 14.295 11.046 -12.782 1.00 0.00 N ATOM 577 CA ASN A 35 15.139 11.998 -13.515 1.00 0.00 C ATOM 578 C ASN A 35 15.703 13.086 -12.605 1.00 0.00 C ATOM 579 O ASN A 35 16.081 14.159 -13.072 1.00 0.00 O ATOM 580 CB ASN A 35 14.369 12.644 -14.680 1.00 0.00 C ATOM 581 CG ASN A 35 14.297 11.767 -15.919 1.00 0.00 C ATOM 582 OD1 ASN A 35 14.251 10.454 -15.735 1.00 0.00 O flip ATOM 583 ND2 ASN A 35 14.284 12.270 -17.043 1.00 0.00 N flip ATOM 0 H ASN A 35 14.671 10.098 -12.751 1.00 0.00 H new ATOM 0 HA ASN A 35 15.975 11.424 -13.916 1.00 0.00 H new ATOM 0 HB2 ASN A 35 13.357 12.878 -14.351 1.00 0.00 H new ATOM 0 HB3 ASN A 35 14.846 13.589 -14.941 1.00 0.00 H new ATOM 0 HD21 ASN A 35 14.321 13.284 -17.148 1.00 0.00 H new ATOM 0 HD22 ASN A 35 14.237 11.673 -17.868 1.00 0.00 H new ATOM 590 N GLY A 36 15.786 12.797 -11.313 1.00 0.00 N ATOM 591 CA GLY A 36 16.306 13.768 -10.372 1.00 0.00 C ATOM 592 C GLY A 36 15.223 14.685 -9.844 1.00 0.00 C ATOM 593 O GLY A 36 15.119 15.840 -10.254 1.00 0.00 O ATOM 0 H GLY A 36 15.503 11.908 -10.901 1.00 0.00 H new ATOM 0 HA2 GLY A 36 16.778 13.248 -9.539 1.00 0.00 H new ATOM 0 HA3 GLY A 36 17.080 14.363 -10.856 1.00 0.00 H new ATOM 597 N ALA A 37 14.408 14.159 -8.944 1.00 0.00 N ATOM 598 CA ALA A 37 13.291 14.904 -8.385 1.00 0.00 C ATOM 599 C ALA A 37 12.900 14.318 -7.033 1.00 0.00 C ATOM 600 O ALA A 37 13.363 13.229 -6.681 1.00 0.00 O ATOM 601 CB ALA A 37 12.109 14.869 -9.347 1.00 0.00 C ATOM 0 H ALA A 37 14.501 13.210 -8.582 1.00 0.00 H new ATOM 0 HA ALA A 37 13.589 15.942 -8.240 1.00 0.00 H new ATOM 0 HB1 ALA A 37 11.277 15.429 -8.921 1.00 0.00 H new ATOM 0 HB2 ALA A 37 12.400 15.317 -10.297 1.00 0.00 H new ATOM 0 HB3 ALA A 37 11.804 13.835 -9.512 1.00 0.00 H new ATOM 607 N PRO A 38 12.079 15.038 -6.242 1.00 0.00 N ATOM 608 CA PRO A 38 11.529 14.511 -4.989 1.00 0.00 C ATOM 609 C PRO A 38 10.945 13.111 -5.171 1.00 0.00 C ATOM 610 O PRO A 38 10.066 12.898 -6.010 1.00 0.00 O ATOM 611 CB PRO A 38 10.430 15.513 -4.641 1.00 0.00 C ATOM 612 CG PRO A 38 10.887 16.797 -5.244 1.00 0.00 C ATOM 613 CD PRO A 38 11.647 16.430 -6.489 1.00 0.00 C ATOM 0 HA PRO A 38 12.286 14.408 -4.212 1.00 0.00 H new ATOM 0 HB2 PRO A 38 9.468 15.204 -5.049 1.00 0.00 H new ATOM 0 HB3 PRO A 38 10.304 15.604 -3.562 1.00 0.00 H new ATOM 0 HG2 PRO A 38 10.039 17.439 -5.481 1.00 0.00 H new ATOM 0 HG3 PRO A 38 11.521 17.349 -4.550 1.00 0.00 H new ATOM 0 HD2 PRO A 38 11.019 16.502 -7.377 1.00 0.00 H new ATOM 0 HD3 PRO A 38 12.499 17.091 -6.647 1.00 0.00 H new ATOM 621 N ALA A 39 11.442 12.165 -4.388 1.00 0.00 N ATOM 622 CA ALA A 39 11.081 10.769 -4.563 1.00 0.00 C ATOM 623 C ALA A 39 9.713 10.469 -3.963 1.00 0.00 C ATOM 624 O ALA A 39 9.462 10.737 -2.785 1.00 0.00 O ATOM 625 CB ALA A 39 12.144 9.874 -3.950 1.00 0.00 C ATOM 0 H ALA A 39 12.096 12.340 -3.626 1.00 0.00 H new ATOM 0 HA ALA A 39 11.022 10.565 -5.632 1.00 0.00 H new ATOM 0 HB1 ALA A 39 11.863 8.830 -4.087 1.00 0.00 H new ATOM 0 HB2 ALA A 39 13.101 10.059 -4.437 1.00 0.00 H new ATOM 0 HB3 ALA A 39 12.231 10.090 -2.885 1.00 0.00 H new ATOM 631 N LYS A 40 8.835 9.913 -4.778 1.00 0.00 N ATOM 632 CA LYS A 40 7.492 9.569 -4.338 1.00 0.00 C ATOM 633 C LYS A 40 7.436 8.081 -4.008 1.00 0.00 C ATOM 634 O LYS A 40 8.190 7.295 -4.583 1.00 0.00 O ATOM 635 CB LYS A 40 6.482 9.946 -5.427 1.00 0.00 C ATOM 636 CG LYS A 40 5.027 9.806 -5.009 1.00 0.00 C ATOM 637 CD LYS A 40 4.104 10.570 -5.949 1.00 0.00 C ATOM 638 CE LYS A 40 4.325 12.071 -5.840 1.00 0.00 C ATOM 639 NZ LYS A 40 3.489 12.834 -6.805 1.00 0.00 N ATOM 0 H LYS A 40 9.028 9.688 -5.754 1.00 0.00 H new ATOM 0 HA LYS A 40 7.235 10.126 -3.437 1.00 0.00 H new ATOM 0 HB2 LYS A 40 6.662 10.977 -5.732 1.00 0.00 H new ATOM 0 HB3 LYS A 40 6.658 9.320 -6.302 1.00 0.00 H new ATOM 0 HG2 LYS A 40 4.749 8.752 -5.000 1.00 0.00 H new ATOM 0 HG3 LYS A 40 4.902 10.177 -3.992 1.00 0.00 H new ATOM 0 HD2 LYS A 40 4.279 10.248 -6.976 1.00 0.00 H new ATOM 0 HD3 LYS A 40 3.066 10.335 -5.714 1.00 0.00 H new ATOM 0 HE2 LYS A 40 4.095 12.398 -4.826 1.00 0.00 H new ATOM 0 HE3 LYS A 40 5.377 12.295 -6.017 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 3.673 13.852 -6.695 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 3.725 12.543 -7.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 2.484 12.642 -6.621 1.00 0.00 H new ATOM 653 N PHE A 41 6.577 7.698 -3.069 1.00 0.00 N ATOM 654 CA PHE A 41 6.553 6.321 -2.594 1.00 0.00 C ATOM 655 C PHE A 41 5.721 5.436 -3.518 1.00 0.00 C ATOM 656 O PHE A 41 4.714 5.872 -4.084 1.00 0.00 O ATOM 657 CB PHE A 41 6.050 6.248 -1.141 1.00 0.00 C ATOM 658 CG PHE A 41 4.566 6.100 -0.979 1.00 0.00 C ATOM 659 CD1 PHE A 41 3.704 7.115 -1.349 1.00 0.00 C ATOM 660 CD2 PHE A 41 4.038 4.934 -0.452 1.00 0.00 C ATOM 661 CE1 PHE A 41 2.342 6.972 -1.199 1.00 0.00 C ATOM 662 CE2 PHE A 41 2.675 4.783 -0.301 1.00 0.00 C ATOM 663 CZ PHE A 41 1.827 5.803 -0.674 1.00 0.00 C ATOM 0 H PHE A 41 5.896 8.315 -2.626 1.00 0.00 H new ATOM 0 HA PHE A 41 7.575 5.941 -2.609 1.00 0.00 H new ATOM 0 HB2 PHE A 41 6.538 5.407 -0.648 1.00 0.00 H new ATOM 0 HB3 PHE A 41 6.367 7.151 -0.619 1.00 0.00 H new ATOM 0 HD1 PHE A 41 4.103 8.031 -1.760 1.00 0.00 H new ATOM 0 HD2 PHE A 41 4.700 4.134 -0.156 1.00 0.00 H new ATOM 0 HE1 PHE A 41 1.678 7.772 -1.491 1.00 0.00 H new ATOM 0 HE2 PHE A 41 2.274 3.868 0.108 1.00 0.00 H new ATOM 0 HZ PHE A 41 0.760 5.688 -0.556 1.00 0.00 H new ATOM 673 N ASP A 42 6.163 4.202 -3.672 1.00 0.00 N ATOM 674 CA ASP A 42 5.538 3.262 -4.587 1.00 0.00 C ATOM 675 C ASP A 42 5.455 1.875 -3.950 1.00 0.00 C ATOM 676 O ASP A 42 6.415 1.410 -3.329 1.00 0.00 O ATOM 677 CB ASP A 42 6.344 3.222 -5.887 1.00 0.00 C ATOM 678 CG ASP A 42 5.882 2.151 -6.847 1.00 0.00 C ATOM 679 OD1 ASP A 42 6.368 1.015 -6.735 1.00 0.00 O ATOM 680 OD2 ASP A 42 5.051 2.447 -7.739 1.00 0.00 O ATOM 0 H ASP A 42 6.964 3.822 -3.168 1.00 0.00 H new ATOM 0 HA ASP A 42 4.521 3.585 -4.809 1.00 0.00 H new ATOM 0 HB2 ASP A 42 6.276 4.193 -6.378 1.00 0.00 H new ATOM 0 HB3 ASP A 42 7.395 3.058 -5.649 1.00 0.00 H new ATOM 685 N ILE A 43 4.301 1.234 -4.086 1.00 0.00 N ATOM 686 CA ILE A 43 4.067 -0.075 -3.483 1.00 0.00 C ATOM 687 C ILE A 43 3.918 -1.136 -4.568 1.00 0.00 C ATOM 688 O ILE A 43 2.929 -1.132 -5.305 1.00 0.00 O ATOM 689 CB ILE A 43 2.780 -0.071 -2.619 1.00 0.00 C ATOM 690 CG1 ILE A 43 2.788 1.100 -1.631 1.00 0.00 C ATOM 691 CG2 ILE A 43 2.630 -1.390 -1.871 1.00 0.00 C ATOM 692 CD1 ILE A 43 1.514 1.221 -0.819 1.00 0.00 C ATOM 0 H ILE A 43 3.507 1.601 -4.611 1.00 0.00 H new ATOM 0 HA ILE A 43 4.924 -0.302 -2.850 1.00 0.00 H new ATOM 0 HB ILE A 43 1.928 0.049 -3.288 1.00 0.00 H new ATOM 0 HG12 ILE A 43 3.632 0.984 -0.951 1.00 0.00 H new ATOM 0 HG13 ILE A 43 2.947 2.027 -2.182 1.00 0.00 H new ATOM 0 HG21 ILE A 43 1.721 -1.366 -1.271 1.00 0.00 H new ATOM 0 HG22 ILE A 43 2.571 -2.210 -2.587 1.00 0.00 H new ATOM 0 HG23 ILE A 43 3.491 -1.539 -1.219 1.00 0.00 H new ATOM 0 HD11 ILE A 43 1.593 2.072 -0.142 1.00 0.00 H new ATOM 0 HD12 ILE A 43 0.668 1.369 -1.490 1.00 0.00 H new ATOM 0 HD13 ILE A 43 1.363 0.310 -0.240 1.00 0.00 H new ATOM 704 N ARG A 44 4.887 -2.046 -4.673 1.00 0.00 N ATOM 705 CA ARG A 44 4.845 -3.078 -5.713 1.00 0.00 C ATOM 706 C ARG A 44 5.452 -4.387 -5.241 1.00 0.00 C ATOM 707 O ARG A 44 5.977 -4.495 -4.130 1.00 0.00 O ATOM 708 CB ARG A 44 5.610 -2.652 -6.970 1.00 0.00 C ATOM 709 CG ARG A 44 5.071 -1.422 -7.664 1.00 0.00 C ATOM 710 CD ARG A 44 5.815 -1.163 -8.959 1.00 0.00 C ATOM 711 NE ARG A 44 5.758 0.237 -9.347 1.00 0.00 N ATOM 712 CZ ARG A 44 6.010 0.680 -10.570 1.00 0.00 C ATOM 713 NH1 ARG A 44 6.245 -0.179 -11.554 1.00 0.00 N ATOM 714 NH2 ARG A 44 6.008 1.983 -10.815 1.00 0.00 N ATOM 0 H ARG A 44 5.701 -2.091 -4.060 1.00 0.00 H new ATOM 0 HA ARG A 44 3.788 -3.215 -5.941 1.00 0.00 H new ATOM 0 HB2 ARG A 44 6.650 -2.471 -6.699 1.00 0.00 H new ATOM 0 HB3 ARG A 44 5.605 -3.481 -7.678 1.00 0.00 H new ATOM 0 HG2 ARG A 44 4.009 -1.552 -7.870 1.00 0.00 H new ATOM 0 HG3 ARG A 44 5.165 -0.558 -7.007 1.00 0.00 H new ATOM 0 HD2 ARG A 44 6.856 -1.466 -8.846 1.00 0.00 H new ATOM 0 HD3 ARG A 44 5.388 -1.777 -9.752 1.00 0.00 H new ATOM 0 HE ARG A 44 5.508 0.921 -8.633 1.00 0.00 H new ATOM 0 HH11 ARG A 44 6.232 -1.182 -11.369 1.00 0.00 H new ATOM 0 HH12 ARG A 44 6.439 0.164 -12.495 1.00 0.00 H new ATOM 0 HH21 ARG A 44 5.813 2.643 -10.062 1.00 0.00 H new ATOM 0 HH22 ARG A 44 6.202 2.325 -11.756 1.00 0.00 H new ATOM 728 N ALA A 45 5.353 -5.378 -6.110 1.00 0.00 N ATOM 729 CA ALA A 45 6.120 -6.597 -5.986 1.00 0.00 C ATOM 730 C ALA A 45 7.195 -6.578 -7.062 1.00 0.00 C ATOM 731 O ALA A 45 6.892 -6.379 -8.240 1.00 0.00 O ATOM 732 CB ALA A 45 5.227 -7.822 -6.127 1.00 0.00 C ATOM 0 H ALA A 45 4.736 -5.356 -6.922 1.00 0.00 H new ATOM 0 HA ALA A 45 6.578 -6.654 -4.998 1.00 0.00 H new ATOM 0 HB1 ALA A 45 5.830 -8.725 -6.030 1.00 0.00 H new ATOM 0 HB2 ALA A 45 4.465 -7.809 -5.348 1.00 0.00 H new ATOM 0 HB3 ALA A 45 4.746 -7.811 -7.105 1.00 0.00 H new ATOM 738 N TRP A 46 8.436 -6.771 -6.665 1.00 0.00 N ATOM 739 CA TRP A 46 9.555 -6.576 -7.568 1.00 0.00 C ATOM 740 C TRP A 46 10.155 -7.904 -7.991 1.00 0.00 C ATOM 741 O TRP A 46 10.211 -8.861 -7.215 1.00 0.00 O ATOM 742 CB TRP A 46 10.610 -5.683 -6.913 1.00 0.00 C ATOM 743 CG TRP A 46 10.106 -4.300 -6.627 1.00 0.00 C ATOM 744 CD1 TRP A 46 9.547 -3.857 -5.464 1.00 0.00 C ATOM 745 CD2 TRP A 46 10.099 -3.186 -7.527 1.00 0.00 C ATOM 746 NE1 TRP A 46 9.196 -2.533 -5.583 1.00 0.00 N ATOM 747 CE2 TRP A 46 9.526 -2.097 -6.841 1.00 0.00 C ATOM 748 CE3 TRP A 46 10.524 -3.001 -8.847 1.00 0.00 C ATOM 749 CZ2 TRP A 46 9.369 -0.844 -7.431 1.00 0.00 C ATOM 750 CZ3 TRP A 46 10.367 -1.758 -9.431 1.00 0.00 C ATOM 751 CH2 TRP A 46 9.794 -0.694 -8.723 1.00 0.00 C ATOM 0 H TRP A 46 8.697 -7.063 -5.723 1.00 0.00 H new ATOM 0 HA TRP A 46 9.189 -6.080 -8.467 1.00 0.00 H new ATOM 0 HB2 TRP A 46 10.942 -6.143 -5.982 1.00 0.00 H new ATOM 0 HB3 TRP A 46 11.481 -5.619 -7.565 1.00 0.00 H new ATOM 0 HD1 TRP A 46 9.401 -4.459 -4.579 1.00 0.00 H new ATOM 0 HE1 TRP A 46 8.761 -1.967 -4.854 1.00 0.00 H new ATOM 0 HE3 TRP A 46 10.967 -3.816 -9.400 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 8.928 -0.021 -6.888 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 10.691 -1.605 -10.450 1.00 0.00 H new ATOM 0 HH2 TRP A 46 9.685 0.265 -9.207 1.00 0.00 H new ATOM 762 N SER A 47 10.594 -7.942 -9.237 1.00 0.00 N ATOM 763 CA SER A 47 11.089 -9.154 -9.859 1.00 0.00 C ATOM 764 C SER A 47 12.470 -9.547 -9.341 1.00 0.00 C ATOM 765 O SER A 47 13.360 -8.700 -9.212 1.00 0.00 O ATOM 766 CB SER A 47 11.137 -8.938 -11.372 1.00 0.00 C ATOM 767 OG SER A 47 11.740 -7.688 -11.678 1.00 0.00 O ATOM 0 H SER A 47 10.616 -7.126 -9.848 1.00 0.00 H new ATOM 0 HA SER A 47 10.414 -9.972 -9.608 1.00 0.00 H new ATOM 0 HB2 SER A 47 11.699 -9.744 -11.843 1.00 0.00 H new ATOM 0 HB3 SER A 47 10.128 -8.972 -11.782 1.00 0.00 H new ATOM 0 HG SER A 47 11.591 -7.476 -12.623 1.00 0.00 H new ATOM 773 N PRO A 48 12.656 -10.838 -9.018 1.00 0.00 N ATOM 774 CA PRO A 48 13.975 -11.391 -8.705 1.00 0.00 C ATOM 775 C PRO A 48 14.859 -11.359 -9.946 1.00 0.00 C ATOM 776 O PRO A 48 15.985 -10.864 -9.917 1.00 0.00 O ATOM 777 CB PRO A 48 13.679 -12.834 -8.282 1.00 0.00 C ATOM 778 CG PRO A 48 12.355 -13.150 -8.889 1.00 0.00 C ATOM 779 CD PRO A 48 11.593 -11.856 -8.925 1.00 0.00 C ATOM 0 HA PRO A 48 14.503 -10.833 -7.932 1.00 0.00 H new ATOM 0 HB2 PRO A 48 14.450 -13.516 -8.640 1.00 0.00 H new ATOM 0 HB3 PRO A 48 13.648 -12.929 -7.197 1.00 0.00 H new ATOM 0 HG2 PRO A 48 12.474 -13.560 -9.892 1.00 0.00 H new ATOM 0 HG3 PRO A 48 11.825 -13.898 -8.300 1.00 0.00 H new ATOM 0 HD2 PRO A 48 10.917 -11.811 -9.779 1.00 0.00 H new ATOM 0 HD3 PRO A 48 10.985 -11.722 -8.030 1.00 0.00 H new ATOM 787 N ASP A 49 14.324 -11.894 -11.035 1.00 0.00 N ATOM 788 CA ASP A 49 14.931 -11.756 -12.345 1.00 0.00 C ATOM 789 C ASP A 49 14.393 -10.477 -12.963 1.00 0.00 C ATOM 790 O ASP A 49 13.227 -10.410 -13.361 1.00 0.00 O ATOM 791 CB ASP A 49 14.588 -12.964 -13.217 1.00 0.00 C ATOM 792 CG ASP A 49 15.556 -13.146 -14.367 1.00 0.00 C ATOM 793 OD1 ASP A 49 15.432 -12.435 -15.379 1.00 0.00 O ATOM 794 OD2 ASP A 49 16.439 -14.026 -14.269 1.00 0.00 O ATOM 0 H ASP A 49 13.459 -12.434 -11.032 1.00 0.00 H new ATOM 0 HA ASP A 49 16.017 -11.709 -12.264 1.00 0.00 H new ATOM 0 HB2 ASP A 49 14.588 -13.863 -12.601 1.00 0.00 H new ATOM 0 HB3 ASP A 49 13.579 -12.848 -13.612 1.00 0.00 H new ATOM 799 N HIS A 50 15.231 -9.458 -13.031 1.00 0.00 N ATOM 800 CA HIS A 50 14.746 -8.100 -13.233 1.00 0.00 C ATOM 801 C HIS A 50 14.553 -7.750 -14.710 1.00 0.00 C ATOM 802 O HIS A 50 14.592 -6.581 -15.086 1.00 0.00 O ATOM 803 CB HIS A 50 15.686 -7.097 -12.560 1.00 0.00 C ATOM 804 CG HIS A 50 15.036 -5.772 -12.292 1.00 0.00 C ATOM 805 ND1 HIS A 50 13.957 -5.626 -11.444 1.00 0.00 N ATOM 806 CD2 HIS A 50 15.303 -4.536 -12.774 1.00 0.00 C ATOM 807 CE1 HIS A 50 13.588 -4.359 -11.421 1.00 0.00 C ATOM 808 NE2 HIS A 50 14.388 -3.676 -12.217 1.00 0.00 N ATOM 0 H HIS A 50 16.244 -9.541 -12.950 1.00 0.00 H new ATOM 0 HA HIS A 50 13.761 -8.042 -12.769 1.00 0.00 H new ATOM 0 HB2 HIS A 50 16.043 -7.517 -11.620 1.00 0.00 H new ATOM 0 HB3 HIS A 50 16.560 -6.945 -13.194 1.00 0.00 H new ATOM 0 HD1 HIS A 50 13.514 -6.379 -10.918 1.00 0.00 H new ATOM 0 HD2 HIS A 50 16.089 -4.275 -13.467 1.00 0.00 H new ATOM 0 HE1 HIS A 50 12.769 -3.950 -10.847 1.00 0.00 H new ATOM 817 N THR A 51 14.326 -8.748 -15.547 1.00 0.00 N ATOM 818 CA THR A 51 13.912 -8.486 -16.917 1.00 0.00 C ATOM 819 C THR A 51 12.433 -8.113 -16.928 1.00 0.00 C ATOM 820 O THR A 51 11.931 -7.490 -17.864 1.00 0.00 O ATOM 821 CB THR A 51 14.146 -9.704 -17.825 1.00 0.00 C ATOM 822 OG1 THR A 51 13.503 -10.858 -17.273 1.00 0.00 O ATOM 823 CG2 THR A 51 15.631 -9.977 -17.998 1.00 0.00 C ATOM 0 H THR A 51 14.419 -9.735 -15.308 1.00 0.00 H new ATOM 0 HA THR A 51 14.514 -7.664 -17.305 1.00 0.00 H new ATOM 0 HB THR A 51 13.719 -9.485 -18.804 1.00 0.00 H new ATOM 0 HG1 THR A 51 14.124 -11.323 -16.674 1.00 0.00 H new ATOM 0 HG21 THR A 51 15.769 -10.844 -18.645 1.00 0.00 H new ATOM 0 HG22 THR A 51 16.111 -9.108 -18.449 1.00 0.00 H new ATOM 0 HG23 THR A 51 16.080 -10.175 -17.025 1.00 0.00 H new ATOM 831 N LYS A 52 11.750 -8.499 -15.857 1.00 0.00 N ATOM 832 CA LYS A 52 10.344 -8.190 -15.674 1.00 0.00 C ATOM 833 C LYS A 52 10.218 -6.907 -14.858 1.00 0.00 C ATOM 834 O LYS A 52 11.080 -6.617 -14.028 1.00 0.00 O ATOM 835 CB LYS A 52 9.655 -9.352 -14.950 1.00 0.00 C ATOM 836 CG LYS A 52 10.182 -10.719 -15.369 1.00 0.00 C ATOM 837 CD LYS A 52 9.577 -11.836 -14.533 1.00 0.00 C ATOM 838 CE LYS A 52 8.232 -12.289 -15.078 1.00 0.00 C ATOM 839 NZ LYS A 52 8.386 -13.057 -16.343 1.00 0.00 N ATOM 0 H LYS A 52 12.159 -9.036 -15.092 1.00 0.00 H new ATOM 0 HA LYS A 52 9.864 -8.047 -16.642 1.00 0.00 H new ATOM 0 HB2 LYS A 52 9.789 -9.232 -13.875 1.00 0.00 H new ATOM 0 HB3 LYS A 52 8.583 -9.308 -15.144 1.00 0.00 H new ATOM 0 HG2 LYS A 52 9.956 -10.889 -16.422 1.00 0.00 H new ATOM 0 HG3 LYS A 52 11.267 -10.737 -15.269 1.00 0.00 H new ATOM 0 HD2 LYS A 52 10.263 -12.683 -14.509 1.00 0.00 H new ATOM 0 HD3 LYS A 52 9.456 -11.495 -13.505 1.00 0.00 H new ATOM 0 HE2 LYS A 52 7.727 -12.907 -14.335 1.00 0.00 H new ATOM 0 HE3 LYS A 52 7.598 -11.420 -15.254 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 7.513 -13.589 -16.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 8.571 -12.400 -17.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 9.182 -13.720 -16.252 1.00 0.00 H new ATOM 853 N MET A 53 9.161 -6.142 -15.087 1.00 0.00 N ATOM 854 CA MET A 53 8.997 -4.856 -14.413 1.00 0.00 C ATOM 855 C MET A 53 8.562 -5.028 -12.959 1.00 0.00 C ATOM 856 O MET A 53 9.356 -4.832 -12.037 1.00 0.00 O ATOM 857 CB MET A 53 7.985 -3.973 -15.152 1.00 0.00 C ATOM 858 CG MET A 53 8.469 -3.480 -16.506 1.00 0.00 C ATOM 859 SD MET A 53 7.268 -2.411 -17.327 1.00 0.00 S ATOM 860 CE MET A 53 8.164 -1.982 -18.819 1.00 0.00 C ATOM 0 H MET A 53 8.407 -6.384 -15.729 1.00 0.00 H new ATOM 0 HA MET A 53 9.972 -4.368 -14.423 1.00 0.00 H new ATOM 0 HB2 MET A 53 7.061 -4.534 -15.290 1.00 0.00 H new ATOM 0 HB3 MET A 53 7.745 -3.112 -14.528 1.00 0.00 H new ATOM 0 HG2 MET A 53 9.405 -2.936 -16.377 1.00 0.00 H new ATOM 0 HG3 MET A 53 8.683 -4.337 -17.145 1.00 0.00 H new ATOM 0 HE1 MET A 53 7.552 -1.322 -19.434 1.00 0.00 H new ATOM 0 HE2 MET A 53 9.091 -1.474 -18.553 1.00 0.00 H new ATOM 0 HE3 MET A 53 8.395 -2.889 -19.378 1.00 0.00 H new ATOM 870 N GLY A 54 7.307 -5.400 -12.761 1.00 0.00 N ATOM 871 CA GLY A 54 6.758 -5.485 -11.424 1.00 0.00 C ATOM 872 C GLY A 54 5.516 -4.628 -11.280 1.00 0.00 C ATOM 873 O GLY A 54 5.549 -3.424 -11.546 1.00 0.00 O ATOM 0 H GLY A 54 6.656 -5.646 -13.506 1.00 0.00 H new ATOM 0 HA2 GLY A 54 6.515 -6.522 -11.194 1.00 0.00 H new ATOM 0 HA3 GLY A 54 7.508 -5.166 -10.700 1.00 0.00 H new ATOM 877 N LYS A 55 4.419 -5.242 -10.863 1.00 0.00 N ATOM 878 CA LYS A 55 3.145 -4.541 -10.784 1.00 0.00 C ATOM 879 C LYS A 55 2.882 -4.016 -9.379 1.00 0.00 C ATOM 880 O LYS A 55 3.308 -4.612 -8.384 1.00 0.00 O ATOM 881 CB LYS A 55 1.994 -5.447 -11.232 1.00 0.00 C ATOM 882 CG LYS A 55 1.994 -6.821 -10.582 1.00 0.00 C ATOM 883 CD LYS A 55 0.775 -7.631 -10.995 1.00 0.00 C ATOM 884 CE LYS A 55 0.880 -9.070 -10.520 1.00 0.00 C ATOM 885 NZ LYS A 55 1.961 -9.808 -11.229 1.00 0.00 N ATOM 0 H LYS A 55 4.384 -6.220 -10.575 1.00 0.00 H new ATOM 0 HA LYS A 55 3.203 -3.687 -11.459 1.00 0.00 H new ATOM 0 HB2 LYS A 55 1.049 -4.952 -11.009 1.00 0.00 H new ATOM 0 HB3 LYS A 55 2.043 -5.569 -12.314 1.00 0.00 H new ATOM 0 HG2 LYS A 55 2.901 -7.357 -10.862 1.00 0.00 H new ATOM 0 HG3 LYS A 55 2.010 -6.712 -9.498 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -0.124 -7.174 -10.582 1.00 0.00 H new ATOM 0 HD3 LYS A 55 0.673 -7.611 -12.080 1.00 0.00 H new ATOM 0 HE2 LYS A 55 1.072 -9.086 -9.447 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -0.072 -9.576 -10.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 1.824 -10.831 -11.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 1.931 -9.578 -12.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 2.884 -9.531 -10.838 1.00 0.00 H new ATOM 899 N GLY A 56 2.182 -2.894 -9.316 1.00 0.00 N ATOM 900 CA GLY A 56 1.844 -2.281 -8.051 1.00 0.00 C ATOM 901 C GLY A 56 1.147 -0.953 -8.250 1.00 0.00 C ATOM 902 O GLY A 56 0.428 -0.767 -9.237 1.00 0.00 O ATOM 0 H GLY A 56 1.838 -2.391 -10.134 1.00 0.00 H new ATOM 0 HA2 GLY A 56 1.199 -2.950 -7.481 1.00 0.00 H new ATOM 0 HA3 GLY A 56 2.750 -2.134 -7.463 1.00 0.00 H new ATOM 906 N ILE A 57 1.368 -0.019 -7.339 1.00 0.00 N ATOM 907 CA ILE A 57 0.710 1.276 -7.412 1.00 0.00 C ATOM 908 C ILE A 57 1.605 2.392 -6.868 1.00 0.00 C ATOM 909 O ILE A 57 2.244 2.242 -5.826 1.00 0.00 O ATOM 910 CB ILE A 57 -0.643 1.254 -6.650 1.00 0.00 C ATOM 911 CG1 ILE A 57 -1.378 2.591 -6.793 1.00 0.00 C ATOM 912 CG2 ILE A 57 -0.436 0.904 -5.181 1.00 0.00 C ATOM 913 CD1 ILE A 57 -2.812 2.551 -6.304 1.00 0.00 C ATOM 0 H ILE A 57 1.996 -0.132 -6.543 1.00 0.00 H new ATOM 0 HA ILE A 57 0.515 1.482 -8.464 1.00 0.00 H new ATOM 0 HB ILE A 57 -1.265 0.479 -7.098 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -0.835 3.356 -6.238 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -1.369 2.891 -7.841 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -1.399 0.895 -4.670 1.00 0.00 H new ATOM 0 HG22 ILE A 57 0.025 -0.081 -5.103 1.00 0.00 H new ATOM 0 HG23 ILE A 57 0.214 1.647 -4.718 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -3.269 3.532 -6.436 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -3.371 1.810 -6.876 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -2.829 2.282 -5.248 1.00 0.00 H new ATOM 925 N THR A 58 1.675 3.493 -7.607 1.00 0.00 N ATOM 926 CA THR A 58 2.343 4.694 -7.134 1.00 0.00 C ATOM 927 C THR A 58 1.296 5.643 -6.561 1.00 0.00 C ATOM 928 O THR A 58 0.275 5.907 -7.202 1.00 0.00 O ATOM 929 CB THR A 58 3.113 5.391 -8.274 1.00 0.00 C ATOM 930 OG1 THR A 58 3.912 4.430 -8.978 1.00 0.00 O ATOM 931 CG2 THR A 58 4.010 6.494 -7.733 1.00 0.00 C ATOM 0 H THR A 58 1.274 3.576 -8.541 1.00 0.00 H new ATOM 0 HA THR A 58 3.065 4.417 -6.365 1.00 0.00 H new ATOM 0 HB THR A 58 2.386 5.837 -8.953 1.00 0.00 H new ATOM 0 HG1 THR A 58 4.202 3.729 -8.358 1.00 0.00 H new ATOM 0 HG21 THR A 58 4.541 6.969 -8.558 1.00 0.00 H new ATOM 0 HG22 THR A 58 3.402 7.237 -7.217 1.00 0.00 H new ATOM 0 HG23 THR A 58 4.731 6.067 -7.035 1.00 0.00 H new ATOM 939 N LEU A 59 1.528 6.142 -5.356 1.00 0.00 N ATOM 940 CA LEU A 59 0.501 6.894 -4.645 1.00 0.00 C ATOM 941 C LEU A 59 1.031 8.245 -4.177 1.00 0.00 C ATOM 942 O LEU A 59 2.232 8.505 -4.228 1.00 0.00 O ATOM 943 CB LEU A 59 -0.012 6.103 -3.437 1.00 0.00 C ATOM 944 CG LEU A 59 -0.086 4.584 -3.609 1.00 0.00 C ATOM 945 CD1 LEU A 59 1.276 3.944 -3.338 1.00 0.00 C ATOM 946 CD2 LEU A 59 -1.151 4.009 -2.690 1.00 0.00 C ATOM 0 H LEU A 59 2.409 6.042 -4.852 1.00 0.00 H new ATOM 0 HA LEU A 59 -0.321 7.061 -5.341 1.00 0.00 H new ATOM 0 HB2 LEU A 59 0.633 6.321 -2.585 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -1.007 6.469 -3.185 1.00 0.00 H new ATOM 0 HG LEU A 59 -0.361 4.359 -4.640 1.00 0.00 H new ATOM 0 HD11 LEU A 59 1.202 2.864 -3.465 1.00 0.00 H new ATOM 0 HD12 LEU A 59 2.011 4.343 -4.037 1.00 0.00 H new ATOM 0 HD13 LEU A 59 1.587 4.169 -2.318 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -1.197 2.928 -2.819 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -0.902 4.241 -1.655 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -2.119 4.445 -2.937 1.00 0.00 H new ATOM 958 N SER A 60 0.121 9.094 -3.725 1.00 0.00 N ATOM 959 CA SER A 60 0.468 10.411 -3.222 1.00 0.00 C ATOM 960 C SER A 60 0.966 10.333 -1.774 1.00 0.00 C ATOM 961 O SER A 60 0.493 9.513 -0.982 1.00 0.00 O ATOM 962 CB SER A 60 -0.754 11.314 -3.332 1.00 0.00 C ATOM 963 OG SER A 60 -1.863 10.592 -3.856 1.00 0.00 O ATOM 0 H SER A 60 -0.878 8.888 -3.697 1.00 0.00 H new ATOM 0 HA SER A 60 1.281 10.825 -3.819 1.00 0.00 H new ATOM 0 HB2 SER A 60 -1.006 11.716 -2.351 1.00 0.00 H new ATOM 0 HB3 SER A 60 -0.529 12.164 -3.977 1.00 0.00 H new ATOM 0 HG SER A 60 -2.695 11.055 -3.622 1.00 0.00 H new ATOM 969 N ASN A 61 1.909 11.203 -1.437 1.00 0.00 N ATOM 970 CA ASN A 61 2.601 11.154 -0.147 1.00 0.00 C ATOM 971 C ASN A 61 1.707 11.595 1.013 1.00 0.00 C ATOM 972 O ASN A 61 1.905 11.174 2.153 1.00 0.00 O ATOM 973 CB ASN A 61 3.858 12.031 -0.187 1.00 0.00 C ATOM 974 CG ASN A 61 3.557 13.496 -0.468 1.00 0.00 C ATOM 975 OD1 ASN A 61 2.615 13.826 -1.190 1.00 0.00 O ATOM 976 ND2 ASN A 61 4.354 14.383 0.103 1.00 0.00 N ATOM 0 H ASN A 61 2.218 11.962 -2.045 1.00 0.00 H new ATOM 0 HA ASN A 61 2.877 10.114 0.026 1.00 0.00 H new ATOM 0 HB2 ASN A 61 4.380 11.950 0.766 1.00 0.00 H new ATOM 0 HB3 ASN A 61 4.534 11.652 -0.954 1.00 0.00 H new ATOM 0 HD21 ASN A 61 4.199 15.380 -0.048 1.00 0.00 H new ATOM 0 HD22 ASN A 61 5.124 14.071 0.695 1.00 0.00 H new ATOM 983 N GLU A 62 0.737 12.450 0.731 1.00 0.00 N ATOM 984 CA GLU A 62 -0.169 12.932 1.766 1.00 0.00 C ATOM 985 C GLU A 62 -1.081 11.814 2.254 1.00 0.00 C ATOM 986 O GLU A 62 -1.187 11.569 3.459 1.00 0.00 O ATOM 987 CB GLU A 62 -0.996 14.102 1.251 1.00 0.00 C ATOM 988 CG GLU A 62 -0.171 15.339 0.955 1.00 0.00 C ATOM 989 CD GLU A 62 -1.023 16.478 0.453 1.00 0.00 C ATOM 990 OE1 GLU A 62 -1.741 17.091 1.271 1.00 0.00 O ATOM 991 OE2 GLU A 62 -0.982 16.758 -0.763 1.00 0.00 O ATOM 0 H GLU A 62 0.556 12.824 -0.200 1.00 0.00 H new ATOM 0 HA GLU A 62 0.433 13.275 2.608 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -1.518 13.797 0.344 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -1.758 14.351 1.989 1.00 0.00 H new ATOM 0 HG2 GLU A 62 0.354 15.650 1.858 1.00 0.00 H new ATOM 0 HG3 GLU A 62 0.589 15.099 0.211 1.00 0.00 H new ATOM 998 N GLU A 63 -1.730 11.134 1.319 1.00 0.00 N ATOM 999 CA GLU A 63 -2.581 9.997 1.645 1.00 0.00 C ATOM 1000 C GLU A 63 -1.755 8.872 2.257 1.00 0.00 C ATOM 1001 O GLU A 63 -2.268 8.040 3.009 1.00 0.00 O ATOM 1002 CB GLU A 63 -3.322 9.496 0.402 1.00 0.00 C ATOM 1003 CG GLU A 63 -4.261 10.528 -0.216 1.00 0.00 C ATOM 1004 CD GLU A 63 -3.588 11.403 -1.252 1.00 0.00 C ATOM 1005 OE1 GLU A 63 -2.695 12.196 -0.889 1.00 0.00 O ATOM 1006 OE2 GLU A 63 -3.954 11.306 -2.441 1.00 0.00 O ATOM 0 H GLU A 63 -1.683 11.351 0.323 1.00 0.00 H new ATOM 0 HA GLU A 63 -3.321 10.325 2.375 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -2.591 9.190 -0.346 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -3.897 8.609 0.667 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -5.103 10.013 -0.677 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -4.667 11.159 0.574 1.00 0.00 H new ATOM 1013 N PHE A 64 -0.473 8.856 1.925 1.00 0.00 N ATOM 1014 CA PHE A 64 0.467 7.925 2.528 1.00 0.00 C ATOM 1015 C PHE A 64 0.503 8.128 4.040 1.00 0.00 C ATOM 1016 O PHE A 64 0.317 7.186 4.809 1.00 0.00 O ATOM 1017 CB PHE A 64 1.853 8.146 1.925 1.00 0.00 C ATOM 1018 CG PHE A 64 2.888 7.134 2.330 1.00 0.00 C ATOM 1019 CD1 PHE A 64 2.521 5.874 2.778 1.00 0.00 C ATOM 1020 CD2 PHE A 64 4.236 7.440 2.235 1.00 0.00 C ATOM 1021 CE1 PHE A 64 3.477 4.943 3.126 1.00 0.00 C ATOM 1022 CE2 PHE A 64 5.196 6.511 2.584 1.00 0.00 C ATOM 1023 CZ PHE A 64 4.815 5.261 3.029 1.00 0.00 C ATOM 0 H PHE A 64 -0.058 9.483 1.236 1.00 0.00 H new ATOM 0 HA PHE A 64 0.150 6.902 2.326 1.00 0.00 H new ATOM 0 HB2 PHE A 64 1.766 8.140 0.839 1.00 0.00 H new ATOM 0 HB3 PHE A 64 2.204 9.138 2.211 1.00 0.00 H new ATOM 0 HD1 PHE A 64 1.474 5.619 2.855 1.00 0.00 H new ATOM 0 HD2 PHE A 64 4.539 8.415 1.884 1.00 0.00 H new ATOM 0 HE1 PHE A 64 3.178 3.965 3.474 1.00 0.00 H new ATOM 0 HE2 PHE A 64 6.244 6.762 2.509 1.00 0.00 H new ATOM 0 HZ PHE A 64 5.565 4.533 3.301 1.00 0.00 H new ATOM 1033 N GLN A 65 0.710 9.375 4.455 1.00 0.00 N ATOM 1034 CA GLN A 65 0.718 9.723 5.872 1.00 0.00 C ATOM 1035 C GLN A 65 -0.637 9.423 6.503 1.00 0.00 C ATOM 1036 O GLN A 65 -0.715 9.047 7.671 1.00 0.00 O ATOM 1037 CB GLN A 65 1.058 11.206 6.054 1.00 0.00 C ATOM 1038 CG GLN A 65 2.460 11.583 5.596 1.00 0.00 C ATOM 1039 CD GLN A 65 3.524 11.391 6.667 1.00 0.00 C ATOM 1040 OE1 GLN A 65 3.301 10.470 7.596 1.00 0.00 O flip ATOM 1041 NE2 GLN A 65 4.544 12.083 6.665 1.00 0.00 N flip ATOM 0 H GLN A 65 0.875 10.163 3.828 1.00 0.00 H new ATOM 0 HA GLN A 65 1.479 9.120 6.368 1.00 0.00 H new ATOM 0 HB2 GLN A 65 0.334 11.804 5.501 1.00 0.00 H new ATOM 0 HB3 GLN A 65 0.949 11.466 7.107 1.00 0.00 H new ATOM 0 HG2 GLN A 65 2.722 10.983 4.724 1.00 0.00 H new ATOM 0 HG3 GLN A 65 2.461 12.625 5.278 1.00 0.00 H new ATOM 0 HE21 GLN A 65 4.684 12.782 5.936 1.00 0.00 H new ATOM 0 HE22 GLN A 65 5.248 11.956 7.392 1.00 0.00 H new ATOM 1050 N THR A 66 -1.695 9.589 5.717 1.00 0.00 N ATOM 1051 CA THR A 66 -3.049 9.323 6.172 1.00 0.00 C ATOM 1052 C THR A 66 -3.214 7.868 6.629 1.00 0.00 C ATOM 1053 O THR A 66 -3.643 7.610 7.755 1.00 0.00 O ATOM 1054 CB THR A 66 -4.065 9.636 5.055 1.00 0.00 C ATOM 1055 OG1 THR A 66 -3.948 11.009 4.657 1.00 0.00 O ATOM 1056 CG2 THR A 66 -5.492 9.354 5.504 1.00 0.00 C ATOM 0 H THR A 66 -1.636 9.911 4.751 1.00 0.00 H new ATOM 0 HA THR A 66 -3.240 9.973 7.026 1.00 0.00 H new ATOM 0 HB THR A 66 -3.840 8.987 4.209 1.00 0.00 H new ATOM 0 HG1 THR A 66 -3.047 11.173 4.308 1.00 0.00 H new ATOM 0 HG21 THR A 66 -6.181 9.586 4.692 1.00 0.00 H new ATOM 0 HG22 THR A 66 -5.588 8.302 5.772 1.00 0.00 H new ATOM 0 HG23 THR A 66 -5.730 9.972 6.370 1.00 0.00 H new ATOM 1064 N MET A 67 -2.852 6.920 5.768 1.00 0.00 N ATOM 1065 CA MET A 67 -3.067 5.511 6.078 1.00 0.00 C ATOM 1066 C MET A 67 -2.099 5.033 7.160 1.00 0.00 C ATOM 1067 O MET A 67 -2.476 4.238 8.019 1.00 0.00 O ATOM 1068 CB MET A 67 -2.982 4.643 4.808 1.00 0.00 C ATOM 1069 CG MET A 67 -1.583 4.439 4.238 1.00 0.00 C ATOM 1070 SD MET A 67 -0.694 3.088 5.039 1.00 0.00 S ATOM 1071 CE MET A 67 0.740 2.940 3.982 1.00 0.00 C ATOM 0 H MET A 67 -2.415 7.098 4.864 1.00 0.00 H new ATOM 0 HA MET A 67 -4.076 5.403 6.475 1.00 0.00 H new ATOM 0 HB2 MET A 67 -3.410 3.665 5.029 1.00 0.00 H new ATOM 0 HB3 MET A 67 -3.605 5.097 4.038 1.00 0.00 H new ATOM 0 HG2 MET A 67 -1.657 4.237 3.169 1.00 0.00 H new ATOM 0 HG3 MET A 67 -1.012 5.361 4.349 1.00 0.00 H new ATOM 0 HE1 MET A 67 0.833 1.910 3.637 1.00 0.00 H new ATOM 0 HE2 MET A 67 0.629 3.602 3.123 1.00 0.00 H new ATOM 0 HE3 MET A 67 1.634 3.217 4.541 1.00 0.00 H new ATOM 1081 N VAL A 68 -0.873 5.549 7.137 1.00 0.00 N ATOM 1082 CA VAL A 68 0.130 5.207 8.145 1.00 0.00 C ATOM 1083 C VAL A 68 -0.365 5.562 9.543 1.00 0.00 C ATOM 1084 O VAL A 68 -0.206 4.789 10.488 1.00 0.00 O ATOM 1085 CB VAL A 68 1.470 5.917 7.851 1.00 0.00 C ATOM 1086 CG1 VAL A 68 2.443 5.814 9.020 1.00 0.00 C ATOM 1087 CG2 VAL A 68 2.089 5.326 6.599 1.00 0.00 C ATOM 0 H VAL A 68 -0.548 6.208 6.429 1.00 0.00 H new ATOM 0 HA VAL A 68 0.296 4.131 8.102 1.00 0.00 H new ATOM 0 HB VAL A 68 1.263 6.976 7.699 1.00 0.00 H new ATOM 0 HG11 VAL A 68 3.371 6.327 8.768 1.00 0.00 H new ATOM 0 HG12 VAL A 68 2.001 6.276 9.903 1.00 0.00 H new ATOM 0 HG13 VAL A 68 2.654 4.765 9.227 1.00 0.00 H new ATOM 0 HG21 VAL A 68 3.035 5.826 6.390 1.00 0.00 H new ATOM 0 HG22 VAL A 68 2.267 4.261 6.749 1.00 0.00 H new ATOM 0 HG23 VAL A 68 1.411 5.466 5.757 1.00 0.00 H new ATOM 1097 N ASP A 69 -0.996 6.722 9.662 1.00 0.00 N ATOM 1098 CA ASP A 69 -1.551 7.155 10.936 1.00 0.00 C ATOM 1099 C ASP A 69 -2.764 6.313 11.320 1.00 0.00 C ATOM 1100 O ASP A 69 -2.908 5.909 12.478 1.00 0.00 O ATOM 1101 CB ASP A 69 -1.934 8.634 10.878 1.00 0.00 C ATOM 1102 CG ASP A 69 -2.645 9.106 12.132 1.00 0.00 C ATOM 1103 OD1 ASP A 69 -2.178 8.794 13.249 1.00 0.00 O ATOM 1104 OD2 ASP A 69 -3.684 9.783 12.004 1.00 0.00 O ATOM 0 H ASP A 69 -1.136 7.378 8.894 1.00 0.00 H new ATOM 0 HA ASP A 69 -0.785 7.019 11.699 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -1.035 9.232 10.729 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -2.577 8.805 10.015 1.00 0.00 H new ATOM 1109 N ALA A 70 -3.621 6.034 10.343 1.00 0.00 N ATOM 1110 CA ALA A 70 -4.848 5.280 10.584 1.00 0.00 C ATOM 1111 C ALA A 70 -4.550 3.863 11.078 1.00 0.00 C ATOM 1112 O ALA A 70 -5.104 3.419 12.085 1.00 0.00 O ATOM 1113 CB ALA A 70 -5.695 5.231 9.321 1.00 0.00 C ATOM 0 H ALA A 70 -3.488 6.320 9.373 1.00 0.00 H new ATOM 0 HA ALA A 70 -5.405 5.795 11.367 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -6.606 4.666 9.516 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -5.955 6.245 9.018 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -5.131 4.747 8.523 1.00 0.00 H new ATOM 1119 N PHE A 71 -3.662 3.166 10.379 1.00 0.00 N ATOM 1120 CA PHE A 71 -3.334 1.787 10.728 1.00 0.00 C ATOM 1121 C PHE A 71 -2.525 1.718 12.014 1.00 0.00 C ATOM 1122 O PHE A 71 -2.645 0.758 12.774 1.00 0.00 O ATOM 1123 CB PHE A 71 -2.581 1.107 9.590 1.00 0.00 C ATOM 1124 CG PHE A 71 -3.419 0.916 8.361 1.00 0.00 C ATOM 1125 CD1 PHE A 71 -4.638 0.259 8.436 1.00 0.00 C ATOM 1126 CD2 PHE A 71 -2.994 1.392 7.135 1.00 0.00 C ATOM 1127 CE1 PHE A 71 -5.413 0.084 7.308 1.00 0.00 C ATOM 1128 CE2 PHE A 71 -3.764 1.219 6.005 1.00 0.00 C ATOM 1129 CZ PHE A 71 -4.975 0.564 6.091 1.00 0.00 C ATOM 0 H PHE A 71 -3.158 3.530 9.571 1.00 0.00 H new ATOM 0 HA PHE A 71 -4.272 1.256 10.892 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -1.704 1.703 9.336 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -2.219 0.137 9.930 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -4.984 -0.119 9.387 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -2.047 1.906 7.062 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -6.361 -0.428 7.378 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -3.420 1.596 5.053 1.00 0.00 H new ATOM 0 HZ PHE A 71 -5.580 0.427 5.207 1.00 0.00 H new ATOM 1139 N LYS A 72 -1.707 2.736 12.258 1.00 0.00 N ATOM 1140 CA LYS A 72 -0.950 2.825 13.501 1.00 0.00 C ATOM 1141 C LYS A 72 -1.902 2.888 14.690 1.00 0.00 C ATOM 1142 O LYS A 72 -1.607 2.365 15.767 1.00 0.00 O ATOM 1143 CB LYS A 72 -0.047 4.059 13.497 1.00 0.00 C ATOM 1144 CG LYS A 72 0.809 4.189 14.748 1.00 0.00 C ATOM 1145 CD LYS A 72 1.553 5.515 14.815 1.00 0.00 C ATOM 1146 CE LYS A 72 0.623 6.676 15.142 1.00 0.00 C ATOM 1147 NZ LYS A 72 -0.234 7.058 13.991 1.00 0.00 N ATOM 0 H LYS A 72 -1.551 3.510 11.612 1.00 0.00 H new ATOM 0 HA LYS A 72 -0.325 1.936 13.586 1.00 0.00 H new ATOM 0 HB2 LYS A 72 0.604 4.020 12.624 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -0.665 4.951 13.395 1.00 0.00 H new ATOM 0 HG2 LYS A 72 0.175 4.088 15.629 1.00 0.00 H new ATOM 0 HG3 LYS A 72 1.529 3.371 14.777 1.00 0.00 H new ATOM 0 HD2 LYS A 72 2.336 5.454 15.571 1.00 0.00 H new ATOM 0 HD3 LYS A 72 2.046 5.703 13.861 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -0.009 6.404 15.987 1.00 0.00 H new ATOM 0 HE3 LYS A 72 1.216 7.537 15.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -0.683 7.976 14.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 0.349 7.130 13.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -0.969 6.336 13.851 1.00 0.00 H new ATOM 1161 N GLY A 73 -3.042 3.537 14.481 1.00 0.00 N ATOM 1162 CA GLY A 73 -4.062 3.615 15.507 1.00 0.00 C ATOM 1163 C GLY A 73 -4.520 2.243 15.956 1.00 0.00 C ATOM 1164 O GLY A 73 -4.577 1.965 17.158 1.00 0.00 O ATOM 0 H GLY A 73 -3.278 4.014 13.611 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -3.673 4.166 16.364 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -4.916 4.176 15.128 1.00 0.00 H new ATOM 1168 N ASN A 74 -4.833 1.379 14.990 1.00 0.00 N ATOM 1169 CA ASN A 74 -5.242 0.010 15.288 1.00 0.00 C ATOM 1170 C ASN A 74 -5.409 -0.819 14.017 1.00 0.00 C ATOM 1171 O ASN A 74 -6.156 -0.448 13.111 1.00 0.00 O ATOM 1172 CB ASN A 74 -6.555 -0.013 16.083 1.00 0.00 C ATOM 1173 CG ASN A 74 -7.019 -1.427 16.400 1.00 0.00 C ATOM 1174 OD1 ASN A 74 -6.585 -2.028 17.384 1.00 0.00 O ATOM 1175 ND2 ASN A 74 -7.923 -1.952 15.589 1.00 0.00 N ATOM 0 H ASN A 74 -4.811 1.605 13.996 1.00 0.00 H new ATOM 0 HA ASN A 74 -4.448 -0.431 15.890 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -6.423 0.540 17.013 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -7.330 0.501 15.514 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -8.287 -2.888 15.768 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -8.256 -1.421 14.785 1.00 0.00 H new ATOM 1182 N LEU A 75 -4.690 -1.928 13.955 1.00 0.00 N ATOM 1183 CA LEU A 75 -4.931 -2.949 12.947 1.00 0.00 C ATOM 1184 C LEU A 75 -4.946 -4.312 13.619 1.00 0.00 C ATOM 1185 O LEU A 75 -5.957 -5.014 13.609 1.00 0.00 O ATOM 1186 CB LEU A 75 -3.866 -2.947 11.847 1.00 0.00 C ATOM 1187 CG LEU A 75 -4.026 -4.078 10.824 1.00 0.00 C ATOM 1188 CD1 LEU A 75 -5.201 -3.804 9.907 1.00 0.00 C ATOM 1189 CD2 LEU A 75 -2.759 -4.283 10.017 1.00 0.00 C ATOM 0 H LEU A 75 -3.928 -2.146 14.597 1.00 0.00 H new ATOM 0 HA LEU A 75 -5.890 -2.731 12.478 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -3.899 -1.991 11.325 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -2.881 -3.024 12.308 1.00 0.00 H new ATOM 0 HG LEU A 75 -4.219 -4.998 11.376 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -5.299 -4.617 9.188 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -6.114 -3.730 10.498 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -5.036 -2.867 9.375 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -2.910 -5.092 9.302 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -2.517 -3.366 9.481 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -1.938 -4.539 10.687 1.00 0.00 H new ATOM 1201 N GLU A 76 -3.813 -4.668 14.207 1.00 0.00 N ATOM 1202 CA GLU A 76 -3.676 -5.934 14.904 1.00 0.00 C ATOM 1203 C GLU A 76 -4.119 -5.789 16.366 1.00 0.00 C ATOM 1204 O GLU A 76 -5.312 -5.856 16.667 1.00 0.00 O ATOM 1205 CB GLU A 76 -2.223 -6.433 14.799 1.00 0.00 C ATOM 1206 CG GLU A 76 -2.002 -7.828 15.370 1.00 0.00 C ATOM 1207 CD GLU A 76 -2.908 -8.871 14.744 1.00 0.00 C ATOM 1208 OE1 GLU A 76 -4.023 -9.076 15.260 1.00 0.00 O ATOM 1209 OE2 GLU A 76 -2.506 -9.498 13.742 1.00 0.00 O ATOM 0 H GLU A 76 -2.971 -4.092 14.214 1.00 0.00 H new ATOM 0 HA GLU A 76 -4.323 -6.676 14.437 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -1.924 -6.429 13.751 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -1.571 -5.732 15.319 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -0.962 -8.118 15.217 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -2.171 -7.806 16.447 1.00 0.00 H new ATOM 1216 N HIS A 77 -3.166 -5.565 17.268 1.00 0.00 N ATOM 1217 CA HIS A 77 -3.461 -5.385 18.689 1.00 0.00 C ATOM 1218 C HIS A 77 -2.402 -4.490 19.324 1.00 0.00 C ATOM 1219 O HIS A 77 -1.373 -4.215 18.707 1.00 0.00 O ATOM 1220 CB HIS A 77 -3.506 -6.732 19.433 1.00 0.00 C ATOM 1221 CG HIS A 77 -4.664 -7.614 19.062 1.00 0.00 C ATOM 1222 ND1 HIS A 77 -5.927 -7.461 19.592 1.00 0.00 N ATOM 1223 CD2 HIS A 77 -4.745 -8.661 18.207 1.00 0.00 C ATOM 1224 CE1 HIS A 77 -6.731 -8.372 19.078 1.00 0.00 C ATOM 1225 NE2 HIS A 77 -6.041 -9.111 18.234 1.00 0.00 N ATOM 0 H HIS A 77 -2.174 -5.503 17.038 1.00 0.00 H new ATOM 0 HA HIS A 77 -4.443 -4.919 18.771 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -2.579 -7.271 19.238 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -3.543 -6.539 20.505 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -3.939 -9.067 17.614 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -7.779 -8.492 19.310 1.00 0.00 H new ATOM 0 HE2 HIS A 77 -6.410 -9.891 17.689 1.00 0.00 H new ATOM 1234 N HIS A 78 -2.656 -4.031 20.543 1.00 0.00 N ATOM 1235 CA HIS A 78 -1.693 -3.205 21.266 1.00 0.00 C ATOM 1236 C HIS A 78 -1.163 -3.968 22.472 1.00 0.00 C ATOM 1237 O HIS A 78 -1.938 -4.557 23.228 1.00 0.00 O ATOM 1238 CB HIS A 78 -2.341 -1.897 21.746 1.00 0.00 C ATOM 1239 CG HIS A 78 -3.060 -1.132 20.678 1.00 0.00 C ATOM 1240 ND1 HIS A 78 -4.391 -1.329 20.392 1.00 0.00 N ATOM 1241 CD2 HIS A 78 -2.634 -0.160 19.836 1.00 0.00 C ATOM 1242 CE1 HIS A 78 -4.758 -0.514 19.425 1.00 0.00 C ATOM 1243 NE2 HIS A 78 -3.714 0.207 19.068 1.00 0.00 N ATOM 0 H HIS A 78 -3.520 -4.216 21.053 1.00 0.00 H new ATOM 0 HA HIS A 78 -0.876 -2.965 20.586 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -3.044 -2.127 22.546 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -1.568 -1.259 22.174 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -1.636 0.249 19.779 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -5.747 -0.448 18.997 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -3.708 0.921 18.340 1.00 0.00 H new ATOM 1252 N HIS A 79 0.146 -3.965 22.662 1.00 0.00 N ATOM 1253 CA HIS A 79 0.740 -4.637 23.808 1.00 0.00 C ATOM 1254 C HIS A 79 1.407 -3.617 24.724 1.00 0.00 C ATOM 1255 O HIS A 79 2.618 -3.406 24.662 1.00 0.00 O ATOM 1256 CB HIS A 79 1.756 -5.692 23.355 1.00 0.00 C ATOM 1257 CG HIS A 79 2.096 -6.701 24.413 1.00 0.00 C ATOM 1258 ND1 HIS A 79 1.809 -8.043 24.289 1.00 0.00 N ATOM 1259 CD2 HIS A 79 2.706 -6.563 25.616 1.00 0.00 C ATOM 1260 CE1 HIS A 79 2.220 -8.686 25.366 1.00 0.00 C ATOM 1261 NE2 HIS A 79 2.769 -7.811 26.185 1.00 0.00 N ATOM 0 H HIS A 79 0.815 -3.508 22.042 1.00 0.00 H new ATOM 0 HA HIS A 79 -0.052 -5.144 24.360 1.00 0.00 H new ATOM 0 HB2 HIS A 79 1.360 -6.213 22.483 1.00 0.00 H new ATOM 0 HB3 HIS A 79 2.670 -5.190 23.038 1.00 0.00 H new ATOM 0 HD2 HIS A 79 3.074 -5.643 26.046 1.00 0.00 H new ATOM 0 HE1 HIS A 79 2.123 -9.747 25.545 1.00 0.00 H new ATOM 0 HE2 HIS A 79 3.175 -8.027 27.095 1.00 0.00 H new ATOM 1270 N HIS A 80 0.606 -2.968 25.552 1.00 0.00 N ATOM 1271 CA HIS A 80 1.121 -1.996 26.506 1.00 0.00 C ATOM 1272 C HIS A 80 1.068 -2.589 27.910 1.00 0.00 C ATOM 1273 O HIS A 80 1.795 -2.165 28.809 1.00 0.00 O ATOM 1274 CB HIS A 80 0.307 -0.700 26.440 1.00 0.00 C ATOM 1275 CG HIS A 80 0.954 0.462 27.140 1.00 0.00 C ATOM 1276 ND1 HIS A 80 0.823 0.696 28.493 1.00 0.00 N ATOM 1277 CD2 HIS A 80 1.744 1.458 26.667 1.00 0.00 C ATOM 1278 CE1 HIS A 80 1.501 1.780 28.819 1.00 0.00 C ATOM 1279 NE2 HIS A 80 2.068 2.259 27.733 1.00 0.00 N ATOM 0 H HIS A 80 -0.405 -3.096 25.584 1.00 0.00 H new ATOM 0 HA HIS A 80 2.155 -1.759 26.256 1.00 0.00 H new ATOM 0 HB2 HIS A 80 0.145 -0.437 25.395 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -0.674 -0.876 26.880 1.00 0.00 H new ATOM 0 HD2 HIS A 80 2.059 1.595 25.643 1.00 0.00 H new ATOM 0 HE1 HIS A 80 1.577 2.203 29.810 1.00 0.00 H new ATOM 0 HE2 HIS A 80 2.655 3.092 27.690 1.00 0.00 H new ATOM 1288 N HIS A 81 0.198 -3.574 28.089 1.00 0.00 N ATOM 1289 CA HIS A 81 0.106 -4.292 29.352 1.00 0.00 C ATOM 1290 C HIS A 81 0.180 -5.790 29.098 1.00 0.00 C ATOM 1291 O HIS A 81 0.176 -6.233 27.948 1.00 0.00 O ATOM 1292 CB HIS A 81 -1.192 -3.954 30.104 1.00 0.00 C ATOM 1293 CG HIS A 81 -2.441 -4.516 29.484 1.00 0.00 C ATOM 1294 ND1 HIS A 81 -2.906 -5.790 29.748 1.00 0.00 N ATOM 1295 CD2 HIS A 81 -3.322 -3.973 28.615 1.00 0.00 C ATOM 1296 CE1 HIS A 81 -4.013 -6.000 29.065 1.00 0.00 C ATOM 1297 NE2 HIS A 81 -4.289 -4.915 28.372 1.00 0.00 N ATOM 0 H HIS A 81 -0.455 -3.894 27.374 1.00 0.00 H new ATOM 0 HA HIS A 81 0.944 -3.981 29.976 1.00 0.00 H new ATOM 0 HB2 HIS A 81 -1.111 -4.325 31.126 1.00 0.00 H new ATOM 0 HB3 HIS A 81 -1.289 -2.870 30.165 1.00 0.00 H new ATOM 0 HD1 HIS A 81 -2.462 -6.462 30.373 1.00 0.00 H new ATOM 0 HD2 HIS A 81 -3.274 -2.981 28.190 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -4.596 -6.909 29.072 1.00 0.00 H new ATOM 1306 N HIS A 82 0.240 -6.561 30.170 1.00 0.00 N ATOM 1307 CA HIS A 82 0.227 -8.008 30.065 1.00 0.00 C ATOM 1308 C HIS A 82 -1.203 -8.508 30.221 1.00 0.00 C ATOM 1309 O HIS A 82 -1.634 -9.352 29.416 1.00 0.00 O ATOM 1310 CB HIS A 82 1.133 -8.635 31.127 1.00 0.00 C ATOM 1311 CG HIS A 82 1.376 -10.094 30.913 1.00 0.00 C ATOM 1312 ND1 HIS A 82 2.502 -10.583 30.291 1.00 0.00 N ATOM 1313 CD2 HIS A 82 0.626 -11.176 31.230 1.00 0.00 C ATOM 1314 CE1 HIS A 82 2.435 -11.898 30.234 1.00 0.00 C ATOM 1315 NE2 HIS A 82 1.306 -12.286 30.797 1.00 0.00 N ATOM 1316 OXT HIS A 82 -1.905 -8.007 31.125 1.00 0.00 O ATOM 0 H HIS A 82 0.298 -6.207 31.125 1.00 0.00 H new ATOM 0 HA HIS A 82 0.608 -8.300 29.086 1.00 0.00 H new ATOM 0 HB2 HIS A 82 2.089 -8.112 31.133 1.00 0.00 H new ATOM 0 HB3 HIS A 82 0.684 -8.489 32.109 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -0.331 -11.167 31.731 1.00 0.00 H new ATOM 0 HE1 HIS A 82 3.179 -12.549 29.799 1.00 0.00 H new ATOM 0 HE2 HIS A 82 0.991 -13.251 30.894 1.00 0.00 H new TER 1325 HIS A 82 ATOM 1326 N MET B 1 -25.426 -13.884 -20.388 1.00 0.00 N ATOM 1327 CA MET B 1 -24.410 -13.103 -19.647 1.00 0.00 C ATOM 1328 C MET B 1 -23.815 -13.919 -18.507 1.00 0.00 C ATOM 1329 O MET B 1 -22.599 -13.942 -18.316 1.00 0.00 O ATOM 1330 CB MET B 1 -25.033 -11.824 -19.081 1.00 0.00 C ATOM 1331 CG MET B 1 -24.060 -10.964 -18.290 1.00 0.00 C ATOM 1332 SD MET B 1 -24.872 -9.576 -17.472 1.00 0.00 S ATOM 1333 CE MET B 1 -25.525 -8.686 -18.884 1.00 0.00 C ATOM 0 H1 MET B 1 -25.766 -13.330 -21.200 1.00 0.00 H new ATOM 0 H2 MET B 1 -25.002 -14.771 -20.728 1.00 0.00 H new ATOM 0 H3 MET B 1 -26.225 -14.101 -19.758 1.00 0.00 H new ATOM 0 HA MET B 1 -23.615 -12.845 -20.346 1.00 0.00 H new ATOM 0 HB2 MET B 1 -25.439 -11.234 -19.903 1.00 0.00 H new ATOM 0 HB3 MET B 1 -25.871 -12.093 -18.438 1.00 0.00 H new ATOM 0 HG2 MET B 1 -23.560 -11.580 -17.543 1.00 0.00 H new ATOM 0 HG3 MET B 1 -23.287 -10.586 -18.959 1.00 0.00 H new ATOM 0 HE1 MET B 1 -25.785 -7.670 -18.586 1.00 0.00 H new ATOM 0 HE2 MET B 1 -24.773 -8.652 -19.672 1.00 0.00 H new ATOM 0 HE3 MET B 1 -26.415 -9.194 -19.254 1.00 0.00 H new ATOM 1345 N LYS B 2 -24.670 -14.593 -17.752 1.00 0.00 N ATOM 1346 CA LYS B 2 -24.234 -15.304 -16.561 1.00 0.00 C ATOM 1347 C LYS B 2 -24.061 -16.793 -16.843 1.00 0.00 C ATOM 1348 O LYS B 2 -25.038 -17.525 -16.996 1.00 0.00 O ATOM 1349 CB LYS B 2 -25.240 -15.086 -15.428 1.00 0.00 C ATOM 1350 CG LYS B 2 -25.455 -13.616 -15.094 1.00 0.00 C ATOM 1351 CD LYS B 2 -26.473 -13.409 -13.979 1.00 0.00 C ATOM 1352 CE LYS B 2 -25.932 -13.803 -12.607 1.00 0.00 C ATOM 1353 NZ LYS B 2 -25.857 -15.278 -12.420 1.00 0.00 N ATOM 0 H LYS B 2 -25.669 -14.662 -17.944 1.00 0.00 H new ATOM 0 HA LYS B 2 -23.265 -14.908 -16.258 1.00 0.00 H new ATOM 0 HB2 LYS B 2 -26.195 -15.532 -15.707 1.00 0.00 H new ATOM 0 HB3 LYS B 2 -24.893 -15.608 -14.536 1.00 0.00 H new ATOM 0 HG2 LYS B 2 -24.504 -13.172 -14.799 1.00 0.00 H new ATOM 0 HG3 LYS B 2 -25.789 -13.090 -15.988 1.00 0.00 H new ATOM 0 HD2 LYS B 2 -26.776 -12.362 -13.959 1.00 0.00 H new ATOM 0 HD3 LYS B 2 -27.366 -13.995 -14.195 1.00 0.00 H new ATOM 0 HE2 LYS B 2 -24.939 -13.373 -12.476 1.00 0.00 H new ATOM 0 HE3 LYS B 2 -26.569 -13.375 -11.833 1.00 0.00 H new ATOM 0 HZ1 LYS B 2 -26.217 -15.527 -11.477 1.00 0.00 H new ATOM 0 HZ2 LYS B 2 -26.433 -15.750 -13.146 1.00 0.00 H new ATOM 0 HZ3 LYS B 2 -24.868 -15.589 -12.506 1.00 0.00 H new ATOM 1367 N LYS B 3 -22.813 -17.222 -16.945 1.00 0.00 N ATOM 1368 CA LYS B 3 -22.493 -18.629 -17.131 1.00 0.00 C ATOM 1369 C LYS B 3 -21.504 -19.107 -16.080 1.00 0.00 C ATOM 1370 O LYS B 3 -21.793 -20.012 -15.298 1.00 0.00 O ATOM 1371 CB LYS B 3 -21.896 -18.882 -18.517 1.00 0.00 C ATOM 1372 CG LYS B 3 -22.908 -19.220 -19.596 1.00 0.00 C ATOM 1373 CD LYS B 3 -22.203 -19.725 -20.843 1.00 0.00 C ATOM 1374 CE LYS B 3 -23.179 -20.199 -21.905 1.00 0.00 C ATOM 1375 NZ LYS B 3 -22.474 -20.839 -23.049 1.00 0.00 N ATOM 0 H LYS B 3 -21.998 -16.610 -16.902 1.00 0.00 H new ATOM 0 HA LYS B 3 -23.426 -19.183 -17.033 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -21.341 -17.996 -18.825 1.00 0.00 H new ATOM 0 HB3 LYS B 3 -21.178 -19.699 -18.444 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -23.600 -19.978 -19.230 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -23.500 -18.337 -19.837 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -21.581 -18.929 -21.253 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -21.536 -20.544 -20.574 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -23.880 -20.909 -21.465 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -23.765 -19.353 -22.265 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -23.171 -21.151 -23.755 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -21.823 -20.154 -23.483 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -21.935 -21.660 -22.709 1.00 0.00 H new ATOM 1389 N MET B 4 -20.333 -18.490 -16.068 1.00 0.00 N ATOM 1390 CA MET B 4 -19.246 -18.951 -15.225 1.00 0.00 C ATOM 1391 C MET B 4 -18.917 -17.942 -14.138 1.00 0.00 C ATOM 1392 O MET B 4 -18.406 -16.857 -14.419 1.00 0.00 O ATOM 1393 CB MET B 4 -17.990 -19.212 -16.063 1.00 0.00 C ATOM 1394 CG MET B 4 -18.178 -20.247 -17.161 1.00 0.00 C ATOM 1395 SD MET B 4 -16.691 -20.477 -18.157 1.00 0.00 S ATOM 1396 CE MET B 4 -17.284 -21.640 -19.383 1.00 0.00 C ATOM 0 H MET B 4 -20.113 -17.670 -16.633 1.00 0.00 H new ATOM 0 HA MET B 4 -19.574 -19.878 -14.754 1.00 0.00 H new ATOM 0 HB2 MET B 4 -17.667 -18.274 -16.515 1.00 0.00 H new ATOM 0 HB3 MET B 4 -17.188 -19.541 -15.402 1.00 0.00 H new ATOM 0 HG2 MET B 4 -18.462 -21.199 -16.713 1.00 0.00 H new ATOM 0 HG3 MET B 4 -19.000 -19.941 -17.807 1.00 0.00 H new ATOM 0 HE1 MET B 4 -16.477 -21.882 -20.075 1.00 0.00 H new ATOM 0 HE2 MET B 4 -17.622 -22.550 -18.888 1.00 0.00 H new ATOM 0 HE3 MET B 4 -18.114 -21.197 -19.934 1.00 0.00 H new ATOM 1406 N ALA B 5 -19.224 -18.288 -12.902 1.00 0.00 N ATOM 1407 CA ALA B 5 -18.761 -17.514 -11.768 1.00 0.00 C ATOM 1408 C ALA B 5 -17.361 -17.982 -11.401 1.00 0.00 C ATOM 1409 O ALA B 5 -17.195 -18.908 -10.608 1.00 0.00 O ATOM 1410 CB ALA B 5 -19.708 -17.649 -10.586 1.00 0.00 C ATOM 0 H ALA B 5 -19.792 -19.100 -12.659 1.00 0.00 H new ATOM 0 HA ALA B 5 -18.736 -16.458 -12.036 1.00 0.00 H new ATOM 0 HB1 ALA B 5 -19.334 -17.057 -9.751 1.00 0.00 H new ATOM 0 HB2 ALA B 5 -20.698 -17.291 -10.870 1.00 0.00 H new ATOM 0 HB3 ALA B 5 -19.772 -18.696 -10.289 1.00 0.00 H new ATOM 1416 N GLU B 6 -16.362 -17.373 -12.033 1.00 0.00 N ATOM 1417 CA GLU B 6 -14.977 -17.800 -11.884 1.00 0.00 C ATOM 1418 C GLU B 6 -14.512 -17.652 -10.439 1.00 0.00 C ATOM 1419 O GLU B 6 -14.386 -18.637 -9.708 1.00 0.00 O ATOM 1420 CB GLU B 6 -14.067 -16.996 -12.819 1.00 0.00 C ATOM 1421 CG GLU B 6 -12.690 -17.607 -12.985 1.00 0.00 C ATOM 1422 CD GLU B 6 -12.733 -18.936 -13.708 1.00 0.00 C ATOM 1423 OE1 GLU B 6 -13.207 -19.928 -13.115 1.00 0.00 O ATOM 1424 OE2 GLU B 6 -12.294 -18.992 -14.873 1.00 0.00 O ATOM 0 H GLU B 6 -16.489 -16.577 -12.657 1.00 0.00 H new ATOM 0 HA GLU B 6 -14.917 -18.854 -12.155 1.00 0.00 H new ATOM 0 HB2 GLU B 6 -14.542 -16.916 -13.797 1.00 0.00 H new ATOM 0 HB3 GLU B 6 -13.963 -15.983 -12.431 1.00 0.00 H new ATOM 0 HG2 GLU B 6 -12.053 -16.916 -13.537 1.00 0.00 H new ATOM 0 HG3 GLU B 6 -12.236 -17.745 -12.004 1.00 0.00 H new ATOM 1431 N PHE B 7 -14.264 -16.420 -10.028 1.00 0.00 N ATOM 1432 CA PHE B 7 -13.876 -16.141 -8.657 1.00 0.00 C ATOM 1433 C PHE B 7 -14.746 -15.035 -8.099 1.00 0.00 C ATOM 1434 O PHE B 7 -14.644 -13.883 -8.520 1.00 0.00 O ATOM 1435 CB PHE B 7 -12.397 -15.753 -8.566 1.00 0.00 C ATOM 1436 CG PHE B 7 -11.459 -16.871 -8.915 1.00 0.00 C ATOM 1437 CD1 PHE B 7 -11.247 -17.914 -8.029 1.00 0.00 C ATOM 1438 CD2 PHE B 7 -10.794 -16.879 -10.127 1.00 0.00 C ATOM 1439 CE1 PHE B 7 -10.387 -18.947 -8.346 1.00 0.00 C ATOM 1440 CE2 PHE B 7 -9.932 -17.909 -10.450 1.00 0.00 C ATOM 1441 CZ PHE B 7 -9.728 -18.945 -9.558 1.00 0.00 C ATOM 0 H PHE B 7 -14.325 -15.596 -10.626 1.00 0.00 H new ATOM 0 HA PHE B 7 -14.017 -17.046 -8.067 1.00 0.00 H new ATOM 0 HB2 PHE B 7 -12.209 -14.911 -9.233 1.00 0.00 H new ATOM 0 HB3 PHE B 7 -12.181 -15.412 -7.553 1.00 0.00 H new ATOM 0 HD1 PHE B 7 -11.760 -17.920 -7.079 1.00 0.00 H new ATOM 0 HD2 PHE B 7 -10.950 -16.072 -10.828 1.00 0.00 H new ATOM 0 HE1 PHE B 7 -10.231 -19.755 -7.646 1.00 0.00 H new ATOM 0 HE2 PHE B 7 -9.417 -17.905 -11.400 1.00 0.00 H new ATOM 0 HZ PHE B 7 -9.054 -19.751 -9.809 1.00 0.00 H new ATOM 1451 N THR B 8 -15.620 -15.396 -7.178 1.00 0.00 N ATOM 1452 CA THR B 8 -16.514 -14.432 -6.569 1.00 0.00 C ATOM 1453 C THR B 8 -15.737 -13.530 -5.623 1.00 0.00 C ATOM 1454 O THR B 8 -15.153 -13.999 -4.645 1.00 0.00 O ATOM 1455 CB THR B 8 -17.633 -15.142 -5.787 1.00 0.00 C ATOM 1456 OG1 THR B 8 -18.129 -16.251 -6.551 1.00 0.00 O ATOM 1457 CG2 THR B 8 -18.770 -14.181 -5.475 1.00 0.00 C ATOM 0 H THR B 8 -15.729 -16.351 -6.836 1.00 0.00 H new ATOM 0 HA THR B 8 -16.962 -13.835 -7.363 1.00 0.00 H new ATOM 0 HB THR B 8 -17.220 -15.503 -4.845 1.00 0.00 H new ATOM 0 HG1 THR B 8 -18.840 -16.702 -6.049 1.00 0.00 H new ATOM 0 HG21 THR B 8 -19.549 -14.706 -4.922 1.00 0.00 H new ATOM 0 HG22 THR B 8 -18.393 -13.354 -4.874 1.00 0.00 H new ATOM 0 HG23 THR B 8 -19.184 -13.793 -6.406 1.00 0.00 H new ATOM 1465 N PHE B 9 -15.716 -12.245 -5.922 1.00 0.00 N ATOM 1466 CA PHE B 9 -15.015 -11.291 -5.083 1.00 0.00 C ATOM 1467 C PHE B 9 -16.003 -10.497 -4.242 1.00 0.00 C ATOM 1468 O PHE B 9 -16.888 -9.820 -4.766 1.00 0.00 O ATOM 1469 CB PHE B 9 -14.121 -10.367 -5.925 1.00 0.00 C ATOM 1470 CG PHE B 9 -14.807 -9.709 -7.096 1.00 0.00 C ATOM 1471 CD1 PHE B 9 -14.946 -10.382 -8.301 1.00 0.00 C ATOM 1472 CD2 PHE B 9 -15.301 -8.418 -6.995 1.00 0.00 C ATOM 1473 CE1 PHE B 9 -15.567 -9.782 -9.380 1.00 0.00 C ATOM 1474 CE2 PHE B 9 -15.922 -7.812 -8.071 1.00 0.00 C ATOM 1475 CZ PHE B 9 -16.056 -8.496 -9.265 1.00 0.00 C ATOM 0 H PHE B 9 -16.175 -11.838 -6.737 1.00 0.00 H new ATOM 0 HA PHE B 9 -14.363 -11.842 -4.405 1.00 0.00 H new ATOM 0 HB2 PHE B 9 -13.716 -9.590 -5.277 1.00 0.00 H new ATOM 0 HB3 PHE B 9 -13.275 -10.945 -6.297 1.00 0.00 H new ATOM 0 HD1 PHE B 9 -14.564 -11.388 -8.397 1.00 0.00 H new ATOM 0 HD2 PHE B 9 -15.200 -7.879 -6.065 1.00 0.00 H new ATOM 0 HE1 PHE B 9 -15.670 -10.318 -10.312 1.00 0.00 H new ATOM 0 HE2 PHE B 9 -16.302 -6.805 -7.979 1.00 0.00 H new ATOM 0 HZ PHE B 9 -16.542 -8.025 -10.106 1.00 0.00 H new ATOM 1485 N GLU B 10 -15.858 -10.614 -2.934 1.00 0.00 N ATOM 1486 CA GLU B 10 -16.727 -9.926 -1.996 1.00 0.00 C ATOM 1487 C GLU B 10 -15.998 -8.778 -1.322 1.00 0.00 C ATOM 1488 O GLU B 10 -14.927 -8.967 -0.738 1.00 0.00 O ATOM 1489 CB GLU B 10 -17.243 -10.900 -0.937 1.00 0.00 C ATOM 1490 CG GLU B 10 -18.647 -11.406 -1.207 1.00 0.00 C ATOM 1491 CD GLU B 10 -19.681 -10.299 -1.140 1.00 0.00 C ATOM 1492 OE1 GLU B 10 -20.072 -9.914 -0.018 1.00 0.00 O ATOM 1493 OE2 GLU B 10 -20.104 -9.807 -2.208 1.00 0.00 O ATOM 0 H GLU B 10 -15.138 -11.186 -2.494 1.00 0.00 H new ATOM 0 HA GLU B 10 -17.571 -9.522 -2.555 1.00 0.00 H new ATOM 0 HB2 GLU B 10 -16.565 -11.751 -0.878 1.00 0.00 H new ATOM 0 HB3 GLU B 10 -17.224 -10.409 0.036 1.00 0.00 H new ATOM 0 HG2 GLU B 10 -18.680 -11.871 -2.192 1.00 0.00 H new ATOM 0 HG3 GLU B 10 -18.898 -12.179 -0.481 1.00 0.00 H new ATOM 1500 N ILE B 11 -16.571 -7.590 -1.417 1.00 0.00 N ATOM 1501 CA ILE B 11 -16.035 -6.434 -0.723 1.00 0.00 C ATOM 1502 C ILE B 11 -16.506 -6.449 0.725 1.00 0.00 C ATOM 1503 O ILE B 11 -17.634 -6.057 1.032 1.00 0.00 O ATOM 1504 CB ILE B 11 -16.448 -5.107 -1.400 1.00 0.00 C ATOM 1505 CG1 ILE B 11 -16.053 -5.121 -2.881 1.00 0.00 C ATOM 1506 CG2 ILE B 11 -15.796 -3.926 -0.686 1.00 0.00 C ATOM 1507 CD1 ILE B 11 -16.513 -3.901 -3.651 1.00 0.00 C ATOM 0 H ILE B 11 -17.408 -7.402 -1.969 1.00 0.00 H new ATOM 0 HA ILE B 11 -14.947 -6.494 -0.763 1.00 0.00 H new ATOM 0 HB ILE B 11 -17.531 -5.000 -1.331 1.00 0.00 H new ATOM 0 HG12 ILE B 11 -14.968 -5.199 -2.957 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -16.470 -6.013 -3.350 1.00 0.00 H new ATOM 0 HG21 ILE B 11 -16.094 -2.997 -1.172 1.00 0.00 H new ATOM 0 HG22 ILE B 11 -16.116 -3.909 0.356 1.00 0.00 H new ATOM 0 HG23 ILE B 11 -14.712 -4.027 -0.731 1.00 0.00 H new ATOM 0 HD11 ILE B 11 -16.195 -3.986 -4.690 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -17.600 -3.832 -3.608 1.00 0.00 H new ATOM 0 HD13 ILE B 11 -16.075 -3.006 -3.209 1.00 0.00 H new ATOM 1519 N GLU B 12 -15.643 -6.942 1.598 1.00 0.00 N ATOM 1520 CA GLU B 12 -15.963 -7.091 3.010 1.00 0.00 C ATOM 1521 C GLU B 12 -16.187 -5.736 3.662 1.00 0.00 C ATOM 1522 O GLU B 12 -17.248 -5.470 4.228 1.00 0.00 O ATOM 1523 CB GLU B 12 -14.822 -7.808 3.728 1.00 0.00 C ATOM 1524 CG GLU B 12 -14.532 -9.193 3.185 1.00 0.00 C ATOM 1525 CD GLU B 12 -15.559 -10.216 3.610 1.00 0.00 C ATOM 1526 OE1 GLU B 12 -15.407 -10.781 4.714 1.00 0.00 O ATOM 1527 OE2 GLU B 12 -16.512 -10.462 2.844 1.00 0.00 O ATOM 0 H GLU B 12 -14.703 -7.250 1.350 1.00 0.00 H new ATOM 0 HA GLU B 12 -16.879 -7.677 3.089 1.00 0.00 H new ATOM 0 HB2 GLU B 12 -13.919 -7.202 3.652 1.00 0.00 H new ATOM 0 HB3 GLU B 12 -15.065 -7.887 4.788 1.00 0.00 H new ATOM 0 HG2 GLU B 12 -14.497 -9.151 2.096 1.00 0.00 H new ATOM 0 HG3 GLU B 12 -13.546 -9.512 3.524 1.00 0.00 H new ATOM 1534 N GLU B 13 -15.180 -4.885 3.567 1.00 0.00 N ATOM 1535 CA GLU B 13 -15.203 -3.593 4.220 1.00 0.00 C ATOM 1536 C GLU B 13 -14.087 -2.722 3.669 1.00 0.00 C ATOM 1537 O GLU B 13 -13.063 -3.235 3.203 1.00 0.00 O ATOM 1538 CB GLU B 13 -15.030 -3.776 5.736 1.00 0.00 C ATOM 1539 CG GLU B 13 -15.044 -2.478 6.529 1.00 0.00 C ATOM 1540 CD GLU B 13 -16.325 -1.702 6.341 1.00 0.00 C ATOM 1541 OE1 GLU B 13 -17.358 -2.119 6.901 1.00 0.00 O ATOM 1542 OE2 GLU B 13 -16.304 -0.668 5.638 1.00 0.00 O ATOM 0 H GLU B 13 -14.329 -5.071 3.037 1.00 0.00 H new ATOM 0 HA GLU B 13 -16.160 -3.107 4.028 1.00 0.00 H new ATOM 0 HB2 GLU B 13 -15.826 -4.422 6.105 1.00 0.00 H new ATOM 0 HB3 GLU B 13 -14.088 -4.292 5.923 1.00 0.00 H new ATOM 0 HG2 GLU B 13 -14.909 -2.701 7.587 1.00 0.00 H new ATOM 0 HG3 GLU B 13 -14.200 -1.860 6.224 1.00 0.00 H new ATOM 1549 N HIS B 14 -14.285 -1.416 3.712 1.00 0.00 N ATOM 1550 CA HIS B 14 -13.244 -0.487 3.326 1.00 0.00 C ATOM 1551 C HIS B 14 -12.576 0.042 4.591 1.00 0.00 C ATOM 1552 O HIS B 14 -13.249 0.504 5.511 1.00 0.00 O ATOM 1553 CB HIS B 14 -13.800 0.652 2.447 1.00 0.00 C ATOM 1554 CG HIS B 14 -14.545 1.742 3.171 1.00 0.00 C ATOM 1555 ND1 HIS B 14 -15.894 1.689 3.456 1.00 0.00 N ATOM 1556 CD2 HIS B 14 -14.115 2.939 3.640 1.00 0.00 C ATOM 1557 CE1 HIS B 14 -16.257 2.799 4.070 1.00 0.00 C ATOM 1558 NE2 HIS B 14 -15.197 3.577 4.194 1.00 0.00 N ATOM 0 H HIS B 14 -15.157 -0.978 4.010 1.00 0.00 H new ATOM 0 HA HIS B 14 -12.501 -1.001 2.716 1.00 0.00 H new ATOM 0 HB2 HIS B 14 -12.969 1.105 1.906 1.00 0.00 H new ATOM 0 HB3 HIS B 14 -14.466 0.217 1.702 1.00 0.00 H new ATOM 0 HD2 HIS B 14 -13.106 3.321 3.587 1.00 0.00 H new ATOM 0 HE1 HIS B 14 -17.254 3.032 4.414 1.00 0.00 H new ATOM 0 HE2 HIS B 14 -15.184 4.499 4.629 1.00 0.00 H new ATOM 1567 N LEU B 15 -11.261 -0.059 4.648 1.00 0.00 N ATOM 1568 CA LEU B 15 -10.528 0.314 5.846 1.00 0.00 C ATOM 1569 C LEU B 15 -10.532 1.825 6.006 1.00 0.00 C ATOM 1570 O LEU B 15 -10.956 2.350 7.037 1.00 0.00 O ATOM 1571 CB LEU B 15 -9.107 -0.235 5.784 1.00 0.00 C ATOM 1572 CG LEU B 15 -9.021 -1.760 5.669 1.00 0.00 C ATOM 1573 CD1 LEU B 15 -7.579 -2.209 5.528 1.00 0.00 C ATOM 1574 CD2 LEU B 15 -9.675 -2.428 6.871 1.00 0.00 C ATOM 0 H LEU B 15 -10.679 -0.395 3.881 1.00 0.00 H new ATOM 0 HA LEU B 15 -11.016 -0.120 6.719 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -8.595 0.211 4.931 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -8.570 0.080 6.678 1.00 0.00 H new ATOM 0 HG LEU B 15 -9.561 -2.063 4.772 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -7.542 -3.295 5.448 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -7.145 -1.764 4.632 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -7.012 -1.890 6.402 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -9.603 -3.511 6.769 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -9.167 -2.114 7.783 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -10.724 -2.137 6.922 1.00 0.00 H new ATOM 1586 N LEU B 16 -10.074 2.518 4.976 1.00 0.00 N ATOM 1587 CA LEU B 16 -10.168 3.966 4.933 1.00 0.00 C ATOM 1588 C LEU B 16 -10.006 4.466 3.509 1.00 0.00 C ATOM 1589 O LEU B 16 -9.249 3.894 2.716 1.00 0.00 O ATOM 1590 CB LEU B 16 -9.133 4.648 5.844 1.00 0.00 C ATOM 1591 CG LEU B 16 -7.670 4.514 5.418 1.00 0.00 C ATOM 1592 CD1 LEU B 16 -6.879 5.735 5.859 1.00 0.00 C ATOM 1593 CD2 LEU B 16 -7.053 3.262 6.013 1.00 0.00 C ATOM 0 H LEU B 16 -9.633 2.099 4.157 1.00 0.00 H new ATOM 0 HA LEU B 16 -11.158 4.230 5.304 1.00 0.00 H new ATOM 0 HB2 LEU B 16 -9.377 5.709 5.906 1.00 0.00 H new ATOM 0 HB3 LEU B 16 -9.237 4.238 6.849 1.00 0.00 H new ATOM 0 HG LEU B 16 -7.637 4.440 4.331 1.00 0.00 H new ATOM 0 HD11 LEU B 16 -5.840 5.626 5.549 1.00 0.00 H new ATOM 0 HD12 LEU B 16 -7.303 6.628 5.400 1.00 0.00 H new ATOM 0 HD13 LEU B 16 -6.927 5.827 6.944 1.00 0.00 H new ATOM 0 HD21 LEU B 16 -6.012 3.184 5.698 1.00 0.00 H new ATOM 0 HD22 LEU B 16 -7.100 3.315 7.101 1.00 0.00 H new ATOM 0 HD23 LEU B 16 -7.603 2.386 5.668 1.00 0.00 H new ATOM 1605 N THR B 17 -10.741 5.515 3.188 1.00 0.00 N ATOM 1606 CA THR B 17 -10.616 6.170 1.901 1.00 0.00 C ATOM 1607 C THR B 17 -9.496 7.204 1.962 1.00 0.00 C ATOM 1608 O THR B 17 -9.550 8.139 2.761 1.00 0.00 O ATOM 1609 CB THR B 17 -11.933 6.868 1.507 1.00 0.00 C ATOM 1610 OG1 THR B 17 -13.048 5.989 1.731 1.00 0.00 O ATOM 1611 CG2 THR B 17 -11.906 7.300 0.046 1.00 0.00 C ATOM 0 H THR B 17 -11.436 5.933 3.807 1.00 0.00 H new ATOM 0 HA THR B 17 -10.386 5.413 1.151 1.00 0.00 H new ATOM 0 HB THR B 17 -12.042 7.756 2.130 1.00 0.00 H new ATOM 0 HG1 THR B 17 -12.820 5.087 1.423 1.00 0.00 H new ATOM 0 HG21 THR B 17 -12.847 7.790 -0.206 1.00 0.00 H new ATOM 0 HG22 THR B 17 -11.081 7.995 -0.113 1.00 0.00 H new ATOM 0 HG23 THR B 17 -11.771 6.425 -0.590 1.00 0.00 H new ATOM 1619 N LEU B 18 -8.476 7.030 1.134 1.00 0.00 N ATOM 1620 CA LEU B 18 -7.334 7.931 1.147 1.00 0.00 C ATOM 1621 C LEU B 18 -7.701 9.260 0.503 1.00 0.00 C ATOM 1622 O LEU B 18 -7.598 10.314 1.127 1.00 0.00 O ATOM 1623 CB LEU B 18 -6.142 7.304 0.419 1.00 0.00 C ATOM 1624 CG LEU B 18 -5.678 5.956 0.975 1.00 0.00 C ATOM 1625 CD1 LEU B 18 -4.477 5.446 0.198 1.00 0.00 C ATOM 1626 CD2 LEU B 18 -5.346 6.072 2.457 1.00 0.00 C ATOM 0 H LEU B 18 -8.416 6.277 0.448 1.00 0.00 H new ATOM 0 HA LEU B 18 -7.051 8.109 2.184 1.00 0.00 H new ATOM 0 HB2 LEU B 18 -6.404 7.176 -0.631 1.00 0.00 H new ATOM 0 HB3 LEU B 18 -5.306 8.002 0.456 1.00 0.00 H new ATOM 0 HG LEU B 18 -6.492 5.240 0.862 1.00 0.00 H new ATOM 0 HD11 LEU B 18 -4.160 4.486 0.607 1.00 0.00 H new ATOM 0 HD12 LEU B 18 -4.748 5.322 -0.851 1.00 0.00 H new ATOM 0 HD13 LEU B 18 -3.660 6.163 0.279 1.00 0.00 H new ATOM 0 HD21 LEU B 18 -5.018 5.103 2.833 1.00 0.00 H new ATOM 0 HD22 LEU B 18 -4.550 6.803 2.595 1.00 0.00 H new ATOM 0 HD23 LEU B 18 -6.232 6.393 3.004 1.00 0.00 H new ATOM 1638 N SER B 19 -8.152 9.197 -0.741 1.00 0.00 N ATOM 1639 CA SER B 19 -8.539 10.388 -1.478 1.00 0.00 C ATOM 1640 C SER B 19 -9.421 9.991 -2.654 1.00 0.00 C ATOM 1641 O SER B 19 -9.543 8.805 -2.964 1.00 0.00 O ATOM 1642 CB SER B 19 -7.295 11.140 -1.969 1.00 0.00 C ATOM 1643 OG SER B 19 -7.629 12.404 -2.519 1.00 0.00 O ATOM 0 H SER B 19 -8.259 8.327 -1.263 1.00 0.00 H new ATOM 0 HA SER B 19 -9.099 11.052 -0.820 1.00 0.00 H new ATOM 0 HB2 SER B 19 -6.601 11.276 -1.140 1.00 0.00 H new ATOM 0 HB3 SER B 19 -6.780 10.541 -2.720 1.00 0.00 H new ATOM 0 HG SER B 19 -6.813 12.856 -2.820 1.00 0.00 H new ATOM 1649 N GLU B 20 -10.033 10.971 -3.297 1.00 0.00 N ATOM 1650 CA GLU B 20 -10.908 10.705 -4.422 1.00 0.00 C ATOM 1651 C GLU B 20 -10.782 11.810 -5.463 1.00 0.00 C ATOM 1652 O GLU B 20 -11.304 12.912 -5.286 1.00 0.00 O ATOM 1653 CB GLU B 20 -12.356 10.565 -3.947 1.00 0.00 C ATOM 1654 CG GLU B 20 -13.316 10.141 -5.042 1.00 0.00 C ATOM 1655 CD GLU B 20 -14.665 9.734 -4.495 1.00 0.00 C ATOM 1656 OE1 GLU B 20 -14.820 8.555 -4.108 1.00 0.00 O ATOM 1657 OE2 GLU B 20 -15.569 10.589 -4.439 1.00 0.00 O ATOM 0 H GLU B 20 -9.939 11.958 -3.058 1.00 0.00 H new ATOM 0 HA GLU B 20 -10.609 9.765 -4.886 1.00 0.00 H new ATOM 0 HB2 GLU B 20 -12.395 9.835 -3.138 1.00 0.00 H new ATOM 0 HB3 GLU B 20 -12.688 11.517 -3.533 1.00 0.00 H new ATOM 0 HG2 GLU B 20 -13.445 10.962 -5.747 1.00 0.00 H new ATOM 0 HG3 GLU B 20 -12.885 9.308 -5.598 1.00 0.00 H new ATOM 1664 N ASN B 21 -10.084 11.504 -6.547 1.00 0.00 N ATOM 1665 CA ASN B 21 -9.822 12.479 -7.591 1.00 0.00 C ATOM 1666 C ASN B 21 -11.054 12.660 -8.462 1.00 0.00 C ATOM 1667 O ASN B 21 -11.587 11.691 -9.013 1.00 0.00 O ATOM 1668 CB ASN B 21 -8.643 12.026 -8.461 1.00 0.00 C ATOM 1669 CG ASN B 21 -7.368 11.796 -7.666 1.00 0.00 C ATOM 1670 OD1 ASN B 21 -7.137 10.706 -7.138 1.00 0.00 O ATOM 1671 ND2 ASN B 21 -6.522 12.809 -7.593 1.00 0.00 N ATOM 0 H ASN B 21 -9.687 10.581 -6.725 1.00 0.00 H new ATOM 0 HA ASN B 21 -9.573 13.429 -7.118 1.00 0.00 H new ATOM 0 HB2 ASN B 21 -8.913 11.105 -8.977 1.00 0.00 H new ATOM 0 HB3 ASN B 21 -8.455 12.778 -9.228 1.00 0.00 H new ATOM 0 HD21 ASN B 21 -5.643 12.704 -7.087 1.00 0.00 H new ATOM 0 HD22 ASN B 21 -6.748 13.696 -8.043 1.00 0.00 H new ATOM 1678 N GLU B 22 -11.513 13.906 -8.560 1.00 0.00 N ATOM 1679 CA GLU B 22 -12.633 14.284 -9.424 1.00 0.00 C ATOM 1680 C GLU B 22 -13.929 13.564 -9.039 1.00 0.00 C ATOM 1681 O GLU B 22 -14.910 13.615 -9.783 1.00 0.00 O ATOM 1682 CB GLU B 22 -12.297 14.012 -10.894 1.00 0.00 C ATOM 1683 CG GLU B 22 -11.012 14.675 -11.362 1.00 0.00 C ATOM 1684 CD GLU B 22 -10.826 14.591 -12.861 1.00 0.00 C ATOM 1685 OE1 GLU B 22 -10.382 13.534 -13.354 1.00 0.00 O ATOM 1686 OE2 GLU B 22 -11.127 15.586 -13.556 1.00 0.00 O ATOM 0 H GLU B 22 -11.116 14.688 -8.039 1.00 0.00 H new ATOM 0 HA GLU B 22 -12.796 15.353 -9.285 1.00 0.00 H new ATOM 0 HB2 GLU B 22 -12.216 12.936 -11.045 1.00 0.00 H new ATOM 0 HB3 GLU B 22 -13.122 14.360 -11.516 1.00 0.00 H new ATOM 0 HG2 GLU B 22 -11.016 15.722 -11.058 1.00 0.00 H new ATOM 0 HG3 GLU B 22 -10.163 14.203 -10.867 1.00 0.00 H new ATOM 1693 N LYS B 23 -13.931 12.920 -7.867 1.00 0.00 N ATOM 1694 CA LYS B 23 -15.079 12.139 -7.399 1.00 0.00 C ATOM 1695 C LYS B 23 -15.329 10.947 -8.336 1.00 0.00 C ATOM 1696 O LYS B 23 -16.404 10.342 -8.345 1.00 0.00 O ATOM 1697 CB LYS B 23 -16.319 13.047 -7.278 1.00 0.00 C ATOM 1698 CG LYS B 23 -17.538 12.376 -6.662 1.00 0.00 C ATOM 1699 CD LYS B 23 -18.605 13.391 -6.293 1.00 0.00 C ATOM 1700 CE LYS B 23 -19.899 12.713 -5.873 1.00 0.00 C ATOM 1701 NZ LYS B 23 -20.667 12.207 -7.042 1.00 0.00 N ATOM 0 H LYS B 23 -13.142 12.926 -7.221 1.00 0.00 H new ATOM 0 HA LYS B 23 -14.865 11.736 -6.409 1.00 0.00 H new ATOM 0 HB2 LYS B 23 -16.058 13.918 -6.677 1.00 0.00 H new ATOM 0 HB3 LYS B 23 -16.584 13.412 -8.270 1.00 0.00 H new ATOM 0 HG2 LYS B 23 -17.950 11.652 -7.365 1.00 0.00 H new ATOM 0 HG3 LYS B 23 -17.239 11.821 -5.773 1.00 0.00 H new ATOM 0 HD2 LYS B 23 -18.243 14.021 -5.481 1.00 0.00 H new ATOM 0 HD3 LYS B 23 -18.796 14.045 -7.144 1.00 0.00 H new ATOM 0 HE2 LYS B 23 -19.673 11.885 -5.201 1.00 0.00 H new ATOM 0 HE3 LYS B 23 -20.513 13.419 -5.313 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 -21.550 11.767 -6.713 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 -20.891 12.998 -7.679 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 -20.098 11.502 -7.552 1.00 0.00 H new ATOM 1715 N GLY B 24 -14.305 10.598 -9.109 1.00 0.00 N ATOM 1716 CA GLY B 24 -14.402 9.479 -10.029 1.00 0.00 C ATOM 1717 C GLY B 24 -13.278 8.482 -9.831 1.00 0.00 C ATOM 1718 O GLY B 24 -13.499 7.272 -9.844 1.00 0.00 O ATOM 0 H GLY B 24 -13.403 11.074 -9.114 1.00 0.00 H new ATOM 0 HA2 GLY B 24 -15.360 8.978 -9.890 1.00 0.00 H new ATOM 0 HA3 GLY B 24 -14.382 9.849 -11.054 1.00 0.00 H new ATOM 1722 N TRP B 25 -12.068 8.994 -9.648 1.00 0.00 N ATOM 1723 CA TRP B 25 -10.910 8.148 -9.412 1.00 0.00 C ATOM 1724 C TRP B 25 -10.542 8.149 -7.937 1.00 0.00 C ATOM 1725 O TRP B 25 -9.776 8.992 -7.472 1.00 0.00 O ATOM 1726 CB TRP B 25 -9.717 8.611 -10.251 1.00 0.00 C ATOM 1727 CG TRP B 25 -9.800 8.196 -11.690 1.00 0.00 C ATOM 1728 CD1 TRP B 25 -10.546 8.776 -12.675 1.00 0.00 C ATOM 1729 CD2 TRP B 25 -9.102 7.106 -12.301 1.00 0.00 C ATOM 1730 NE1 TRP B 25 -10.354 8.109 -13.863 1.00 0.00 N ATOM 1731 CE2 TRP B 25 -9.471 7.080 -13.658 1.00 0.00 C ATOM 1732 CE3 TRP B 25 -8.198 6.149 -11.831 1.00 0.00 C ATOM 1733 CZ2 TRP B 25 -8.968 6.134 -14.548 1.00 0.00 C ATOM 1734 CZ3 TRP B 25 -7.698 5.213 -12.715 1.00 0.00 C ATOM 1735 CH2 TRP B 25 -8.084 5.212 -14.060 1.00 0.00 C ATOM 0 H TRP B 25 -11.865 9.993 -9.659 1.00 0.00 H new ATOM 0 HA TRP B 25 -11.168 7.132 -9.710 1.00 0.00 H new ATOM 0 HB2 TRP B 25 -9.646 9.697 -10.198 1.00 0.00 H new ATOM 0 HB3 TRP B 25 -8.801 8.210 -9.818 1.00 0.00 H new ATOM 0 HD1 TRP B 25 -11.191 9.632 -12.542 1.00 0.00 H new ATOM 0 HE1 TRP B 25 -10.797 8.342 -14.752 1.00 0.00 H new ATOM 0 HE3 TRP B 25 -7.896 6.142 -10.794 1.00 0.00 H new ATOM 0 HZ2 TRP B 25 -9.265 6.129 -15.586 1.00 0.00 H new ATOM 0 HZ3 TRP B 25 -6.998 4.470 -12.363 1.00 0.00 H new ATOM 0 HH2 TRP B 25 -7.675 4.467 -14.727 1.00 0.00 H new ATOM 1746 N THR B 26 -11.094 7.208 -7.202 1.00 0.00 N ATOM 1747 CA THR B 26 -10.858 7.122 -5.771 1.00 0.00 C ATOM 1748 C THR B 26 -9.587 6.320 -5.496 1.00 0.00 C ATOM 1749 O THR B 26 -9.140 5.553 -6.340 1.00 0.00 O ATOM 1750 CB THR B 26 -12.057 6.451 -5.067 1.00 0.00 C ATOM 1751 OG1 THR B 26 -13.284 6.926 -5.639 1.00 0.00 O ATOM 1752 CG2 THR B 26 -12.054 6.734 -3.571 1.00 0.00 C ATOM 0 H THR B 26 -11.713 6.486 -7.571 1.00 0.00 H new ATOM 0 HA THR B 26 -10.738 8.132 -5.380 1.00 0.00 H new ATOM 0 HB THR B 26 -11.970 5.374 -5.212 1.00 0.00 H new ATOM 0 HG1 THR B 26 -13.791 7.420 -4.961 1.00 0.00 H new ATOM 0 HG21 THR B 26 -12.911 6.247 -3.107 1.00 0.00 H new ATOM 0 HG22 THR B 26 -11.135 6.349 -3.130 1.00 0.00 H new ATOM 0 HG23 THR B 26 -12.114 7.809 -3.404 1.00 0.00 H new ATOM 1760 N LYS B 27 -8.981 6.528 -4.342 1.00 0.00 N ATOM 1761 CA LYS B 27 -7.869 5.699 -3.913 1.00 0.00 C ATOM 1762 C LYS B 27 -8.141 5.227 -2.497 1.00 0.00 C ATOM 1763 O LYS B 27 -8.261 6.042 -1.579 1.00 0.00 O ATOM 1764 CB LYS B 27 -6.548 6.464 -3.982 1.00 0.00 C ATOM 1765 CG LYS B 27 -5.336 5.552 -4.074 1.00 0.00 C ATOM 1766 CD LYS B 27 -4.034 6.338 -4.164 1.00 0.00 C ATOM 1767 CE LYS B 27 -4.060 7.360 -5.293 1.00 0.00 C ATOM 1768 NZ LYS B 27 -4.469 6.765 -6.595 1.00 0.00 N ATOM 0 H LYS B 27 -9.240 7.264 -3.685 1.00 0.00 H new ATOM 0 HA LYS B 27 -7.778 4.842 -4.581 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -6.563 7.127 -4.847 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -6.454 7.096 -3.099 1.00 0.00 H new ATOM 0 HG2 LYS B 27 -5.306 4.900 -3.201 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -5.432 4.909 -4.949 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -3.852 6.848 -3.218 1.00 0.00 H new ATOM 0 HD3 LYS B 27 -3.204 5.648 -4.319 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -4.748 8.165 -5.034 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -3.071 7.807 -5.397 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -3.987 7.263 -7.371 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -4.207 5.759 -6.614 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -5.498 6.857 -6.711 1.00 0.00 H new ATOM 1782 N GLU B 28 -8.260 3.923 -2.321 1.00 0.00 N ATOM 1783 CA GLU B 28 -8.742 3.384 -1.064 1.00 0.00 C ATOM 1784 C GLU B 28 -8.108 2.030 -0.753 1.00 0.00 C ATOM 1785 O GLU B 28 -7.638 1.326 -1.652 1.00 0.00 O ATOM 1786 CB GLU B 28 -10.265 3.263 -1.136 1.00 0.00 C ATOM 1787 CG GLU B 28 -10.915 2.768 0.141 1.00 0.00 C ATOM 1788 CD GLU B 28 -12.420 2.777 0.055 1.00 0.00 C ATOM 1789 OE1 GLU B 28 -12.982 1.974 -0.717 1.00 0.00 O ATOM 1790 OE2 GLU B 28 -13.048 3.583 0.768 1.00 0.00 O ATOM 0 H GLU B 28 -8.031 3.223 -3.027 1.00 0.00 H new ATOM 0 HA GLU B 28 -8.460 4.059 -0.256 1.00 0.00 H new ATOM 0 HB2 GLU B 28 -10.683 4.238 -1.388 1.00 0.00 H new ATOM 0 HB3 GLU B 28 -10.525 2.585 -1.948 1.00 0.00 H new ATOM 0 HG2 GLU B 28 -10.571 1.756 0.353 1.00 0.00 H new ATOM 0 HG3 GLU B 28 -10.597 3.394 0.975 1.00 0.00 H new ATOM 1797 N ILE B 29 -8.083 1.688 0.530 1.00 0.00 N ATOM 1798 CA ILE B 29 -7.606 0.391 0.976 1.00 0.00 C ATOM 1799 C ILE B 29 -8.780 -0.416 1.527 1.00 0.00 C ATOM 1800 O ILE B 29 -9.459 0.020 2.458 1.00 0.00 O ATOM 1801 CB ILE B 29 -6.510 0.535 2.054 1.00 0.00 C ATOM 1802 CG1 ILE B 29 -5.373 1.421 1.532 1.00 0.00 C ATOM 1803 CG2 ILE B 29 -5.979 -0.835 2.450 1.00 0.00 C ATOM 1804 CD1 ILE B 29 -4.266 1.655 2.536 1.00 0.00 C ATOM 0 H ILE B 29 -8.392 2.301 1.285 1.00 0.00 H new ATOM 0 HA ILE B 29 -7.167 -0.128 0.124 1.00 0.00 H new ATOM 0 HB ILE B 29 -6.942 1.006 2.937 1.00 0.00 H new ATOM 0 HG12 ILE B 29 -4.949 0.962 0.639 1.00 0.00 H new ATOM 0 HG13 ILE B 29 -5.785 2.384 1.230 1.00 0.00 H new ATOM 0 HG21 ILE B 29 -5.207 -0.720 3.211 1.00 0.00 H new ATOM 0 HG22 ILE B 29 -6.794 -1.440 2.848 1.00 0.00 H new ATOM 0 HG23 ILE B 29 -5.556 -1.328 1.575 1.00 0.00 H new ATOM 0 HD11 ILE B 29 -3.500 2.290 2.092 1.00 0.00 H new ATOM 0 HD12 ILE B 29 -4.674 2.144 3.421 1.00 0.00 H new ATOM 0 HD13 ILE B 29 -3.825 0.700 2.820 1.00 0.00 H new ATOM 1816 N ASN B 30 -9.019 -1.586 0.954 1.00 0.00 N ATOM 1817 CA ASN B 30 -10.207 -2.367 1.292 1.00 0.00 C ATOM 1818 C ASN B 30 -9.868 -3.841 1.448 1.00 0.00 C ATOM 1819 O ASN B 30 -8.778 -4.276 1.087 1.00 0.00 O ATOM 1820 CB ASN B 30 -11.313 -2.200 0.229 1.00 0.00 C ATOM 1821 CG ASN B 30 -10.963 -2.778 -1.144 1.00 0.00 C ATOM 1822 OD1 ASN B 30 -9.722 -2.617 -1.580 1.00 0.00 O flip ATOM 1823 ND2 ASN B 30 -11.824 -3.331 -1.828 1.00 0.00 N flip ATOM 0 H ASN B 30 -8.412 -2.017 0.256 1.00 0.00 H new ATOM 0 HA ASN B 30 -10.578 -1.987 2.244 1.00 0.00 H new ATOM 0 HB2 ASN B 30 -12.223 -2.680 0.590 1.00 0.00 H new ATOM 0 HB3 ASN B 30 -11.535 -1.139 0.117 1.00 0.00 H new ATOM 0 HD21 ASN B 30 -12.771 -3.440 -1.465 1.00 0.00 H new ATOM 0 HD22 ASN B 30 -11.590 -3.680 -2.758 1.00 0.00 H new ATOM 1830 N ARG B 31 -10.800 -4.600 2.003 1.00 0.00 N ATOM 1831 CA ARG B 31 -10.624 -6.036 2.148 1.00 0.00 C ATOM 1832 C ARG B 31 -11.539 -6.776 1.186 1.00 0.00 C ATOM 1833 O ARG B 31 -12.754 -6.571 1.192 1.00 0.00 O ATOM 1834 CB ARG B 31 -10.911 -6.487 3.580 1.00 0.00 C ATOM 1835 CG ARG B 31 -9.959 -5.911 4.610 1.00 0.00 C ATOM 1836 CD ARG B 31 -10.122 -6.600 5.953 1.00 0.00 C ATOM 1837 NE ARG B 31 -9.787 -8.025 5.881 1.00 0.00 N ATOM 1838 CZ ARG B 31 -10.139 -8.921 6.802 1.00 0.00 C ATOM 1839 NH1 ARG B 31 -10.836 -8.550 7.871 1.00 0.00 N ATOM 1840 NH2 ARG B 31 -9.795 -10.194 6.654 1.00 0.00 N ATOM 0 H ARG B 31 -11.687 -4.245 2.361 1.00 0.00 H new ATOM 0 HA ARG B 31 -9.585 -6.271 1.915 1.00 0.00 H new ATOM 0 HB2 ARG B 31 -11.930 -6.202 3.842 1.00 0.00 H new ATOM 0 HB3 ARG B 31 -10.863 -7.575 3.624 1.00 0.00 H new ATOM 0 HG2 ARG B 31 -8.932 -6.023 4.263 1.00 0.00 H new ATOM 0 HG3 ARG B 31 -10.143 -4.842 4.722 1.00 0.00 H new ATOM 0 HD2 ARG B 31 -9.483 -6.114 6.690 1.00 0.00 H new ATOM 0 HD3 ARG B 31 -11.150 -6.486 6.297 1.00 0.00 H new ATOM 0 HE ARG B 31 -9.251 -8.351 5.076 1.00 0.00 H new ATOM 0 HH11 ARG B 31 -11.105 -7.573 7.991 1.00 0.00 H new ATOM 0 HH12 ARG B 31 -11.102 -9.242 8.572 1.00 0.00 H new ATOM 0 HH21 ARG B 31 -9.261 -10.486 5.835 1.00 0.00 H new ATOM 0 HH22 ARG B 31 -10.064 -10.880 7.359 1.00 0.00 H new ATOM 1854 N VAL B 32 -10.955 -7.631 0.362 1.00 0.00 N ATOM 1855 CA VAL B 32 -11.716 -8.379 -0.625 1.00 0.00 C ATOM 1856 C VAL B 32 -11.533 -9.877 -0.414 1.00 0.00 C ATOM 1857 O VAL B 32 -10.407 -10.364 -0.279 1.00 0.00 O ATOM 1858 CB VAL B 32 -11.291 -8.013 -2.065 1.00 0.00 C ATOM 1859 CG1 VAL B 32 -12.175 -8.715 -3.085 1.00 0.00 C ATOM 1860 CG2 VAL B 32 -11.331 -6.507 -2.277 1.00 0.00 C ATOM 0 H VAL B 32 -9.954 -7.824 0.357 1.00 0.00 H new ATOM 0 HA VAL B 32 -12.765 -8.114 -0.494 1.00 0.00 H new ATOM 0 HB VAL B 32 -10.265 -8.352 -2.207 1.00 0.00 H new ATOM 0 HG11 VAL B 32 -11.857 -8.442 -4.091 1.00 0.00 H new ATOM 0 HG12 VAL B 32 -12.091 -9.794 -2.958 1.00 0.00 H new ATOM 0 HG13 VAL B 32 -13.212 -8.412 -2.938 1.00 0.00 H new ATOM 0 HG21 VAL B 32 -11.028 -6.275 -3.298 1.00 0.00 H new ATOM 0 HG22 VAL B 32 -12.344 -6.143 -2.108 1.00 0.00 H new ATOM 0 HG23 VAL B 32 -10.650 -6.023 -1.577 1.00 0.00 H new ATOM 1870 N SER B 33 -12.643 -10.595 -0.358 1.00 0.00 N ATOM 1871 CA SER B 33 -12.610 -12.042 -0.265 1.00 0.00 C ATOM 1872 C SER B 33 -12.764 -12.642 -1.658 1.00 0.00 C ATOM 1873 O SER B 33 -13.728 -12.346 -2.365 1.00 0.00 O ATOM 1874 CB SER B 33 -13.723 -12.544 0.658 1.00 0.00 C ATOM 1875 OG SER B 33 -13.701 -13.957 0.769 1.00 0.00 O ATOM 0 H SER B 33 -13.581 -10.195 -0.376 1.00 0.00 H new ATOM 0 HA SER B 33 -11.654 -12.352 0.156 1.00 0.00 H new ATOM 0 HB2 SER B 33 -13.608 -12.098 1.646 1.00 0.00 H new ATOM 0 HB3 SER B 33 -14.691 -12.222 0.273 1.00 0.00 H new ATOM 0 HG SER B 33 -12.827 -14.245 1.106 1.00 0.00 H new ATOM 1881 N PHE B 34 -11.806 -13.466 -2.056 1.00 0.00 N ATOM 1882 CA PHE B 34 -11.824 -14.075 -3.378 1.00 0.00 C ATOM 1883 C PHE B 34 -12.205 -15.548 -3.294 1.00 0.00 C ATOM 1884 O PHE B 34 -11.512 -16.332 -2.644 1.00 0.00 O ATOM 1885 CB PHE B 34 -10.450 -13.945 -4.050 1.00 0.00 C ATOM 1886 CG PHE B 34 -10.040 -12.529 -4.351 1.00 0.00 C ATOM 1887 CD1 PHE B 34 -10.477 -11.900 -5.508 1.00 0.00 C ATOM 1888 CD2 PHE B 34 -9.211 -11.833 -3.488 1.00 0.00 C ATOM 1889 CE1 PHE B 34 -10.095 -10.605 -5.795 1.00 0.00 C ATOM 1890 CE2 PHE B 34 -8.826 -10.535 -3.770 1.00 0.00 C ATOM 1891 CZ PHE B 34 -9.268 -9.919 -4.925 1.00 0.00 C ATOM 0 H PHE B 34 -11.005 -13.729 -1.481 1.00 0.00 H new ATOM 0 HA PHE B 34 -12.570 -13.549 -3.974 1.00 0.00 H new ATOM 0 HB2 PHE B 34 -9.698 -14.399 -3.404 1.00 0.00 H new ATOM 0 HB3 PHE B 34 -10.458 -14.514 -4.980 1.00 0.00 H new ATOM 0 HD1 PHE B 34 -11.124 -12.430 -6.192 1.00 0.00 H new ATOM 0 HD2 PHE B 34 -8.861 -12.309 -2.584 1.00 0.00 H new ATOM 0 HE1 PHE B 34 -10.442 -10.128 -6.699 1.00 0.00 H new ATOM 0 HE2 PHE B 34 -8.180 -10.003 -3.087 1.00 0.00 H new ATOM 0 HZ PHE B 34 -8.969 -8.905 -5.147 1.00 0.00 H new ATOM 1901 N ASN B 35 -13.334 -15.898 -3.916 1.00 0.00 N ATOM 1902 CA ASN B 35 -13.771 -17.297 -4.078 1.00 0.00 C ATOM 1903 C ASN B 35 -14.274 -17.919 -2.770 1.00 0.00 C ATOM 1904 O ASN B 35 -15.128 -18.806 -2.783 1.00 0.00 O ATOM 1905 CB ASN B 35 -12.639 -18.141 -4.682 1.00 0.00 C ATOM 1906 CG ASN B 35 -12.943 -19.629 -4.704 1.00 0.00 C ATOM 1907 OD1 ASN B 35 -12.553 -20.368 -3.801 1.00 0.00 O ATOM 1908 ND2 ASN B 35 -13.650 -20.074 -5.728 1.00 0.00 N ATOM 0 H ASN B 35 -13.977 -15.220 -4.325 1.00 0.00 H new ATOM 0 HA ASN B 35 -14.619 -17.289 -4.763 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -12.446 -17.802 -5.700 1.00 0.00 H new ATOM 0 HB3 ASN B 35 -11.726 -17.972 -4.111 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -13.891 -21.063 -5.790 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -13.954 -19.428 -6.457 1.00 0.00 H new ATOM 1915 N GLY B 36 -13.760 -17.443 -1.649 1.00 0.00 N ATOM 1916 CA GLY B 36 -14.119 -18.009 -0.365 1.00 0.00 C ATOM 1917 C GLY B 36 -12.953 -17.991 0.597 1.00 0.00 C ATOM 1918 O GLY B 36 -13.097 -18.337 1.769 1.00 0.00 O ATOM 0 H GLY B 36 -13.096 -16.670 -1.604 1.00 0.00 H new ATOM 0 HA2 GLY B 36 -14.951 -17.448 0.061 1.00 0.00 H new ATOM 0 HA3 GLY B 36 -14.463 -19.034 -0.502 1.00 0.00 H new ATOM 1922 N ALA B 37 -11.788 -17.604 0.093 1.00 0.00 N ATOM 1923 CA ALA B 37 -10.608 -17.457 0.924 1.00 0.00 C ATOM 1924 C ALA B 37 -10.731 -16.205 1.784 1.00 0.00 C ATOM 1925 O ALA B 37 -11.352 -15.223 1.363 1.00 0.00 O ATOM 1926 CB ALA B 37 -9.362 -17.389 0.052 1.00 0.00 C ATOM 0 H ALA B 37 -11.639 -17.386 -0.892 1.00 0.00 H new ATOM 0 HA ALA B 37 -10.522 -18.322 1.581 1.00 0.00 H new ATOM 0 HB1 ALA B 37 -8.481 -17.279 0.684 1.00 0.00 H new ATOM 0 HB2 ALA B 37 -9.277 -18.305 -0.533 1.00 0.00 H new ATOM 0 HB3 ALA B 37 -9.435 -16.535 -0.621 1.00 0.00 H new ATOM 1932 N PRO B 38 -10.164 -16.229 3.002 1.00 0.00 N ATOM 1933 CA PRO B 38 -10.192 -15.085 3.919 1.00 0.00 C ATOM 1934 C PRO B 38 -9.774 -13.787 3.232 1.00 0.00 C ATOM 1935 O PRO B 38 -8.761 -13.744 2.533 1.00 0.00 O ATOM 1936 CB PRO B 38 -9.184 -15.474 4.998 1.00 0.00 C ATOM 1937 CG PRO B 38 -9.203 -16.961 5.006 1.00 0.00 C ATOM 1938 CD PRO B 38 -9.452 -17.384 3.584 1.00 0.00 C ATOM 0 HA PRO B 38 -11.192 -14.891 4.306 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -8.190 -15.091 4.769 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -9.466 -15.068 5.970 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -8.257 -17.361 5.371 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -9.984 -17.337 5.667 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -8.520 -17.589 3.057 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -10.052 -18.292 3.534 1.00 0.00 H new ATOM 1946 N ALA B 39 -10.569 -12.741 3.433 1.00 0.00 N ATOM 1947 CA ALA B 39 -10.358 -11.461 2.766 1.00 0.00 C ATOM 1948 C ALA B 39 -8.975 -10.886 3.032 1.00 0.00 C ATOM 1949 O ALA B 39 -8.588 -10.671 4.184 1.00 0.00 O ATOM 1950 CB ALA B 39 -11.417 -10.465 3.202 1.00 0.00 C ATOM 0 H ALA B 39 -11.374 -12.756 4.060 1.00 0.00 H new ATOM 0 HA ALA B 39 -10.436 -11.644 1.694 1.00 0.00 H new ATOM 0 HB1 ALA B 39 -11.250 -9.513 2.698 1.00 0.00 H new ATOM 0 HB2 ALA B 39 -12.404 -10.846 2.941 1.00 0.00 H new ATOM 0 HB3 ALA B 39 -11.358 -10.320 4.281 1.00 0.00 H new ATOM 1956 N LYS B 40 -8.248 -10.624 1.958 1.00 0.00 N ATOM 1957 CA LYS B 40 -6.942 -9.990 2.047 1.00 0.00 C ATOM 1958 C LYS B 40 -7.100 -8.481 1.991 1.00 0.00 C ATOM 1959 O LYS B 40 -8.208 -7.971 1.812 1.00 0.00 O ATOM 1960 CB LYS B 40 -6.024 -10.475 0.918 1.00 0.00 C ATOM 1961 CG LYS B 40 -5.061 -11.578 1.334 1.00 0.00 C ATOM 1962 CD LYS B 40 -5.787 -12.793 1.884 1.00 0.00 C ATOM 1963 CE LYS B 40 -4.805 -13.843 2.380 1.00 0.00 C ATOM 1964 NZ LYS B 40 -5.500 -15.011 2.976 1.00 0.00 N ATOM 0 H LYS B 40 -8.543 -10.843 1.006 1.00 0.00 H new ATOM 0 HA LYS B 40 -6.483 -10.265 2.996 1.00 0.00 H new ATOM 0 HB2 LYS B 40 -6.639 -10.835 0.093 1.00 0.00 H new ATOM 0 HB3 LYS B 40 -5.450 -9.628 0.541 1.00 0.00 H new ATOM 0 HG2 LYS B 40 -4.458 -11.874 0.476 1.00 0.00 H new ATOM 0 HG3 LYS B 40 -4.375 -11.194 2.089 1.00 0.00 H new ATOM 0 HD2 LYS B 40 -6.442 -12.490 2.701 1.00 0.00 H new ATOM 0 HD3 LYS B 40 -6.422 -13.222 1.109 1.00 0.00 H new ATOM 0 HE2 LYS B 40 -4.180 -14.176 1.551 1.00 0.00 H new ATOM 0 HE3 LYS B 40 -4.141 -13.398 3.121 1.00 0.00 H new ATOM 0 HZ1 LYS B 40 -4.797 -15.704 3.302 1.00 0.00 H new ATOM 0 HZ2 LYS B 40 -6.077 -14.697 3.783 1.00 0.00 H new ATOM 0 HZ3 LYS B 40 -6.114 -15.451 2.262 1.00 0.00 H new ATOM 1978 N PHE B 41 -5.996 -7.770 2.140 1.00 0.00 N ATOM 1979 CA PHE B 41 -6.025 -6.322 2.160 1.00 0.00 C ATOM 1980 C PHE B 41 -5.522 -5.784 0.830 1.00 0.00 C ATOM 1981 O PHE B 41 -4.355 -5.944 0.492 1.00 0.00 O ATOM 1982 CB PHE B 41 -5.159 -5.797 3.305 1.00 0.00 C ATOM 1983 CG PHE B 41 -5.473 -6.414 4.640 1.00 0.00 C ATOM 1984 CD1 PHE B 41 -4.819 -7.561 5.059 1.00 0.00 C ATOM 1985 CD2 PHE B 41 -6.413 -5.841 5.478 1.00 0.00 C ATOM 1986 CE1 PHE B 41 -5.099 -8.128 6.287 1.00 0.00 C ATOM 1987 CE2 PHE B 41 -6.696 -6.400 6.708 1.00 0.00 C ATOM 1988 CZ PHE B 41 -6.039 -7.545 7.114 1.00 0.00 C ATOM 0 H PHE B 41 -5.066 -8.176 2.249 1.00 0.00 H new ATOM 0 HA PHE B 41 -7.050 -5.984 2.316 1.00 0.00 H new ATOM 0 HB2 PHE B 41 -4.111 -5.981 3.068 1.00 0.00 H new ATOM 0 HB3 PHE B 41 -5.285 -4.717 3.377 1.00 0.00 H new ATOM 0 HD1 PHE B 41 -4.080 -8.018 4.417 1.00 0.00 H new ATOM 0 HD2 PHE B 41 -6.931 -4.946 5.166 1.00 0.00 H new ATOM 0 HE1 PHE B 41 -4.584 -9.025 6.600 1.00 0.00 H new ATOM 0 HE2 PHE B 41 -7.431 -5.942 7.353 1.00 0.00 H new ATOM 0 HZ PHE B 41 -6.260 -7.983 8.076 1.00 0.00 H new ATOM 1998 N ASP B 42 -6.396 -5.142 0.083 1.00 0.00 N ATOM 1999 CA ASP B 42 -6.055 -4.691 -1.255 1.00 0.00 C ATOM 2000 C ASP B 42 -5.966 -3.173 -1.315 1.00 0.00 C ATOM 2001 O ASP B 42 -6.868 -2.464 -0.852 1.00 0.00 O ATOM 2002 CB ASP B 42 -7.083 -5.215 -2.259 1.00 0.00 C ATOM 2003 CG ASP B 42 -6.809 -4.750 -3.673 1.00 0.00 C ATOM 2004 OD1 ASP B 42 -5.911 -5.317 -4.329 1.00 0.00 O ATOM 2005 OD2 ASP B 42 -7.501 -3.817 -4.129 1.00 0.00 O ATOM 0 H ASP B 42 -7.347 -4.920 0.377 1.00 0.00 H new ATOM 0 HA ASP B 42 -5.074 -5.089 -1.515 1.00 0.00 H new ATOM 0 HB2 ASP B 42 -7.087 -6.305 -2.234 1.00 0.00 H new ATOM 0 HB3 ASP B 42 -8.078 -4.886 -1.959 1.00 0.00 H new ATOM 2010 N ILE B 43 -4.866 -2.681 -1.865 1.00 0.00 N ATOM 2011 CA ILE B 43 -4.655 -1.254 -2.013 1.00 0.00 C ATOM 2012 C ILE B 43 -4.713 -0.882 -3.484 1.00 0.00 C ATOM 2013 O ILE B 43 -3.804 -1.213 -4.251 1.00 0.00 O ATOM 2014 CB ILE B 43 -3.288 -0.813 -1.444 1.00 0.00 C ATOM 2015 CG1 ILE B 43 -3.101 -1.347 -0.021 1.00 0.00 C ATOM 2016 CG2 ILE B 43 -3.175 0.707 -1.464 1.00 0.00 C ATOM 2017 CD1 ILE B 43 -1.821 -0.884 0.640 1.00 0.00 C ATOM 0 H ILE B 43 -4.102 -3.257 -2.218 1.00 0.00 H new ATOM 0 HA ILE B 43 -5.441 -0.746 -1.454 1.00 0.00 H new ATOM 0 HB ILE B 43 -2.499 -1.229 -2.071 1.00 0.00 H new ATOM 0 HG12 ILE B 43 -3.948 -1.034 0.589 1.00 0.00 H new ATOM 0 HG13 ILE B 43 -3.112 -2.437 -0.047 1.00 0.00 H new ATOM 0 HG21 ILE B 43 -2.207 1.005 -1.061 1.00 0.00 H new ATOM 0 HG22 ILE B 43 -3.267 1.065 -2.489 1.00 0.00 H new ATOM 0 HG23 ILE B 43 -3.970 1.139 -0.856 1.00 0.00 H new ATOM 0 HD11 ILE B 43 -1.758 -1.302 1.645 1.00 0.00 H new ATOM 0 HD12 ILE B 43 -0.966 -1.220 0.053 1.00 0.00 H new ATOM 0 HD13 ILE B 43 -1.815 0.204 0.699 1.00 0.00 H new ATOM 2029 N ARG B 44 -5.772 -0.202 -3.889 1.00 0.00 N ATOM 2030 CA ARG B 44 -5.927 0.152 -5.286 1.00 0.00 C ATOM 2031 C ARG B 44 -6.785 1.395 -5.446 1.00 0.00 C ATOM 2032 O ARG B 44 -7.114 2.073 -4.470 1.00 0.00 O ATOM 2033 CB ARG B 44 -6.522 -1.020 -6.080 1.00 0.00 C ATOM 2034 CG ARG B 44 -8.007 -1.254 -5.859 1.00 0.00 C ATOM 2035 CD ARG B 44 -8.483 -2.469 -6.639 1.00 0.00 C ATOM 2036 NE ARG B 44 -9.938 -2.583 -6.670 1.00 0.00 N ATOM 2037 CZ ARG B 44 -10.652 -3.267 -5.775 1.00 0.00 C ATOM 2038 NH1 ARG B 44 -10.057 -3.850 -4.743 1.00 0.00 N ATOM 2039 NH2 ARG B 44 -11.964 -3.374 -5.928 1.00 0.00 N ATOM 0 H ARG B 44 -6.527 0.112 -3.279 1.00 0.00 H new ATOM 0 HA ARG B 44 -4.937 0.373 -5.686 1.00 0.00 H new ATOM 0 HB2 ARG B 44 -6.351 -0.844 -7.142 1.00 0.00 H new ATOM 0 HB3 ARG B 44 -5.982 -1.930 -5.816 1.00 0.00 H new ATOM 0 HG2 ARG B 44 -8.203 -1.398 -4.797 1.00 0.00 H new ATOM 0 HG3 ARG B 44 -8.569 -0.373 -6.170 1.00 0.00 H new ATOM 0 HD2 ARG B 44 -8.105 -2.411 -7.660 1.00 0.00 H new ATOM 0 HD3 ARG B 44 -8.061 -3.370 -6.193 1.00 0.00 H new ATOM 0 HE ARG B 44 -10.439 -2.111 -7.422 1.00 0.00 H new ATOM 0 HH11 ARG B 44 -9.046 -3.777 -4.629 1.00 0.00 H new ATOM 0 HH12 ARG B 44 -10.610 -4.371 -4.063 1.00 0.00 H new ATOM 0 HH21 ARG B 44 -12.422 -2.935 -6.727 1.00 0.00 H new ATOM 0 HH22 ARG B 44 -12.516 -3.896 -5.247 1.00 0.00 H new ATOM 2053 N ALA B 45 -7.126 1.698 -6.684 1.00 0.00 N ATOM 2054 CA ALA B 45 -7.939 2.855 -6.987 1.00 0.00 C ATOM 2055 C ALA B 45 -9.325 2.432 -7.451 1.00 0.00 C ATOM 2056 O ALA B 45 -9.541 1.284 -7.836 1.00 0.00 O ATOM 2057 CB ALA B 45 -7.258 3.704 -8.052 1.00 0.00 C ATOM 0 H ALA B 45 -6.849 1.153 -7.500 1.00 0.00 H new ATOM 0 HA ALA B 45 -8.051 3.449 -6.080 1.00 0.00 H new ATOM 0 HB1 ALA B 45 -7.877 4.573 -8.275 1.00 0.00 H new ATOM 0 HB2 ALA B 45 -6.286 4.034 -7.687 1.00 0.00 H new ATOM 0 HB3 ALA B 45 -7.124 3.113 -8.958 1.00 0.00 H new ATOM 2063 N TRP B 46 -10.255 3.366 -7.399 1.00 0.00 N ATOM 2064 CA TRP B 46 -11.579 3.172 -7.956 1.00 0.00 C ATOM 2065 C TRP B 46 -11.696 4.017 -9.213 1.00 0.00 C ATOM 2066 O TRP B 46 -11.082 5.078 -9.311 1.00 0.00 O ATOM 2067 CB TRP B 46 -12.673 3.570 -6.959 1.00 0.00 C ATOM 2068 CG TRP B 46 -12.748 2.703 -5.733 1.00 0.00 C ATOM 2069 CD1 TRP B 46 -12.351 3.030 -4.467 1.00 0.00 C ATOM 2070 CD2 TRP B 46 -13.271 1.371 -5.656 1.00 0.00 C ATOM 2071 NE1 TRP B 46 -12.597 1.984 -3.610 1.00 0.00 N ATOM 2072 CE2 TRP B 46 -13.155 0.954 -4.317 1.00 0.00 C ATOM 2073 CE3 TRP B 46 -13.821 0.489 -6.590 1.00 0.00 C ATOM 2074 CZ2 TRP B 46 -13.574 -0.303 -3.888 1.00 0.00 C ATOM 2075 CZ3 TRP B 46 -14.236 -0.758 -6.163 1.00 0.00 C ATOM 2076 CH2 TRP B 46 -14.109 -1.146 -4.824 1.00 0.00 C ATOM 0 H TRP B 46 -10.114 4.280 -6.969 1.00 0.00 H new ATOM 0 HA TRP B 46 -11.715 2.115 -8.187 1.00 0.00 H new ATOM 0 HB2 TRP B 46 -12.506 4.601 -6.649 1.00 0.00 H new ATOM 0 HB3 TRP B 46 -13.637 3.542 -7.467 1.00 0.00 H new ATOM 0 HD1 TRP B 46 -11.908 3.973 -4.181 1.00 0.00 H new ATOM 0 HE1 TRP B 46 -12.396 1.977 -2.610 1.00 0.00 H new ATOM 0 HE3 TRP B 46 -13.920 0.777 -7.626 1.00 0.00 H new ATOM 0 HZ2 TRP B 46 -13.480 -0.602 -2.854 1.00 0.00 H new ATOM 0 HZ3 TRP B 46 -14.666 -1.446 -6.876 1.00 0.00 H new ATOM 0 HH2 TRP B 46 -14.440 -2.129 -4.524 1.00 0.00 H new ATOM 2087 N SER B 47 -12.455 3.540 -10.175 1.00 0.00 N ATOM 2088 CA SER B 47 -12.587 4.227 -11.444 1.00 0.00 C ATOM 2089 C SER B 47 -14.012 4.095 -11.949 1.00 0.00 C ATOM 2090 O SER B 47 -14.768 3.275 -11.430 1.00 0.00 O ATOM 2091 CB SER B 47 -11.608 3.622 -12.452 1.00 0.00 C ATOM 2092 OG SER B 47 -10.302 3.539 -11.906 1.00 0.00 O ATOM 0 H SER B 47 -12.993 2.676 -10.103 1.00 0.00 H new ATOM 0 HA SER B 47 -12.357 5.285 -11.316 1.00 0.00 H new ATOM 0 HB2 SER B 47 -11.948 2.628 -12.743 1.00 0.00 H new ATOM 0 HB3 SER B 47 -11.590 4.230 -13.356 1.00 0.00 H new ATOM 0 HG SER B 47 -9.749 4.262 -12.269 1.00 0.00 H new ATOM 2098 N PRO B 48 -14.411 4.912 -12.943 1.00 0.00 N ATOM 2099 CA PRO B 48 -15.717 4.777 -13.590 1.00 0.00 C ATOM 2100 C PRO B 48 -15.944 3.356 -14.092 1.00 0.00 C ATOM 2101 O PRO B 48 -15.452 2.969 -15.157 1.00 0.00 O ATOM 2102 CB PRO B 48 -15.643 5.758 -14.762 1.00 0.00 C ATOM 2103 CG PRO B 48 -14.638 6.774 -14.343 1.00 0.00 C ATOM 2104 CD PRO B 48 -13.637 6.043 -13.489 1.00 0.00 C ATOM 0 HA PRO B 48 -16.542 4.985 -12.909 1.00 0.00 H new ATOM 0 HB2 PRO B 48 -15.339 5.256 -15.680 1.00 0.00 H new ATOM 0 HB3 PRO B 48 -16.613 6.217 -14.956 1.00 0.00 H new ATOM 0 HG2 PRO B 48 -14.155 7.225 -15.210 1.00 0.00 H new ATOM 0 HG3 PRO B 48 -15.110 7.582 -13.785 1.00 0.00 H new ATOM 0 HD2 PRO B 48 -12.784 5.700 -14.075 1.00 0.00 H new ATOM 0 HD3 PRO B 48 -13.244 6.680 -12.697 1.00 0.00 H new ATOM 2112 N ASP B 49 -16.671 2.581 -13.299 1.00 0.00 N ATOM 2113 CA ASP B 49 -16.904 1.173 -13.586 1.00 0.00 C ATOM 2114 C ASP B 49 -17.728 1.016 -14.857 1.00 0.00 C ATOM 2115 O ASP B 49 -18.495 1.910 -15.215 1.00 0.00 O ATOM 2116 CB ASP B 49 -17.591 0.505 -12.390 1.00 0.00 C ATOM 2117 CG ASP B 49 -18.150 -0.862 -12.715 1.00 0.00 C ATOM 2118 OD1 ASP B 49 -17.359 -1.812 -12.906 1.00 0.00 O ATOM 2119 OD2 ASP B 49 -19.386 -0.988 -12.787 1.00 0.00 O ATOM 0 H ASP B 49 -17.115 2.910 -12.441 1.00 0.00 H new ATOM 0 HA ASP B 49 -15.947 0.679 -13.751 1.00 0.00 H new ATOM 0 HB2 ASP B 49 -16.876 0.414 -11.572 1.00 0.00 H new ATOM 0 HB3 ASP B 49 -18.398 1.147 -12.037 1.00 0.00 H new ATOM 2124 N HIS B 50 -17.547 -0.119 -15.539 1.00 0.00 N ATOM 2125 CA HIS B 50 -18.141 -0.356 -16.858 1.00 0.00 C ATOM 2126 C HIS B 50 -17.445 0.494 -17.921 1.00 0.00 C ATOM 2127 O HIS B 50 -17.898 0.567 -19.061 1.00 0.00 O ATOM 2128 CB HIS B 50 -19.656 -0.082 -16.863 1.00 0.00 C ATOM 2129 CG HIS B 50 -20.498 -1.208 -16.336 1.00 0.00 C ATOM 2130 ND1 HIS B 50 -20.520 -1.590 -15.010 1.00 0.00 N ATOM 2131 CD2 HIS B 50 -21.366 -2.035 -16.971 1.00 0.00 C ATOM 2132 CE1 HIS B 50 -21.358 -2.596 -14.854 1.00 0.00 C ATOM 2133 NE2 HIS B 50 -21.884 -2.883 -16.025 1.00 0.00 N ATOM 0 H HIS B 50 -16.986 -0.898 -15.193 1.00 0.00 H new ATOM 0 HA HIS B 50 -17.996 -1.410 -17.095 1.00 0.00 H new ATOM 0 HB2 HIS B 50 -19.852 0.810 -16.268 1.00 0.00 H new ATOM 0 HB3 HIS B 50 -19.968 0.140 -17.883 1.00 0.00 H new ATOM 0 HD1 HIS B 50 -19.972 -1.160 -14.265 1.00 0.00 H new ATOM 0 HD2 HIS B 50 -21.605 -2.027 -18.024 1.00 0.00 H new ATOM 0 HE1 HIS B 50 -21.575 -3.099 -13.923 1.00 0.00 H new ATOM 2142 N THR B 51 -16.336 1.127 -17.546 1.00 0.00 N ATOM 2143 CA THR B 51 -15.564 1.938 -18.479 1.00 0.00 C ATOM 2144 C THR B 51 -14.062 1.801 -18.220 1.00 0.00 C ATOM 2145 O THR B 51 -13.318 1.322 -19.078 1.00 0.00 O ATOM 2146 CB THR B 51 -15.978 3.424 -18.404 1.00 0.00 C ATOM 2147 OG1 THR B 51 -17.379 3.547 -18.674 1.00 0.00 O ATOM 2148 CG2 THR B 51 -15.196 4.266 -19.405 1.00 0.00 C ATOM 0 H THR B 51 -15.953 1.093 -16.601 1.00 0.00 H new ATOM 0 HA THR B 51 -15.779 1.568 -19.482 1.00 0.00 H new ATOM 0 HB THR B 51 -15.757 3.787 -17.400 1.00 0.00 H new ATOM 0 HG1 THR B 51 -17.640 4.490 -18.624 1.00 0.00 H new ATOM 0 HG21 THR B 51 -15.510 5.307 -19.328 1.00 0.00 H new ATOM 0 HG22 THR B 51 -14.130 4.191 -19.189 1.00 0.00 H new ATOM 0 HG23 THR B 51 -15.388 3.903 -20.415 1.00 0.00 H new ATOM 2156 N LYS B 52 -13.614 2.215 -17.041 1.00 0.00 N ATOM 2157 CA LYS B 52 -12.198 2.143 -16.693 1.00 0.00 C ATOM 2158 C LYS B 52 -12.012 1.463 -15.342 1.00 0.00 C ATOM 2159 O LYS B 52 -12.879 1.554 -14.475 1.00 0.00 O ATOM 2160 CB LYS B 52 -11.563 3.538 -16.651 1.00 0.00 C ATOM 2161 CG LYS B 52 -11.563 4.262 -17.987 1.00 0.00 C ATOM 2162 CD LYS B 52 -10.757 5.551 -17.913 1.00 0.00 C ATOM 2163 CE LYS B 52 -10.790 6.314 -19.229 1.00 0.00 C ATOM 2164 NZ LYS B 52 -9.904 7.508 -19.201 1.00 0.00 N ATOM 0 H LYS B 52 -14.209 2.604 -16.310 1.00 0.00 H new ATOM 0 HA LYS B 52 -11.702 1.556 -17.466 1.00 0.00 H new ATOM 0 HB2 LYS B 52 -12.097 4.146 -15.921 1.00 0.00 H new ATOM 0 HB3 LYS B 52 -10.535 3.447 -16.300 1.00 0.00 H new ATOM 0 HG2 LYS B 52 -11.145 3.612 -18.756 1.00 0.00 H new ATOM 0 HG3 LYS B 52 -12.588 4.487 -18.282 1.00 0.00 H new ATOM 0 HD2 LYS B 52 -11.153 6.182 -17.117 1.00 0.00 H new ATOM 0 HD3 LYS B 52 -9.724 5.320 -17.653 1.00 0.00 H new ATOM 0 HE2 LYS B 52 -10.483 5.653 -20.039 1.00 0.00 H new ATOM 0 HE3 LYS B 52 -11.812 6.626 -19.442 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 -9.955 8.000 -20.116 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 -10.212 8.151 -18.444 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 -8.924 7.209 -19.023 1.00 0.00 H new ATOM 2178 N MET B 53 -10.887 0.780 -15.174 1.00 0.00 N ATOM 2179 CA MET B 53 -10.572 0.120 -13.912 1.00 0.00 C ATOM 2180 C MET B 53 -9.098 0.287 -13.554 1.00 0.00 C ATOM 2181 O MET B 53 -8.233 -0.402 -14.097 1.00 0.00 O ATOM 2182 CB MET B 53 -10.915 -1.372 -13.979 1.00 0.00 C ATOM 2183 CG MET B 53 -12.396 -1.661 -14.159 1.00 0.00 C ATOM 2184 SD MET B 53 -12.751 -3.427 -14.218 1.00 0.00 S ATOM 2185 CE MET B 53 -14.523 -3.403 -14.486 1.00 0.00 C ATOM 0 H MET B 53 -10.176 0.668 -15.897 1.00 0.00 H new ATOM 0 HA MET B 53 -11.176 0.593 -13.138 1.00 0.00 H new ATOM 0 HB2 MET B 53 -10.365 -1.824 -14.805 1.00 0.00 H new ATOM 0 HB3 MET B 53 -10.570 -1.854 -13.064 1.00 0.00 H new ATOM 0 HG2 MET B 53 -12.954 -1.209 -13.339 1.00 0.00 H new ATOM 0 HG3 MET B 53 -12.745 -1.192 -15.079 1.00 0.00 H new ATOM 0 HE1 MET B 53 -14.896 -4.426 -14.545 1.00 0.00 H new ATOM 0 HE2 MET B 53 -15.009 -2.887 -13.658 1.00 0.00 H new ATOM 0 HE3 MET B 53 -14.743 -2.882 -15.418 1.00 0.00 H new ATOM 2195 N GLY B 54 -8.813 1.226 -12.663 1.00 0.00 N ATOM 2196 CA GLY B 54 -7.469 1.363 -12.138 1.00 0.00 C ATOM 2197 C GLY B 54 -7.262 0.470 -10.930 1.00 0.00 C ATOM 2198 O GLY B 54 -8.233 -0.006 -10.336 1.00 0.00 O ATOM 0 H GLY B 54 -9.488 1.896 -12.294 1.00 0.00 H new ATOM 0 HA2 GLY B 54 -6.745 1.107 -12.912 1.00 0.00 H new ATOM 0 HA3 GLY B 54 -7.287 2.402 -11.862 1.00 0.00 H new ATOM 2202 N LYS B 55 -6.014 0.233 -10.554 1.00 0.00 N ATOM 2203 CA LYS B 55 -5.728 -0.647 -9.431 1.00 0.00 C ATOM 2204 C LYS B 55 -4.326 -0.432 -8.885 1.00 0.00 C ATOM 2205 O LYS B 55 -3.621 0.496 -9.280 1.00 0.00 O ATOM 2206 CB LYS B 55 -5.878 -2.113 -9.835 1.00 0.00 C ATOM 2207 CG LYS B 55 -4.971 -2.523 -10.981 1.00 0.00 C ATOM 2208 CD LYS B 55 -4.866 -4.032 -11.096 1.00 0.00 C ATOM 2209 CE LYS B 55 -3.898 -4.441 -12.194 1.00 0.00 C ATOM 2210 NZ LYS B 55 -3.609 -5.899 -12.160 1.00 0.00 N ATOM 0 H LYS B 55 -5.191 0.633 -11.005 1.00 0.00 H new ATOM 0 HA LYS B 55 -6.450 -0.402 -8.652 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -5.665 -2.743 -8.971 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -6.914 -2.299 -10.118 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -5.355 -2.112 -11.915 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -3.978 -2.099 -10.830 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -4.535 -4.448 -10.144 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -5.851 -4.452 -11.303 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -4.317 -4.176 -13.165 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -2.968 -3.883 -12.085 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -2.945 -6.139 -12.924 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -3.186 -6.148 -11.243 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -4.493 -6.431 -12.289 1.00 0.00 H new ATOM 2224 N GLY B 56 -3.940 -1.309 -7.970 1.00 0.00 N ATOM 2225 CA GLY B 56 -2.617 -1.268 -7.395 1.00 0.00 C ATOM 2226 C GLY B 56 -2.092 -2.651 -7.077 1.00 0.00 C ATOM 2227 O GLY B 56 -1.680 -3.385 -7.976 1.00 0.00 O ATOM 0 H GLY B 56 -4.532 -2.059 -7.613 1.00 0.00 H new ATOM 0 HA2 GLY B 56 -1.936 -0.773 -8.087 1.00 0.00 H new ATOM 0 HA3 GLY B 56 -2.636 -0.670 -6.484 1.00 0.00 H new ATOM 2231 N ILE B 57 -2.131 -3.031 -5.808 1.00 0.00 N ATOM 2232 CA ILE B 57 -1.572 -4.305 -5.388 1.00 0.00 C ATOM 2233 C ILE B 57 -2.274 -4.834 -4.137 1.00 0.00 C ATOM 2234 O ILE B 57 -2.683 -4.067 -3.261 1.00 0.00 O ATOM 2235 CB ILE B 57 -0.050 -4.182 -5.136 1.00 0.00 C ATOM 2236 CG1 ILE B 57 0.568 -5.559 -4.869 1.00 0.00 C ATOM 2237 CG2 ILE B 57 0.224 -3.231 -3.975 1.00 0.00 C ATOM 2238 CD1 ILE B 57 2.080 -5.555 -4.864 1.00 0.00 C ATOM 0 H ILE B 57 -2.542 -2.478 -5.056 1.00 0.00 H new ATOM 0 HA ILE B 57 -1.735 -5.018 -6.196 1.00 0.00 H new ATOM 0 HB ILE B 57 0.415 -3.771 -6.032 1.00 0.00 H new ATOM 0 HG12 ILE B 57 0.211 -5.927 -3.907 1.00 0.00 H new ATOM 0 HG13 ILE B 57 0.218 -6.258 -5.628 1.00 0.00 H new ATOM 0 HG21 ILE B 57 1.299 -3.156 -3.812 1.00 0.00 H new ATOM 0 HG22 ILE B 57 -0.177 -2.245 -4.210 1.00 0.00 H new ATOM 0 HG23 ILE B 57 -0.254 -3.611 -3.072 1.00 0.00 H new ATOM 0 HD11 ILE B 57 2.446 -6.563 -4.669 1.00 0.00 H new ATOM 0 HD12 ILE B 57 2.446 -5.217 -5.834 1.00 0.00 H new ATOM 0 HD13 ILE B 57 2.439 -4.882 -4.086 1.00 0.00 H new ATOM 2250 N THR B 58 -2.426 -6.148 -4.071 1.00 0.00 N ATOM 2251 CA THR B 58 -3.059 -6.789 -2.932 1.00 0.00 C ATOM 2252 C THR B 58 -2.005 -7.267 -1.930 1.00 0.00 C ATOM 2253 O THR B 58 -0.993 -7.872 -2.310 1.00 0.00 O ATOM 2254 CB THR B 58 -3.909 -7.987 -3.392 1.00 0.00 C ATOM 2255 OG1 THR B 58 -4.658 -7.629 -4.563 1.00 0.00 O ATOM 2256 CG2 THR B 58 -4.867 -8.428 -2.294 1.00 0.00 C ATOM 0 H THR B 58 -2.117 -6.793 -4.798 1.00 0.00 H new ATOM 0 HA THR B 58 -3.705 -6.056 -2.448 1.00 0.00 H new ATOM 0 HB THR B 58 -3.238 -8.815 -3.621 1.00 0.00 H new ATOM 0 HG1 THR B 58 -5.337 -6.963 -4.326 1.00 0.00 H new ATOM 0 HG21 THR B 58 -5.456 -9.276 -2.644 1.00 0.00 H new ATOM 0 HG22 THR B 58 -4.299 -8.721 -1.411 1.00 0.00 H new ATOM 0 HG23 THR B 58 -5.533 -7.604 -2.040 1.00 0.00 H new ATOM 2264 N LEU B 59 -2.237 -6.988 -0.659 1.00 0.00 N ATOM 2265 CA LEU B 59 -1.325 -7.394 0.395 1.00 0.00 C ATOM 2266 C LEU B 59 -1.970 -8.482 1.246 1.00 0.00 C ATOM 2267 O LEU B 59 -3.176 -8.448 1.501 1.00 0.00 O ATOM 2268 CB LEU B 59 -0.963 -6.204 1.295 1.00 0.00 C ATOM 2269 CG LEU B 59 -0.511 -4.930 0.573 1.00 0.00 C ATOM 2270 CD1 LEU B 59 -0.123 -3.864 1.583 1.00 0.00 C ATOM 2271 CD2 LEU B 59 0.651 -5.220 -0.363 1.00 0.00 C ATOM 0 H LEU B 59 -3.057 -6.477 -0.331 1.00 0.00 H new ATOM 0 HA LEU B 59 -0.416 -7.774 -0.071 1.00 0.00 H new ATOM 0 HB2 LEU B 59 -1.830 -5.962 1.910 1.00 0.00 H new ATOM 0 HB3 LEU B 59 -0.168 -6.515 1.973 1.00 0.00 H new ATOM 0 HG LEU B 59 -1.344 -4.562 -0.025 1.00 0.00 H new ATOM 0 HD11 LEU B 59 0.196 -2.964 1.058 1.00 0.00 H new ATOM 0 HD12 LEU B 59 -0.981 -3.631 2.214 1.00 0.00 H new ATOM 0 HD13 LEU B 59 0.694 -4.231 2.204 1.00 0.00 H new ATOM 0 HD21 LEU B 59 0.953 -4.300 -0.863 1.00 0.00 H new ATOM 0 HD22 LEU B 59 1.490 -5.614 0.210 1.00 0.00 H new ATOM 0 HD23 LEU B 59 0.344 -5.954 -1.108 1.00 0.00 H new ATOM 2283 N SER B 60 -1.181 -9.450 1.672 1.00 0.00 N ATOM 2284 CA SER B 60 -1.673 -10.466 2.579 1.00 0.00 C ATOM 2285 C SER B 60 -1.582 -9.945 4.010 1.00 0.00 C ATOM 2286 O SER B 60 -1.065 -8.847 4.243 1.00 0.00 O ATOM 2287 CB SER B 60 -0.864 -11.754 2.423 1.00 0.00 C ATOM 2288 OG SER B 60 -0.634 -12.042 1.055 1.00 0.00 O ATOM 0 H SER B 60 -0.202 -9.553 1.406 1.00 0.00 H new ATOM 0 HA SER B 60 -2.713 -10.691 2.344 1.00 0.00 H new ATOM 0 HB2 SER B 60 0.089 -11.656 2.944 1.00 0.00 H new ATOM 0 HB3 SER B 60 -1.398 -12.582 2.889 1.00 0.00 H new ATOM 0 HG SER B 60 0.067 -11.451 0.710 1.00 0.00 H new ATOM 2294 N ASN B 61 -2.082 -10.725 4.959 1.00 0.00 N ATOM 2295 CA ASN B 61 -2.092 -10.326 6.365 1.00 0.00 C ATOM 2296 C ASN B 61 -0.688 -9.977 6.846 1.00 0.00 C ATOM 2297 O ASN B 61 -0.498 -9.022 7.602 1.00 0.00 O ATOM 2298 CB ASN B 61 -2.661 -11.444 7.244 1.00 0.00 C ATOM 2299 CG ASN B 61 -4.110 -11.778 6.932 1.00 0.00 C ATOM 2300 OD1 ASN B 61 -4.553 -11.701 5.786 1.00 0.00 O ATOM 2301 ND2 ASN B 61 -4.858 -12.149 7.956 1.00 0.00 N ATOM 0 H ASN B 61 -2.489 -11.643 4.782 1.00 0.00 H new ATOM 0 HA ASN B 61 -2.726 -9.443 6.448 1.00 0.00 H new ATOM 0 HB2 ASN B 61 -2.054 -12.340 7.117 1.00 0.00 H new ATOM 0 HB3 ASN B 61 -2.581 -11.150 8.290 1.00 0.00 H new ATOM 0 HD21 ASN B 61 -5.840 -12.384 7.812 1.00 0.00 H new ATOM 0 HD22 ASN B 61 -4.453 -12.200 8.891 1.00 0.00 H new ATOM 2308 N GLU B 62 0.288 -10.752 6.392 1.00 0.00 N ATOM 2309 CA GLU B 62 1.672 -10.558 6.798 1.00 0.00 C ATOM 2310 C GLU B 62 2.195 -9.195 6.345 1.00 0.00 C ATOM 2311 O GLU B 62 2.588 -8.376 7.176 1.00 0.00 O ATOM 2312 CB GLU B 62 2.556 -11.687 6.255 1.00 0.00 C ATOM 2313 CG GLU B 62 4.011 -11.575 6.683 1.00 0.00 C ATOM 2314 CD GLU B 62 4.811 -12.827 6.379 1.00 0.00 C ATOM 2315 OE1 GLU B 62 5.329 -12.957 5.251 1.00 0.00 O ATOM 2316 OE2 GLU B 62 4.938 -13.684 7.274 1.00 0.00 O ATOM 0 H GLU B 62 0.145 -11.523 5.740 1.00 0.00 H new ATOM 0 HA GLU B 62 1.710 -10.584 7.887 1.00 0.00 H new ATOM 0 HB2 GLU B 62 2.158 -12.644 6.593 1.00 0.00 H new ATOM 0 HB3 GLU B 62 2.504 -11.687 5.166 1.00 0.00 H new ATOM 0 HG2 GLU B 62 4.469 -10.725 6.178 1.00 0.00 H new ATOM 0 HG3 GLU B 62 4.056 -11.372 7.753 1.00 0.00 H new ATOM 2323 N GLU B 63 2.180 -8.947 5.033 1.00 0.00 N ATOM 2324 CA GLU B 63 2.698 -7.691 4.479 1.00 0.00 C ATOM 2325 C GLU B 63 2.007 -6.489 5.107 1.00 0.00 C ATOM 2326 O GLU B 63 2.652 -5.500 5.457 1.00 0.00 O ATOM 2327 CB GLU B 63 2.511 -7.615 2.958 1.00 0.00 C ATOM 2328 CG GLU B 63 3.071 -8.795 2.190 1.00 0.00 C ATOM 2329 CD GLU B 63 2.061 -9.903 2.025 1.00 0.00 C ATOM 2330 OE1 GLU B 63 1.893 -10.701 2.967 1.00 0.00 O ATOM 2331 OE2 GLU B 63 1.421 -9.970 0.951 1.00 0.00 O ATOM 0 H GLU B 63 1.816 -9.596 4.335 1.00 0.00 H new ATOM 0 HA GLU B 63 3.763 -7.672 4.710 1.00 0.00 H new ATOM 0 HB2 GLU B 63 1.446 -7.530 2.741 1.00 0.00 H new ATOM 0 HB3 GLU B 63 2.985 -6.704 2.593 1.00 0.00 H new ATOM 0 HG2 GLU B 63 3.404 -8.461 1.207 1.00 0.00 H new ATOM 0 HG3 GLU B 63 3.948 -9.181 2.710 1.00 0.00 H new ATOM 2338 N PHE B 64 0.696 -6.593 5.257 1.00 0.00 N ATOM 2339 CA PHE B 64 -0.110 -5.478 5.717 1.00 0.00 C ATOM 2340 C PHE B 64 0.250 -5.088 7.150 1.00 0.00 C ATOM 2341 O PHE B 64 0.536 -3.928 7.428 1.00 0.00 O ATOM 2342 CB PHE B 64 -1.589 -5.828 5.615 1.00 0.00 C ATOM 2343 CG PHE B 64 -2.470 -4.626 5.483 1.00 0.00 C ATOM 2344 CD1 PHE B 64 -2.515 -3.924 4.289 1.00 0.00 C ATOM 2345 CD2 PHE B 64 -3.249 -4.196 6.541 1.00 0.00 C ATOM 2346 CE1 PHE B 64 -3.321 -2.816 4.154 1.00 0.00 C ATOM 2347 CE2 PHE B 64 -4.057 -3.086 6.412 1.00 0.00 C ATOM 2348 CZ PHE B 64 -4.095 -2.397 5.217 1.00 0.00 C ATOM 0 H PHE B 64 0.167 -7.444 5.065 1.00 0.00 H new ATOM 0 HA PHE B 64 0.098 -4.620 5.078 1.00 0.00 H new ATOM 0 HB2 PHE B 64 -1.743 -6.480 4.755 1.00 0.00 H new ATOM 0 HB3 PHE B 64 -1.884 -6.392 6.500 1.00 0.00 H new ATOM 0 HD1 PHE B 64 -1.911 -4.250 3.455 1.00 0.00 H new ATOM 0 HD2 PHE B 64 -3.225 -4.734 7.477 1.00 0.00 H new ATOM 0 HE1 PHE B 64 -3.347 -2.276 3.219 1.00 0.00 H new ATOM 0 HE2 PHE B 64 -4.660 -2.756 7.245 1.00 0.00 H new ATOM 0 HZ PHE B 64 -4.730 -1.530 5.114 1.00 0.00 H new ATOM 2358 N GLN B 65 0.248 -6.061 8.051 1.00 0.00 N ATOM 2359 CA GLN B 65 0.599 -5.800 9.442 1.00 0.00 C ATOM 2360 C GLN B 65 2.060 -5.349 9.554 1.00 0.00 C ATOM 2361 O GLN B 65 2.409 -4.525 10.405 1.00 0.00 O ATOM 2362 CB GLN B 65 0.352 -7.050 10.298 1.00 0.00 C ATOM 2363 CG GLN B 65 0.890 -6.950 11.721 1.00 0.00 C ATOM 2364 CD GLN B 65 0.374 -5.737 12.480 1.00 0.00 C ATOM 2365 OE1 GLN B 65 -0.739 -5.269 12.257 1.00 0.00 O ATOM 2366 NE2 GLN B 65 1.194 -5.214 13.377 1.00 0.00 N ATOM 0 H GLN B 65 0.009 -7.031 7.847 1.00 0.00 H new ATOM 0 HA GLN B 65 -0.035 -4.995 9.814 1.00 0.00 H new ATOM 0 HB2 GLN B 65 -0.720 -7.242 10.340 1.00 0.00 H new ATOM 0 HB3 GLN B 65 0.811 -7.909 9.808 1.00 0.00 H new ATOM 0 HG2 GLN B 65 0.619 -7.853 12.268 1.00 0.00 H new ATOM 0 HG3 GLN B 65 1.979 -6.912 11.688 1.00 0.00 H new ATOM 0 HE21 GLN B 65 2.111 -5.631 13.534 1.00 0.00 H new ATOM 0 HE22 GLN B 65 0.909 -4.393 13.911 1.00 0.00 H new ATOM 2375 N THR B 66 2.907 -5.885 8.679 1.00 0.00 N ATOM 2376 CA THR B 66 4.321 -5.536 8.668 1.00 0.00 C ATOM 2377 C THR B 66 4.520 -4.046 8.394 1.00 0.00 C ATOM 2378 O THR B 66 5.284 -3.380 9.093 1.00 0.00 O ATOM 2379 CB THR B 66 5.102 -6.371 7.629 1.00 0.00 C ATOM 2380 OG1 THR B 66 4.997 -7.764 7.947 1.00 0.00 O ATOM 2381 CG2 THR B 66 6.573 -5.977 7.595 1.00 0.00 C ATOM 0 H THR B 66 2.636 -6.564 7.968 1.00 0.00 H new ATOM 0 HA THR B 66 4.714 -5.765 9.659 1.00 0.00 H new ATOM 0 HB THR B 66 4.667 -6.176 6.649 1.00 0.00 H new ATOM 0 HG1 THR B 66 4.326 -8.182 7.368 1.00 0.00 H new ATOM 0 HG21 THR B 66 7.095 -6.583 6.854 1.00 0.00 H new ATOM 0 HG22 THR B 66 6.661 -4.923 7.330 1.00 0.00 H new ATOM 0 HG23 THR B 66 7.017 -6.143 8.577 1.00 0.00 H new ATOM 2389 N MET B 67 3.815 -3.518 7.398 1.00 0.00 N ATOM 2390 CA MET B 67 3.979 -2.116 7.030 1.00 0.00 C ATOM 2391 C MET B 67 3.379 -1.196 8.091 1.00 0.00 C ATOM 2392 O MET B 67 3.859 -0.087 8.286 1.00 0.00 O ATOM 2393 CB MET B 67 3.390 -1.832 5.636 1.00 0.00 C ATOM 2394 CG MET B 67 1.877 -1.962 5.522 1.00 0.00 C ATOM 2395 SD MET B 67 0.997 -0.494 6.088 1.00 0.00 S ATOM 2396 CE MET B 67 -0.693 -0.960 5.729 1.00 0.00 C ATOM 0 H MET B 67 3.134 -4.031 6.838 1.00 0.00 H new ATOM 0 HA MET B 67 5.047 -1.906 6.980 1.00 0.00 H new ATOM 0 HB2 MET B 67 3.673 -0.822 5.341 1.00 0.00 H new ATOM 0 HB3 MET B 67 3.850 -2.514 4.921 1.00 0.00 H new ATOM 0 HG2 MET B 67 1.612 -2.159 4.483 1.00 0.00 H new ATOM 0 HG3 MET B 67 1.547 -2.823 6.104 1.00 0.00 H new ATOM 0 HE1 MET B 67 -1.232 -0.099 5.335 1.00 0.00 H new ATOM 0 HE2 MET B 67 -0.700 -1.762 4.990 1.00 0.00 H new ATOM 0 HE3 MET B 67 -1.177 -1.304 6.643 1.00 0.00 H new ATOM 2406 N VAL B 68 2.353 -1.675 8.792 1.00 0.00 N ATOM 2407 CA VAL B 68 1.721 -0.901 9.860 1.00 0.00 C ATOM 2408 C VAL B 68 2.723 -0.554 10.958 1.00 0.00 C ATOM 2409 O VAL B 68 2.959 0.620 11.253 1.00 0.00 O ATOM 2410 CB VAL B 68 0.518 -1.660 10.464 1.00 0.00 C ATOM 2411 CG1 VAL B 68 0.032 -1.015 11.755 1.00 0.00 C ATOM 2412 CG2 VAL B 68 -0.609 -1.716 9.453 1.00 0.00 C ATOM 0 H VAL B 68 1.941 -2.596 8.640 1.00 0.00 H new ATOM 0 HA VAL B 68 1.359 0.026 9.416 1.00 0.00 H new ATOM 0 HB VAL B 68 0.846 -2.671 10.706 1.00 0.00 H new ATOM 0 HG11 VAL B 68 -0.814 -1.579 12.147 1.00 0.00 H new ATOM 0 HG12 VAL B 68 0.839 -1.015 12.488 1.00 0.00 H new ATOM 0 HG13 VAL B 68 -0.277 0.011 11.555 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -1.456 -2.252 9.882 1.00 0.00 H new ATOM 0 HG22 VAL B 68 -0.915 -0.703 9.193 1.00 0.00 H new ATOM 0 HG23 VAL B 68 -0.268 -2.234 8.556 1.00 0.00 H new ATOM 2422 N ASP B 69 3.314 -1.580 11.559 1.00 0.00 N ATOM 2423 CA ASP B 69 4.329 -1.382 12.592 1.00 0.00 C ATOM 2424 C ASP B 69 5.517 -0.589 12.047 1.00 0.00 C ATOM 2425 O ASP B 69 6.012 0.346 12.690 1.00 0.00 O ATOM 2426 CB ASP B 69 4.798 -2.737 13.127 1.00 0.00 C ATOM 2427 CG ASP B 69 5.858 -2.608 14.202 1.00 0.00 C ATOM 2428 OD1 ASP B 69 5.533 -2.128 15.308 1.00 0.00 O ATOM 2429 OD2 ASP B 69 7.017 -3.008 13.957 1.00 0.00 O ATOM 0 H ASP B 69 3.110 -2.557 11.351 1.00 0.00 H new ATOM 0 HA ASP B 69 3.885 -0.809 13.406 1.00 0.00 H new ATOM 0 HB2 ASP B 69 3.943 -3.279 13.530 1.00 0.00 H new ATOM 0 HB3 ASP B 69 5.193 -3.331 12.303 1.00 0.00 H new ATOM 2434 N ALA B 70 5.946 -0.944 10.843 1.00 0.00 N ATOM 2435 CA ALA B 70 7.102 -0.315 10.225 1.00 0.00 C ATOM 2436 C ALA B 70 6.872 1.170 9.966 1.00 0.00 C ATOM 2437 O ALA B 70 7.696 1.991 10.339 1.00 0.00 O ATOM 2438 CB ALA B 70 7.463 -1.020 8.935 1.00 0.00 C ATOM 0 H ALA B 70 5.507 -1.668 10.274 1.00 0.00 H new ATOM 0 HA ALA B 70 7.932 -0.404 10.926 1.00 0.00 H new ATOM 0 HB1 ALA B 70 8.330 -0.536 8.486 1.00 0.00 H new ATOM 0 HB2 ALA B 70 7.698 -2.064 9.144 1.00 0.00 H new ATOM 0 HB3 ALA B 70 6.621 -0.969 8.244 1.00 0.00 H new ATOM 2444 N PHE B 71 5.753 1.518 9.340 1.00 0.00 N ATOM 2445 CA PHE B 71 5.462 2.914 9.018 1.00 0.00 C ATOM 2446 C PHE B 71 5.224 3.739 10.275 1.00 0.00 C ATOM 2447 O PHE B 71 5.444 4.953 10.279 1.00 0.00 O ATOM 2448 CB PHE B 71 4.273 3.022 8.068 1.00 0.00 C ATOM 2449 CG PHE B 71 4.617 2.656 6.655 1.00 0.00 C ATOM 2450 CD1 PHE B 71 5.806 3.090 6.090 1.00 0.00 C ATOM 2451 CD2 PHE B 71 3.762 1.883 5.892 1.00 0.00 C ATOM 2452 CE1 PHE B 71 6.134 2.758 4.794 1.00 0.00 C ATOM 2453 CE2 PHE B 71 4.083 1.547 4.593 1.00 0.00 C ATOM 2454 CZ PHE B 71 5.271 1.985 4.043 1.00 0.00 C ATOM 0 H PHE B 71 5.034 0.857 9.046 1.00 0.00 H new ATOM 0 HA PHE B 71 6.339 3.321 8.514 1.00 0.00 H new ATOM 0 HB2 PHE B 71 3.473 2.372 8.421 1.00 0.00 H new ATOM 0 HB3 PHE B 71 3.889 4.042 8.090 1.00 0.00 H new ATOM 0 HD1 PHE B 71 6.484 3.696 6.673 1.00 0.00 H new ATOM 0 HD2 PHE B 71 2.831 1.538 6.318 1.00 0.00 H new ATOM 0 HE1 PHE B 71 7.064 3.102 4.366 1.00 0.00 H new ATOM 0 HE2 PHE B 71 3.406 0.942 4.008 1.00 0.00 H new ATOM 0 HZ PHE B 71 5.525 1.723 3.026 1.00 0.00 H new ATOM 2464 N LYS B 72 4.782 3.072 11.332 1.00 0.00 N ATOM 2465 CA LYS B 72 4.678 3.690 12.648 1.00 0.00 C ATOM 2466 C LYS B 72 6.049 4.191 13.105 1.00 0.00 C ATOM 2467 O LYS B 72 6.172 5.268 13.687 1.00 0.00 O ATOM 2468 CB LYS B 72 4.106 2.682 13.654 1.00 0.00 C ATOM 2469 CG LYS B 72 4.298 3.075 15.115 1.00 0.00 C ATOM 2470 CD LYS B 72 3.597 2.101 16.052 1.00 0.00 C ATOM 2471 CE LYS B 72 4.023 0.662 15.797 1.00 0.00 C ATOM 2472 NZ LYS B 72 5.461 0.436 16.098 1.00 0.00 N ATOM 0 H LYS B 72 4.488 2.096 11.304 1.00 0.00 H new ATOM 0 HA LYS B 72 4.003 4.544 12.590 1.00 0.00 H new ATOM 0 HB2 LYS B 72 3.041 2.558 13.460 1.00 0.00 H new ATOM 0 HB3 LYS B 72 4.575 1.713 13.486 1.00 0.00 H new ATOM 0 HG2 LYS B 72 5.362 3.104 15.348 1.00 0.00 H new ATOM 0 HG3 LYS B 72 3.909 4.080 15.276 1.00 0.00 H new ATOM 0 HD2 LYS B 72 3.819 2.368 17.085 1.00 0.00 H new ATOM 0 HD3 LYS B 72 2.518 2.188 15.925 1.00 0.00 H new ATOM 0 HE2 LYS B 72 3.417 -0.007 16.408 1.00 0.00 H new ATOM 0 HE3 LYS B 72 3.828 0.407 14.755 1.00 0.00 H new ATOM 0 HZ1 LYS B 72 5.707 -0.553 15.893 1.00 0.00 H new ATOM 0 HZ2 LYS B 72 6.042 1.067 15.510 1.00 0.00 H new ATOM 0 HZ3 LYS B 72 5.641 0.636 17.102 1.00 0.00 H new ATOM 2486 N GLY B 73 7.079 3.404 12.820 1.00 0.00 N ATOM 2487 CA GLY B 73 8.429 3.798 13.187 1.00 0.00 C ATOM 2488 C GLY B 73 9.143 4.585 12.097 1.00 0.00 C ATOM 2489 O GLY B 73 9.912 5.500 12.390 1.00 0.00 O ATOM 0 H GLY B 73 7.007 2.505 12.344 1.00 0.00 H new ATOM 0 HA2 GLY B 73 8.390 4.400 14.095 1.00 0.00 H new ATOM 0 HA3 GLY B 73 9.010 2.906 13.421 1.00 0.00 H new ATOM 2493 N ASN B 74 8.877 4.238 10.845 1.00 0.00 N ATOM 2494 CA ASN B 74 9.599 4.806 9.707 1.00 0.00 C ATOM 2495 C ASN B 74 9.024 6.154 9.264 1.00 0.00 C ATOM 2496 O ASN B 74 9.651 7.193 9.475 1.00 0.00 O ATOM 2497 CB ASN B 74 9.583 3.816 8.534 1.00 0.00 C ATOM 2498 CG ASN B 74 10.249 4.356 7.277 1.00 0.00 C ATOM 2499 OD1 ASN B 74 9.603 4.980 6.439 1.00 0.00 O ATOM 2500 ND2 ASN B 74 11.539 4.101 7.132 1.00 0.00 N ATOM 0 H ASN B 74 8.160 3.560 10.587 1.00 0.00 H new ATOM 0 HA ASN B 74 10.625 4.984 10.028 1.00 0.00 H new ATOM 0 HB2 ASN B 74 10.086 2.898 8.837 1.00 0.00 H new ATOM 0 HB3 ASN B 74 8.550 3.553 8.305 1.00 0.00 H new ATOM 0 HD21 ASN B 74 12.033 4.426 6.301 1.00 0.00 H new ATOM 0 HD22 ASN B 74 12.040 3.579 7.851 1.00 0.00 H new ATOM 2507 N LEU B 75 7.836 6.137 8.664 1.00 0.00 N ATOM 2508 CA LEU B 75 7.289 7.331 8.029 1.00 0.00 C ATOM 2509 C LEU B 75 6.852 8.366 9.057 1.00 0.00 C ATOM 2510 O LEU B 75 7.388 9.474 9.096 1.00 0.00 O ATOM 2511 CB LEU B 75 6.111 6.983 7.116 1.00 0.00 C ATOM 2512 CG LEU B 75 5.533 8.178 6.351 1.00 0.00 C ATOM 2513 CD1 LEU B 75 6.584 8.792 5.445 1.00 0.00 C ATOM 2514 CD2 LEU B 75 4.319 7.772 5.539 1.00 0.00 C ATOM 0 H LEU B 75 7.237 5.313 8.605 1.00 0.00 H new ATOM 0 HA LEU B 75 8.089 7.761 7.426 1.00 0.00 H new ATOM 0 HB2 LEU B 75 6.433 6.228 6.398 1.00 0.00 H new ATOM 0 HB3 LEU B 75 5.320 6.534 7.717 1.00 0.00 H new ATOM 0 HG LEU B 75 5.222 8.922 7.084 1.00 0.00 H new ATOM 0 HD11 LEU B 75 6.154 9.639 4.911 1.00 0.00 H new ATOM 0 HD12 LEU B 75 7.428 9.132 6.045 1.00 0.00 H new ATOM 0 HD13 LEU B 75 6.926 8.046 4.727 1.00 0.00 H new ATOM 0 HD21 LEU B 75 3.930 8.640 5.007 1.00 0.00 H new ATOM 0 HD22 LEU B 75 4.602 7.003 4.820 1.00 0.00 H new ATOM 0 HD23 LEU B 75 3.550 7.380 6.205 1.00 0.00 H new ATOM 2526 N GLU B 76 5.876 8.014 9.885 1.00 0.00 N ATOM 2527 CA GLU B 76 5.378 8.942 10.883 1.00 0.00 C ATOM 2528 C GLU B 76 6.391 9.059 12.009 1.00 0.00 C ATOM 2529 O GLU B 76 6.681 10.159 12.487 1.00 0.00 O ATOM 2530 CB GLU B 76 4.029 8.481 11.432 1.00 0.00 C ATOM 2531 CG GLU B 76 3.298 9.561 12.213 1.00 0.00 C ATOM 2532 CD GLU B 76 2.047 9.051 12.896 1.00 0.00 C ATOM 2533 OE1 GLU B 76 1.271 8.313 12.260 1.00 0.00 O ATOM 2534 OE2 GLU B 76 1.833 9.397 14.077 1.00 0.00 O ATOM 0 H GLU B 76 5.420 7.102 9.883 1.00 0.00 H new ATOM 0 HA GLU B 76 5.235 9.917 10.417 1.00 0.00 H new ATOM 0 HB2 GLU B 76 3.401 8.152 10.604 1.00 0.00 H new ATOM 0 HB3 GLU B 76 4.183 7.617 12.078 1.00 0.00 H new ATOM 0 HG2 GLU B 76 3.970 9.978 12.963 1.00 0.00 H new ATOM 0 HG3 GLU B 76 3.031 10.373 11.537 1.00 0.00 H new ATOM 2541 N HIS B 77 6.931 7.903 12.402 1.00 0.00 N ATOM 2542 CA HIS B 77 7.959 7.807 13.435 1.00 0.00 C ATOM 2543 C HIS B 77 7.370 8.102 14.815 1.00 0.00 C ATOM 2544 O HIS B 77 6.655 9.086 15.002 1.00 0.00 O ATOM 2545 CB HIS B 77 9.139 8.746 13.123 1.00 0.00 C ATOM 2546 CG HIS B 77 10.301 8.608 14.058 1.00 0.00 C ATOM 2547 ND1 HIS B 77 11.313 7.687 13.882 1.00 0.00 N ATOM 2548 CD2 HIS B 77 10.611 9.289 15.184 1.00 0.00 C ATOM 2549 CE1 HIS B 77 12.191 7.807 14.861 1.00 0.00 C ATOM 2550 NE2 HIS B 77 11.786 8.772 15.664 1.00 0.00 N ATOM 0 H HIS B 77 6.663 7.001 12.008 1.00 0.00 H new ATOM 0 HA HIS B 77 8.339 6.785 13.444 1.00 0.00 H new ATOM 0 HB2 HIS B 77 9.481 8.554 12.106 1.00 0.00 H new ATOM 0 HB3 HIS B 77 8.785 9.777 13.151 1.00 0.00 H new ATOM 0 HD1 HIS B 77 11.374 7.017 13.115 1.00 0.00 H new ATOM 0 HD2 HIS B 77 10.038 10.092 15.624 1.00 0.00 H new ATOM 0 HE1 HIS B 77 13.087 7.216 14.983 1.00 0.00 H new ATOM 2559 N HIS B 78 7.655 7.220 15.774 1.00 0.00 N ATOM 2560 CA HIS B 78 7.193 7.401 17.151 1.00 0.00 C ATOM 2561 C HIS B 78 7.522 8.814 17.633 1.00 0.00 C ATOM 2562 O HIS B 78 8.652 9.285 17.486 1.00 0.00 O ATOM 2563 CB HIS B 78 7.803 6.345 18.091 1.00 0.00 C ATOM 2564 CG HIS B 78 9.289 6.458 18.284 1.00 0.00 C ATOM 2565 ND1 HIS B 78 9.853 7.106 19.359 1.00 0.00 N ATOM 2566 CD2 HIS B 78 10.321 5.998 17.539 1.00 0.00 C ATOM 2567 CE1 HIS B 78 11.167 7.044 19.269 1.00 0.00 C ATOM 2568 NE2 HIS B 78 11.477 6.378 18.174 1.00 0.00 N ATOM 0 H HIS B 78 8.203 6.373 15.623 1.00 0.00 H new ATOM 0 HA HIS B 78 6.111 7.267 17.169 1.00 0.00 H new ATOM 0 HB2 HIS B 78 7.317 6.421 19.064 1.00 0.00 H new ATOM 0 HB3 HIS B 78 7.576 5.354 17.698 1.00 0.00 H new ATOM 0 HD2 HIS B 78 10.249 5.438 16.619 1.00 0.00 H new ATOM 0 HE1 HIS B 78 11.869 7.467 19.972 1.00 0.00 H new ATOM 0 HE2 HIS B 78 12.423 6.177 17.851 1.00 0.00 H new ATOM 2577 N HIS B 79 6.530 9.481 18.189 1.00 0.00 N ATOM 2578 CA HIS B 79 6.648 10.901 18.489 1.00 0.00 C ATOM 2579 C HIS B 79 7.481 11.138 19.740 1.00 0.00 C ATOM 2580 O HIS B 79 6.990 11.031 20.863 1.00 0.00 O ATOM 2581 CB HIS B 79 5.264 11.540 18.638 1.00 0.00 C ATOM 2582 CG HIS B 79 4.449 11.508 17.380 1.00 0.00 C ATOM 2583 ND1 HIS B 79 4.276 12.607 16.568 1.00 0.00 N ATOM 2584 CD2 HIS B 79 3.749 10.502 16.800 1.00 0.00 C ATOM 2585 CE1 HIS B 79 3.508 12.279 15.543 1.00 0.00 C ATOM 2586 NE2 HIS B 79 3.176 11.009 15.663 1.00 0.00 N ATOM 0 H HIS B 79 5.633 9.067 18.443 1.00 0.00 H new ATOM 0 HA HIS B 79 7.161 11.373 17.651 1.00 0.00 H new ATOM 0 HB2 HIS B 79 4.718 11.024 19.428 1.00 0.00 H new ATOM 0 HB3 HIS B 79 5.384 12.575 18.957 1.00 0.00 H new ATOM 0 HD2 HIS B 79 3.660 9.490 17.166 1.00 0.00 H new ATOM 0 HE1 HIS B 79 3.204 12.939 14.744 1.00 0.00 H new ATOM 0 HE2 HIS B 79 2.587 10.487 15.014 1.00 0.00 H new ATOM 2595 N HIS B 80 8.754 11.444 19.535 1.00 0.00 N ATOM 2596 CA HIS B 80 9.659 11.738 20.636 1.00 0.00 C ATOM 2597 C HIS B 80 9.873 13.244 20.740 1.00 0.00 C ATOM 2598 O HIS B 80 10.385 13.733 21.745 1.00 0.00 O ATOM 2599 CB HIS B 80 10.997 11.019 20.427 1.00 0.00 C ATOM 2600 CG HIS B 80 11.915 11.077 21.613 1.00 0.00 C ATOM 2601 ND1 HIS B 80 13.152 11.683 21.582 1.00 0.00 N ATOM 2602 CD2 HIS B 80 11.775 10.581 22.864 1.00 0.00 C ATOM 2603 CE1 HIS B 80 13.729 11.558 22.764 1.00 0.00 C ATOM 2604 NE2 HIS B 80 12.913 10.896 23.560 1.00 0.00 N ATOM 0 H HIS B 80 9.185 11.495 18.612 1.00 0.00 H new ATOM 0 HA HIS B 80 9.218 11.381 21.566 1.00 0.00 H new ATOM 0 HB2 HIS B 80 10.802 9.975 20.183 1.00 0.00 H new ATOM 0 HB3 HIS B 80 11.503 11.458 19.567 1.00 0.00 H new ATOM 0 HD2 HIS B 80 10.923 10.037 23.244 1.00 0.00 H new ATOM 0 HE1 HIS B 80 14.705 11.935 23.033 1.00 0.00 H new ATOM 0 HE2 HIS B 80 13.098 10.657 24.534 1.00 0.00 H new ATOM 2613 N HIS B 81 9.460 13.953 19.682 1.00 0.00 N ATOM 2614 CA HIS B 81 9.548 15.421 19.561 1.00 0.00 C ATOM 2615 C HIS B 81 10.965 15.970 19.766 1.00 0.00 C ATOM 2616 O HIS B 81 11.879 15.268 20.204 1.00 0.00 O ATOM 2617 CB HIS B 81 8.536 16.146 20.480 1.00 0.00 C ATOM 2618 CG HIS B 81 8.864 16.174 21.948 1.00 0.00 C ATOM 2619 ND1 HIS B 81 8.280 15.326 22.864 1.00 0.00 N ATOM 2620 CD2 HIS B 81 9.693 16.974 22.662 1.00 0.00 C ATOM 2621 CE1 HIS B 81 8.733 15.601 24.070 1.00 0.00 C ATOM 2622 NE2 HIS B 81 9.592 16.596 23.977 1.00 0.00 N ATOM 0 H HIS B 81 9.043 13.513 18.862 1.00 0.00 H new ATOM 0 HA HIS B 81 9.279 15.636 18.527 1.00 0.00 H new ATOM 0 HB2 HIS B 81 8.436 17.174 20.133 1.00 0.00 H new ATOM 0 HB3 HIS B 81 7.562 15.672 20.357 1.00 0.00 H new ATOM 0 HD2 HIS B 81 10.317 17.763 22.269 1.00 0.00 H new ATOM 0 HE1 HIS B 81 8.448 15.096 24.981 1.00 0.00 H new ATOM 0 HE2 HIS B 81 10.099 17.017 24.756 1.00 0.00 H new ATOM 2631 N HIS B 82 11.144 17.234 19.419 1.00 0.00 N ATOM 2632 CA HIS B 82 12.421 17.906 19.592 1.00 0.00 C ATOM 2633 C HIS B 82 12.201 19.404 19.740 1.00 0.00 C ATOM 2634 O HIS B 82 12.395 19.922 20.853 1.00 0.00 O ATOM 2635 CB HIS B 82 13.389 17.600 18.433 1.00 0.00 C ATOM 2636 CG HIS B 82 12.875 17.948 17.068 1.00 0.00 C ATOM 2637 ND1 HIS B 82 13.171 19.134 16.434 1.00 0.00 N ATOM 2638 CD2 HIS B 82 12.091 17.253 16.210 1.00 0.00 C ATOM 2639 CE1 HIS B 82 12.595 19.155 15.252 1.00 0.00 C ATOM 2640 NE2 HIS B 82 11.934 18.026 15.088 1.00 0.00 N ATOM 2641 OXT HIS B 82 11.786 20.052 18.761 1.00 0.00 O ATOM 0 H HIS B 82 10.414 17.819 19.013 1.00 0.00 H new ATOM 0 HA HIS B 82 12.885 17.525 20.502 1.00 0.00 H new ATOM 0 HB2 HIS B 82 14.319 18.143 18.604 1.00 0.00 H new ATOM 0 HB3 HIS B 82 13.632 16.538 18.453 1.00 0.00 H new ATOM 0 HD2 HIS B 82 11.668 16.273 16.378 1.00 0.00 H new ATOM 0 HE1 HIS B 82 12.654 19.961 14.536 1.00 0.00 H new ATOM 0 HE2 HIS B 82 11.394 17.769 14.262 1.00 0.00 H new TER 2650 HIS B 82