USER MOD reduce.3.24.130724 H: found=0, std=0, add=1298, rem=0, adj=48 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 78 HIS : no HE2:sc= 0.513 K(o=2,f=-4.8!) USER MOD Set 1.2: B 65 GLN : amide:sc= 1.49 K(o=2,f=-3.4) USER MOD Set 2.1: A 21 ASN :FLIP amide:sc= -0.375 F(o=0.16!,f=1.2) USER MOD Set 2.2: A 27 LYS NZ :NH3+ -168:sc= 1.6 (180deg=1.23) USER MOD Single : A 1 MET CE :methyl 164:sc= -0.0739 (180deg=-0.429) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 168:sc=-0.00292 (180deg=-0.112) USER MOD Single : A 3 LYS NZ :NH3+ -162:sc= -0.113 (180deg=-0.455) USER MOD Single : A 4 MET CE :methyl 165:sc= -0.0633 (180deg=-0.417) USER MOD Single : A 8 THR OG1 : rot 180:sc= -0.0357 USER MOD Single : A 14 HIS : no HE2:sc= 0.949 K(o=0.95,f=-6.2!) USER MOD Single : A 17 THR OG1 : rot -64:sc= 0.37 USER MOD Single : A 19 SER OG : rot 111:sc= 0.398 USER MOD Single : A 23 LYS NZ :NH3+ 163:sc= 1.15 (180deg=0.645) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 ASN : amide:sc= -2.91! C(o=-2.9!,f=-6.6!) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= -3.11! C(o=-3.1!,f=-8.5!) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 SER OG : rot 85:sc= 1.93 USER MOD Single : A 50 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ -144:sc= -1.15 (180deg=-3.17!) USER MOD Single : A 53 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00131) USER MOD Single : A 58 THR OG1 : rot -50:sc= 1.27 USER MOD Single : A 60 SER OG : rot 75:sc= 1.08 USER MOD Single : A 61 ASN : amide:sc=-0.00192 X(o=-0.0019,f=0.0094) USER MOD Single : A 65 GLN : amide:sc= 0.833 K(o=0.83,f=-1) USER MOD Single : A 66 THR OG1 : rot 63:sc= 1.28 USER MOD Single : A 67 MET CE :methyl -165:sc= -0.0177 (180deg=-0.486) USER MOD Single : A 72 LYS NZ :NH3+ -167:sc= 1.15 (180deg=0.913) USER MOD Single : A 74 ASN :FLIP amide:sc= 0 F(o=-0.51,f=0) USER MOD Single : A 77 HIS :FLIP no HD1:sc= 0 F(o=-0.95,f=0) USER MOD Single : A 79 HIS : no HD1:sc=-0.00516 X(o=-0.0052,f=-0.05) USER MOD Single : A 80 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 81 HIS : no HD1:sc= -0.0105 X(o=-0.011,f=-0.057) USER MOD Single : A 82 HIS : no HD1:sc= -0.019 X(o=-0.019,f=0) USER MOD Single : B 1 MET CE :methyl -164:sc= -0.103 (180deg=-0.497) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 LYS NZ :NH3+ 168:sc=-0.00211 (180deg=-0.105) USER MOD Single : B 3 LYS NZ :NH3+ -166:sc=-0.00316 (180deg=-0.187) USER MOD Single : B 4 MET CE :methyl 155:sc= 0 (180deg=-0.0731) USER MOD Single : B 8 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 HIS : no HE2:sc= -0.0248 K(o=-0.025,f=-4.7!) USER MOD Single : B 17 THR OG1 : rot -28:sc= 1.22 USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD Single : B 21 ASN : amide:sc= 0.58 K(o=0.58,f=-4.2!) USER MOD Single : B 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 THR OG1 : rot 180:sc= 0 USER MOD Single : B 27 LYS NZ :NH3+ -170:sc= 1.84 (180deg=1.41) USER MOD Single : B 30 ASN :FLIP amide:sc= -3.59! C(o=-4.4!,f=-3.6!) USER MOD Single : B 33 SER OG : rot -107:sc= 1.25 USER MOD Single : B 35 ASN : amide:sc= 0.843 K(o=0.84,f=-7.7!) USER MOD Single : B 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 47 SER OG : rot -100:sc= 0.078 USER MOD Single : B 50 HIS : no HD1:sc= -0.011 X(o=-0.011,f=0) USER MOD Single : B 51 THR OG1 : rot 180:sc= 0.0335 USER MOD Single : B 52 LYS NZ :NH3+ 156:sc= 1.72 (180deg=0.907) USER MOD Single : B 53 MET CE :methyl 161:sc= -0.176 (180deg=-0.707) USER MOD Single : B 55 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.0101) USER MOD Single : B 58 THR OG1 : rot -43:sc= 1.25 USER MOD Single : B 60 SER OG : rot 85:sc= 1.22 USER MOD Single : B 61 ASN : amide:sc= 0.318 K(o=0.32,f=-8.4!) USER MOD Single : B 66 THR OG1 : rot 88:sc= 1.22 USER MOD Single : B 67 MET CE :methyl 164:sc= -0.0126 (180deg=-0.889) USER MOD Single : B 72 LYS NZ :NH3+ -170:sc= 1.18 (180deg=0.923) USER MOD Single : B 74 ASN : amide:sc= 0 K(o=0,f=-0.68) USER MOD Single : B 77 HIS : no HD1:sc= -0.477 X(o=-0.48,f=-0.15) USER MOD Single : B 78 HIS : no HD1:sc=-0.00717 X(o=-0.0072,f=0) USER MOD Single : B 79 HIS : no HD1:sc= -0.688 X(o=-0.69,f=-0.21) USER MOD Single : B 80 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 81 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 82 HIS :FLIP no HE2:sc= 0.00337 F(o=-0.79,f=0.0034) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 16.945 2.064 -22.378 1.00 0.00 N ATOM 2 CA MET A 1 17.932 3.005 -21.807 1.00 0.00 C ATOM 3 C MET A 1 18.623 3.794 -22.912 1.00 0.00 C ATOM 4 O MET A 1 19.444 3.256 -23.658 1.00 0.00 O ATOM 5 CB MET A 1 18.973 2.246 -20.983 1.00 0.00 C ATOM 6 CG MET A 1 20.096 3.126 -20.450 1.00 0.00 C ATOM 7 SD MET A 1 19.509 4.454 -19.379 1.00 0.00 S ATOM 8 CE MET A 1 18.775 3.518 -18.038 1.00 0.00 C ATOM 0 H1 MET A 1 16.485 1.535 -21.610 1.00 0.00 H new ATOM 0 H2 MET A 1 16.227 2.595 -22.912 1.00 0.00 H new ATOM 0 H3 MET A 1 17.428 1.399 -23.015 1.00 0.00 H new ATOM 0 HA MET A 1 17.403 3.702 -21.158 1.00 0.00 H new ATOM 0 HB2 MET A 1 18.475 1.761 -20.144 1.00 0.00 H new ATOM 0 HB3 MET A 1 19.404 1.456 -21.598 1.00 0.00 H new ATOM 0 HG2 MET A 1 20.803 2.507 -19.897 1.00 0.00 H new ATOM 0 HG3 MET A 1 20.640 3.558 -21.290 1.00 0.00 H new ATOM 0 HE1 MET A 1 18.626 4.170 -17.178 1.00 0.00 H new ATOM 0 HE2 MET A 1 17.814 3.116 -18.358 1.00 0.00 H new ATOM 0 HE3 MET A 1 19.438 2.698 -17.761 1.00 0.00 H new ATOM 20 N LYS A 2 18.278 5.067 -23.021 1.00 0.00 N ATOM 21 CA LYS A 2 18.900 5.948 -24.000 1.00 0.00 C ATOM 22 C LYS A 2 18.852 7.387 -23.502 1.00 0.00 C ATOM 23 O LYS A 2 17.885 7.791 -22.858 1.00 0.00 O ATOM 24 CB LYS A 2 18.180 5.831 -25.350 1.00 0.00 C ATOM 25 CG LYS A 2 18.905 6.508 -26.501 1.00 0.00 C ATOM 26 CD LYS A 2 20.255 5.863 -26.751 1.00 0.00 C ATOM 27 CE LYS A 2 20.113 4.450 -27.302 1.00 0.00 C ATOM 28 NZ LYS A 2 19.570 4.442 -28.685 1.00 0.00 N ATOM 0 H LYS A 2 17.568 5.516 -22.442 1.00 0.00 H new ATOM 0 HA LYS A 2 19.941 5.653 -24.134 1.00 0.00 H new ATOM 0 HB2 LYS A 2 18.048 4.776 -25.589 1.00 0.00 H new ATOM 0 HB3 LYS A 2 17.184 6.264 -25.257 1.00 0.00 H new ATOM 0 HG2 LYS A 2 18.297 6.448 -27.404 1.00 0.00 H new ATOM 0 HG3 LYS A 2 19.040 7.566 -26.278 1.00 0.00 H new ATOM 0 HD2 LYS A 2 20.824 6.472 -27.454 1.00 0.00 H new ATOM 0 HD3 LYS A 2 20.822 5.835 -25.821 1.00 0.00 H new ATOM 0 HE2 LYS A 2 21.086 3.958 -27.292 1.00 0.00 H new ATOM 0 HE3 LYS A 2 19.456 3.872 -26.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 19.678 3.492 -29.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 18.562 4.697 -28.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 20.089 5.131 -29.266 1.00 0.00 H new ATOM 42 N LYS A 3 19.898 8.158 -23.777 1.00 0.00 N ATOM 43 CA LYS A 3 19.907 9.561 -23.392 1.00 0.00 C ATOM 44 C LYS A 3 19.040 10.370 -24.343 1.00 0.00 C ATOM 45 O LYS A 3 19.509 10.935 -25.333 1.00 0.00 O ATOM 46 CB LYS A 3 21.328 10.120 -23.326 1.00 0.00 C ATOM 47 CG LYS A 3 21.389 11.548 -22.797 1.00 0.00 C ATOM 48 CD LYS A 3 22.741 11.868 -22.179 1.00 0.00 C ATOM 49 CE LYS A 3 22.986 11.058 -20.914 1.00 0.00 C ATOM 50 NZ LYS A 3 21.921 11.280 -19.894 1.00 0.00 N ATOM 0 H LYS A 3 20.739 7.840 -24.258 1.00 0.00 H new ATOM 0 HA LYS A 3 19.489 9.640 -22.389 1.00 0.00 H new ATOM 0 HB2 LYS A 3 21.935 9.477 -22.688 1.00 0.00 H new ATOM 0 HB3 LYS A 3 21.770 10.089 -24.322 1.00 0.00 H new ATOM 0 HG2 LYS A 3 21.188 12.245 -23.610 1.00 0.00 H new ATOM 0 HG3 LYS A 3 20.606 11.693 -22.052 1.00 0.00 H new ATOM 0 HD2 LYS A 3 23.530 11.662 -22.902 1.00 0.00 H new ATOM 0 HD3 LYS A 3 22.792 12.932 -21.946 1.00 0.00 H new ATOM 0 HE2 LYS A 3 23.032 9.998 -21.165 1.00 0.00 H new ATOM 0 HE3 LYS A 3 23.954 11.328 -20.492 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 22.263 10.971 -18.962 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 21.682 12.291 -19.857 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 21.075 10.733 -20.151 1.00 0.00 H new ATOM 64 N MET A 4 17.765 10.372 -24.033 1.00 0.00 N ATOM 65 CA MET A 4 16.751 11.051 -24.810 1.00 0.00 C ATOM 66 C MET A 4 15.660 11.472 -23.832 1.00 0.00 C ATOM 67 O MET A 4 15.865 11.363 -22.622 1.00 0.00 O ATOM 68 CB MET A 4 16.214 10.082 -25.879 1.00 0.00 C ATOM 69 CG MET A 4 15.461 10.741 -27.022 1.00 0.00 C ATOM 70 SD MET A 4 15.021 9.575 -28.326 1.00 0.00 S ATOM 71 CE MET A 4 13.956 8.441 -27.436 1.00 0.00 C ATOM 0 H MET A 4 17.394 9.890 -23.214 1.00 0.00 H new ATOM 0 HA MET A 4 17.139 11.929 -25.327 1.00 0.00 H new ATOM 0 HB2 MET A 4 17.052 9.520 -26.292 1.00 0.00 H new ATOM 0 HB3 MET A 4 15.554 9.362 -25.396 1.00 0.00 H new ATOM 0 HG2 MET A 4 14.555 11.206 -26.635 1.00 0.00 H new ATOM 0 HG3 MET A 4 16.073 11.538 -27.444 1.00 0.00 H new ATOM 0 HE1 MET A 4 13.399 7.831 -28.147 1.00 0.00 H new ATOM 0 HE2 MET A 4 14.562 7.795 -26.801 1.00 0.00 H new ATOM 0 HE3 MET A 4 13.258 9.006 -26.818 1.00 0.00 H new ATOM 81 N ALA A 5 14.532 11.970 -24.317 1.00 0.00 N ATOM 82 CA ALA A 5 13.388 12.199 -23.448 1.00 0.00 C ATOM 83 C ALA A 5 12.879 10.864 -22.907 1.00 0.00 C ATOM 84 O ALA A 5 12.028 10.215 -23.516 1.00 0.00 O ATOM 85 CB ALA A 5 12.282 12.940 -24.187 1.00 0.00 C ATOM 0 H ALA A 5 14.385 12.220 -25.295 1.00 0.00 H new ATOM 0 HA ALA A 5 13.701 12.824 -22.612 1.00 0.00 H new ATOM 0 HB1 ALA A 5 11.438 13.099 -23.515 1.00 0.00 H new ATOM 0 HB2 ALA A 5 12.657 13.903 -24.532 1.00 0.00 H new ATOM 0 HB3 ALA A 5 11.958 12.349 -25.044 1.00 0.00 H new ATOM 91 N GLU A 6 13.446 10.445 -21.785 1.00 0.00 N ATOM 92 CA GLU A 6 13.152 9.148 -21.205 1.00 0.00 C ATOM 93 C GLU A 6 13.056 9.277 -19.691 1.00 0.00 C ATOM 94 O GLU A 6 13.910 9.900 -19.058 1.00 0.00 O ATOM 95 CB GLU A 6 14.249 8.154 -21.610 1.00 0.00 C ATOM 96 CG GLU A 6 13.962 6.709 -21.238 1.00 0.00 C ATOM 97 CD GLU A 6 14.800 5.732 -22.045 1.00 0.00 C ATOM 98 OE1 GLU A 6 14.428 5.456 -23.208 1.00 0.00 O ATOM 99 OE2 GLU A 6 15.826 5.241 -21.533 1.00 0.00 O ATOM 0 H GLU A 6 14.121 10.995 -21.254 1.00 0.00 H new ATOM 0 HA GLU A 6 12.196 8.778 -21.575 1.00 0.00 H new ATOM 0 HB2 GLU A 6 14.397 8.215 -22.688 1.00 0.00 H new ATOM 0 HB3 GLU A 6 15.186 8.457 -21.142 1.00 0.00 H new ATOM 0 HG2 GLU A 6 14.159 6.563 -20.176 1.00 0.00 H new ATOM 0 HG3 GLU A 6 12.905 6.497 -21.398 1.00 0.00 H new ATOM 106 N PHE A 7 12.003 8.716 -19.118 1.00 0.00 N ATOM 107 CA PHE A 7 11.747 8.855 -17.693 1.00 0.00 C ATOM 108 C PHE A 7 12.561 7.846 -16.901 1.00 0.00 C ATOM 109 O PHE A 7 12.205 6.670 -16.817 1.00 0.00 O ATOM 110 CB PHE A 7 10.259 8.676 -17.388 1.00 0.00 C ATOM 111 CG PHE A 7 9.367 9.567 -18.202 1.00 0.00 C ATOM 112 CD1 PHE A 7 9.551 10.940 -18.197 1.00 0.00 C ATOM 113 CD2 PHE A 7 8.345 9.033 -18.971 1.00 0.00 C ATOM 114 CE1 PHE A 7 8.735 11.762 -18.946 1.00 0.00 C ATOM 115 CE2 PHE A 7 7.526 9.852 -19.721 1.00 0.00 C ATOM 116 CZ PHE A 7 7.722 11.218 -19.709 1.00 0.00 C ATOM 0 H PHE A 7 11.311 8.159 -19.619 1.00 0.00 H new ATOM 0 HA PHE A 7 12.046 9.860 -17.396 1.00 0.00 H new ATOM 0 HB2 PHE A 7 9.982 7.637 -17.568 1.00 0.00 H new ATOM 0 HB3 PHE A 7 10.087 8.873 -16.330 1.00 0.00 H new ATOM 0 HD1 PHE A 7 10.341 11.371 -17.601 1.00 0.00 H new ATOM 0 HD2 PHE A 7 8.188 7.965 -18.983 1.00 0.00 H new ATOM 0 HE1 PHE A 7 8.889 12.831 -18.935 1.00 0.00 H new ATOM 0 HE2 PHE A 7 6.733 9.425 -20.316 1.00 0.00 H new ATOM 0 HZ PHE A 7 7.083 11.861 -20.296 1.00 0.00 H new ATOM 126 N THR A 8 13.661 8.307 -16.334 1.00 0.00 N ATOM 127 CA THR A 8 14.512 7.457 -15.528 1.00 0.00 C ATOM 128 C THR A 8 13.941 7.303 -14.123 1.00 0.00 C ATOM 129 O THR A 8 13.788 8.282 -13.391 1.00 0.00 O ATOM 130 CB THR A 8 15.944 8.026 -15.446 1.00 0.00 C ATOM 131 OG1 THR A 8 15.909 9.403 -15.032 1.00 0.00 O ATOM 132 CG2 THR A 8 16.649 7.913 -16.790 1.00 0.00 C ATOM 0 H THR A 8 13.985 9.270 -16.419 1.00 0.00 H new ATOM 0 HA THR A 8 14.551 6.479 -16.007 1.00 0.00 H new ATOM 0 HB THR A 8 16.499 7.443 -14.711 1.00 0.00 H new ATOM 0 HG1 THR A 8 16.823 9.753 -14.982 1.00 0.00 H new ATOM 0 HG21 THR A 8 17.657 8.320 -16.708 1.00 0.00 H new ATOM 0 HG22 THR A 8 16.704 6.865 -17.085 1.00 0.00 H new ATOM 0 HG23 THR A 8 16.092 8.472 -17.541 1.00 0.00 H new ATOM 140 N PHE A 9 13.612 6.079 -13.755 1.00 0.00 N ATOM 141 CA PHE A 9 13.140 5.801 -12.413 1.00 0.00 C ATOM 142 C PHE A 9 14.241 5.130 -11.608 1.00 0.00 C ATOM 143 O PHE A 9 14.849 4.157 -12.052 1.00 0.00 O ATOM 144 CB PHE A 9 11.858 4.951 -12.430 1.00 0.00 C ATOM 145 CG PHE A 9 11.908 3.742 -13.330 1.00 0.00 C ATOM 146 CD1 PHE A 9 11.544 3.843 -14.663 1.00 0.00 C ATOM 147 CD2 PHE A 9 12.306 2.508 -12.840 1.00 0.00 C ATOM 148 CE1 PHE A 9 11.580 2.738 -15.491 1.00 0.00 C ATOM 149 CE2 PHE A 9 12.343 1.399 -13.664 1.00 0.00 C ATOM 150 CZ PHE A 9 11.982 1.514 -14.991 1.00 0.00 C ATOM 0 H PHE A 9 13.663 5.263 -14.365 1.00 0.00 H new ATOM 0 HA PHE A 9 12.885 6.746 -11.933 1.00 0.00 H new ATOM 0 HB2 PHE A 9 11.646 4.620 -11.413 1.00 0.00 H new ATOM 0 HB3 PHE A 9 11.025 5.582 -12.740 1.00 0.00 H new ATOM 0 HD1 PHE A 9 11.228 4.797 -15.059 1.00 0.00 H new ATOM 0 HD2 PHE A 9 12.590 2.412 -11.803 1.00 0.00 H new ATOM 0 HE1 PHE A 9 11.294 2.831 -16.528 1.00 0.00 H new ATOM 0 HE2 PHE A 9 12.654 0.443 -13.270 1.00 0.00 H new ATOM 0 HZ PHE A 9 12.014 0.649 -15.637 1.00 0.00 H new ATOM 160 N GLU A 10 14.520 5.681 -10.443 1.00 0.00 N ATOM 161 CA GLU A 10 15.588 5.174 -9.595 1.00 0.00 C ATOM 162 C GLU A 10 15.117 5.136 -8.147 1.00 0.00 C ATOM 163 O GLU A 10 14.318 5.976 -7.731 1.00 0.00 O ATOM 164 CB GLU A 10 16.822 6.070 -9.730 1.00 0.00 C ATOM 165 CG GLU A 10 18.109 5.437 -9.230 1.00 0.00 C ATOM 166 CD GLU A 10 19.285 6.385 -9.316 1.00 0.00 C ATOM 167 OE1 GLU A 10 19.571 6.891 -10.425 1.00 0.00 O ATOM 168 OE2 GLU A 10 19.930 6.633 -8.278 1.00 0.00 O ATOM 0 H GLU A 10 14.021 6.483 -10.058 1.00 0.00 H new ATOM 0 HA GLU A 10 15.852 4.163 -9.906 1.00 0.00 H new ATOM 0 HB2 GLU A 10 16.947 6.341 -10.778 1.00 0.00 H new ATOM 0 HB3 GLU A 10 16.648 6.995 -9.180 1.00 0.00 H new ATOM 0 HG2 GLU A 10 17.977 5.118 -8.196 1.00 0.00 H new ATOM 0 HG3 GLU A 10 18.323 4.542 -9.815 1.00 0.00 H new ATOM 175 N ILE A 11 15.595 4.164 -7.385 1.00 0.00 N ATOM 176 CA ILE A 11 15.206 4.049 -5.990 1.00 0.00 C ATOM 177 C ILE A 11 15.964 5.062 -5.145 1.00 0.00 C ATOM 178 O ILE A 11 17.194 5.031 -5.067 1.00 0.00 O ATOM 179 CB ILE A 11 15.452 2.631 -5.433 1.00 0.00 C ATOM 180 CG1 ILE A 11 14.726 1.589 -6.292 1.00 0.00 C ATOM 181 CG2 ILE A 11 14.986 2.544 -3.983 1.00 0.00 C ATOM 182 CD1 ILE A 11 15.000 0.160 -5.875 1.00 0.00 C ATOM 0 H ILE A 11 16.248 3.449 -7.707 1.00 0.00 H new ATOM 0 HA ILE A 11 14.136 4.250 -5.939 1.00 0.00 H new ATOM 0 HB ILE A 11 16.522 2.423 -5.466 1.00 0.00 H new ATOM 0 HG12 ILE A 11 13.653 1.774 -6.242 1.00 0.00 H new ATOM 0 HG13 ILE A 11 15.023 1.718 -7.333 1.00 0.00 H new ATOM 0 HG21 ILE A 11 15.165 1.538 -3.603 1.00 0.00 H new ATOM 0 HG22 ILE A 11 15.539 3.264 -3.379 1.00 0.00 H new ATOM 0 HG23 ILE A 11 13.920 2.767 -3.929 1.00 0.00 H new ATOM 0 HD11 ILE A 11 14.453 -0.521 -6.527 1.00 0.00 H new ATOM 0 HD12 ILE A 11 16.068 -0.043 -5.952 1.00 0.00 H new ATOM 0 HD13 ILE A 11 14.676 0.013 -4.845 1.00 0.00 H new ATOM 194 N GLU A 12 15.227 5.972 -4.535 1.00 0.00 N ATOM 195 CA GLU A 12 15.815 6.993 -3.687 1.00 0.00 C ATOM 196 C GLU A 12 16.034 6.463 -2.284 1.00 0.00 C ATOM 197 O GLU A 12 17.099 6.654 -1.697 1.00 0.00 O ATOM 198 CB GLU A 12 14.915 8.225 -3.651 1.00 0.00 C ATOM 199 CG GLU A 12 15.209 9.213 -4.759 1.00 0.00 C ATOM 200 CD GLU A 12 16.273 10.217 -4.369 1.00 0.00 C ATOM 201 OE1 GLU A 12 17.298 9.812 -3.788 1.00 0.00 O ATOM 202 OE2 GLU A 12 16.078 11.423 -4.635 1.00 0.00 O ATOM 0 H GLU A 12 14.211 6.025 -4.612 1.00 0.00 H new ATOM 0 HA GLU A 12 16.783 7.273 -4.103 1.00 0.00 H new ATOM 0 HB2 GLU A 12 13.874 7.909 -3.722 1.00 0.00 H new ATOM 0 HB3 GLU A 12 15.031 8.723 -2.689 1.00 0.00 H new ATOM 0 HG2 GLU A 12 15.532 8.672 -5.648 1.00 0.00 H new ATOM 0 HG3 GLU A 12 14.293 9.742 -5.023 1.00 0.00 H new ATOM 209 N GLU A 13 15.035 5.777 -1.759 1.00 0.00 N ATOM 210 CA GLU A 13 15.091 5.304 -0.388 1.00 0.00 C ATOM 211 C GLU A 13 14.191 4.089 -0.195 1.00 0.00 C ATOM 212 O GLU A 13 13.011 4.117 -0.555 1.00 0.00 O ATOM 213 CB GLU A 13 14.668 6.436 0.553 1.00 0.00 C ATOM 214 CG GLU A 13 14.909 6.156 2.025 1.00 0.00 C ATOM 215 CD GLU A 13 14.557 7.344 2.895 1.00 0.00 C ATOM 216 OE1 GLU A 13 15.359 8.299 2.960 1.00 0.00 O ATOM 217 OE2 GLU A 13 13.478 7.332 3.516 1.00 0.00 O ATOM 0 H GLU A 13 14.179 5.536 -2.258 1.00 0.00 H new ATOM 0 HA GLU A 13 16.113 5.002 -0.158 1.00 0.00 H new ATOM 0 HB2 GLU A 13 15.207 7.342 0.276 1.00 0.00 H new ATOM 0 HB3 GLU A 13 13.607 6.638 0.404 1.00 0.00 H new ATOM 0 HG2 GLU A 13 14.316 5.294 2.332 1.00 0.00 H new ATOM 0 HG3 GLU A 13 15.956 5.893 2.177 1.00 0.00 H new ATOM 224 N HIS A 14 14.757 3.017 0.345 1.00 0.00 N ATOM 225 CA HIS A 14 13.976 1.840 0.708 1.00 0.00 C ATOM 226 C HIS A 14 13.266 2.096 2.029 1.00 0.00 C ATOM 227 O HIS A 14 13.913 2.293 3.058 1.00 0.00 O ATOM 228 CB HIS A 14 14.862 0.592 0.832 1.00 0.00 C ATOM 229 CG HIS A 14 15.460 0.120 -0.462 1.00 0.00 C ATOM 230 ND1 HIS A 14 14.999 -0.980 -1.154 1.00 0.00 N ATOM 231 CD2 HIS A 14 16.511 0.588 -1.177 1.00 0.00 C ATOM 232 CE1 HIS A 14 15.735 -1.164 -2.231 1.00 0.00 C ATOM 233 NE2 HIS A 14 16.662 -0.228 -2.270 1.00 0.00 N ATOM 0 H HIS A 14 15.755 2.938 0.542 1.00 0.00 H new ATOM 0 HA HIS A 14 13.247 1.657 -0.082 1.00 0.00 H new ATOM 0 HB2 HIS A 14 15.668 0.803 1.534 1.00 0.00 H new ATOM 0 HB3 HIS A 14 14.270 -0.217 1.260 1.00 0.00 H new ATOM 0 HD1 HIS A 14 14.209 -1.562 -0.875 1.00 0.00 H new ATOM 0 HD2 HIS A 14 17.119 1.446 -0.932 1.00 0.00 H new ATOM 0 HE1 HIS A 14 15.601 -1.950 -2.960 1.00 0.00 H new ATOM 242 N LEU A 15 11.945 2.113 1.997 1.00 0.00 N ATOM 243 CA LEU A 15 11.165 2.413 3.189 1.00 0.00 C ATOM 244 C LEU A 15 10.869 1.151 3.982 1.00 0.00 C ATOM 245 O LEU A 15 11.149 1.081 5.178 1.00 0.00 O ATOM 246 CB LEU A 15 9.851 3.098 2.811 1.00 0.00 C ATOM 247 CG LEU A 15 9.997 4.467 2.150 1.00 0.00 C ATOM 248 CD1 LEU A 15 8.636 4.987 1.729 1.00 0.00 C ATOM 249 CD2 LEU A 15 10.674 5.446 3.095 1.00 0.00 C ATOM 0 H LEU A 15 11.390 1.924 1.163 1.00 0.00 H new ATOM 0 HA LEU A 15 11.757 3.085 3.810 1.00 0.00 H new ATOM 0 HB2 LEU A 15 9.300 2.443 2.136 1.00 0.00 H new ATOM 0 HB3 LEU A 15 9.246 3.210 3.711 1.00 0.00 H new ATOM 0 HG LEU A 15 10.622 4.364 1.263 1.00 0.00 H new ATOM 0 HD11 LEU A 15 8.749 5.964 1.259 1.00 0.00 H new ATOM 0 HD12 LEU A 15 8.185 4.293 1.020 1.00 0.00 H new ATOM 0 HD13 LEU A 15 7.994 5.079 2.605 1.00 0.00 H new ATOM 0 HD21 LEU A 15 10.769 6.416 2.607 1.00 0.00 H new ATOM 0 HD22 LEU A 15 10.075 5.552 3.999 1.00 0.00 H new ATOM 0 HD23 LEU A 15 11.664 5.073 3.357 1.00 0.00 H new ATOM 261 N LEU A 16 10.305 0.159 3.315 1.00 0.00 N ATOM 262 CA LEU A 16 9.873 -1.049 3.996 1.00 0.00 C ATOM 263 C LEU A 16 9.855 -2.234 3.043 1.00 0.00 C ATOM 264 O LEU A 16 9.055 -2.279 2.110 1.00 0.00 O ATOM 265 CB LEU A 16 8.471 -0.837 4.570 1.00 0.00 C ATOM 266 CG LEU A 16 8.224 -1.407 5.970 1.00 0.00 C ATOM 267 CD1 LEU A 16 6.777 -1.193 6.354 1.00 0.00 C ATOM 268 CD2 LEU A 16 8.568 -2.885 6.045 1.00 0.00 C ATOM 0 H LEU A 16 10.136 0.165 2.309 1.00 0.00 H new ATOM 0 HA LEU A 16 10.577 -1.262 4.800 1.00 0.00 H new ATOM 0 HB2 LEU A 16 8.268 0.234 4.595 1.00 0.00 H new ATOM 0 HB3 LEU A 16 7.749 -1.282 3.886 1.00 0.00 H new ATOM 0 HG LEU A 16 8.875 -0.882 6.669 1.00 0.00 H new ATOM 0 HD11 LEU A 16 6.601 -1.599 7.350 1.00 0.00 H new ATOM 0 HD12 LEU A 16 6.554 -0.126 6.352 1.00 0.00 H new ATOM 0 HD13 LEU A 16 6.131 -1.700 5.637 1.00 0.00 H new ATOM 0 HD21 LEU A 16 8.379 -3.252 7.054 1.00 0.00 H new ATOM 0 HD22 LEU A 16 7.952 -3.438 5.336 1.00 0.00 H new ATOM 0 HD23 LEU A 16 9.620 -3.027 5.799 1.00 0.00 H new ATOM 280 N THR A 17 10.733 -3.187 3.279 1.00 0.00 N ATOM 281 CA THR A 17 10.719 -4.432 2.536 1.00 0.00 C ATOM 282 C THR A 17 9.801 -5.416 3.258 1.00 0.00 C ATOM 283 O THR A 17 10.142 -5.928 4.325 1.00 0.00 O ATOM 284 CB THR A 17 12.138 -5.026 2.391 1.00 0.00 C ATOM 285 OG1 THR A 17 13.035 -4.040 1.845 1.00 0.00 O ATOM 286 CG2 THR A 17 12.121 -6.255 1.490 1.00 0.00 C ATOM 0 H THR A 17 11.469 -3.123 3.983 1.00 0.00 H new ATOM 0 HA THR A 17 10.350 -4.240 1.529 1.00 0.00 H new ATOM 0 HB THR A 17 12.485 -5.323 3.381 1.00 0.00 H new ATOM 0 HG1 THR A 17 12.754 -3.811 0.934 1.00 0.00 H new ATOM 0 HG21 THR A 17 13.131 -6.656 1.403 1.00 0.00 H new ATOM 0 HG22 THR A 17 11.466 -7.012 1.920 1.00 0.00 H new ATOM 0 HG23 THR A 17 11.754 -5.977 0.502 1.00 0.00 H new ATOM 294 N LEU A 18 8.629 -5.654 2.684 1.00 0.00 N ATOM 295 CA LEU A 18 7.574 -6.393 3.369 1.00 0.00 C ATOM 296 C LEU A 18 7.878 -7.883 3.448 1.00 0.00 C ATOM 297 O LEU A 18 8.116 -8.417 4.537 1.00 0.00 O ATOM 298 CB LEU A 18 6.233 -6.170 2.665 1.00 0.00 C ATOM 299 CG LEU A 18 5.773 -4.711 2.595 1.00 0.00 C ATOM 300 CD1 LEU A 18 4.481 -4.603 1.805 1.00 0.00 C ATOM 301 CD2 LEU A 18 5.588 -4.145 3.995 1.00 0.00 C ATOM 0 H LEU A 18 8.384 -5.346 1.743 1.00 0.00 H new ATOM 0 HA LEU A 18 7.520 -6.014 4.389 1.00 0.00 H new ATOM 0 HB2 LEU A 18 6.303 -6.562 1.650 1.00 0.00 H new ATOM 0 HB3 LEU A 18 5.468 -6.752 3.180 1.00 0.00 H new ATOM 0 HG LEU A 18 6.541 -4.129 2.086 1.00 0.00 H new ATOM 0 HD11 LEU A 18 4.166 -3.560 1.764 1.00 0.00 H new ATOM 0 HD12 LEU A 18 4.641 -4.974 0.793 1.00 0.00 H new ATOM 0 HD13 LEU A 18 3.707 -5.197 2.291 1.00 0.00 H new ATOM 0 HD21 LEU A 18 5.261 -3.107 3.928 1.00 0.00 H new ATOM 0 HD22 LEU A 18 4.837 -4.729 4.527 1.00 0.00 H new ATOM 0 HD23 LEU A 18 6.534 -4.193 4.535 1.00 0.00 H new ATOM 313 N SER A 19 7.882 -8.551 2.300 1.00 0.00 N ATOM 314 CA SER A 19 8.007 -10.004 2.270 1.00 0.00 C ATOM 315 C SER A 19 8.258 -10.511 0.853 1.00 0.00 C ATOM 316 O SER A 19 8.201 -9.745 -0.108 1.00 0.00 O ATOM 317 CB SER A 19 6.733 -10.635 2.842 1.00 0.00 C ATOM 318 OG SER A 19 5.590 -9.886 2.457 1.00 0.00 O ATOM 0 H SER A 19 7.801 -8.113 1.382 1.00 0.00 H new ATOM 0 HA SER A 19 8.864 -10.291 2.879 1.00 0.00 H new ATOM 0 HB2 SER A 19 6.638 -11.662 2.488 1.00 0.00 H new ATOM 0 HB3 SER A 19 6.798 -10.677 3.929 1.00 0.00 H new ATOM 0 HG SER A 19 5.052 -10.410 1.827 1.00 0.00 H new ATOM 324 N GLU A 20 8.545 -11.803 0.735 1.00 0.00 N ATOM 325 CA GLU A 20 8.777 -12.428 -0.560 1.00 0.00 C ATOM 326 C GLU A 20 7.715 -13.498 -0.813 1.00 0.00 C ATOM 327 O GLU A 20 7.537 -14.411 -0.007 1.00 0.00 O ATOM 328 CB GLU A 20 10.181 -13.042 -0.601 1.00 0.00 C ATOM 329 CG GLU A 20 10.611 -13.495 -1.985 1.00 0.00 C ATOM 330 CD GLU A 20 11.970 -14.169 -1.990 1.00 0.00 C ATOM 331 OE1 GLU A 20 12.989 -13.480 -1.774 1.00 0.00 O ATOM 332 OE2 GLU A 20 12.021 -15.391 -2.226 1.00 0.00 O ATOM 0 H GLU A 20 8.623 -12.441 1.527 1.00 0.00 H new ATOM 0 HA GLU A 20 8.707 -11.673 -1.343 1.00 0.00 H new ATOM 0 HB2 GLU A 20 10.898 -12.311 -0.229 1.00 0.00 H new ATOM 0 HB3 GLU A 20 10.215 -13.895 0.077 1.00 0.00 H new ATOM 0 HG2 GLU A 20 9.867 -14.185 -2.383 1.00 0.00 H new ATOM 0 HG3 GLU A 20 10.636 -12.634 -2.652 1.00 0.00 H new ATOM 339 N ASN A 21 7.003 -13.380 -1.926 1.00 0.00 N ATOM 340 CA ASN A 21 5.873 -14.262 -2.217 1.00 0.00 C ATOM 341 C ASN A 21 6.288 -15.449 -3.072 1.00 0.00 C ATOM 342 O ASN A 21 6.927 -15.282 -4.118 1.00 0.00 O ATOM 343 CB ASN A 21 4.745 -13.497 -2.918 1.00 0.00 C ATOM 344 CG ASN A 21 3.961 -12.596 -1.980 1.00 0.00 C ATOM 345 OD1 ASN A 21 4.628 -12.047 -0.981 1.00 0.00 O flip ATOM 346 ND2 ASN A 21 2.759 -12.394 -2.161 1.00 0.00 N flip ATOM 0 H ASN A 21 7.186 -12.681 -2.646 1.00 0.00 H new ATOM 0 HA ASN A 21 5.512 -14.637 -1.259 1.00 0.00 H new ATOM 0 HB2 ASN A 21 5.168 -12.894 -3.721 1.00 0.00 H new ATOM 0 HB3 ASN A 21 4.063 -14.211 -3.380 1.00 0.00 H new ATOM 0 HD21 ASN A 21 2.280 -12.837 -2.945 1.00 0.00 H new ATOM 0 HD22 ASN A 21 2.243 -11.784 -1.527 1.00 0.00 H new ATOM 353 N GLU A 22 5.921 -16.643 -2.593 1.00 0.00 N ATOM 354 CA GLU A 22 6.155 -17.903 -3.301 1.00 0.00 C ATOM 355 C GLU A 22 7.624 -18.073 -3.677 1.00 0.00 C ATOM 356 O GLU A 22 7.945 -18.761 -4.646 1.00 0.00 O ATOM 357 CB GLU A 22 5.268 -17.999 -4.551 1.00 0.00 C ATOM 358 CG GLU A 22 3.799 -18.295 -4.256 1.00 0.00 C ATOM 359 CD GLU A 22 3.030 -17.100 -3.723 1.00 0.00 C ATOM 360 OE1 GLU A 22 3.009 -16.894 -2.489 1.00 0.00 O ATOM 361 OE2 GLU A 22 2.414 -16.379 -4.536 1.00 0.00 O ATOM 0 H GLU A 22 5.450 -16.761 -1.696 1.00 0.00 H new ATOM 0 HA GLU A 22 5.889 -18.712 -2.621 1.00 0.00 H new ATOM 0 HB2 GLU A 22 5.334 -17.061 -5.102 1.00 0.00 H new ATOM 0 HB3 GLU A 22 5.661 -18.780 -5.202 1.00 0.00 H new ATOM 0 HG2 GLU A 22 3.318 -18.647 -5.169 1.00 0.00 H new ATOM 0 HG3 GLU A 22 3.740 -19.107 -3.531 1.00 0.00 H new ATOM 368 N LYS A 23 8.499 -17.476 -2.871 1.00 0.00 N ATOM 369 CA LYS A 23 9.937 -17.451 -3.134 1.00 0.00 C ATOM 370 C LYS A 23 10.216 -16.932 -4.543 1.00 0.00 C ATOM 371 O LYS A 23 10.297 -17.699 -5.508 1.00 0.00 O ATOM 372 CB LYS A 23 10.569 -18.838 -2.930 1.00 0.00 C ATOM 373 CG LYS A 23 11.999 -18.796 -2.392 1.00 0.00 C ATOM 374 CD LYS A 23 13.050 -19.080 -3.462 1.00 0.00 C ATOM 375 CE LYS A 23 13.257 -17.906 -4.413 1.00 0.00 C ATOM 376 NZ LYS A 23 13.737 -16.683 -3.707 1.00 0.00 N ATOM 0 H LYS A 23 8.230 -16.994 -2.013 1.00 0.00 H new ATOM 0 HA LYS A 23 10.395 -16.770 -2.417 1.00 0.00 H new ATOM 0 HB2 LYS A 23 9.949 -19.411 -2.240 1.00 0.00 H new ATOM 0 HB3 LYS A 23 10.565 -19.371 -3.881 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.188 -17.815 -1.957 1.00 0.00 H new ATOM 0 HG3 LYS A 23 12.100 -19.526 -1.589 1.00 0.00 H new ATOM 0 HD2 LYS A 23 13.997 -19.322 -2.980 1.00 0.00 H new ATOM 0 HD3 LYS A 23 12.751 -19.958 -4.035 1.00 0.00 H new ATOM 0 HE2 LYS A 23 13.978 -18.186 -5.181 1.00 0.00 H new ATOM 0 HE3 LYS A 23 12.319 -17.684 -4.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 14.134 -16.016 -4.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 12.941 -16.234 -3.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 14.471 -16.945 -3.019 1.00 0.00 H new ATOM 390 N GLY A 24 10.356 -15.625 -4.657 1.00 0.00 N ATOM 391 CA GLY A 24 10.617 -15.015 -5.939 1.00 0.00 C ATOM 392 C GLY A 24 10.098 -13.600 -6.011 1.00 0.00 C ATOM 393 O GLY A 24 10.875 -12.650 -6.104 1.00 0.00 O ATOM 0 H GLY A 24 10.293 -14.970 -3.878 1.00 0.00 H new ATOM 0 HA2 GLY A 24 11.690 -15.017 -6.129 1.00 0.00 H new ATOM 0 HA3 GLY A 24 10.153 -15.611 -6.725 1.00 0.00 H new ATOM 397 N TRP A 25 8.783 -13.448 -5.942 1.00 0.00 N ATOM 398 CA TRP A 25 8.173 -12.140 -6.104 1.00 0.00 C ATOM 399 C TRP A 25 8.168 -11.384 -4.784 1.00 0.00 C ATOM 400 O TRP A 25 7.329 -11.617 -3.920 1.00 0.00 O ATOM 401 CB TRP A 25 6.760 -12.273 -6.674 1.00 0.00 C ATOM 402 CG TRP A 25 6.757 -12.680 -8.116 1.00 0.00 C ATOM 403 CD1 TRP A 25 6.959 -13.935 -8.622 1.00 0.00 C ATOM 404 CD2 TRP A 25 6.550 -11.820 -9.242 1.00 0.00 C ATOM 405 NE1 TRP A 25 6.890 -13.904 -9.995 1.00 0.00 N ATOM 406 CE2 TRP A 25 6.640 -12.617 -10.398 1.00 0.00 C ATOM 407 CE3 TRP A 25 6.299 -10.453 -9.384 1.00 0.00 C ATOM 408 CZ2 TRP A 25 6.485 -12.091 -11.678 1.00 0.00 C ATOM 409 CZ3 TRP A 25 6.144 -9.932 -10.655 1.00 0.00 C ATOM 410 CH2 TRP A 25 6.239 -10.750 -11.787 1.00 0.00 C ATOM 0 H TRP A 25 8.124 -14.209 -5.776 1.00 0.00 H new ATOM 0 HA TRP A 25 8.767 -11.565 -6.815 1.00 0.00 H new ATOM 0 HB2 TRP A 25 6.205 -13.008 -6.092 1.00 0.00 H new ATOM 0 HB3 TRP A 25 6.238 -11.322 -6.567 1.00 0.00 H new ATOM 0 HD1 TRP A 25 7.145 -14.819 -8.031 1.00 0.00 H new ATOM 0 HE1 TRP A 25 7.006 -14.707 -10.613 1.00 0.00 H new ATOM 0 HE3 TRP A 25 6.227 -9.814 -8.516 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 6.556 -12.719 -12.553 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 5.946 -8.877 -10.777 1.00 0.00 H new ATOM 0 HH2 TRP A 25 6.115 -10.313 -12.767 1.00 0.00 H new ATOM 421 N THR A 26 9.119 -10.478 -4.639 1.00 0.00 N ATOM 422 CA THR A 26 9.292 -9.738 -3.402 1.00 0.00 C ATOM 423 C THR A 26 8.406 -8.498 -3.404 1.00 0.00 C ATOM 424 O THR A 26 8.260 -7.844 -4.423 1.00 0.00 O ATOM 425 CB THR A 26 10.767 -9.326 -3.231 1.00 0.00 C ATOM 426 OG1 THR A 26 11.613 -10.439 -3.546 1.00 0.00 O ATOM 427 CG2 THR A 26 11.049 -8.868 -1.807 1.00 0.00 C ATOM 0 H THR A 26 9.788 -10.236 -5.370 1.00 0.00 H new ATOM 0 HA THR A 26 9.004 -10.379 -2.569 1.00 0.00 H new ATOM 0 HB THR A 26 10.970 -8.495 -3.907 1.00 0.00 H new ATOM 0 HG1 THR A 26 12.551 -10.177 -3.439 1.00 0.00 H new ATOM 0 HG21 THR A 26 12.097 -8.584 -1.717 1.00 0.00 H new ATOM 0 HG22 THR A 26 10.419 -8.011 -1.569 1.00 0.00 H new ATOM 0 HG23 THR A 26 10.833 -9.681 -1.114 1.00 0.00 H new ATOM 435 N LYS A 27 7.800 -8.189 -2.273 1.00 0.00 N ATOM 436 CA LYS A 27 6.922 -7.037 -2.184 1.00 0.00 C ATOM 437 C LYS A 27 7.531 -5.994 -1.255 1.00 0.00 C ATOM 438 O LYS A 27 7.827 -6.284 -0.090 1.00 0.00 O ATOM 439 CB LYS A 27 5.540 -7.480 -1.705 1.00 0.00 C ATOM 440 CG LYS A 27 4.448 -6.443 -1.909 1.00 0.00 C ATOM 441 CD LYS A 27 3.097 -7.115 -2.114 1.00 0.00 C ATOM 442 CE LYS A 27 2.751 -8.038 -0.961 1.00 0.00 C ATOM 443 NZ LYS A 27 1.583 -8.909 -1.266 1.00 0.00 N ATOM 0 H LYS A 27 7.899 -8.717 -1.406 1.00 0.00 H new ATOM 0 HA LYS A 27 6.807 -6.581 -3.168 1.00 0.00 H new ATOM 0 HB2 LYS A 27 5.261 -8.393 -2.231 1.00 0.00 H new ATOM 0 HB3 LYS A 27 5.597 -7.727 -0.645 1.00 0.00 H new ATOM 0 HG2 LYS A 27 4.403 -5.781 -1.044 1.00 0.00 H new ATOM 0 HG3 LYS A 27 4.686 -5.823 -2.773 1.00 0.00 H new ATOM 0 HD2 LYS A 27 2.323 -6.354 -2.216 1.00 0.00 H new ATOM 0 HD3 LYS A 27 3.110 -7.683 -3.044 1.00 0.00 H new ATOM 0 HE2 LYS A 27 3.614 -8.661 -0.725 1.00 0.00 H new ATOM 0 HE3 LYS A 27 2.536 -7.443 -0.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 1.257 -9.371 -0.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 0.813 -8.332 -1.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 1.862 -9.634 -1.958 1.00 0.00 H new ATOM 457 N GLU A 28 7.727 -4.790 -1.783 1.00 0.00 N ATOM 458 CA GLU A 28 8.462 -3.750 -1.076 1.00 0.00 C ATOM 459 C GLU A 28 7.807 -2.378 -1.246 1.00 0.00 C ATOM 460 O GLU A 28 7.140 -2.102 -2.246 1.00 0.00 O ATOM 461 CB GLU A 28 9.906 -3.708 -1.591 1.00 0.00 C ATOM 462 CG GLU A 28 10.731 -2.560 -1.031 1.00 0.00 C ATOM 463 CD GLU A 28 12.143 -2.529 -1.573 1.00 0.00 C ATOM 464 OE1 GLU A 28 12.313 -2.333 -2.796 1.00 0.00 O ATOM 465 OE2 GLU A 28 13.084 -2.695 -0.772 1.00 0.00 O ATOM 0 H GLU A 28 7.385 -4.511 -2.702 1.00 0.00 H new ATOM 0 HA GLU A 28 8.452 -3.990 -0.013 1.00 0.00 H new ATOM 0 HB2 GLU A 28 10.397 -4.649 -1.343 1.00 0.00 H new ATOM 0 HB3 GLU A 28 9.891 -3.634 -2.678 1.00 0.00 H new ATOM 0 HG2 GLU A 28 10.237 -1.617 -1.265 1.00 0.00 H new ATOM 0 HG3 GLU A 28 10.766 -2.641 0.055 1.00 0.00 H new ATOM 472 N ILE A 29 8.002 -1.532 -0.244 1.00 0.00 N ATOM 473 CA ILE A 29 7.564 -0.150 -0.285 1.00 0.00 C ATOM 474 C ILE A 29 8.788 0.761 -0.282 1.00 0.00 C ATOM 475 O ILE A 29 9.650 0.652 0.596 1.00 0.00 O ATOM 476 CB ILE A 29 6.666 0.182 0.924 1.00 0.00 C ATOM 477 CG1 ILE A 29 5.478 -0.784 0.975 1.00 0.00 C ATOM 478 CG2 ILE A 29 6.188 1.627 0.858 1.00 0.00 C ATOM 479 CD1 ILE A 29 4.578 -0.586 2.173 1.00 0.00 C ATOM 0 H ILE A 29 8.472 -1.790 0.624 1.00 0.00 H new ATOM 0 HA ILE A 29 6.982 0.007 -1.193 1.00 0.00 H new ATOM 0 HB ILE A 29 7.249 0.064 1.837 1.00 0.00 H new ATOM 0 HG12 ILE A 29 4.888 -0.667 0.066 1.00 0.00 H new ATOM 0 HG13 ILE A 29 5.854 -1.807 0.981 1.00 0.00 H new ATOM 0 HG21 ILE A 29 5.556 1.841 1.720 1.00 0.00 H new ATOM 0 HG22 ILE A 29 7.049 2.296 0.864 1.00 0.00 H new ATOM 0 HG23 ILE A 29 5.617 1.780 -0.058 1.00 0.00 H new ATOM 0 HD11 ILE A 29 3.761 -1.307 2.137 1.00 0.00 H new ATOM 0 HD12 ILE A 29 5.152 -0.733 3.088 1.00 0.00 H new ATOM 0 HD13 ILE A 29 4.171 0.425 2.159 1.00 0.00 H new ATOM 491 N ASN A 30 8.872 1.653 -1.257 1.00 0.00 N ATOM 492 CA ASN A 30 10.068 2.479 -1.427 1.00 0.00 C ATOM 493 C ASN A 30 9.733 3.822 -2.062 1.00 0.00 C ATOM 494 O ASN A 30 8.630 4.023 -2.563 1.00 0.00 O ATOM 495 CB ASN A 30 11.125 1.753 -2.280 1.00 0.00 C ATOM 496 CG ASN A 30 10.678 1.449 -3.710 1.00 0.00 C ATOM 497 OD1 ASN A 30 11.460 1.577 -4.652 1.00 0.00 O ATOM 498 ND2 ASN A 30 9.441 1.003 -3.884 1.00 0.00 N ATOM 0 H ASN A 30 8.135 1.826 -1.940 1.00 0.00 H new ATOM 0 HA ASN A 30 10.476 2.658 -0.432 1.00 0.00 H new ATOM 0 HB2 ASN A 30 12.028 2.363 -2.316 1.00 0.00 H new ATOM 0 HB3 ASN A 30 11.392 0.817 -1.788 1.00 0.00 H new ATOM 0 HD21 ASN A 30 9.115 0.755 -4.818 1.00 0.00 H new ATOM 0 HD22 ASN A 30 8.816 0.908 -3.084 1.00 0.00 H new ATOM 505 N ARG A 31 10.690 4.742 -2.019 1.00 0.00 N ATOM 506 CA ARG A 31 10.539 6.035 -2.670 1.00 0.00 C ATOM 507 C ARG A 31 11.266 6.025 -4.006 1.00 0.00 C ATOM 508 O ARG A 31 12.457 5.704 -4.069 1.00 0.00 O ATOM 509 CB ARG A 31 11.076 7.169 -1.790 1.00 0.00 C ATOM 510 CG ARG A 31 10.359 7.295 -0.455 1.00 0.00 C ATOM 511 CD ARG A 31 10.750 8.570 0.275 1.00 0.00 C ATOM 512 NE ARG A 31 10.285 9.768 -0.430 1.00 0.00 N ATOM 513 CZ ARG A 31 10.215 10.979 0.119 1.00 0.00 C ATOM 514 NH1 ARG A 31 10.568 11.162 1.385 1.00 0.00 N ATOM 515 NH2 ARG A 31 9.785 12.010 -0.600 1.00 0.00 N ATOM 0 H ARG A 31 11.581 4.614 -1.538 1.00 0.00 H new ATOM 0 HA ARG A 31 9.476 6.212 -2.833 1.00 0.00 H new ATOM 0 HB2 ARG A 31 12.138 7.005 -1.608 1.00 0.00 H new ATOM 0 HB3 ARG A 31 10.987 8.111 -2.331 1.00 0.00 H new ATOM 0 HG2 ARG A 31 9.281 7.285 -0.618 1.00 0.00 H new ATOM 0 HG3 ARG A 31 10.595 6.432 0.168 1.00 0.00 H new ATOM 0 HD2 ARG A 31 10.331 8.555 1.281 1.00 0.00 H new ATOM 0 HD3 ARG A 31 11.834 8.609 0.382 1.00 0.00 H new ATOM 0 HE ARG A 31 9.997 9.668 -1.403 1.00 0.00 H new ATOM 0 HH11 ARG A 31 10.895 10.373 1.942 1.00 0.00 H new ATOM 0 HH12 ARG A 31 10.512 12.092 1.801 1.00 0.00 H new ATOM 0 HH21 ARG A 31 9.509 11.874 -1.572 1.00 0.00 H new ATOM 0 HH22 ARG A 31 9.731 12.938 -0.180 1.00 0.00 H new ATOM 529 N VAL A 32 10.556 6.367 -5.065 1.00 0.00 N ATOM 530 CA VAL A 32 11.111 6.293 -6.406 1.00 0.00 C ATOM 531 C VAL A 32 11.262 7.684 -7.014 1.00 0.00 C ATOM 532 O VAL A 32 10.329 8.489 -6.986 1.00 0.00 O ATOM 533 CB VAL A 32 10.231 5.423 -7.332 1.00 0.00 C ATOM 534 CG1 VAL A 32 10.887 5.239 -8.693 1.00 0.00 C ATOM 535 CG2 VAL A 32 9.949 4.075 -6.686 1.00 0.00 C ATOM 0 H VAL A 32 9.593 6.699 -5.024 1.00 0.00 H new ATOM 0 HA VAL A 32 12.095 5.832 -6.320 1.00 0.00 H new ATOM 0 HB VAL A 32 9.283 5.940 -7.483 1.00 0.00 H new ATOM 0 HG11 VAL A 32 10.247 4.623 -9.325 1.00 0.00 H new ATOM 0 HG12 VAL A 32 11.031 6.212 -9.162 1.00 0.00 H new ATOM 0 HG13 VAL A 32 11.853 4.750 -8.568 1.00 0.00 H new ATOM 0 HG21 VAL A 32 9.328 3.475 -7.352 1.00 0.00 H new ATOM 0 HG22 VAL A 32 10.890 3.556 -6.502 1.00 0.00 H new ATOM 0 HG23 VAL A 32 9.427 4.226 -5.741 1.00 0.00 H new ATOM 545 N SER A 33 12.444 7.951 -7.547 1.00 0.00 N ATOM 546 CA SER A 33 12.725 9.213 -8.209 1.00 0.00 C ATOM 547 C SER A 33 12.393 9.101 -9.690 1.00 0.00 C ATOM 548 O SER A 33 12.855 8.179 -10.368 1.00 0.00 O ATOM 549 CB SER A 33 14.201 9.587 -8.026 1.00 0.00 C ATOM 550 OG SER A 33 14.510 10.834 -8.628 1.00 0.00 O ATOM 0 H SER A 33 13.231 7.302 -7.533 1.00 0.00 H new ATOM 0 HA SER A 33 12.109 9.994 -7.764 1.00 0.00 H new ATOM 0 HB2 SER A 33 14.435 9.630 -6.962 1.00 0.00 H new ATOM 0 HB3 SER A 33 14.829 8.809 -8.460 1.00 0.00 H new ATOM 0 HG SER A 33 15.458 11.038 -8.489 1.00 0.00 H new ATOM 556 N PHE A 34 11.586 10.025 -10.180 1.00 0.00 N ATOM 557 CA PHE A 34 11.195 10.028 -11.579 1.00 0.00 C ATOM 558 C PHE A 34 11.861 11.184 -12.312 1.00 0.00 C ATOM 559 O PHE A 34 11.498 12.335 -12.096 1.00 0.00 O ATOM 560 CB PHE A 34 9.673 10.123 -11.715 1.00 0.00 C ATOM 561 CG PHE A 34 8.941 8.964 -11.101 1.00 0.00 C ATOM 562 CD1 PHE A 34 8.894 7.739 -11.747 1.00 0.00 C ATOM 563 CD2 PHE A 34 8.301 9.100 -9.879 1.00 0.00 C ATOM 564 CE1 PHE A 34 8.223 6.669 -11.186 1.00 0.00 C ATOM 565 CE2 PHE A 34 7.627 8.034 -9.314 1.00 0.00 C ATOM 566 CZ PHE A 34 7.589 6.817 -9.967 1.00 0.00 C ATOM 0 H PHE A 34 11.188 10.785 -9.629 1.00 0.00 H new ATOM 0 HA PHE A 34 11.524 9.091 -12.028 1.00 0.00 H new ATOM 0 HB2 PHE A 34 9.332 11.046 -11.247 1.00 0.00 H new ATOM 0 HB3 PHE A 34 9.414 10.187 -12.772 1.00 0.00 H new ATOM 0 HD1 PHE A 34 9.388 7.619 -12.700 1.00 0.00 H new ATOM 0 HD2 PHE A 34 8.329 10.048 -9.363 1.00 0.00 H new ATOM 0 HE1 PHE A 34 8.194 5.719 -11.699 1.00 0.00 H new ATOM 0 HE2 PHE A 34 7.130 8.152 -8.362 1.00 0.00 H new ATOM 0 HZ PHE A 34 7.065 5.983 -9.525 1.00 0.00 H new ATOM 576 N ASN A 35 12.834 10.838 -13.164 1.00 0.00 N ATOM 577 CA ASN A 35 13.632 11.782 -13.978 1.00 0.00 C ATOM 578 C ASN A 35 13.863 13.148 -13.305 1.00 0.00 C ATOM 579 O ASN A 35 14.881 13.341 -12.639 1.00 0.00 O ATOM 580 CB ASN A 35 13.089 11.933 -15.426 1.00 0.00 C ATOM 581 CG ASN A 35 11.663 12.462 -15.554 1.00 0.00 C ATOM 582 OD1 ASN A 35 10.788 12.180 -14.744 1.00 0.00 O ATOM 583 ND2 ASN A 35 11.425 13.242 -16.595 1.00 0.00 N ATOM 0 H ASN A 35 13.101 9.865 -13.315 1.00 0.00 H new ATOM 0 HA ASN A 35 14.617 11.320 -14.051 1.00 0.00 H new ATOM 0 HB2 ASN A 35 13.754 12.601 -15.974 1.00 0.00 H new ATOM 0 HB3 ASN A 35 13.140 10.960 -15.915 1.00 0.00 H new ATOM 0 HD21 ASN A 35 10.492 13.627 -16.741 1.00 0.00 H new ATOM 0 HD22 ASN A 35 12.175 13.459 -17.252 1.00 0.00 H new ATOM 590 N GLY A 36 12.936 14.087 -13.465 1.00 0.00 N ATOM 591 CA GLY A 36 13.110 15.405 -12.887 1.00 0.00 C ATOM 592 C GLY A 36 11.992 15.760 -11.929 1.00 0.00 C ATOM 593 O GLY A 36 11.356 16.807 -12.069 1.00 0.00 O ATOM 0 H GLY A 36 12.068 13.958 -13.985 1.00 0.00 H new ATOM 0 HA2 GLY A 36 14.064 15.447 -12.361 1.00 0.00 H new ATOM 0 HA3 GLY A 36 13.153 16.147 -13.684 1.00 0.00 H new ATOM 597 N ALA A 37 11.750 14.888 -10.963 1.00 0.00 N ATOM 598 CA ALA A 37 10.684 15.087 -9.991 1.00 0.00 C ATOM 599 C ALA A 37 11.057 14.467 -8.648 1.00 0.00 C ATOM 600 O ALA A 37 11.779 13.470 -8.602 1.00 0.00 O ATOM 601 CB ALA A 37 9.386 14.484 -10.507 1.00 0.00 C ATOM 0 H ALA A 37 12.282 14.028 -10.830 1.00 0.00 H new ATOM 0 HA ALA A 37 10.543 16.158 -9.847 1.00 0.00 H new ATOM 0 HB1 ALA A 37 8.596 14.638 -9.772 1.00 0.00 H new ATOM 0 HB2 ALA A 37 9.109 14.965 -11.445 1.00 0.00 H new ATOM 0 HB3 ALA A 37 9.522 13.416 -10.674 1.00 0.00 H new ATOM 607 N PRO A 38 10.572 15.053 -7.536 1.00 0.00 N ATOM 608 CA PRO A 38 10.831 14.537 -6.188 1.00 0.00 C ATOM 609 C PRO A 38 10.286 13.126 -6.002 1.00 0.00 C ATOM 610 O PRO A 38 9.220 12.786 -6.528 1.00 0.00 O ATOM 611 CB PRO A 38 10.095 15.521 -5.268 1.00 0.00 C ATOM 612 CG PRO A 38 9.910 16.749 -6.092 1.00 0.00 C ATOM 613 CD PRO A 38 9.744 16.267 -7.504 1.00 0.00 C ATOM 0 HA PRO A 38 11.899 14.466 -5.980 1.00 0.00 H new ATOM 0 HB2 PRO A 38 9.137 15.116 -4.942 1.00 0.00 H new ATOM 0 HB3 PRO A 38 10.675 15.731 -4.369 1.00 0.00 H new ATOM 0 HG2 PRO A 38 9.036 17.312 -5.765 1.00 0.00 H new ATOM 0 HG3 PRO A 38 10.769 17.414 -6.003 1.00 0.00 H new ATOM 0 HD2 PRO A 38 8.701 16.051 -7.737 1.00 0.00 H new ATOM 0 HD3 PRO A 38 10.085 17.008 -8.227 1.00 0.00 H new ATOM 621 N ALA A 39 11.029 12.316 -5.257 1.00 0.00 N ATOM 622 CA ALA A 39 10.680 10.920 -5.028 1.00 0.00 C ATOM 623 C ALA A 39 9.319 10.765 -4.359 1.00 0.00 C ATOM 624 O ALA A 39 9.079 11.304 -3.275 1.00 0.00 O ATOM 625 CB ALA A 39 11.750 10.248 -4.186 1.00 0.00 C ATOM 0 H ALA A 39 11.890 12.609 -4.795 1.00 0.00 H new ATOM 0 HA ALA A 39 10.620 10.437 -6.003 1.00 0.00 H new ATOM 0 HB1 ALA A 39 11.481 9.205 -4.020 1.00 0.00 H new ATOM 0 HB2 ALA A 39 12.707 10.297 -4.706 1.00 0.00 H new ATOM 0 HB3 ALA A 39 11.832 10.759 -3.227 1.00 0.00 H new ATOM 631 N LYS A 40 8.440 10.022 -5.013 1.00 0.00 N ATOM 632 CA LYS A 40 7.143 9.692 -4.447 1.00 0.00 C ATOM 633 C LYS A 40 7.227 8.369 -3.697 1.00 0.00 C ATOM 634 O LYS A 40 8.279 7.729 -3.668 1.00 0.00 O ATOM 635 CB LYS A 40 6.078 9.598 -5.542 1.00 0.00 C ATOM 636 CG LYS A 40 5.748 10.921 -6.218 1.00 0.00 C ATOM 637 CD LYS A 40 5.181 11.935 -5.234 1.00 0.00 C ATOM 638 CE LYS A 40 4.514 13.089 -5.962 1.00 0.00 C ATOM 639 NZ LYS A 40 4.036 14.143 -5.032 1.00 0.00 N ATOM 0 H LYS A 40 8.604 9.634 -5.942 1.00 0.00 H new ATOM 0 HA LYS A 40 6.859 10.485 -3.756 1.00 0.00 H new ATOM 0 HB2 LYS A 40 6.416 8.892 -6.300 1.00 0.00 H new ATOM 0 HB3 LYS A 40 5.165 9.188 -5.109 1.00 0.00 H new ATOM 0 HG2 LYS A 40 6.648 11.327 -6.680 1.00 0.00 H new ATOM 0 HG3 LYS A 40 5.028 10.750 -7.019 1.00 0.00 H new ATOM 0 HD2 LYS A 40 4.458 11.447 -4.580 1.00 0.00 H new ATOM 0 HD3 LYS A 40 5.980 12.315 -4.598 1.00 0.00 H new ATOM 0 HE2 LYS A 40 5.219 13.525 -6.670 1.00 0.00 H new ATOM 0 HE3 LYS A 40 3.672 12.711 -6.542 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 3.589 14.909 -5.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 3.343 13.736 -4.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 4.841 14.524 -4.496 1.00 0.00 H new ATOM 653 N PHE A 41 6.118 7.957 -3.103 1.00 0.00 N ATOM 654 CA PHE A 41 6.065 6.707 -2.362 1.00 0.00 C ATOM 655 C PHE A 41 5.382 5.645 -3.208 1.00 0.00 C ATOM 656 O PHE A 41 4.255 5.838 -3.644 1.00 0.00 O ATOM 657 CB PHE A 41 5.298 6.901 -1.053 1.00 0.00 C ATOM 658 CG PHE A 41 5.845 8.002 -0.184 1.00 0.00 C ATOM 659 CD1 PHE A 41 5.400 9.306 -0.333 1.00 0.00 C ATOM 660 CD2 PHE A 41 6.796 7.730 0.781 1.00 0.00 C ATOM 661 CE1 PHE A 41 5.899 10.316 0.465 1.00 0.00 C ATOM 662 CE2 PHE A 41 7.298 8.736 1.583 1.00 0.00 C ATOM 663 CZ PHE A 41 6.849 10.032 1.424 1.00 0.00 C ATOM 0 H PHE A 41 5.238 8.473 -3.120 1.00 0.00 H new ATOM 0 HA PHE A 41 7.081 6.387 -2.128 1.00 0.00 H new ATOM 0 HB2 PHE A 41 4.255 7.117 -1.283 1.00 0.00 H new ATOM 0 HB3 PHE A 41 5.314 5.967 -0.492 1.00 0.00 H new ATOM 0 HD1 PHE A 41 4.655 9.534 -1.081 1.00 0.00 H new ATOM 0 HD2 PHE A 41 7.151 6.718 0.910 1.00 0.00 H new ATOM 0 HE1 PHE A 41 5.546 11.329 0.338 1.00 0.00 H new ATOM 0 HE2 PHE A 41 8.041 8.509 2.334 1.00 0.00 H new ATOM 0 HZ PHE A 41 7.241 10.821 2.049 1.00 0.00 H new ATOM 673 N ASP A 42 6.055 4.534 -3.453 1.00 0.00 N ATOM 674 CA ASP A 42 5.509 3.506 -4.330 1.00 0.00 C ATOM 675 C ASP A 42 5.563 2.132 -3.669 1.00 0.00 C ATOM 676 O ASP A 42 6.622 1.688 -3.209 1.00 0.00 O ATOM 677 CB ASP A 42 6.276 3.492 -5.658 1.00 0.00 C ATOM 678 CG ASP A 42 5.694 2.530 -6.680 1.00 0.00 C ATOM 679 OD1 ASP A 42 4.563 2.771 -7.154 1.00 0.00 O ATOM 680 OD2 ASP A 42 6.385 1.551 -7.037 1.00 0.00 O ATOM 0 H ASP A 42 6.972 4.319 -3.062 1.00 0.00 H new ATOM 0 HA ASP A 42 4.463 3.741 -4.524 1.00 0.00 H new ATOM 0 HB2 ASP A 42 6.280 4.498 -6.078 1.00 0.00 H new ATOM 0 HB3 ASP A 42 7.315 3.223 -5.467 1.00 0.00 H new ATOM 685 N ILE A 43 4.413 1.480 -3.593 1.00 0.00 N ATOM 686 CA ILE A 43 4.332 0.113 -3.098 1.00 0.00 C ATOM 687 C ILE A 43 4.329 -0.832 -4.289 1.00 0.00 C ATOM 688 O ILE A 43 3.365 -0.867 -5.052 1.00 0.00 O ATOM 689 CB ILE A 43 3.059 -0.118 -2.254 1.00 0.00 C ATOM 690 CG1 ILE A 43 2.982 0.904 -1.115 1.00 0.00 C ATOM 691 CG2 ILE A 43 3.031 -1.540 -1.704 1.00 0.00 C ATOM 692 CD1 ILE A 43 1.717 0.803 -0.287 1.00 0.00 C ATOM 0 H ILE A 43 3.516 1.879 -3.870 1.00 0.00 H new ATOM 0 HA ILE A 43 5.192 -0.074 -2.454 1.00 0.00 H new ATOM 0 HB ILE A 43 2.189 0.016 -2.896 1.00 0.00 H new ATOM 0 HG12 ILE A 43 3.844 0.771 -0.462 1.00 0.00 H new ATOM 0 HG13 ILE A 43 3.051 1.908 -1.535 1.00 0.00 H new ATOM 0 HG21 ILE A 43 2.127 -1.684 -1.112 1.00 0.00 H new ATOM 0 HG22 ILE A 43 3.040 -2.250 -2.531 1.00 0.00 H new ATOM 0 HG23 ILE A 43 3.906 -1.704 -1.075 1.00 0.00 H new ATOM 0 HD11 ILE A 43 1.735 1.558 0.499 1.00 0.00 H new ATOM 0 HD12 ILE A 43 0.850 0.966 -0.927 1.00 0.00 H new ATOM 0 HD13 ILE A 43 1.655 -0.188 0.163 1.00 0.00 H new ATOM 704 N ARG A 44 5.396 -1.595 -4.448 1.00 0.00 N ATOM 705 CA ARG A 44 5.631 -2.293 -5.699 1.00 0.00 C ATOM 706 C ARG A 44 6.136 -3.715 -5.470 1.00 0.00 C ATOM 707 O ARG A 44 6.669 -4.040 -4.406 1.00 0.00 O ATOM 708 CB ARG A 44 6.645 -1.489 -6.505 1.00 0.00 C ATOM 709 CG ARG A 44 6.889 -1.993 -7.915 1.00 0.00 C ATOM 710 CD ARG A 44 7.919 -1.128 -8.624 1.00 0.00 C ATOM 711 NE ARG A 44 9.211 -1.142 -7.933 1.00 0.00 N ATOM 712 CZ ARG A 44 9.694 -0.112 -7.228 1.00 0.00 C ATOM 713 NH1 ARG A 44 8.947 0.966 -7.019 1.00 0.00 N ATOM 714 NH2 ARG A 44 10.905 -0.179 -6.687 1.00 0.00 N ATOM 0 H ARG A 44 6.108 -1.746 -3.733 1.00 0.00 H new ATOM 0 HA ARG A 44 4.691 -2.379 -6.244 1.00 0.00 H new ATOM 0 HB2 ARG A 44 6.306 -0.455 -6.559 1.00 0.00 H new ATOM 0 HB3 ARG A 44 7.593 -1.486 -5.967 1.00 0.00 H new ATOM 0 HG2 ARG A 44 7.235 -3.026 -7.882 1.00 0.00 H new ATOM 0 HG3 ARG A 44 5.954 -1.987 -8.475 1.00 0.00 H new ATOM 0 HD2 ARG A 44 8.050 -1.483 -9.646 1.00 0.00 H new ATOM 0 HD3 ARG A 44 7.552 -0.104 -8.687 1.00 0.00 H new ATOM 0 HE ARG A 44 9.777 -1.989 -7.993 1.00 0.00 H new ATOM 0 HH11 ARG A 44 8.001 1.012 -7.396 1.00 0.00 H new ATOM 0 HH12 ARG A 44 9.320 1.748 -6.481 1.00 0.00 H new ATOM 0 HH21 ARG A 44 11.472 -1.018 -6.808 1.00 0.00 H new ATOM 0 HH22 ARG A 44 11.268 0.609 -6.151 1.00 0.00 H new ATOM 728 N ALA A 45 5.951 -4.558 -6.473 1.00 0.00 N ATOM 729 CA ALA A 45 6.453 -5.918 -6.433 1.00 0.00 C ATOM 730 C ALA A 45 7.688 -6.067 -7.322 1.00 0.00 C ATOM 731 O ALA A 45 7.789 -5.441 -8.381 1.00 0.00 O ATOM 732 CB ALA A 45 5.365 -6.892 -6.860 1.00 0.00 C ATOM 0 H ALA A 45 5.453 -4.320 -7.330 1.00 0.00 H new ATOM 0 HA ALA A 45 6.745 -6.148 -5.408 1.00 0.00 H new ATOM 0 HB1 ALA A 45 5.754 -7.910 -6.826 1.00 0.00 H new ATOM 0 HB2 ALA A 45 4.514 -6.806 -6.184 1.00 0.00 H new ATOM 0 HB3 ALA A 45 5.047 -6.659 -7.876 1.00 0.00 H new ATOM 738 N TRP A 46 8.621 -6.882 -6.869 1.00 0.00 N ATOM 739 CA TRP A 46 9.832 -7.187 -7.608 1.00 0.00 C ATOM 740 C TRP A 46 9.776 -8.609 -8.143 1.00 0.00 C ATOM 741 O TRP A 46 9.487 -9.547 -7.397 1.00 0.00 O ATOM 742 CB TRP A 46 11.068 -7.064 -6.709 1.00 0.00 C ATOM 743 CG TRP A 46 11.467 -5.663 -6.358 1.00 0.00 C ATOM 744 CD1 TRP A 46 11.270 -5.027 -5.166 1.00 0.00 C ATOM 745 CD2 TRP A 46 12.157 -4.736 -7.201 1.00 0.00 C ATOM 746 NE1 TRP A 46 11.805 -3.762 -5.213 1.00 0.00 N ATOM 747 CE2 TRP A 46 12.351 -3.559 -6.457 1.00 0.00 C ATOM 748 CE3 TRP A 46 12.630 -4.791 -8.514 1.00 0.00 C ATOM 749 CZ2 TRP A 46 12.999 -2.447 -6.984 1.00 0.00 C ATOM 750 CZ3 TRP A 46 13.273 -3.685 -9.037 1.00 0.00 C ATOM 751 CH2 TRP A 46 13.453 -2.527 -8.273 1.00 0.00 C ATOM 0 H TRP A 46 8.559 -7.356 -5.968 1.00 0.00 H new ATOM 0 HA TRP A 46 9.904 -6.474 -8.430 1.00 0.00 H new ATOM 0 HB2 TRP A 46 10.882 -7.613 -5.786 1.00 0.00 H new ATOM 0 HB3 TRP A 46 11.908 -7.550 -7.205 1.00 0.00 H new ATOM 0 HD1 TRP A 46 10.767 -5.455 -4.311 1.00 0.00 H new ATOM 0 HE1 TRP A 46 11.798 -3.085 -4.450 1.00 0.00 H new ATOM 0 HE3 TRP A 46 12.496 -5.682 -9.110 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 13.139 -1.552 -6.397 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 13.642 -3.715 -10.051 1.00 0.00 H new ATOM 0 HH2 TRP A 46 13.960 -1.679 -8.709 1.00 0.00 H new ATOM 762 N SER A 47 10.038 -8.771 -9.425 1.00 0.00 N ATOM 763 CA SER A 47 10.195 -10.089 -9.999 1.00 0.00 C ATOM 764 C SER A 47 11.605 -10.611 -9.707 1.00 0.00 C ATOM 765 O SER A 47 12.571 -9.850 -9.748 1.00 0.00 O ATOM 766 CB SER A 47 9.901 -10.036 -11.498 1.00 0.00 C ATOM 767 OG SER A 47 10.237 -8.768 -12.033 1.00 0.00 O ATOM 0 H SER A 47 10.146 -8.004 -10.088 1.00 0.00 H new ATOM 0 HA SER A 47 9.485 -10.783 -9.549 1.00 0.00 H new ATOM 0 HB2 SER A 47 10.466 -10.814 -12.012 1.00 0.00 H new ATOM 0 HB3 SER A 47 8.845 -10.241 -11.673 1.00 0.00 H new ATOM 0 HG SER A 47 11.192 -8.748 -12.253 1.00 0.00 H new ATOM 773 N PRO A 48 11.726 -11.913 -9.398 1.00 0.00 N ATOM 774 CA PRO A 48 12.968 -12.514 -8.881 1.00 0.00 C ATOM 775 C PRO A 48 14.200 -12.289 -9.760 1.00 0.00 C ATOM 776 O PRO A 48 15.321 -12.207 -9.250 1.00 0.00 O ATOM 777 CB PRO A 48 12.648 -14.014 -8.799 1.00 0.00 C ATOM 778 CG PRO A 48 11.407 -14.206 -9.603 1.00 0.00 C ATOM 779 CD PRO A 48 10.655 -12.912 -9.523 1.00 0.00 C ATOM 0 HA PRO A 48 13.236 -12.054 -7.930 1.00 0.00 H new ATOM 0 HB2 PRO A 48 13.468 -14.612 -9.196 1.00 0.00 H new ATOM 0 HB3 PRO A 48 12.497 -14.326 -7.766 1.00 0.00 H new ATOM 0 HG2 PRO A 48 11.647 -14.454 -10.637 1.00 0.00 H new ATOM 0 HG3 PRO A 48 10.810 -15.028 -9.208 1.00 0.00 H new ATOM 0 HD2 PRO A 48 10.047 -12.743 -10.412 1.00 0.00 H new ATOM 0 HD3 PRO A 48 9.981 -12.890 -8.667 1.00 0.00 H new ATOM 787 N ASP A 49 14.015 -12.195 -11.066 1.00 0.00 N ATOM 788 CA ASP A 49 15.152 -12.059 -11.972 1.00 0.00 C ATOM 789 C ASP A 49 15.319 -10.616 -12.434 1.00 0.00 C ATOM 790 O ASP A 49 16.045 -9.834 -11.820 1.00 0.00 O ATOM 791 CB ASP A 49 15.007 -12.993 -13.176 1.00 0.00 C ATOM 792 CG ASP A 49 14.790 -14.433 -12.765 1.00 0.00 C ATOM 793 OD1 ASP A 49 15.714 -15.037 -12.182 1.00 0.00 O ATOM 794 OD2 ASP A 49 13.682 -14.962 -13.007 1.00 0.00 O ATOM 0 H ASP A 49 13.103 -12.210 -11.522 1.00 0.00 H new ATOM 0 HA ASP A 49 16.048 -12.345 -11.421 1.00 0.00 H new ATOM 0 HB2 ASP A 49 14.169 -12.663 -13.790 1.00 0.00 H new ATOM 0 HB3 ASP A 49 15.902 -12.925 -13.795 1.00 0.00 H new ATOM 799 N HIS A 50 14.649 -10.266 -13.519 1.00 0.00 N ATOM 800 CA HIS A 50 14.652 -8.899 -14.014 1.00 0.00 C ATOM 801 C HIS A 50 13.260 -8.323 -13.879 1.00 0.00 C ATOM 802 O HIS A 50 12.348 -9.024 -13.445 1.00 0.00 O ATOM 803 CB HIS A 50 15.113 -8.840 -15.473 1.00 0.00 C ATOM 804 CG HIS A 50 16.555 -9.187 -15.661 1.00 0.00 C ATOM 805 ND1 HIS A 50 17.555 -8.244 -15.675 1.00 0.00 N ATOM 806 CD2 HIS A 50 17.166 -10.381 -15.834 1.00 0.00 C ATOM 807 CE1 HIS A 50 18.717 -8.839 -15.850 1.00 0.00 C ATOM 808 NE2 HIS A 50 18.514 -10.141 -15.946 1.00 0.00 N ATOM 0 H HIS A 50 14.093 -10.914 -14.077 1.00 0.00 H new ATOM 0 HA HIS A 50 15.354 -8.311 -13.423 1.00 0.00 H new ATOM 0 HB2 HIS A 50 14.504 -9.523 -16.065 1.00 0.00 H new ATOM 0 HB3 HIS A 50 14.936 -7.837 -15.861 1.00 0.00 H new ATOM 0 HD2 HIS A 50 16.683 -11.346 -15.876 1.00 0.00 H new ATOM 0 HE1 HIS A 50 19.676 -8.345 -15.906 1.00 0.00 H new ATOM 0 HE2 HIS A 50 19.236 -10.849 -16.081 1.00 0.00 H new ATOM 817 N THR A 51 13.086 -7.067 -14.247 1.00 0.00 N ATOM 818 CA THR A 51 11.795 -6.416 -14.105 1.00 0.00 C ATOM 819 C THR A 51 10.814 -6.908 -15.171 1.00 0.00 C ATOM 820 O THR A 51 10.755 -6.361 -16.276 1.00 0.00 O ATOM 821 CB THR A 51 11.926 -4.885 -14.195 1.00 0.00 C ATOM 822 OG1 THR A 51 13.033 -4.449 -13.396 1.00 0.00 O ATOM 823 CG2 THR A 51 10.655 -4.199 -13.712 1.00 0.00 C ATOM 0 H THR A 51 13.818 -6.479 -14.645 1.00 0.00 H new ATOM 0 HA THR A 51 11.411 -6.676 -13.119 1.00 0.00 H new ATOM 0 HB THR A 51 12.091 -4.617 -15.239 1.00 0.00 H new ATOM 0 HG1 THR A 51 13.116 -3.474 -13.456 1.00 0.00 H new ATOM 0 HG21 THR A 51 10.774 -3.118 -13.786 1.00 0.00 H new ATOM 0 HG22 THR A 51 9.814 -4.514 -14.330 1.00 0.00 H new ATOM 0 HG23 THR A 51 10.466 -4.473 -12.674 1.00 0.00 H new ATOM 831 N LYS A 52 10.070 -7.958 -14.842 1.00 0.00 N ATOM 832 CA LYS A 52 9.061 -8.499 -15.743 1.00 0.00 C ATOM 833 C LYS A 52 7.804 -7.654 -15.654 1.00 0.00 C ATOM 834 O LYS A 52 7.410 -6.988 -16.611 1.00 0.00 O ATOM 835 CB LYS A 52 8.736 -9.956 -15.386 1.00 0.00 C ATOM 836 CG LYS A 52 9.956 -10.865 -15.352 1.00 0.00 C ATOM 837 CD LYS A 52 9.602 -12.299 -14.981 1.00 0.00 C ATOM 838 CE LYS A 52 9.050 -13.090 -16.162 1.00 0.00 C ATOM 839 NZ LYS A 52 7.692 -12.641 -16.578 1.00 0.00 N ATOM 0 H LYS A 52 10.148 -8.453 -13.954 1.00 0.00 H new ATOM 0 HA LYS A 52 9.450 -8.476 -16.761 1.00 0.00 H new ATOM 0 HB2 LYS A 52 8.248 -9.982 -14.412 1.00 0.00 H new ATOM 0 HB3 LYS A 52 8.022 -10.348 -16.111 1.00 0.00 H new ATOM 0 HG2 LYS A 52 10.441 -10.854 -16.328 1.00 0.00 H new ATOM 0 HG3 LYS A 52 10.677 -10.474 -14.634 1.00 0.00 H new ATOM 0 HD2 LYS A 52 10.490 -12.801 -14.595 1.00 0.00 H new ATOM 0 HD3 LYS A 52 8.866 -12.291 -14.177 1.00 0.00 H new ATOM 0 HE2 LYS A 52 9.733 -12.996 -17.007 1.00 0.00 H new ATOM 0 HE3 LYS A 52 9.013 -14.147 -15.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 7.133 -13.463 -16.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 7.218 -12.179 -15.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 7.775 -11.967 -17.365 1.00 0.00 H new ATOM 853 N MET A 53 7.191 -7.672 -14.483 1.00 0.00 N ATOM 854 CA MET A 53 6.021 -6.856 -14.215 1.00 0.00 C ATOM 855 C MET A 53 6.125 -6.248 -12.826 1.00 0.00 C ATOM 856 O MET A 53 5.613 -6.807 -11.856 1.00 0.00 O ATOM 857 CB MET A 53 4.726 -7.675 -14.326 1.00 0.00 C ATOM 858 CG MET A 53 4.344 -8.048 -15.748 1.00 0.00 C ATOM 859 SD MET A 53 2.803 -8.986 -15.827 1.00 0.00 S ATOM 860 CE MET A 53 2.655 -9.233 -17.596 1.00 0.00 C ATOM 0 H MET A 53 7.488 -8.249 -13.696 1.00 0.00 H new ATOM 0 HA MET A 53 5.985 -6.064 -14.963 1.00 0.00 H new ATOM 0 HB2 MET A 53 4.835 -8.588 -13.740 1.00 0.00 H new ATOM 0 HB3 MET A 53 3.910 -7.106 -13.880 1.00 0.00 H new ATOM 0 HG2 MET A 53 4.244 -7.141 -16.344 1.00 0.00 H new ATOM 0 HG3 MET A 53 5.146 -8.636 -16.194 1.00 0.00 H new ATOM 0 HE1 MET A 53 1.749 -9.800 -17.810 1.00 0.00 H new ATOM 0 HE2 MET A 53 2.604 -8.266 -18.095 1.00 0.00 H new ATOM 0 HE3 MET A 53 3.522 -9.784 -17.960 1.00 0.00 H new ATOM 870 N GLY A 54 6.818 -5.120 -12.726 1.00 0.00 N ATOM 871 CA GLY A 54 6.962 -4.443 -11.451 1.00 0.00 C ATOM 872 C GLY A 54 5.735 -3.630 -11.117 1.00 0.00 C ATOM 873 O GLY A 54 5.793 -2.405 -11.035 1.00 0.00 O ATOM 0 H GLY A 54 7.284 -4.661 -13.508 1.00 0.00 H new ATOM 0 HA2 GLY A 54 7.138 -5.178 -10.665 1.00 0.00 H new ATOM 0 HA3 GLY A 54 7.835 -3.791 -11.480 1.00 0.00 H new ATOM 877 N LYS A 55 4.619 -4.318 -10.937 1.00 0.00 N ATOM 878 CA LYS A 55 3.348 -3.662 -10.704 1.00 0.00 C ATOM 879 C LYS A 55 3.146 -3.347 -9.231 1.00 0.00 C ATOM 880 O LYS A 55 3.664 -4.037 -8.349 1.00 0.00 O ATOM 881 CB LYS A 55 2.191 -4.514 -11.242 1.00 0.00 C ATOM 882 CG LYS A 55 2.196 -5.960 -10.768 1.00 0.00 C ATOM 883 CD LYS A 55 1.286 -6.822 -11.633 1.00 0.00 C ATOM 884 CE LYS A 55 1.203 -8.251 -11.120 1.00 0.00 C ATOM 885 NZ LYS A 55 0.355 -8.359 -9.902 1.00 0.00 N ATOM 0 H LYS A 55 4.571 -5.337 -10.948 1.00 0.00 H new ATOM 0 HA LYS A 55 3.360 -2.716 -11.245 1.00 0.00 H new ATOM 0 HB2 LYS A 55 1.249 -4.052 -10.947 1.00 0.00 H new ATOM 0 HB3 LYS A 55 2.224 -4.502 -12.331 1.00 0.00 H new ATOM 0 HG2 LYS A 55 3.212 -6.353 -10.799 1.00 0.00 H new ATOM 0 HG3 LYS A 55 1.868 -6.007 -9.730 1.00 0.00 H new ATOM 0 HD2 LYS A 55 0.287 -6.386 -11.656 1.00 0.00 H new ATOM 0 HD3 LYS A 55 1.656 -6.825 -12.658 1.00 0.00 H new ATOM 0 HE2 LYS A 55 0.798 -8.894 -11.902 1.00 0.00 H new ATOM 0 HE3 LYS A 55 2.206 -8.615 -10.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 0.312 -9.352 -9.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 0.764 -7.780 -9.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -0.605 -8.021 -10.116 1.00 0.00 H new ATOM 899 N GLY A 56 2.398 -2.287 -8.987 1.00 0.00 N ATOM 900 CA GLY A 56 2.118 -1.850 -7.642 1.00 0.00 C ATOM 901 C GLY A 56 1.232 -0.627 -7.649 1.00 0.00 C ATOM 902 O GLY A 56 0.365 -0.497 -8.517 1.00 0.00 O ATOM 0 H GLY A 56 1.972 -1.712 -9.714 1.00 0.00 H new ATOM 0 HA2 GLY A 56 1.633 -2.653 -7.088 1.00 0.00 H new ATOM 0 HA3 GLY A 56 3.051 -1.625 -7.126 1.00 0.00 H new ATOM 906 N ILE A 57 1.447 0.275 -6.708 1.00 0.00 N ATOM 907 CA ILE A 57 0.651 1.488 -6.636 1.00 0.00 C ATOM 908 C ILE A 57 1.427 2.619 -5.955 1.00 0.00 C ATOM 909 O ILE A 57 2.015 2.438 -4.886 1.00 0.00 O ATOM 910 CB ILE A 57 -0.696 1.231 -5.915 1.00 0.00 C ATOM 911 CG1 ILE A 57 -1.582 2.476 -5.961 1.00 0.00 C ATOM 912 CG2 ILE A 57 -0.473 0.781 -4.476 1.00 0.00 C ATOM 913 CD1 ILE A 57 -2.994 2.222 -5.486 1.00 0.00 C ATOM 0 H ILE A 57 2.163 0.192 -5.986 1.00 0.00 H new ATOM 0 HA ILE A 57 0.431 1.799 -7.657 1.00 0.00 H new ATOM 0 HB ILE A 57 -1.208 0.426 -6.442 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -1.134 3.256 -5.345 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -1.612 2.855 -6.983 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -1.436 0.608 -3.995 1.00 0.00 H new ATOM 0 HG22 ILE A 57 0.107 -0.142 -4.469 1.00 0.00 H new ATOM 0 HG23 ILE A 57 0.070 1.554 -3.933 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -3.569 3.146 -5.544 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -3.459 1.465 -6.117 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -2.973 1.872 -4.454 1.00 0.00 H new ATOM 925 N THR A 58 1.442 3.774 -6.602 1.00 0.00 N ATOM 926 CA THR A 58 2.163 4.932 -6.099 1.00 0.00 C ATOM 927 C THR A 58 1.239 5.828 -5.272 1.00 0.00 C ATOM 928 O THR A 58 0.051 5.974 -5.580 1.00 0.00 O ATOM 929 CB THR A 58 2.759 5.740 -7.269 1.00 0.00 C ATOM 930 OG1 THR A 58 3.431 4.857 -8.174 1.00 0.00 O ATOM 931 CG2 THR A 58 3.741 6.791 -6.770 1.00 0.00 C ATOM 0 H THR A 58 0.958 3.934 -7.485 1.00 0.00 H new ATOM 0 HA THR A 58 2.971 4.577 -5.460 1.00 0.00 H new ATOM 0 HB THR A 58 1.940 6.247 -7.780 1.00 0.00 H new ATOM 0 HG1 THR A 58 4.037 4.273 -7.672 1.00 0.00 H new ATOM 0 HG21 THR A 58 4.144 7.344 -7.618 1.00 0.00 H new ATOM 0 HG22 THR A 58 3.227 7.479 -6.099 1.00 0.00 H new ATOM 0 HG23 THR A 58 4.556 6.303 -6.235 1.00 0.00 H new ATOM 939 N LEU A 59 1.783 6.416 -4.217 1.00 0.00 N ATOM 940 CA LEU A 59 1.022 7.283 -3.334 1.00 0.00 C ATOM 941 C LEU A 59 1.730 8.619 -3.158 1.00 0.00 C ATOM 942 O LEU A 59 2.961 8.696 -3.213 1.00 0.00 O ATOM 943 CB LEU A 59 0.826 6.636 -1.954 1.00 0.00 C ATOM 944 CG LEU A 59 0.160 5.259 -1.941 1.00 0.00 C ATOM 945 CD1 LEU A 59 1.183 4.154 -2.158 1.00 0.00 C ATOM 946 CD2 LEU A 59 -0.582 5.049 -0.632 1.00 0.00 C ATOM 0 H LEU A 59 2.761 6.305 -3.951 1.00 0.00 H new ATOM 0 HA LEU A 59 0.046 7.442 -3.794 1.00 0.00 H new ATOM 0 HB2 LEU A 59 1.801 6.549 -1.475 1.00 0.00 H new ATOM 0 HB3 LEU A 59 0.229 7.311 -1.341 1.00 0.00 H new ATOM 0 HG LEU A 59 -0.556 5.218 -2.762 1.00 0.00 H new ATOM 0 HD11 LEU A 59 0.682 3.186 -2.144 1.00 0.00 H new ATOM 0 HD12 LEU A 59 1.672 4.295 -3.122 1.00 0.00 H new ATOM 0 HD13 LEU A 59 1.929 4.188 -1.364 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -1.052 4.066 -0.634 1.00 0.00 H new ATOM 0 HD22 LEU A 59 0.121 5.114 0.199 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -1.348 5.817 -0.520 1.00 0.00 H new ATOM 958 N SER A 60 0.947 9.666 -2.961 1.00 0.00 N ATOM 959 CA SER A 60 1.485 10.972 -2.628 1.00 0.00 C ATOM 960 C SER A 60 1.791 11.015 -1.133 1.00 0.00 C ATOM 961 O SER A 60 1.291 10.179 -0.382 1.00 0.00 O ATOM 962 CB SER A 60 0.473 12.055 -2.997 1.00 0.00 C ATOM 963 OG SER A 60 -0.093 11.804 -4.275 1.00 0.00 O ATOM 0 H SER A 60 -0.070 9.635 -3.027 1.00 0.00 H new ATOM 0 HA SER A 60 2.403 11.151 -3.188 1.00 0.00 H new ATOM 0 HB2 SER A 60 -0.316 12.092 -2.246 1.00 0.00 H new ATOM 0 HB3 SER A 60 0.961 13.030 -2.996 1.00 0.00 H new ATOM 0 HG SER A 60 -0.736 11.068 -4.209 1.00 0.00 H new ATOM 969 N ASN A 61 2.598 11.977 -0.701 1.00 0.00 N ATOM 970 CA ASN A 61 2.960 12.092 0.719 1.00 0.00 C ATOM 971 C ASN A 61 1.715 12.182 1.601 1.00 0.00 C ATOM 972 O ASN A 61 1.617 11.503 2.623 1.00 0.00 O ATOM 973 CB ASN A 61 3.861 13.310 0.948 1.00 0.00 C ATOM 974 CG ASN A 61 4.192 13.531 2.416 1.00 0.00 C ATOM 975 OD1 ASN A 61 5.111 12.917 2.958 1.00 0.00 O ATOM 976 ND2 ASN A 61 3.468 14.433 3.060 1.00 0.00 N ATOM 0 H ASN A 61 3.015 12.687 -1.303 1.00 0.00 H new ATOM 0 HA ASN A 61 3.509 11.192 0.997 1.00 0.00 H new ATOM 0 HB2 ASN A 61 4.787 13.182 0.387 1.00 0.00 H new ATOM 0 HB3 ASN A 61 3.369 14.199 0.553 1.00 0.00 H new ATOM 0 HD21 ASN A 61 3.664 14.639 4.039 1.00 0.00 H new ATOM 0 HD22 ASN A 61 2.714 14.922 2.577 1.00 0.00 H new ATOM 983 N GLU A 62 0.766 13.011 1.187 1.00 0.00 N ATOM 984 CA GLU A 62 -0.492 13.180 1.905 1.00 0.00 C ATOM 985 C GLU A 62 -1.223 11.843 2.041 1.00 0.00 C ATOM 986 O GLU A 62 -1.652 11.464 3.133 1.00 0.00 O ATOM 987 CB GLU A 62 -1.401 14.185 1.179 1.00 0.00 C ATOM 988 CG GLU A 62 -0.801 15.578 0.999 1.00 0.00 C ATOM 989 CD GLU A 62 0.313 15.619 -0.030 1.00 0.00 C ATOM 990 OE1 GLU A 62 0.009 15.688 -1.238 1.00 0.00 O ATOM 991 OE2 GLU A 62 1.495 15.560 0.366 1.00 0.00 O ATOM 0 H GLU A 62 0.845 13.584 0.347 1.00 0.00 H new ATOM 0 HA GLU A 62 -0.258 13.561 2.899 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -1.652 13.783 0.197 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -2.335 14.276 1.734 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -1.588 16.270 0.701 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -0.416 15.927 1.957 1.00 0.00 H new ATOM 998 N GLU A 63 -1.343 11.131 0.925 1.00 0.00 N ATOM 999 CA GLU A 63 -2.043 9.850 0.888 1.00 0.00 C ATOM 1000 C GLU A 63 -1.307 8.813 1.728 1.00 0.00 C ATOM 1001 O GLU A 63 -1.921 8.053 2.480 1.00 0.00 O ATOM 1002 CB GLU A 63 -2.150 9.354 -0.555 1.00 0.00 C ATOM 1003 CG GLU A 63 -2.666 10.401 -1.528 1.00 0.00 C ATOM 1004 CD GLU A 63 -2.729 9.884 -2.947 1.00 0.00 C ATOM 1005 OE1 GLU A 63 -1.655 9.636 -3.544 1.00 0.00 O ATOM 1006 OE2 GLU A 63 -3.842 9.706 -3.471 1.00 0.00 O ATOM 0 H GLU A 63 -0.961 11.423 0.025 1.00 0.00 H new ATOM 0 HA GLU A 63 -3.042 9.993 1.299 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -1.168 9.016 -0.887 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -2.811 8.488 -0.583 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -3.659 10.724 -1.217 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -2.019 11.278 -1.491 1.00 0.00 H new ATOM 1013 N PHE A 64 0.010 8.809 1.599 1.00 0.00 N ATOM 1014 CA PHE A 64 0.858 7.852 2.292 1.00 0.00 C ATOM 1015 C PHE A 64 0.762 8.046 3.802 1.00 0.00 C ATOM 1016 O PHE A 64 0.611 7.082 4.554 1.00 0.00 O ATOM 1017 CB PHE A 64 2.301 8.024 1.820 1.00 0.00 C ATOM 1018 CG PHE A 64 3.189 6.849 2.111 1.00 0.00 C ATOM 1019 CD1 PHE A 64 3.182 5.739 1.281 1.00 0.00 C ATOM 1020 CD2 PHE A 64 4.040 6.860 3.202 1.00 0.00 C ATOM 1021 CE1 PHE A 64 4.007 4.662 1.536 1.00 0.00 C ATOM 1022 CE2 PHE A 64 4.867 5.786 3.462 1.00 0.00 C ATOM 1023 CZ PHE A 64 4.851 4.686 2.627 1.00 0.00 C ATOM 0 H PHE A 64 0.521 9.468 1.012 1.00 0.00 H new ATOM 0 HA PHE A 64 0.522 6.841 2.062 1.00 0.00 H new ATOM 0 HB2 PHE A 64 2.300 8.207 0.745 1.00 0.00 H new ATOM 0 HB3 PHE A 64 2.723 8.910 2.294 1.00 0.00 H new ATOM 0 HD1 PHE A 64 2.524 5.716 0.425 1.00 0.00 H new ATOM 0 HD2 PHE A 64 4.057 7.718 3.857 1.00 0.00 H new ATOM 0 HE1 PHE A 64 3.992 3.802 0.883 1.00 0.00 H new ATOM 0 HE2 PHE A 64 5.526 5.806 4.317 1.00 0.00 H new ATOM 0 HZ PHE A 64 5.499 3.845 2.828 1.00 0.00 H new ATOM 1033 N GLN A 65 0.834 9.297 4.241 1.00 0.00 N ATOM 1034 CA GLN A 65 0.711 9.619 5.656 1.00 0.00 C ATOM 1035 C GLN A 65 -0.671 9.223 6.171 1.00 0.00 C ATOM 1036 O GLN A 65 -0.816 8.780 7.315 1.00 0.00 O ATOM 1037 CB GLN A 65 0.954 11.113 5.891 1.00 0.00 C ATOM 1038 CG GLN A 65 0.899 11.526 7.355 1.00 0.00 C ATOM 1039 CD GLN A 65 1.954 10.835 8.202 1.00 0.00 C ATOM 1040 OE1 GLN A 65 3.069 11.332 8.348 1.00 0.00 O ATOM 1041 NE2 GLN A 65 1.609 9.689 8.769 1.00 0.00 N ATOM 0 H GLN A 65 0.977 10.105 3.636 1.00 0.00 H new ATOM 0 HA GLN A 65 1.466 9.055 6.204 1.00 0.00 H new ATOM 0 HB2 GLN A 65 1.930 11.380 5.485 1.00 0.00 H new ATOM 0 HB3 GLN A 65 0.210 11.684 5.335 1.00 0.00 H new ATOM 0 HG2 GLN A 65 1.031 12.606 7.428 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -0.089 11.297 7.755 1.00 0.00 H new ATOM 0 HE21 GLN A 65 0.674 9.309 8.624 1.00 0.00 H new ATOM 0 HE22 GLN A 65 2.279 9.186 9.351 1.00 0.00 H new ATOM 1050 N THR A 66 -1.677 9.376 5.315 1.00 0.00 N ATOM 1051 CA THR A 66 -3.048 9.028 5.661 1.00 0.00 C ATOM 1052 C THR A 66 -3.162 7.562 6.074 1.00 0.00 C ATOM 1053 O THR A 66 -3.683 7.255 7.150 1.00 0.00 O ATOM 1054 CB THR A 66 -4.004 9.313 4.487 1.00 0.00 C ATOM 1055 OG1 THR A 66 -4.031 10.721 4.216 1.00 0.00 O ATOM 1056 CG2 THR A 66 -5.412 8.820 4.791 1.00 0.00 C ATOM 0 H THR A 66 -1.565 9.742 4.370 1.00 0.00 H new ATOM 0 HA THR A 66 -3.334 9.651 6.509 1.00 0.00 H new ATOM 0 HB THR A 66 -3.638 8.777 3.611 1.00 0.00 H new ATOM 0 HG1 THR A 66 -3.141 11.017 3.932 1.00 0.00 H new ATOM 0 HG21 THR A 66 -6.064 9.035 3.944 1.00 0.00 H new ATOM 0 HG22 THR A 66 -5.391 7.745 4.968 1.00 0.00 H new ATOM 0 HG23 THR A 66 -5.791 9.327 5.678 1.00 0.00 H new ATOM 1064 N MET A 67 -2.656 6.661 5.233 1.00 0.00 N ATOM 1065 CA MET A 67 -2.755 5.233 5.510 1.00 0.00 C ATOM 1066 C MET A 67 -2.013 4.886 6.801 1.00 0.00 C ATOM 1067 O MET A 67 -2.500 4.103 7.610 1.00 0.00 O ATOM 1068 CB MET A 67 -2.222 4.389 4.337 1.00 0.00 C ATOM 1069 CG MET A 67 -0.705 4.301 4.250 1.00 0.00 C ATOM 1070 SD MET A 67 -0.143 3.178 2.961 1.00 0.00 S ATOM 1071 CE MET A 67 1.600 3.071 3.360 1.00 0.00 C ATOM 0 H MET A 67 -2.178 6.894 4.363 1.00 0.00 H new ATOM 0 HA MET A 67 -3.811 4.993 5.636 1.00 0.00 H new ATOM 0 HB2 MET A 67 -2.626 3.380 4.421 1.00 0.00 H new ATOM 0 HB3 MET A 67 -2.601 4.808 3.405 1.00 0.00 H new ATOM 0 HG2 MET A 67 -0.298 5.295 4.062 1.00 0.00 H new ATOM 0 HG3 MET A 67 -0.309 3.971 5.211 1.00 0.00 H new ATOM 0 HE1 MET A 67 2.140 2.638 2.518 1.00 0.00 H new ATOM 0 HE2 MET A 67 1.988 4.069 3.565 1.00 0.00 H new ATOM 0 HE3 MET A 67 1.734 2.441 4.240 1.00 0.00 H new ATOM 1081 N VAL A 68 -0.855 5.506 7.003 1.00 0.00 N ATOM 1082 CA VAL A 68 -0.049 5.242 8.187 1.00 0.00 C ATOM 1083 C VAL A 68 -0.805 5.623 9.455 1.00 0.00 C ATOM 1084 O VAL A 68 -0.874 4.840 10.399 1.00 0.00 O ATOM 1085 CB VAL A 68 1.292 6.001 8.142 1.00 0.00 C ATOM 1086 CG1 VAL A 68 2.096 5.748 9.406 1.00 0.00 C ATOM 1087 CG2 VAL A 68 2.094 5.596 6.919 1.00 0.00 C ATOM 0 H VAL A 68 -0.455 6.193 6.363 1.00 0.00 H new ATOM 0 HA VAL A 68 0.159 4.172 8.199 1.00 0.00 H new ATOM 0 HB VAL A 68 1.076 7.067 8.078 1.00 0.00 H new ATOM 0 HG11 VAL A 68 3.038 6.293 9.353 1.00 0.00 H new ATOM 0 HG12 VAL A 68 1.528 6.088 10.272 1.00 0.00 H new ATOM 0 HG13 VAL A 68 2.299 4.681 9.501 1.00 0.00 H new ATOM 0 HG21 VAL A 68 3.037 6.142 6.905 1.00 0.00 H new ATOM 0 HG22 VAL A 68 2.295 4.525 6.954 1.00 0.00 H new ATOM 0 HG23 VAL A 68 1.526 5.829 6.018 1.00 0.00 H new ATOM 1097 N ASP A 69 -1.383 6.813 9.455 1.00 0.00 N ATOM 1098 CA ASP A 69 -2.132 7.303 10.608 1.00 0.00 C ATOM 1099 C ASP A 69 -3.388 6.466 10.848 1.00 0.00 C ATOM 1100 O ASP A 69 -3.665 6.045 11.974 1.00 0.00 O ATOM 1101 CB ASP A 69 -2.509 8.770 10.395 1.00 0.00 C ATOM 1102 CG ASP A 69 -3.389 9.316 11.502 1.00 0.00 C ATOM 1103 OD1 ASP A 69 -2.849 9.729 12.550 1.00 0.00 O ATOM 1104 OD2 ASP A 69 -4.622 9.350 11.319 1.00 0.00 O ATOM 0 H ASP A 69 -1.349 7.462 8.669 1.00 0.00 H new ATOM 0 HA ASP A 69 -1.498 7.216 11.490 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -1.600 9.368 10.331 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -3.027 8.873 9.441 1.00 0.00 H new ATOM 1109 N ALA A 70 -4.131 6.208 9.778 1.00 0.00 N ATOM 1110 CA ALA A 70 -5.377 5.460 9.873 1.00 0.00 C ATOM 1111 C ALA A 70 -5.135 4.032 10.355 1.00 0.00 C ATOM 1112 O ALA A 70 -5.884 3.515 11.184 1.00 0.00 O ATOM 1113 CB ALA A 70 -6.090 5.457 8.533 1.00 0.00 C ATOM 0 H ALA A 70 -3.891 6.507 8.833 1.00 0.00 H new ATOM 0 HA ALA A 70 -6.011 5.954 10.609 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -7.020 4.895 8.617 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -6.311 6.482 8.236 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -5.451 4.992 7.782 1.00 0.00 H new ATOM 1119 N PHE A 71 -4.088 3.402 9.840 1.00 0.00 N ATOM 1120 CA PHE A 71 -3.748 2.043 10.246 1.00 0.00 C ATOM 1121 C PHE A 71 -3.106 2.026 11.628 1.00 0.00 C ATOM 1122 O PHE A 71 -3.207 1.033 12.352 1.00 0.00 O ATOM 1123 CB PHE A 71 -2.824 1.379 9.227 1.00 0.00 C ATOM 1124 CG PHE A 71 -3.478 1.134 7.899 1.00 0.00 C ATOM 1125 CD1 PHE A 71 -4.810 0.756 7.828 1.00 0.00 C ATOM 1126 CD2 PHE A 71 -2.763 1.279 6.723 1.00 0.00 C ATOM 1127 CE1 PHE A 71 -5.414 0.531 6.610 1.00 0.00 C ATOM 1128 CE2 PHE A 71 -3.364 1.055 5.503 1.00 0.00 C ATOM 1129 CZ PHE A 71 -4.689 0.681 5.445 1.00 0.00 C ATOM 0 H PHE A 71 -3.462 3.806 9.144 1.00 0.00 H new ATOM 0 HA PHE A 71 -4.677 1.474 10.291 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -1.946 2.008 9.080 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -2.473 0.430 9.631 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -5.380 0.637 8.737 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -1.724 1.571 6.762 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -6.453 0.238 6.567 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -2.796 1.173 4.592 1.00 0.00 H new ATOM 0 HZ PHE A 71 -5.160 0.505 4.489 1.00 0.00 H new ATOM 1139 N LYS A 72 -2.448 3.126 11.988 1.00 0.00 N ATOM 1140 CA LYS A 72 -1.873 3.275 13.319 1.00 0.00 C ATOM 1141 C LYS A 72 -2.959 3.093 14.367 1.00 0.00 C ATOM 1142 O LYS A 72 -2.748 2.446 15.391 1.00 0.00 O ATOM 1143 CB LYS A 72 -1.205 4.649 13.471 1.00 0.00 C ATOM 1144 CG LYS A 72 -0.601 4.895 14.846 1.00 0.00 C ATOM 1145 CD LYS A 72 0.265 6.144 14.865 1.00 0.00 C ATOM 1146 CE LYS A 72 0.866 6.374 16.241 1.00 0.00 C ATOM 1147 NZ LYS A 72 1.932 7.411 16.226 1.00 0.00 N ATOM 0 H LYS A 72 -2.301 3.927 11.374 1.00 0.00 H new ATOM 0 HA LYS A 72 -1.108 2.511 13.461 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -0.422 4.746 12.719 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -1.942 5.425 13.265 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -1.399 4.995 15.581 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -0.002 4.033 15.140 1.00 0.00 H new ATOM 0 HD2 LYS A 72 1.063 6.048 14.128 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -0.333 7.009 14.577 1.00 0.00 H new ATOM 0 HE2 LYS A 72 0.079 6.675 16.933 1.00 0.00 H new ATOM 0 HE3 LYS A 72 1.279 5.437 16.616 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 2.459 7.380 17.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 2.582 7.229 15.435 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 1.501 8.350 16.110 1.00 0.00 H new ATOM 1161 N GLY A 73 -4.128 3.638 14.080 1.00 0.00 N ATOM 1162 CA GLY A 73 -5.260 3.460 14.962 1.00 0.00 C ATOM 1163 C GLY A 73 -6.216 2.397 14.451 1.00 0.00 C ATOM 1164 O GLY A 73 -7.434 2.557 14.537 1.00 0.00 O ATOM 0 H GLY A 73 -4.314 4.202 13.251 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -4.906 3.183 15.955 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -5.791 4.406 15.066 1.00 0.00 H new ATOM 1168 N ASN A 74 -5.669 1.316 13.902 1.00 0.00 N ATOM 1169 CA ASN A 74 -6.492 0.232 13.371 1.00 0.00 C ATOM 1170 C ASN A 74 -5.806 -1.123 13.530 1.00 0.00 C ATOM 1171 O ASN A 74 -6.146 -1.899 14.419 1.00 0.00 O ATOM 1172 CB ASN A 74 -6.817 0.478 11.892 1.00 0.00 C ATOM 1173 CG ASN A 74 -7.688 -0.612 11.278 1.00 0.00 C ATOM 1174 OD1 ASN A 74 -8.625 -1.150 12.048 1.00 0.00 O flip ATOM 1175 ND2 ASN A 74 -7.536 -0.950 10.106 1.00 0.00 N flip ATOM 0 H ASN A 74 -4.664 1.167 13.813 1.00 0.00 H new ATOM 0 HA ASN A 74 -7.418 0.215 13.945 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -7.324 1.438 11.793 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -5.886 0.550 11.329 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -6.806 -0.517 9.541 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -8.140 -1.664 9.699 1.00 0.00 H new ATOM 1182 N LEU A 75 -4.809 -1.387 12.692 1.00 0.00 N ATOM 1183 CA LEU A 75 -4.233 -2.722 12.598 1.00 0.00 C ATOM 1184 C LEU A 75 -3.051 -2.897 13.551 1.00 0.00 C ATOM 1185 O LEU A 75 -2.212 -3.776 13.366 1.00 0.00 O ATOM 1186 CB LEU A 75 -3.797 -3.018 11.158 1.00 0.00 C ATOM 1187 CG LEU A 75 -3.461 -4.487 10.876 1.00 0.00 C ATOM 1188 CD1 LEU A 75 -4.700 -5.355 11.021 1.00 0.00 C ATOM 1189 CD2 LEU A 75 -2.859 -4.648 9.490 1.00 0.00 C ATOM 0 H LEU A 75 -4.385 -0.697 12.071 1.00 0.00 H new ATOM 0 HA LEU A 75 -5.006 -3.432 12.891 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -4.592 -2.706 10.481 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -2.923 -2.409 10.926 1.00 0.00 H new ATOM 0 HG LEU A 75 -2.722 -4.812 11.608 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -4.442 -6.394 10.817 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -5.087 -5.270 12.036 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -5.461 -5.024 10.314 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -2.629 -5.699 9.313 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -3.571 -4.301 8.741 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -1.944 -4.060 9.420 1.00 0.00 H new ATOM 1201 N GLU A 76 -2.974 -2.071 14.582 1.00 0.00 N ATOM 1202 CA GLU A 76 -1.970 -2.279 15.609 1.00 0.00 C ATOM 1203 C GLU A 76 -2.463 -3.336 16.586 1.00 0.00 C ATOM 1204 O GLU A 76 -1.692 -3.898 17.360 1.00 0.00 O ATOM 1205 CB GLU A 76 -1.646 -0.981 16.353 1.00 0.00 C ATOM 1206 CG GLU A 76 -2.824 -0.381 17.098 1.00 0.00 C ATOM 1207 CD GLU A 76 -2.386 0.430 18.297 1.00 0.00 C ATOM 1208 OE1 GLU A 76 -1.787 1.506 18.114 1.00 0.00 O ATOM 1209 OE2 GLU A 76 -2.615 -0.026 19.435 1.00 0.00 O ATOM 0 H GLU A 76 -3.583 -1.266 14.728 1.00 0.00 H new ATOM 0 HA GLU A 76 -1.052 -2.618 15.129 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -0.841 -1.173 17.063 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -1.272 -0.249 15.637 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -3.395 0.254 16.421 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -3.490 -1.179 17.425 1.00 0.00 H new ATOM 1216 N HIS A 77 -3.761 -3.612 16.529 1.00 0.00 N ATOM 1217 CA HIS A 77 -4.371 -4.584 17.416 1.00 0.00 C ATOM 1218 C HIS A 77 -4.656 -5.895 16.701 1.00 0.00 C ATOM 1219 O HIS A 77 -5.767 -6.127 16.225 1.00 0.00 O ATOM 1220 CB HIS A 77 -5.666 -4.038 18.022 1.00 0.00 C ATOM 1221 CG HIS A 77 -5.482 -3.377 19.348 1.00 0.00 C ATOM 1222 ND1 HIS A 77 -4.734 -2.312 19.714 1.00 0.00 N flip ATOM 1223 CD2 HIS A 77 -6.121 -3.802 20.492 1.00 0.00 C flip ATOM 1224 CE1 HIS A 77 -4.931 -2.117 21.057 1.00 0.00 C flip ATOM 1225 NE2 HIS A 77 -5.770 -3.030 21.500 1.00 0.00 N flip ATOM 0 H HIS A 77 -4.409 -3.173 15.875 1.00 0.00 H new ATOM 0 HA HIS A 77 -3.656 -4.776 18.216 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -6.107 -3.322 17.328 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -6.378 -4.856 18.131 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -6.803 -4.637 20.553 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -4.473 -1.342 21.653 1.00 0.00 H new ATOM 0 HE2 HIS A 77 -6.094 -3.124 22.463 1.00 0.00 H new ATOM 1234 N HIS A 78 -3.644 -6.739 16.600 1.00 0.00 N ATOM 1235 CA HIS A 78 -3.859 -8.106 16.161 1.00 0.00 C ATOM 1236 C HIS A 78 -4.073 -8.973 17.390 1.00 0.00 C ATOM 1237 O HIS A 78 -3.275 -8.937 18.328 1.00 0.00 O ATOM 1238 CB HIS A 78 -2.697 -8.630 15.287 1.00 0.00 C ATOM 1239 CG HIS A 78 -1.330 -8.536 15.902 1.00 0.00 C ATOM 1240 ND1 HIS A 78 -0.402 -7.589 15.526 1.00 0.00 N ATOM 1241 CD2 HIS A 78 -0.726 -9.292 16.848 1.00 0.00 C ATOM 1242 CE1 HIS A 78 0.712 -7.767 16.215 1.00 0.00 C ATOM 1243 NE2 HIS A 78 0.539 -8.794 17.024 1.00 0.00 N ATOM 0 H HIS A 78 -2.674 -6.505 16.814 1.00 0.00 H new ATOM 0 HA HIS A 78 -4.743 -8.143 15.525 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -2.894 -9.673 15.040 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -2.693 -8.075 14.349 1.00 0.00 H new ATOM 0 HD1 HIS A 78 -0.552 -6.863 14.825 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -1.160 -10.133 17.368 1.00 0.00 H new ATOM 0 HE1 HIS A 78 1.610 -7.173 16.130 1.00 0.00 H new ATOM 1252 N HIS A 79 -5.166 -9.712 17.414 1.00 0.00 N ATOM 1253 CA HIS A 79 -5.531 -10.473 18.598 1.00 0.00 C ATOM 1254 C HIS A 79 -5.477 -11.966 18.330 1.00 0.00 C ATOM 1255 O HIS A 79 -6.105 -12.470 17.398 1.00 0.00 O ATOM 1256 CB HIS A 79 -6.918 -10.064 19.130 1.00 0.00 C ATOM 1257 CG HIS A 79 -8.016 -10.058 18.107 1.00 0.00 C ATOM 1258 ND1 HIS A 79 -8.806 -11.156 17.832 1.00 0.00 N ATOM 1259 CD2 HIS A 79 -8.463 -9.068 17.296 1.00 0.00 C ATOM 1260 CE1 HIS A 79 -9.687 -10.840 16.901 1.00 0.00 C ATOM 1261 NE2 HIS A 79 -9.500 -9.581 16.560 1.00 0.00 N ATOM 0 H HIS A 79 -5.815 -9.803 16.632 1.00 0.00 H new ATOM 0 HA HIS A 79 -4.797 -10.240 19.370 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -7.196 -10.744 19.935 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -6.843 -9.068 19.566 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -8.074 -8.062 17.240 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -10.435 -11.501 16.489 1.00 0.00 H new ATOM 0 HE2 HIS A 79 -10.040 -9.070 15.861 1.00 0.00 H new ATOM 1270 N HIS A 80 -4.709 -12.664 19.153 1.00 0.00 N ATOM 1271 CA HIS A 80 -4.589 -14.106 19.044 1.00 0.00 C ATOM 1272 C HIS A 80 -5.246 -14.766 20.248 1.00 0.00 C ATOM 1273 O HIS A 80 -5.097 -14.304 21.381 1.00 0.00 O ATOM 1274 CB HIS A 80 -3.116 -14.541 18.907 1.00 0.00 C ATOM 1275 CG HIS A 80 -2.272 -14.386 20.146 1.00 0.00 C ATOM 1276 ND1 HIS A 80 -1.546 -13.249 20.436 1.00 0.00 N ATOM 1277 CD2 HIS A 80 -2.015 -15.256 21.154 1.00 0.00 C ATOM 1278 CE1 HIS A 80 -0.880 -13.430 21.563 1.00 0.00 C ATOM 1279 NE2 HIS A 80 -1.148 -14.636 22.017 1.00 0.00 N ATOM 0 H HIS A 80 -4.158 -12.251 19.906 1.00 0.00 H new ATOM 0 HA HIS A 80 -5.103 -14.430 18.139 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -3.092 -15.587 18.602 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -2.659 -13.964 18.103 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -2.418 -16.252 21.258 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -0.226 -12.710 22.032 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -0.772 -15.044 22.873 1.00 0.00 H new ATOM 1288 N HIS A 81 -5.989 -15.825 19.994 1.00 0.00 N ATOM 1289 CA HIS A 81 -6.676 -16.545 21.049 1.00 0.00 C ATOM 1290 C HIS A 81 -6.132 -17.966 21.130 1.00 0.00 C ATOM 1291 O HIS A 81 -5.711 -18.528 20.119 1.00 0.00 O ATOM 1292 CB HIS A 81 -8.185 -16.556 20.771 1.00 0.00 C ATOM 1293 CG HIS A 81 -9.001 -17.211 21.842 1.00 0.00 C ATOM 1294 ND1 HIS A 81 -9.341 -18.544 21.819 1.00 0.00 N ATOM 1295 CD2 HIS A 81 -9.540 -16.706 22.974 1.00 0.00 C ATOM 1296 CE1 HIS A 81 -10.051 -18.832 22.893 1.00 0.00 C ATOM 1297 NE2 HIS A 81 -10.185 -17.733 23.612 1.00 0.00 N ATOM 0 H HIS A 81 -6.133 -16.208 19.060 1.00 0.00 H new ATOM 0 HA HIS A 81 -6.505 -16.050 22.005 1.00 0.00 H new ATOM 0 HB2 HIS A 81 -8.528 -15.529 20.646 1.00 0.00 H new ATOM 0 HB3 HIS A 81 -8.366 -17.070 19.827 1.00 0.00 H new ATOM 0 HD2 HIS A 81 -9.474 -15.683 23.313 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -10.454 -19.802 23.142 1.00 0.00 H new ATOM 0 HE2 HIS A 81 -10.686 -17.660 24.497 1.00 0.00 H new ATOM 1306 N HIS A 82 -6.119 -18.532 22.325 1.00 0.00 N ATOM 1307 CA HIS A 82 -5.653 -19.894 22.515 1.00 0.00 C ATOM 1308 C HIS A 82 -6.737 -20.875 22.080 1.00 0.00 C ATOM 1309 O HIS A 82 -7.661 -21.127 22.873 1.00 0.00 O ATOM 1310 CB HIS A 82 -5.274 -20.134 23.980 1.00 0.00 C ATOM 1311 CG HIS A 82 -4.602 -21.454 24.227 1.00 0.00 C ATOM 1312 ND1 HIS A 82 -3.238 -21.585 24.368 1.00 0.00 N ATOM 1313 CD2 HIS A 82 -5.111 -22.704 24.365 1.00 0.00 C ATOM 1314 CE1 HIS A 82 -2.938 -22.850 24.578 1.00 0.00 C ATOM 1315 NE2 HIS A 82 -4.052 -23.549 24.583 1.00 0.00 N ATOM 1316 OXT HIS A 82 -6.666 -21.384 20.943 1.00 0.00 O ATOM 0 H HIS A 82 -6.427 -18.068 23.180 1.00 0.00 H new ATOM 0 HA HIS A 82 -4.765 -20.051 21.903 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -4.612 -19.333 24.310 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -6.174 -20.076 24.592 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -6.153 -22.982 24.313 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -1.944 -23.247 24.722 1.00 0.00 H new ATOM 0 HE2 HIS A 82 -4.118 -24.557 24.726 1.00 0.00 H new TER 1325 HIS A 82 ATOM 1326 N MET B 1 -16.739 -27.483 -7.583 1.00 0.00 N ATOM 1327 CA MET B 1 -16.428 -28.925 -7.441 1.00 0.00 C ATOM 1328 C MET B 1 -15.256 -29.315 -8.336 1.00 0.00 C ATOM 1329 O MET B 1 -14.241 -29.819 -7.855 1.00 0.00 O ATOM 1330 CB MET B 1 -17.643 -29.793 -7.787 1.00 0.00 C ATOM 1331 CG MET B 1 -18.808 -29.638 -6.825 1.00 0.00 C ATOM 1332 SD MET B 1 -20.132 -30.824 -7.144 1.00 0.00 S ATOM 1333 CE MET B 1 -20.558 -30.421 -8.838 1.00 0.00 C ATOM 0 H1 MET B 1 -17.539 -27.238 -6.966 1.00 0.00 H new ATOM 0 H2 MET B 1 -15.908 -26.920 -7.312 1.00 0.00 H new ATOM 0 H3 MET B 1 -16.989 -27.277 -8.571 1.00 0.00 H new ATOM 0 HA MET B 1 -16.159 -29.098 -6.399 1.00 0.00 H new ATOM 0 HB2 MET B 1 -17.980 -29.543 -8.793 1.00 0.00 H new ATOM 0 HB3 MET B 1 -17.336 -30.839 -7.804 1.00 0.00 H new ATOM 0 HG2 MET B 1 -18.450 -29.764 -5.803 1.00 0.00 H new ATOM 0 HG3 MET B 1 -19.205 -28.626 -6.901 1.00 0.00 H new ATOM 0 HE1 MET B 1 -21.527 -30.856 -9.083 1.00 0.00 H new ATOM 0 HE2 MET B 1 -20.607 -29.338 -8.953 1.00 0.00 H new ATOM 0 HE3 MET B 1 -19.799 -30.823 -9.509 1.00 0.00 H new ATOM 1345 N LYS B 2 -15.394 -29.085 -9.639 1.00 0.00 N ATOM 1346 CA LYS B 2 -14.344 -29.458 -10.580 1.00 0.00 C ATOM 1347 C LYS B 2 -13.757 -28.229 -11.270 1.00 0.00 C ATOM 1348 O LYS B 2 -12.583 -28.219 -11.635 1.00 0.00 O ATOM 1349 CB LYS B 2 -14.852 -30.474 -11.623 1.00 0.00 C ATOM 1350 CG LYS B 2 -15.923 -29.953 -12.579 1.00 0.00 C ATOM 1351 CD LYS B 2 -17.273 -29.782 -11.900 1.00 0.00 C ATOM 1352 CE LYS B 2 -18.366 -29.406 -12.891 1.00 0.00 C ATOM 1353 NZ LYS B 2 -18.698 -30.528 -13.807 1.00 0.00 N ATOM 0 H LYS B 2 -16.212 -28.648 -10.063 1.00 0.00 H new ATOM 0 HA LYS B 2 -13.552 -29.937 -10.004 1.00 0.00 H new ATOM 0 HB2 LYS B 2 -14.002 -30.821 -12.211 1.00 0.00 H new ATOM 0 HB3 LYS B 2 -15.250 -31.341 -11.096 1.00 0.00 H new ATOM 0 HG2 LYS B 2 -15.603 -28.996 -12.992 1.00 0.00 H new ATOM 0 HG3 LYS B 2 -16.025 -30.643 -13.416 1.00 0.00 H new ATOM 0 HD2 LYS B 2 -17.545 -30.709 -11.395 1.00 0.00 H new ATOM 0 HD3 LYS B 2 -17.198 -29.011 -11.133 1.00 0.00 H new ATOM 0 HE2 LYS B 2 -19.261 -29.106 -12.346 1.00 0.00 H new ATOM 0 HE3 LYS B 2 -18.044 -28.544 -13.476 1.00 0.00 H new ATOM 0 HZ1 LYS B 2 -19.573 -30.307 -14.324 1.00 0.00 H new ATOM 0 HZ2 LYS B 2 -17.921 -30.665 -14.484 1.00 0.00 H new ATOM 0 HZ3 LYS B 2 -18.833 -31.399 -13.255 1.00 0.00 H new ATOM 1367 N LYS B 3 -14.570 -27.192 -11.416 1.00 0.00 N ATOM 1368 CA LYS B 3 -14.144 -25.961 -12.074 1.00 0.00 C ATOM 1369 C LYS B 3 -15.181 -24.863 -11.838 1.00 0.00 C ATOM 1370 O LYS B 3 -16.356 -25.160 -11.607 1.00 0.00 O ATOM 1371 CB LYS B 3 -13.948 -26.197 -13.581 1.00 0.00 C ATOM 1372 CG LYS B 3 -13.297 -25.033 -14.316 1.00 0.00 C ATOM 1373 CD LYS B 3 -11.912 -24.722 -13.764 1.00 0.00 C ATOM 1374 CE LYS B 3 -11.215 -23.630 -14.565 1.00 0.00 C ATOM 1375 NZ LYS B 3 -10.931 -24.054 -15.964 1.00 0.00 N ATOM 0 H LYS B 3 -15.535 -27.178 -11.086 1.00 0.00 H new ATOM 0 HA LYS B 3 -13.191 -25.646 -11.650 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -13.336 -27.088 -13.721 1.00 0.00 H new ATOM 0 HB3 LYS B 3 -14.918 -26.402 -14.034 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -13.221 -25.270 -15.377 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -13.930 -24.149 -14.231 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -11.997 -24.411 -12.723 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -11.304 -25.627 -13.777 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -11.839 -22.736 -14.577 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -10.281 -23.360 -14.072 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -10.258 -23.391 -16.398 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -10.522 -25.010 -15.961 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -11.815 -24.058 -16.512 1.00 0.00 H new ATOM 1389 N MET B 4 -14.748 -23.608 -11.883 1.00 0.00 N ATOM 1390 CA MET B 4 -15.643 -22.474 -11.669 1.00 0.00 C ATOM 1391 C MET B 4 -15.404 -21.402 -12.724 1.00 0.00 C ATOM 1392 O MET B 4 -14.406 -21.444 -13.448 1.00 0.00 O ATOM 1393 CB MET B 4 -15.443 -21.886 -10.267 1.00 0.00 C ATOM 1394 CG MET B 4 -14.062 -21.286 -10.042 1.00 0.00 C ATOM 1395 SD MET B 4 -13.857 -20.606 -8.383 1.00 0.00 S ATOM 1396 CE MET B 4 -12.173 -19.997 -8.474 1.00 0.00 C ATOM 0 H MET B 4 -13.779 -23.348 -12.066 1.00 0.00 H new ATOM 0 HA MET B 4 -16.670 -22.829 -11.755 1.00 0.00 H new ATOM 0 HB2 MET B 4 -16.195 -21.116 -10.096 1.00 0.00 H new ATOM 0 HB3 MET B 4 -15.613 -22.668 -9.528 1.00 0.00 H new ATOM 0 HG2 MET B 4 -13.306 -22.053 -10.212 1.00 0.00 H new ATOM 0 HG3 MET B 4 -13.889 -20.499 -10.776 1.00 0.00 H new ATOM 0 HE1 MET B 4 -12.037 -19.192 -7.751 1.00 0.00 H new ATOM 0 HE2 MET B 4 -11.480 -20.808 -8.249 1.00 0.00 H new ATOM 0 HE3 MET B 4 -11.976 -19.620 -9.478 1.00 0.00 H new ATOM 1406 N ALA B 5 -16.319 -20.448 -12.812 1.00 0.00 N ATOM 1407 CA ALA B 5 -16.188 -19.353 -13.763 1.00 0.00 C ATOM 1408 C ALA B 5 -15.428 -18.190 -13.139 1.00 0.00 C ATOM 1409 O ALA B 5 -15.905 -17.569 -12.185 1.00 0.00 O ATOM 1410 CB ALA B 5 -17.558 -18.903 -14.246 1.00 0.00 C ATOM 0 H ALA B 5 -17.160 -20.410 -12.237 1.00 0.00 H new ATOM 0 HA ALA B 5 -15.620 -19.708 -14.623 1.00 0.00 H new ATOM 0 HB1 ALA B 5 -17.443 -18.084 -14.956 1.00 0.00 H new ATOM 0 HB2 ALA B 5 -18.064 -19.737 -14.733 1.00 0.00 H new ATOM 0 HB3 ALA B 5 -18.151 -18.565 -13.396 1.00 0.00 H new ATOM 1416 N GLU B 6 -14.245 -17.907 -13.685 1.00 0.00 N ATOM 1417 CA GLU B 6 -13.370 -16.852 -13.176 1.00 0.00 C ATOM 1418 C GLU B 6 -13.006 -17.092 -11.714 1.00 0.00 C ATOM 1419 O GLU B 6 -12.154 -17.929 -11.407 1.00 0.00 O ATOM 1420 CB GLU B 6 -13.995 -15.459 -13.350 1.00 0.00 C ATOM 1421 CG GLU B 6 -13.985 -14.936 -14.781 1.00 0.00 C ATOM 1422 CD GLU B 6 -14.847 -15.747 -15.728 1.00 0.00 C ATOM 1423 OE1 GLU B 6 -16.080 -15.565 -15.717 1.00 0.00 O ATOM 1424 OE2 GLU B 6 -14.292 -16.564 -16.491 1.00 0.00 O ATOM 0 H GLU B 6 -13.867 -18.403 -14.492 1.00 0.00 H new ATOM 0 HA GLU B 6 -12.456 -16.885 -13.769 1.00 0.00 H new ATOM 0 HB2 GLU B 6 -15.025 -15.490 -12.995 1.00 0.00 H new ATOM 0 HB3 GLU B 6 -13.460 -14.753 -12.715 1.00 0.00 H new ATOM 0 HG2 GLU B 6 -14.330 -13.902 -14.784 1.00 0.00 H new ATOM 0 HG3 GLU B 6 -12.959 -14.931 -15.150 1.00 0.00 H new ATOM 1431 N PHE B 7 -13.670 -16.365 -10.826 1.00 0.00 N ATOM 1432 CA PHE B 7 -13.436 -16.467 -9.396 1.00 0.00 C ATOM 1433 C PHE B 7 -14.470 -15.629 -8.655 1.00 0.00 C ATOM 1434 O PHE B 7 -15.293 -14.951 -9.280 1.00 0.00 O ATOM 1435 CB PHE B 7 -12.013 -16.010 -9.040 1.00 0.00 C ATOM 1436 CG PHE B 7 -11.701 -14.575 -9.390 1.00 0.00 C ATOM 1437 CD1 PHE B 7 -11.365 -14.219 -10.686 1.00 0.00 C ATOM 1438 CD2 PHE B 7 -11.737 -13.588 -8.417 1.00 0.00 C ATOM 1439 CE1 PHE B 7 -11.073 -12.907 -11.006 1.00 0.00 C ATOM 1440 CE2 PHE B 7 -11.444 -12.273 -8.732 1.00 0.00 C ATOM 1441 CZ PHE B 7 -11.112 -11.933 -10.029 1.00 0.00 C ATOM 0 H PHE B 7 -14.388 -15.686 -11.080 1.00 0.00 H new ATOM 0 HA PHE B 7 -13.534 -17.510 -9.094 1.00 0.00 H new ATOM 0 HB2 PHE B 7 -11.859 -16.150 -7.970 1.00 0.00 H new ATOM 0 HB3 PHE B 7 -11.300 -16.657 -9.552 1.00 0.00 H new ATOM 0 HD1 PHE B 7 -11.331 -14.976 -11.455 1.00 0.00 H new ATOM 0 HD2 PHE B 7 -11.997 -13.849 -7.402 1.00 0.00 H new ATOM 0 HE1 PHE B 7 -10.814 -12.644 -12.021 1.00 0.00 H new ATOM 0 HE2 PHE B 7 -11.475 -11.513 -7.965 1.00 0.00 H new ATOM 0 HZ PHE B 7 -10.883 -10.907 -10.278 1.00 0.00 H new ATOM 1451 N THR B 8 -14.434 -15.676 -7.334 1.00 0.00 N ATOM 1452 CA THR B 8 -15.362 -14.915 -6.516 1.00 0.00 C ATOM 1453 C THR B 8 -14.613 -13.844 -5.726 1.00 0.00 C ATOM 1454 O THR B 8 -13.516 -14.089 -5.230 1.00 0.00 O ATOM 1455 CB THR B 8 -16.123 -15.841 -5.544 1.00 0.00 C ATOM 1456 OG1 THR B 8 -16.712 -16.926 -6.275 1.00 0.00 O ATOM 1457 CG2 THR B 8 -17.213 -15.083 -4.795 1.00 0.00 C ATOM 0 H THR B 8 -13.768 -16.237 -6.803 1.00 0.00 H new ATOM 0 HA THR B 8 -16.083 -14.436 -7.178 1.00 0.00 H new ATOM 0 HB THR B 8 -15.411 -16.225 -4.814 1.00 0.00 H new ATOM 0 HG1 THR B 8 -17.193 -17.514 -5.656 1.00 0.00 H new ATOM 0 HG21 THR B 8 -17.730 -15.763 -4.119 1.00 0.00 H new ATOM 0 HG22 THR B 8 -16.764 -14.273 -4.221 1.00 0.00 H new ATOM 0 HG23 THR B 8 -17.925 -14.670 -5.509 1.00 0.00 H new ATOM 1465 N PHE B 9 -15.189 -12.656 -5.632 1.00 0.00 N ATOM 1466 CA PHE B 9 -14.601 -11.591 -4.835 1.00 0.00 C ATOM 1467 C PHE B 9 -15.661 -10.574 -4.443 1.00 0.00 C ATOM 1468 O PHE B 9 -16.510 -10.198 -5.256 1.00 0.00 O ATOM 1469 CB PHE B 9 -13.453 -10.903 -5.593 1.00 0.00 C ATOM 1470 CG PHE B 9 -13.892 -10.068 -6.764 1.00 0.00 C ATOM 1471 CD1 PHE B 9 -14.304 -10.663 -7.945 1.00 0.00 C ATOM 1472 CD2 PHE B 9 -13.890 -8.685 -6.680 1.00 0.00 C ATOM 1473 CE1 PHE B 9 -14.706 -9.894 -9.020 1.00 0.00 C ATOM 1474 CE2 PHE B 9 -14.290 -7.913 -7.752 1.00 0.00 C ATOM 1475 CZ PHE B 9 -14.699 -8.517 -8.922 1.00 0.00 C ATOM 0 H PHE B 9 -16.062 -12.405 -6.097 1.00 0.00 H new ATOM 0 HA PHE B 9 -14.190 -12.035 -3.929 1.00 0.00 H new ATOM 0 HB2 PHE B 9 -12.903 -10.270 -4.897 1.00 0.00 H new ATOM 0 HB3 PHE B 9 -12.759 -11.666 -5.946 1.00 0.00 H new ATOM 0 HD1 PHE B 9 -14.311 -11.740 -8.026 1.00 0.00 H new ATOM 0 HD2 PHE B 9 -13.572 -8.206 -5.766 1.00 0.00 H new ATOM 0 HE1 PHE B 9 -15.025 -10.369 -9.936 1.00 0.00 H new ATOM 0 HE2 PHE B 9 -14.283 -6.836 -7.674 1.00 0.00 H new ATOM 0 HZ PHE B 9 -15.013 -7.914 -9.761 1.00 0.00 H new ATOM 1485 N GLU B 10 -15.623 -10.150 -3.190 1.00 0.00 N ATOM 1486 CA GLU B 10 -16.542 -9.137 -2.693 1.00 0.00 C ATOM 1487 C GLU B 10 -15.891 -8.329 -1.579 1.00 0.00 C ATOM 1488 O GLU B 10 -14.989 -8.811 -0.892 1.00 0.00 O ATOM 1489 CB GLU B 10 -17.847 -9.775 -2.214 1.00 0.00 C ATOM 1490 CG GLU B 10 -17.657 -10.980 -1.310 1.00 0.00 C ATOM 1491 CD GLU B 10 -18.975 -11.591 -0.893 1.00 0.00 C ATOM 1492 OE1 GLU B 10 -19.694 -12.124 -1.765 1.00 0.00 O ATOM 1493 OE2 GLU B 10 -19.315 -11.519 0.308 1.00 0.00 O ATOM 0 H GLU B 10 -14.961 -10.494 -2.494 1.00 0.00 H new ATOM 0 HA GLU B 10 -16.782 -8.459 -3.512 1.00 0.00 H new ATOM 0 HB2 GLU B 10 -18.431 -9.024 -1.682 1.00 0.00 H new ATOM 0 HB3 GLU B 10 -18.431 -10.076 -3.083 1.00 0.00 H new ATOM 0 HG2 GLU B 10 -17.058 -11.730 -1.827 1.00 0.00 H new ATOM 0 HG3 GLU B 10 -17.099 -10.682 -0.422 1.00 0.00 H new ATOM 1500 N ILE B 11 -16.337 -7.093 -1.416 1.00 0.00 N ATOM 1501 CA ILE B 11 -15.737 -6.189 -0.444 1.00 0.00 C ATOM 1502 C ILE B 11 -16.491 -6.251 0.880 1.00 0.00 C ATOM 1503 O ILE B 11 -17.573 -5.676 1.014 1.00 0.00 O ATOM 1504 CB ILE B 11 -15.743 -4.728 -0.949 1.00 0.00 C ATOM 1505 CG1 ILE B 11 -15.349 -4.657 -2.432 1.00 0.00 C ATOM 1506 CG2 ILE B 11 -14.804 -3.874 -0.105 1.00 0.00 C ATOM 1507 CD1 ILE B 11 -13.977 -5.219 -2.737 1.00 0.00 C ATOM 0 H ILE B 11 -17.112 -6.692 -1.944 1.00 0.00 H new ATOM 0 HA ILE B 11 -14.705 -6.511 -0.302 1.00 0.00 H new ATOM 0 HB ILE B 11 -16.756 -4.337 -0.851 1.00 0.00 H new ATOM 0 HG12 ILE B 11 -16.090 -5.199 -3.020 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -15.384 -3.617 -2.756 1.00 0.00 H new ATOM 0 HG21 ILE B 11 -14.818 -2.847 -0.471 1.00 0.00 H new ATOM 0 HG22 ILE B 11 -15.131 -3.893 0.935 1.00 0.00 H new ATOM 0 HG23 ILE B 11 -13.791 -4.270 -0.174 1.00 0.00 H new ATOM 0 HD11 ILE B 11 -13.777 -5.131 -3.805 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -13.224 -4.663 -2.179 1.00 0.00 H new ATOM 0 HD13 ILE B 11 -13.941 -6.269 -2.447 1.00 0.00 H new ATOM 1519 N GLU B 12 -15.932 -6.958 1.857 1.00 0.00 N ATOM 1520 CA GLU B 12 -16.576 -7.077 3.159 1.00 0.00 C ATOM 1521 C GLU B 12 -16.256 -5.871 4.036 1.00 0.00 C ATOM 1522 O GLU B 12 -17.042 -5.497 4.909 1.00 0.00 O ATOM 1523 CB GLU B 12 -16.170 -8.378 3.862 1.00 0.00 C ATOM 1524 CG GLU B 12 -14.682 -8.502 4.154 1.00 0.00 C ATOM 1525 CD GLU B 12 -14.359 -9.745 4.961 1.00 0.00 C ATOM 1526 OE1 GLU B 12 -14.173 -10.821 4.356 1.00 0.00 O ATOM 1527 OE2 GLU B 12 -14.314 -9.656 6.208 1.00 0.00 O ATOM 0 H GLU B 12 -15.044 -7.452 1.773 1.00 0.00 H new ATOM 0 HA GLU B 12 -17.653 -7.105 2.994 1.00 0.00 H new ATOM 0 HB2 GLU B 12 -16.719 -8.455 4.801 1.00 0.00 H new ATOM 0 HB3 GLU B 12 -16.477 -9.221 3.243 1.00 0.00 H new ATOM 0 HG2 GLU B 12 -14.130 -8.527 3.215 1.00 0.00 H new ATOM 0 HG3 GLU B 12 -14.345 -7.620 4.698 1.00 0.00 H new ATOM 1534 N GLU B 13 -15.105 -5.256 3.793 1.00 0.00 N ATOM 1535 CA GLU B 13 -14.689 -4.091 4.556 1.00 0.00 C ATOM 1536 C GLU B 13 -13.708 -3.244 3.756 1.00 0.00 C ATOM 1537 O GLU B 13 -12.730 -3.757 3.214 1.00 0.00 O ATOM 1538 CB GLU B 13 -14.052 -4.526 5.882 1.00 0.00 C ATOM 1539 CG GLU B 13 -13.504 -3.371 6.705 1.00 0.00 C ATOM 1540 CD GLU B 13 -12.983 -3.817 8.054 1.00 0.00 C ATOM 1541 OE1 GLU B 13 -11.882 -4.397 8.105 1.00 0.00 O ATOM 1542 OE2 GLU B 13 -13.681 -3.597 9.068 1.00 0.00 O ATOM 0 H GLU B 13 -14.444 -5.547 3.072 1.00 0.00 H new ATOM 0 HA GLU B 13 -15.571 -3.487 4.768 1.00 0.00 H new ATOM 0 HB2 GLU B 13 -14.795 -5.061 6.473 1.00 0.00 H new ATOM 0 HB3 GLU B 13 -13.244 -5.228 5.674 1.00 0.00 H new ATOM 0 HG2 GLU B 13 -12.701 -2.884 6.152 1.00 0.00 H new ATOM 0 HG3 GLU B 13 -14.288 -2.628 6.849 1.00 0.00 H new ATOM 1549 N HIS B 14 -13.974 -1.952 3.670 1.00 0.00 N ATOM 1550 CA HIS B 14 -13.028 -1.029 3.065 1.00 0.00 C ATOM 1551 C HIS B 14 -12.383 -0.196 4.168 1.00 0.00 C ATOM 1552 O HIS B 14 -13.049 0.594 4.841 1.00 0.00 O ATOM 1553 CB HIS B 14 -13.681 -0.156 1.977 1.00 0.00 C ATOM 1554 CG HIS B 14 -14.756 0.785 2.442 1.00 0.00 C ATOM 1555 ND1 HIS B 14 -14.696 2.145 2.231 1.00 0.00 N ATOM 1556 CD2 HIS B 14 -15.932 0.555 3.074 1.00 0.00 C ATOM 1557 CE1 HIS B 14 -15.786 2.711 2.715 1.00 0.00 C ATOM 1558 NE2 HIS B 14 -16.553 1.769 3.232 1.00 0.00 N ATOM 0 H HIS B 14 -14.833 -1.519 4.010 1.00 0.00 H new ATOM 0 HA HIS B 14 -12.253 -1.597 2.550 1.00 0.00 H new ATOM 0 HB2 HIS B 14 -12.900 0.429 1.491 1.00 0.00 H new ATOM 0 HB3 HIS B 14 -14.105 -0.814 1.218 1.00 0.00 H new ATOM 0 HD1 HIS B 14 -13.929 2.638 1.773 1.00 0.00 H new ATOM 0 HD2 HIS B 14 -16.310 -0.405 3.394 1.00 0.00 H new ATOM 0 HE1 HIS B 14 -16.012 3.767 2.692 1.00 0.00 H new ATOM 1567 N LEU B 15 -11.082 -0.401 4.350 1.00 0.00 N ATOM 1568 CA LEU B 15 -10.356 0.106 5.509 1.00 0.00 C ATOM 1569 C LEU B 15 -10.479 1.622 5.631 1.00 0.00 C ATOM 1570 O LEU B 15 -11.160 2.114 6.528 1.00 0.00 O ATOM 1571 CB LEU B 15 -8.892 -0.327 5.431 1.00 0.00 C ATOM 1572 CG LEU B 15 -8.680 -1.822 5.149 1.00 0.00 C ATOM 1573 CD1 LEU B 15 -7.204 -2.145 5.039 1.00 0.00 C ATOM 1574 CD2 LEU B 15 -9.325 -2.680 6.228 1.00 0.00 C ATOM 0 H LEU B 15 -10.500 -0.925 3.696 1.00 0.00 H new ATOM 0 HA LEU B 15 -10.801 -0.320 6.408 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -8.398 0.250 4.650 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -8.402 -0.075 6.372 1.00 0.00 H new ATOM 0 HG LEU B 15 -9.159 -2.050 4.197 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -7.078 -3.209 4.839 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -6.765 -1.569 4.225 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -6.705 -1.890 5.974 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -9.159 -3.733 6.003 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -8.882 -2.442 7.195 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -10.396 -2.480 6.260 1.00 0.00 H new ATOM 1586 N LEU B 16 -9.840 2.366 4.730 1.00 0.00 N ATOM 1587 CA LEU B 16 -9.995 3.816 4.724 1.00 0.00 C ATOM 1588 C LEU B 16 -9.651 4.406 3.361 1.00 0.00 C ATOM 1589 O LEU B 16 -8.787 3.890 2.639 1.00 0.00 O ATOM 1590 CB LEU B 16 -9.195 4.488 5.876 1.00 0.00 C ATOM 1591 CG LEU B 16 -7.675 4.733 5.711 1.00 0.00 C ATOM 1592 CD1 LEU B 16 -6.929 3.522 5.190 1.00 0.00 C ATOM 1593 CD2 LEU B 16 -7.390 5.950 4.849 1.00 0.00 C ATOM 0 H LEU B 16 -9.222 1.996 4.008 1.00 0.00 H new ATOM 0 HA LEU B 16 -11.047 4.034 4.909 1.00 0.00 H new ATOM 0 HB2 LEU B 16 -9.661 5.453 6.077 1.00 0.00 H new ATOM 0 HB3 LEU B 16 -9.332 3.876 6.768 1.00 0.00 H new ATOM 0 HG LEU B 16 -7.299 4.928 6.715 1.00 0.00 H new ATOM 0 HD11 LEU B 16 -5.869 3.760 5.097 1.00 0.00 H new ATOM 0 HD12 LEU B 16 -7.055 2.691 5.884 1.00 0.00 H new ATOM 0 HD13 LEU B 16 -7.325 3.243 4.214 1.00 0.00 H new ATOM 0 HD21 LEU B 16 -6.312 6.087 4.758 1.00 0.00 H new ATOM 0 HD22 LEU B 16 -7.822 5.804 3.859 1.00 0.00 H new ATOM 0 HD23 LEU B 16 -7.831 6.834 5.310 1.00 0.00 H new ATOM 1605 N THR B 17 -10.359 5.468 3.007 1.00 0.00 N ATOM 1606 CA THR B 17 -10.131 6.170 1.757 1.00 0.00 C ATOM 1607 C THR B 17 -8.876 7.030 1.862 1.00 0.00 C ATOM 1608 O THR B 17 -8.809 7.940 2.691 1.00 0.00 O ATOM 1609 CB THR B 17 -11.339 7.060 1.403 1.00 0.00 C ATOM 1610 OG1 THR B 17 -12.552 6.296 1.471 1.00 0.00 O ATOM 1611 CG2 THR B 17 -11.190 7.658 0.014 1.00 0.00 C ATOM 0 H THR B 17 -11.105 5.865 3.578 1.00 0.00 H new ATOM 0 HA THR B 17 -9.998 5.429 0.968 1.00 0.00 H new ATOM 0 HB THR B 17 -11.380 7.874 2.127 1.00 0.00 H new ATOM 0 HG1 THR B 17 -12.357 5.355 1.278 1.00 0.00 H new ATOM 0 HG21 THR B 17 -12.056 8.281 -0.209 1.00 0.00 H new ATOM 0 HG22 THR B 17 -10.286 8.266 -0.025 1.00 0.00 H new ATOM 0 HG23 THR B 17 -11.121 6.857 -0.722 1.00 0.00 H new ATOM 1619 N LEU B 18 -7.880 6.729 1.040 1.00 0.00 N ATOM 1620 CA LEU B 18 -6.615 7.448 1.084 1.00 0.00 C ATOM 1621 C LEU B 18 -6.808 8.885 0.632 1.00 0.00 C ATOM 1622 O LEU B 18 -6.540 9.824 1.384 1.00 0.00 O ATOM 1623 CB LEU B 18 -5.574 6.758 0.205 1.00 0.00 C ATOM 1624 CG LEU B 18 -5.240 5.323 0.604 1.00 0.00 C ATOM 1625 CD1 LEU B 18 -4.189 4.748 -0.327 1.00 0.00 C ATOM 1626 CD2 LEU B 18 -4.762 5.270 2.047 1.00 0.00 C ATOM 0 H LEU B 18 -7.924 5.993 0.336 1.00 0.00 H new ATOM 0 HA LEU B 18 -6.257 7.447 2.113 1.00 0.00 H new ATOM 0 HB2 LEU B 18 -5.932 6.759 -0.824 1.00 0.00 H new ATOM 0 HB3 LEU B 18 -4.657 7.347 0.224 1.00 0.00 H new ATOM 0 HG LEU B 18 -6.144 4.720 0.520 1.00 0.00 H new ATOM 0 HD11 LEU B 18 -3.961 3.724 -0.030 1.00 0.00 H new ATOM 0 HD12 LEU B 18 -4.566 4.754 -1.350 1.00 0.00 H new ATOM 0 HD13 LEU B 18 -3.284 5.352 -0.271 1.00 0.00 H new ATOM 0 HD21 LEU B 18 -4.528 4.240 2.315 1.00 0.00 H new ATOM 0 HD22 LEU B 18 -3.869 5.885 2.157 1.00 0.00 H new ATOM 0 HD23 LEU B 18 -5.546 5.647 2.704 1.00 0.00 H new ATOM 1638 N SER B 19 -7.289 9.048 -0.591 1.00 0.00 N ATOM 1639 CA SER B 19 -7.540 10.370 -1.134 1.00 0.00 C ATOM 1640 C SER B 19 -8.303 10.255 -2.446 1.00 0.00 C ATOM 1641 O SER B 19 -8.332 9.188 -3.072 1.00 0.00 O ATOM 1642 CB SER B 19 -6.220 11.120 -1.354 1.00 0.00 C ATOM 1643 OG SER B 19 -6.418 12.525 -1.342 1.00 0.00 O ATOM 0 H SER B 19 -7.513 8.280 -1.224 1.00 0.00 H new ATOM 0 HA SER B 19 -8.142 10.933 -0.420 1.00 0.00 H new ATOM 0 HB2 SER B 19 -5.508 10.844 -0.576 1.00 0.00 H new ATOM 0 HB3 SER B 19 -5.783 10.820 -2.307 1.00 0.00 H new ATOM 0 HG SER B 19 -5.560 12.977 -1.483 1.00 0.00 H new ATOM 1649 N GLU B 20 -8.943 11.341 -2.841 1.00 0.00 N ATOM 1650 CA GLU B 20 -9.629 11.395 -4.116 1.00 0.00 C ATOM 1651 C GLU B 20 -8.800 12.198 -5.110 1.00 0.00 C ATOM 1652 O GLU B 20 -8.405 13.331 -4.831 1.00 0.00 O ATOM 1653 CB GLU B 20 -11.020 12.014 -3.952 1.00 0.00 C ATOM 1654 CG GLU B 20 -11.800 12.119 -5.252 1.00 0.00 C ATOM 1655 CD GLU B 20 -13.181 12.699 -5.054 1.00 0.00 C ATOM 1656 OE1 GLU B 20 -13.295 13.930 -4.888 1.00 0.00 O ATOM 1657 OE2 GLU B 20 -14.162 11.924 -5.061 1.00 0.00 O ATOM 0 H GLU B 20 -9.001 12.200 -2.294 1.00 0.00 H new ATOM 0 HA GLU B 20 -9.753 10.381 -4.495 1.00 0.00 H new ATOM 0 HB2 GLU B 20 -11.592 11.416 -3.243 1.00 0.00 H new ATOM 0 HB3 GLU B 20 -10.916 13.009 -3.520 1.00 0.00 H new ATOM 0 HG2 GLU B 20 -11.246 12.741 -5.955 1.00 0.00 H new ATOM 0 HG3 GLU B 20 -11.886 11.130 -5.701 1.00 0.00 H new ATOM 1664 N ASN B 21 -8.527 11.601 -6.258 1.00 0.00 N ATOM 1665 CA ASN B 21 -7.726 12.246 -7.287 1.00 0.00 C ATOM 1666 C ASN B 21 -8.584 13.214 -8.086 1.00 0.00 C ATOM 1667 O ASN B 21 -9.747 12.929 -8.379 1.00 0.00 O ATOM 1668 CB ASN B 21 -7.094 11.204 -8.215 1.00 0.00 C ATOM 1669 CG ASN B 21 -6.194 11.829 -9.265 1.00 0.00 C ATOM 1670 OD1 ASN B 21 -6.640 12.168 -10.359 1.00 0.00 O ATOM 1671 ND2 ASN B 21 -4.922 11.991 -8.935 1.00 0.00 N ATOM 0 H ASN B 21 -8.850 10.665 -6.502 1.00 0.00 H new ATOM 0 HA ASN B 21 -6.924 12.802 -6.803 1.00 0.00 H new ATOM 0 HB2 ASN B 21 -6.516 10.496 -7.621 1.00 0.00 H new ATOM 0 HB3 ASN B 21 -7.883 10.636 -8.709 1.00 0.00 H new ATOM 0 HD21 ASN B 21 -4.272 12.411 -9.600 1.00 0.00 H new ATOM 0 HD22 ASN B 21 -4.592 11.696 -8.016 1.00 0.00 H new ATOM 1678 N GLU B 22 -7.986 14.344 -8.449 1.00 0.00 N ATOM 1679 CA GLU B 22 -8.693 15.448 -9.099 1.00 0.00 C ATOM 1680 C GLU B 22 -9.374 15.032 -10.410 1.00 0.00 C ATOM 1681 O GLU B 22 -10.293 15.706 -10.877 1.00 0.00 O ATOM 1682 CB GLU B 22 -7.716 16.596 -9.350 1.00 0.00 C ATOM 1683 CG GLU B 22 -8.380 17.868 -9.836 1.00 0.00 C ATOM 1684 CD GLU B 22 -7.426 19.038 -9.873 1.00 0.00 C ATOM 1685 OE1 GLU B 22 -7.152 19.618 -8.802 1.00 0.00 O ATOM 1686 OE2 GLU B 22 -6.947 19.387 -10.972 1.00 0.00 O ATOM 0 H GLU B 22 -6.993 14.523 -8.301 1.00 0.00 H new ATOM 0 HA GLU B 22 -9.488 15.769 -8.426 1.00 0.00 H new ATOM 0 HB2 GLU B 22 -7.175 16.809 -8.428 1.00 0.00 H new ATOM 0 HB3 GLU B 22 -6.978 16.278 -10.086 1.00 0.00 H new ATOM 0 HG2 GLU B 22 -8.788 17.704 -10.833 1.00 0.00 H new ATOM 0 HG3 GLU B 22 -9.220 18.108 -9.184 1.00 0.00 H new ATOM 1693 N LYS B 23 -8.939 13.921 -10.995 1.00 0.00 N ATOM 1694 CA LYS B 23 -9.562 13.410 -12.217 1.00 0.00 C ATOM 1695 C LYS B 23 -10.943 12.820 -11.933 1.00 0.00 C ATOM 1696 O LYS B 23 -11.629 12.361 -12.848 1.00 0.00 O ATOM 1697 CB LYS B 23 -8.679 12.345 -12.872 1.00 0.00 C ATOM 1698 CG LYS B 23 -7.406 12.897 -13.486 1.00 0.00 C ATOM 1699 CD LYS B 23 -6.585 11.797 -14.133 1.00 0.00 C ATOM 1700 CE LYS B 23 -5.386 12.364 -14.872 1.00 0.00 C ATOM 1701 NZ LYS B 23 -4.591 11.305 -15.546 1.00 0.00 N ATOM 0 H LYS B 23 -8.163 13.358 -10.648 1.00 0.00 H new ATOM 0 HA LYS B 23 -9.676 14.253 -12.899 1.00 0.00 H new ATOM 0 HB2 LYS B 23 -8.416 11.596 -12.126 1.00 0.00 H new ATOM 0 HB3 LYS B 23 -9.253 11.836 -13.646 1.00 0.00 H new ATOM 0 HG2 LYS B 23 -7.657 13.653 -14.230 1.00 0.00 H new ATOM 0 HG3 LYS B 23 -6.813 13.392 -12.717 1.00 0.00 H new ATOM 0 HD2 LYS B 23 -6.246 11.097 -13.370 1.00 0.00 H new ATOM 0 HD3 LYS B 23 -7.210 11.235 -14.827 1.00 0.00 H new ATOM 0 HE2 LYS B 23 -5.727 13.087 -15.613 1.00 0.00 H new ATOM 0 HE3 LYS B 23 -4.750 12.902 -14.170 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 -3.783 11.737 -16.038 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 -4.243 10.628 -14.837 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 -5.190 10.807 -16.236 1.00 0.00 H new ATOM 1715 N GLY B 24 -11.342 12.834 -10.670 1.00 0.00 N ATOM 1716 CA GLY B 24 -12.624 12.282 -10.291 1.00 0.00 C ATOM 1717 C GLY B 24 -12.524 10.810 -9.982 1.00 0.00 C ATOM 1718 O GLY B 24 -13.492 10.064 -10.135 1.00 0.00 O ATOM 0 H GLY B 24 -10.798 13.220 -9.899 1.00 0.00 H new ATOM 0 HA2 GLY B 24 -13.006 12.812 -9.419 1.00 0.00 H new ATOM 0 HA3 GLY B 24 -13.341 12.437 -11.097 1.00 0.00 H new ATOM 1722 N TRP B 25 -11.339 10.390 -9.562 1.00 0.00 N ATOM 1723 CA TRP B 25 -11.089 8.995 -9.231 1.00 0.00 C ATOM 1724 C TRP B 25 -10.772 8.875 -7.754 1.00 0.00 C ATOM 1725 O TRP B 25 -10.377 9.848 -7.123 1.00 0.00 O ATOM 1726 CB TRP B 25 -9.927 8.435 -10.057 1.00 0.00 C ATOM 1727 CG TRP B 25 -10.245 8.255 -11.511 1.00 0.00 C ATOM 1728 CD1 TRP B 25 -11.406 8.592 -12.142 1.00 0.00 C ATOM 1729 CD2 TRP B 25 -9.392 7.686 -12.513 1.00 0.00 C ATOM 1730 NE1 TRP B 25 -11.332 8.269 -13.471 1.00 0.00 N ATOM 1731 CE2 TRP B 25 -10.104 7.712 -13.727 1.00 0.00 C ATOM 1732 CE3 TRP B 25 -8.096 7.161 -12.503 1.00 0.00 C ATOM 1733 CZ2 TRP B 25 -9.566 7.227 -14.917 1.00 0.00 C ATOM 1734 CZ3 TRP B 25 -7.563 6.678 -13.688 1.00 0.00 C ATOM 1735 CH2 TRP B 25 -8.297 6.717 -14.880 1.00 0.00 C ATOM 0 H TRP B 25 -10.531 11.001 -9.442 1.00 0.00 H new ATOM 0 HA TRP B 25 -11.984 8.418 -9.465 1.00 0.00 H new ATOM 0 HB2 TRP B 25 -9.072 9.104 -9.963 1.00 0.00 H new ATOM 0 HB3 TRP B 25 -9.627 7.474 -9.639 1.00 0.00 H new ATOM 0 HD1 TRP B 25 -12.260 9.048 -11.663 1.00 0.00 H new ATOM 0 HE1 TRP B 25 -12.070 8.418 -14.159 1.00 0.00 H new ATOM 0 HE3 TRP B 25 -7.521 7.132 -11.589 1.00 0.00 H new ATOM 0 HZ2 TRP B 25 -10.131 7.253 -15.837 1.00 0.00 H new ATOM 0 HZ3 TRP B 25 -6.565 6.265 -13.692 1.00 0.00 H new ATOM 0 HH2 TRP B 25 -7.853 6.337 -15.788 1.00 0.00 H new ATOM 1746 N THR B 26 -10.942 7.695 -7.193 1.00 0.00 N ATOM 1747 CA THR B 26 -10.683 7.506 -5.781 1.00 0.00 C ATOM 1748 C THR B 26 -9.674 6.383 -5.554 1.00 0.00 C ATOM 1749 O THR B 26 -9.726 5.339 -6.206 1.00 0.00 O ATOM 1750 CB THR B 26 -11.990 7.199 -5.026 1.00 0.00 C ATOM 1751 OG1 THR B 26 -13.003 8.135 -5.426 1.00 0.00 O ATOM 1752 CG2 THR B 26 -11.785 7.290 -3.523 1.00 0.00 C ATOM 0 H THR B 26 -11.255 6.860 -7.688 1.00 0.00 H new ATOM 0 HA THR B 26 -10.261 8.433 -5.393 1.00 0.00 H new ATOM 0 HB THR B 26 -12.300 6.183 -5.272 1.00 0.00 H new ATOM 0 HG1 THR B 26 -13.836 7.940 -4.948 1.00 0.00 H new ATOM 0 HG21 THR B 26 -12.723 7.069 -3.014 1.00 0.00 H new ATOM 0 HG22 THR B 26 -11.026 6.570 -3.215 1.00 0.00 H new ATOM 0 HG23 THR B 26 -11.458 8.296 -3.261 1.00 0.00 H new ATOM 1760 N LYS B 27 -8.751 6.611 -4.632 1.00 0.00 N ATOM 1761 CA LYS B 27 -7.765 5.612 -4.279 1.00 0.00 C ATOM 1762 C LYS B 27 -7.934 5.236 -2.812 1.00 0.00 C ATOM 1763 O LYS B 27 -7.815 6.084 -1.921 1.00 0.00 O ATOM 1764 CB LYS B 27 -6.355 6.137 -4.557 1.00 0.00 C ATOM 1765 CG LYS B 27 -5.264 5.092 -4.393 1.00 0.00 C ATOM 1766 CD LYS B 27 -3.939 5.574 -4.965 1.00 0.00 C ATOM 1767 CE LYS B 27 -3.451 6.831 -4.268 1.00 0.00 C ATOM 1768 NZ LYS B 27 -2.242 7.400 -4.922 1.00 0.00 N ATOM 0 H LYS B 27 -8.668 7.486 -4.114 1.00 0.00 H new ATOM 0 HA LYS B 27 -7.912 4.720 -4.888 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -6.318 6.530 -5.573 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -6.150 6.971 -3.885 1.00 0.00 H new ATOM 0 HG2 LYS B 27 -5.141 4.856 -3.336 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -5.563 4.171 -4.892 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -3.191 4.788 -4.863 1.00 0.00 H new ATOM 0 HD3 LYS B 27 -4.053 5.770 -6.031 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -4.246 7.576 -4.267 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -3.226 6.603 -3.226 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -1.844 8.151 -4.323 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -1.533 6.650 -5.054 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -2.502 7.797 -5.847 1.00 0.00 H new ATOM 1782 N GLU B 28 -8.226 3.969 -2.570 1.00 0.00 N ATOM 1783 CA GLU B 28 -8.561 3.503 -1.235 1.00 0.00 C ATOM 1784 C GLU B 28 -7.928 2.144 -0.964 1.00 0.00 C ATOM 1785 O GLU B 28 -7.664 1.373 -1.891 1.00 0.00 O ATOM 1786 CB GLU B 28 -10.088 3.421 -1.077 1.00 0.00 C ATOM 1787 CG GLU B 28 -10.537 2.841 0.256 1.00 0.00 C ATOM 1788 CD GLU B 28 -12.039 2.855 0.440 1.00 0.00 C ATOM 1789 OE1 GLU B 28 -12.738 2.140 -0.299 1.00 0.00 O ATOM 1790 OE2 GLU B 28 -12.522 3.576 1.338 1.00 0.00 O ATOM 0 H GLU B 28 -8.238 3.241 -3.285 1.00 0.00 H new ATOM 0 HA GLU B 28 -8.166 4.214 -0.509 1.00 0.00 H new ATOM 0 HB2 GLU B 28 -10.510 4.420 -1.188 1.00 0.00 H new ATOM 0 HB3 GLU B 28 -10.495 2.811 -1.884 1.00 0.00 H new ATOM 0 HG2 GLU B 28 -10.178 1.815 0.337 1.00 0.00 H new ATOM 0 HG3 GLU B 28 -10.074 3.406 1.065 1.00 0.00 H new ATOM 1797 N ILE B 29 -7.669 1.874 0.308 1.00 0.00 N ATOM 1798 CA ILE B 29 -7.200 0.570 0.733 1.00 0.00 C ATOM 1799 C ILE B 29 -8.362 -0.201 1.342 1.00 0.00 C ATOM 1800 O ILE B 29 -9.001 0.266 2.287 1.00 0.00 O ATOM 1801 CB ILE B 29 -6.059 0.681 1.767 1.00 0.00 C ATOM 1802 CG1 ILE B 29 -4.917 1.529 1.200 1.00 0.00 C ATOM 1803 CG2 ILE B 29 -5.559 -0.706 2.151 1.00 0.00 C ATOM 1804 CD1 ILE B 29 -3.757 1.715 2.155 1.00 0.00 C ATOM 0 H ILE B 29 -7.778 2.548 1.065 1.00 0.00 H new ATOM 0 HA ILE B 29 -6.809 0.048 -0.140 1.00 0.00 H new ATOM 0 HB ILE B 29 -6.440 1.169 2.664 1.00 0.00 H new ATOM 0 HG12 ILE B 29 -4.551 1.062 0.286 1.00 0.00 H new ATOM 0 HG13 ILE B 29 -5.308 2.508 0.924 1.00 0.00 H new ATOM 0 HG21 ILE B 29 -4.755 -0.614 2.881 1.00 0.00 H new ATOM 0 HG22 ILE B 29 -6.378 -1.281 2.584 1.00 0.00 H new ATOM 0 HG23 ILE B 29 -5.187 -1.217 1.263 1.00 0.00 H new ATOM 0 HD11 ILE B 29 -2.989 2.326 1.680 1.00 0.00 H new ATOM 0 HD12 ILE B 29 -4.107 2.211 3.060 1.00 0.00 H new ATOM 0 HD13 ILE B 29 -3.338 0.742 2.413 1.00 0.00 H new ATOM 1816 N ASN B 30 -8.641 -1.370 0.799 1.00 0.00 N ATOM 1817 CA ASN B 30 -9.796 -2.144 1.228 1.00 0.00 C ATOM 1818 C ASN B 30 -9.411 -3.589 1.506 1.00 0.00 C ATOM 1819 O ASN B 30 -8.269 -3.985 1.293 1.00 0.00 O ATOM 1820 CB ASN B 30 -10.934 -2.070 0.192 1.00 0.00 C ATOM 1821 CG ASN B 30 -10.680 -2.837 -1.103 1.00 0.00 C ATOM 1822 OD1 ASN B 30 -9.439 -2.895 -1.560 1.00 0.00 O flip ATOM 1823 ND2 ASN B 30 -11.614 -3.356 -1.704 1.00 0.00 N flip ATOM 0 H ASN B 30 -8.087 -1.806 0.062 1.00 0.00 H new ATOM 0 HA ASN B 30 -10.161 -1.706 2.157 1.00 0.00 H new ATOM 0 HB2 ASN B 30 -11.847 -2.452 0.650 1.00 0.00 H new ATOM 0 HB3 ASN B 30 -11.114 -1.023 -0.053 1.00 0.00 H new ATOM 0 HD21 ASN B 30 -12.560 -3.295 -1.327 1.00 0.00 H new ATOM 0 HD22 ASN B 30 -11.445 -3.849 -2.581 1.00 0.00 H new ATOM 1830 N ARG B 31 -10.361 -4.361 2.006 1.00 0.00 N ATOM 1831 CA ARG B 31 -10.127 -5.753 2.336 1.00 0.00 C ATOM 1832 C ARG B 31 -11.155 -6.626 1.617 1.00 0.00 C ATOM 1833 O ARG B 31 -12.358 -6.548 1.886 1.00 0.00 O ATOM 1834 CB ARG B 31 -10.186 -5.933 3.856 1.00 0.00 C ATOM 1835 CG ARG B 31 -9.711 -7.290 4.329 1.00 0.00 C ATOM 1836 CD ARG B 31 -9.415 -7.300 5.820 1.00 0.00 C ATOM 1837 NE ARG B 31 -10.538 -6.817 6.624 1.00 0.00 N ATOM 1838 CZ ARG B 31 -11.321 -7.606 7.357 1.00 0.00 C ATOM 1839 NH1 ARG B 31 -11.124 -8.916 7.372 1.00 0.00 N ATOM 1840 NH2 ARG B 31 -12.286 -7.076 8.094 1.00 0.00 N ATOM 0 H ARG B 31 -11.311 -4.041 2.193 1.00 0.00 H new ATOM 0 HA ARG B 31 -9.136 -6.061 2.002 1.00 0.00 H new ATOM 0 HB2 ARG B 31 -9.578 -5.161 4.328 1.00 0.00 H new ATOM 0 HB3 ARG B 31 -11.212 -5.780 4.191 1.00 0.00 H new ATOM 0 HG2 ARG B 31 -10.471 -8.039 4.105 1.00 0.00 H new ATOM 0 HG3 ARG B 31 -8.813 -7.572 3.779 1.00 0.00 H new ATOM 0 HD2 ARG B 31 -9.163 -8.314 6.129 1.00 0.00 H new ATOM 0 HD3 ARG B 31 -8.540 -6.680 6.016 1.00 0.00 H new ATOM 0 HE ARG B 31 -10.733 -5.816 6.623 1.00 0.00 H new ATOM 0 HH11 ARG B 31 -10.370 -9.325 6.820 1.00 0.00 H new ATOM 0 HH12 ARG B 31 -11.727 -9.516 7.935 1.00 0.00 H new ATOM 0 HH21 ARG B 31 -12.428 -6.066 8.099 1.00 0.00 H new ATOM 0 HH22 ARG B 31 -12.887 -7.678 8.656 1.00 0.00 H new ATOM 1854 N VAL B 32 -10.667 -7.443 0.693 1.00 0.00 N ATOM 1855 CA VAL B 32 -11.532 -8.176 -0.228 1.00 0.00 C ATOM 1856 C VAL B 32 -11.601 -9.658 0.125 1.00 0.00 C ATOM 1857 O VAL B 32 -10.579 -10.301 0.376 1.00 0.00 O ATOM 1858 CB VAL B 32 -11.029 -8.040 -1.684 1.00 0.00 C ATOM 1859 CG1 VAL B 32 -12.036 -8.617 -2.669 1.00 0.00 C ATOM 1860 CG2 VAL B 32 -10.718 -6.590 -2.017 1.00 0.00 C ATOM 0 H VAL B 32 -9.671 -7.617 0.559 1.00 0.00 H new ATOM 0 HA VAL B 32 -12.527 -7.740 -0.137 1.00 0.00 H new ATOM 0 HB VAL B 32 -10.107 -8.614 -1.773 1.00 0.00 H new ATOM 0 HG11 VAL B 32 -11.655 -8.507 -3.685 1.00 0.00 H new ATOM 0 HG12 VAL B 32 -12.193 -9.674 -2.452 1.00 0.00 H new ATOM 0 HG13 VAL B 32 -12.982 -8.084 -2.577 1.00 0.00 H new ATOM 0 HG21 VAL B 32 -10.366 -6.520 -3.046 1.00 0.00 H new ATOM 0 HG22 VAL B 32 -11.619 -5.988 -1.900 1.00 0.00 H new ATOM 0 HG23 VAL B 32 -9.945 -6.220 -1.344 1.00 0.00 H new ATOM 1870 N SER B 33 -12.809 -10.196 0.137 1.00 0.00 N ATOM 1871 CA SER B 33 -13.013 -11.613 0.360 1.00 0.00 C ATOM 1872 C SER B 33 -12.839 -12.368 -0.960 1.00 0.00 C ATOM 1873 O SER B 33 -13.711 -12.325 -1.830 1.00 0.00 O ATOM 1874 CB SER B 33 -14.414 -11.850 0.930 1.00 0.00 C ATOM 1875 OG SER B 33 -14.784 -10.802 1.808 1.00 0.00 O ATOM 0 H SER B 33 -13.668 -9.666 -0.007 1.00 0.00 H new ATOM 0 HA SER B 33 -12.278 -11.980 1.076 1.00 0.00 H new ATOM 0 HB2 SER B 33 -15.136 -11.920 0.116 1.00 0.00 H new ATOM 0 HB3 SER B 33 -14.439 -12.801 1.461 1.00 0.00 H new ATOM 0 HG SER B 33 -14.758 -11.125 2.733 1.00 0.00 H new ATOM 1881 N PHE B 34 -11.692 -13.021 -1.120 1.00 0.00 N ATOM 1882 CA PHE B 34 -11.388 -13.739 -2.355 1.00 0.00 C ATOM 1883 C PHE B 34 -11.826 -15.196 -2.274 1.00 0.00 C ATOM 1884 O PHE B 34 -11.254 -15.980 -1.511 1.00 0.00 O ATOM 1885 CB PHE B 34 -9.892 -13.666 -2.669 1.00 0.00 C ATOM 1886 CG PHE B 34 -9.407 -12.286 -3.010 1.00 0.00 C ATOM 1887 CD1 PHE B 34 -9.662 -11.739 -4.258 1.00 0.00 C ATOM 1888 CD2 PHE B 34 -8.697 -11.538 -2.086 1.00 0.00 C ATOM 1889 CE1 PHE B 34 -9.218 -10.471 -4.577 1.00 0.00 C ATOM 1890 CE2 PHE B 34 -8.249 -10.269 -2.400 1.00 0.00 C ATOM 1891 CZ PHE B 34 -8.511 -9.735 -3.647 1.00 0.00 C ATOM 0 H PHE B 34 -10.959 -13.068 -0.412 1.00 0.00 H new ATOM 0 HA PHE B 34 -11.946 -13.256 -3.158 1.00 0.00 H new ATOM 0 HB2 PHE B 34 -9.332 -14.035 -1.810 1.00 0.00 H new ATOM 0 HB3 PHE B 34 -9.673 -14.333 -3.502 1.00 0.00 H new ATOM 0 HD1 PHE B 34 -10.214 -12.311 -4.989 1.00 0.00 H new ATOM 0 HD2 PHE B 34 -8.491 -11.951 -1.109 1.00 0.00 H new ATOM 0 HE1 PHE B 34 -9.423 -10.056 -5.553 1.00 0.00 H new ATOM 0 HE2 PHE B 34 -7.695 -9.696 -1.672 1.00 0.00 H new ATOM 0 HZ PHE B 34 -8.163 -8.743 -3.894 1.00 0.00 H new ATOM 1901 N ASN B 35 -12.835 -15.532 -3.077 1.00 0.00 N ATOM 1902 CA ASN B 35 -13.390 -16.890 -3.176 1.00 0.00 C ATOM 1903 C ASN B 35 -14.078 -17.312 -1.882 1.00 0.00 C ATOM 1904 O ASN B 35 -15.303 -17.421 -1.832 1.00 0.00 O ATOM 1905 CB ASN B 35 -12.313 -17.905 -3.583 1.00 0.00 C ATOM 1906 CG ASN B 35 -11.816 -17.681 -5.000 1.00 0.00 C ATOM 1907 OD1 ASN B 35 -12.556 -17.212 -5.867 1.00 0.00 O ATOM 1908 ND2 ASN B 35 -10.562 -18.016 -5.245 1.00 0.00 N ATOM 0 H ASN B 35 -13.300 -14.861 -3.688 1.00 0.00 H new ATOM 0 HA ASN B 35 -14.147 -16.873 -3.960 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -11.473 -17.838 -2.891 1.00 0.00 H new ATOM 0 HB3 ASN B 35 -12.717 -18.914 -3.497 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -10.174 -17.889 -6.180 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -9.982 -18.401 -4.500 1.00 0.00 H new ATOM 1915 N GLY B 36 -13.295 -17.552 -0.843 1.00 0.00 N ATOM 1916 CA GLY B 36 -13.856 -17.856 0.453 1.00 0.00 C ATOM 1917 C GLY B 36 -13.937 -16.612 1.311 1.00 0.00 C ATOM 1918 O GLY B 36 -14.295 -15.537 0.825 1.00 0.00 O ATOM 0 H GLY B 36 -12.276 -17.541 -0.876 1.00 0.00 H new ATOM 0 HA2 GLY B 36 -14.851 -18.285 0.332 1.00 0.00 H new ATOM 0 HA3 GLY B 36 -13.244 -18.607 0.952 1.00 0.00 H new ATOM 1922 N ALA B 37 -13.566 -16.734 2.575 1.00 0.00 N ATOM 1923 CA ALA B 37 -13.565 -15.583 3.468 1.00 0.00 C ATOM 1924 C ALA B 37 -12.217 -15.391 4.178 1.00 0.00 C ATOM 1925 O ALA B 37 -12.168 -15.322 5.407 1.00 0.00 O ATOM 1926 CB ALA B 37 -14.682 -15.719 4.486 1.00 0.00 C ATOM 0 H ALA B 37 -13.264 -17.609 3.004 1.00 0.00 H new ATOM 0 HA ALA B 37 -13.731 -14.696 2.857 1.00 0.00 H new ATOM 0 HB1 ALA B 37 -14.676 -14.855 5.151 1.00 0.00 H new ATOM 0 HB2 ALA B 37 -15.640 -15.773 3.970 1.00 0.00 H new ATOM 0 HB3 ALA B 37 -14.533 -16.627 5.070 1.00 0.00 H new ATOM 1932 N PRO B 38 -11.096 -15.295 3.427 1.00 0.00 N ATOM 1933 CA PRO B 38 -9.797 -14.995 4.020 1.00 0.00 C ATOM 1934 C PRO B 38 -9.590 -13.491 4.174 1.00 0.00 C ATOM 1935 O PRO B 38 -8.848 -13.042 5.048 1.00 0.00 O ATOM 1936 CB PRO B 38 -8.817 -15.580 3.009 1.00 0.00 C ATOM 1937 CG PRO B 38 -9.509 -15.467 1.692 1.00 0.00 C ATOM 1938 CD PRO B 38 -10.993 -15.483 1.966 1.00 0.00 C ATOM 0 HA PRO B 38 -9.681 -15.405 5.023 1.00 0.00 H new ATOM 0 HB2 PRO B 38 -7.875 -15.031 3.009 1.00 0.00 H new ATOM 0 HB3 PRO B 38 -8.581 -16.618 3.243 1.00 0.00 H new ATOM 0 HG2 PRO B 38 -9.221 -14.547 1.184 1.00 0.00 H new ATOM 0 HG3 PRO B 38 -9.229 -16.293 1.038 1.00 0.00 H new ATOM 0 HD2 PRO B 38 -11.506 -14.688 1.425 1.00 0.00 H new ATOM 0 HD3 PRO B 38 -11.445 -16.424 1.653 1.00 0.00 H new ATOM 1946 N ALA B 39 -10.277 -12.736 3.313 1.00 0.00 N ATOM 1947 CA ALA B 39 -10.227 -11.277 3.293 1.00 0.00 C ATOM 1948 C ALA B 39 -8.800 -10.741 3.259 1.00 0.00 C ATOM 1949 O ALA B 39 -8.212 -10.431 4.297 1.00 0.00 O ATOM 1950 CB ALA B 39 -10.990 -10.703 4.475 1.00 0.00 C ATOM 0 H ALA B 39 -10.892 -13.130 2.601 1.00 0.00 H new ATOM 0 HA ALA B 39 -10.707 -10.953 2.369 1.00 0.00 H new ATOM 0 HB1 ALA B 39 -10.943 -9.614 4.445 1.00 0.00 H new ATOM 0 HB2 ALA B 39 -12.031 -11.022 4.426 1.00 0.00 H new ATOM 0 HB3 ALA B 39 -10.545 -11.060 5.404 1.00 0.00 H new ATOM 1956 N LYS B 40 -8.244 -10.638 2.060 1.00 0.00 N ATOM 1957 CA LYS B 40 -6.914 -10.077 1.894 1.00 0.00 C ATOM 1958 C LYS B 40 -7.009 -8.569 1.730 1.00 0.00 C ATOM 1959 O LYS B 40 -8.057 -8.039 1.360 1.00 0.00 O ATOM 1960 CB LYS B 40 -6.195 -10.687 0.688 1.00 0.00 C ATOM 1961 CG LYS B 40 -5.815 -12.146 0.870 1.00 0.00 C ATOM 1962 CD LYS B 40 -4.895 -12.621 -0.244 1.00 0.00 C ATOM 1963 CE LYS B 40 -4.502 -14.078 -0.064 1.00 0.00 C ATOM 1964 NZ LYS B 40 -3.524 -14.527 -1.095 1.00 0.00 N ATOM 0 H LYS B 40 -8.692 -10.934 1.193 1.00 0.00 H new ATOM 0 HA LYS B 40 -6.334 -10.314 2.786 1.00 0.00 H new ATOM 0 HB2 LYS B 40 -6.836 -10.596 -0.189 1.00 0.00 H new ATOM 0 HB3 LYS B 40 -5.293 -10.110 0.485 1.00 0.00 H new ATOM 0 HG2 LYS B 40 -5.322 -12.278 1.833 1.00 0.00 H new ATOM 0 HG3 LYS B 40 -6.716 -12.759 0.887 1.00 0.00 H new ATOM 0 HD2 LYS B 40 -5.392 -12.494 -1.206 1.00 0.00 H new ATOM 0 HD3 LYS B 40 -3.998 -12.002 -0.265 1.00 0.00 H new ATOM 0 HE2 LYS B 40 -4.072 -14.217 0.928 1.00 0.00 H new ATOM 0 HE3 LYS B 40 -5.394 -14.702 -0.115 1.00 0.00 H new ATOM 0 HZ1 LYS B 40 -3.284 -15.526 -0.934 1.00 0.00 H new ATOM 0 HZ2 LYS B 40 -3.943 -14.419 -2.041 1.00 0.00 H new ATOM 0 HZ3 LYS B 40 -2.662 -13.949 -1.030 1.00 0.00 H new ATOM 1978 N PHE B 41 -5.918 -7.883 2.001 1.00 0.00 N ATOM 1979 CA PHE B 41 -5.889 -6.435 1.930 1.00 0.00 C ATOM 1980 C PHE B 41 -5.476 -6.003 0.533 1.00 0.00 C ATOM 1981 O PHE B 41 -4.547 -6.558 -0.035 1.00 0.00 O ATOM 1982 CB PHE B 41 -4.910 -5.889 2.967 1.00 0.00 C ATOM 1983 CG PHE B 41 -5.145 -6.410 4.357 1.00 0.00 C ATOM 1984 CD1 PHE B 41 -4.524 -7.570 4.793 1.00 0.00 C ATOM 1985 CD2 PHE B 41 -5.981 -5.736 5.226 1.00 0.00 C ATOM 1986 CE1 PHE B 41 -4.735 -8.046 6.072 1.00 0.00 C ATOM 1987 CE2 PHE B 41 -6.196 -6.205 6.506 1.00 0.00 C ATOM 1988 CZ PHE B 41 -5.572 -7.363 6.931 1.00 0.00 C ATOM 0 H PHE B 41 -5.032 -8.308 2.275 1.00 0.00 H new ATOM 0 HA PHE B 41 -6.882 -6.038 2.143 1.00 0.00 H new ATOM 0 HB2 PHE B 41 -3.894 -6.141 2.662 1.00 0.00 H new ATOM 0 HB3 PHE B 41 -4.979 -4.801 2.980 1.00 0.00 H new ATOM 0 HD1 PHE B 41 -3.868 -8.108 4.125 1.00 0.00 H new ATOM 0 HD2 PHE B 41 -6.472 -4.831 4.900 1.00 0.00 H new ATOM 0 HE1 PHE B 41 -4.246 -8.951 6.400 1.00 0.00 H new ATOM 0 HE2 PHE B 41 -6.851 -5.668 7.175 1.00 0.00 H new ATOM 0 HZ PHE B 41 -5.739 -7.732 7.932 1.00 0.00 H new ATOM 1998 N ASP B 42 -6.165 -5.028 -0.028 1.00 0.00 N ATOM 1999 CA ASP B 42 -5.898 -4.611 -1.395 1.00 0.00 C ATOM 2000 C ASP B 42 -5.863 -3.091 -1.508 1.00 0.00 C ATOM 2001 O ASP B 42 -6.764 -2.398 -1.026 1.00 0.00 O ATOM 2002 CB ASP B 42 -6.963 -5.191 -2.330 1.00 0.00 C ATOM 2003 CG ASP B 42 -6.726 -4.848 -3.787 1.00 0.00 C ATOM 2004 OD1 ASP B 42 -5.859 -5.489 -4.420 1.00 0.00 O ATOM 2005 OD2 ASP B 42 -7.427 -3.957 -4.309 1.00 0.00 O ATOM 0 H ASP B 42 -6.911 -4.511 0.437 1.00 0.00 H new ATOM 0 HA ASP B 42 -4.919 -4.990 -1.687 1.00 0.00 H new ATOM 0 HB2 ASP B 42 -6.985 -6.275 -2.217 1.00 0.00 H new ATOM 0 HB3 ASP B 42 -7.943 -4.819 -2.030 1.00 0.00 H new ATOM 2010 N ILE B 43 -4.805 -2.582 -2.117 1.00 0.00 N ATOM 2011 CA ILE B 43 -4.665 -1.153 -2.351 1.00 0.00 C ATOM 2012 C ILE B 43 -4.819 -0.870 -3.837 1.00 0.00 C ATOM 2013 O ILE B 43 -3.998 -1.313 -4.640 1.00 0.00 O ATOM 2014 CB ILE B 43 -3.284 -0.643 -1.880 1.00 0.00 C ATOM 2015 CG1 ILE B 43 -3.011 -1.090 -0.439 1.00 0.00 C ATOM 2016 CG2 ILE B 43 -3.209 0.875 -1.991 1.00 0.00 C ATOM 2017 CD1 ILE B 43 -1.633 -0.718 0.067 1.00 0.00 C ATOM 0 H ILE B 43 -4.025 -3.142 -2.461 1.00 0.00 H new ATOM 0 HA ILE B 43 -5.438 -0.635 -1.783 1.00 0.00 H new ATOM 0 HB ILE B 43 -2.519 -1.073 -2.526 1.00 0.00 H new ATOM 0 HG12 ILE B 43 -3.760 -0.647 0.217 1.00 0.00 H new ATOM 0 HG13 ILE B 43 -3.131 -2.171 -0.375 1.00 0.00 H new ATOM 0 HG21 ILE B 43 -2.230 1.216 -1.655 1.00 0.00 H new ATOM 0 HG22 ILE B 43 -3.361 1.172 -3.029 1.00 0.00 H new ATOM 0 HG23 ILE B 43 -3.983 1.324 -1.369 1.00 0.00 H new ATOM 0 HD11 ILE B 43 -1.515 -1.068 1.093 1.00 0.00 H new ATOM 0 HD12 ILE B 43 -0.876 -1.183 -0.564 1.00 0.00 H new ATOM 0 HD13 ILE B 43 -1.515 0.365 0.037 1.00 0.00 H new ATOM 2029 N ARG B 44 -5.867 -0.144 -4.211 1.00 0.00 N ATOM 2030 CA ARG B 44 -6.153 0.065 -5.624 1.00 0.00 C ATOM 2031 C ARG B 44 -6.679 1.468 -5.905 1.00 0.00 C ATOM 2032 O ARG B 44 -7.127 2.182 -5.002 1.00 0.00 O ATOM 2033 CB ARG B 44 -7.180 -0.955 -6.115 1.00 0.00 C ATOM 2034 CG ARG B 44 -8.565 -0.747 -5.517 1.00 0.00 C ATOM 2035 CD ARG B 44 -9.599 -1.653 -6.163 1.00 0.00 C ATOM 2036 NE ARG B 44 -9.369 -3.063 -5.861 1.00 0.00 N ATOM 2037 CZ ARG B 44 -10.204 -4.036 -6.209 1.00 0.00 C ATOM 2038 NH1 ARG B 44 -11.313 -3.748 -6.883 1.00 0.00 N ATOM 2039 NH2 ARG B 44 -9.924 -5.294 -5.890 1.00 0.00 N ATOM 0 H ARG B 44 -6.521 0.302 -3.568 1.00 0.00 H new ATOM 0 HA ARG B 44 -5.211 -0.061 -6.157 1.00 0.00 H new ATOM 0 HB2 ARG B 44 -7.248 -0.898 -7.201 1.00 0.00 H new ATOM 0 HB3 ARG B 44 -6.832 -1.958 -5.869 1.00 0.00 H new ATOM 0 HG2 ARG B 44 -8.531 -0.941 -4.445 1.00 0.00 H new ATOM 0 HG3 ARG B 44 -8.863 0.294 -5.644 1.00 0.00 H new ATOM 0 HD2 ARG B 44 -10.593 -1.368 -5.819 1.00 0.00 H new ATOM 0 HD3 ARG B 44 -9.581 -1.508 -7.243 1.00 0.00 H new ATOM 0 HE ARG B 44 -8.520 -3.315 -5.355 1.00 0.00 H new ATOM 0 HH11 ARG B 44 -11.522 -2.781 -7.132 1.00 0.00 H new ATOM 0 HH12 ARG B 44 -11.955 -4.494 -7.151 1.00 0.00 H new ATOM 0 HH21 ARG B 44 -9.069 -5.512 -5.379 1.00 0.00 H new ATOM 0 HH22 ARG B 44 -10.564 -6.042 -6.156 1.00 0.00 H new ATOM 2053 N ALA B 45 -6.626 1.842 -7.176 1.00 0.00 N ATOM 2054 CA ALA B 45 -7.227 3.078 -7.654 1.00 0.00 C ATOM 2055 C ALA B 45 -8.453 2.755 -8.500 1.00 0.00 C ATOM 2056 O ALA B 45 -8.332 2.162 -9.575 1.00 0.00 O ATOM 2057 CB ALA B 45 -6.221 3.874 -8.470 1.00 0.00 C ATOM 0 H ALA B 45 -6.165 1.297 -7.904 1.00 0.00 H new ATOM 0 HA ALA B 45 -7.530 3.681 -6.798 1.00 0.00 H new ATOM 0 HB1 ALA B 45 -6.685 4.796 -8.821 1.00 0.00 H new ATOM 0 HB2 ALA B 45 -5.358 4.115 -7.849 1.00 0.00 H new ATOM 0 HB3 ALA B 45 -5.897 3.282 -9.326 1.00 0.00 H new ATOM 2063 N TRP B 46 -9.625 3.135 -8.025 1.00 0.00 N ATOM 2064 CA TRP B 46 -10.857 2.792 -8.719 1.00 0.00 C ATOM 2065 C TRP B 46 -11.606 4.037 -9.174 1.00 0.00 C ATOM 2066 O TRP B 46 -11.342 5.148 -8.702 1.00 0.00 O ATOM 2067 CB TRP B 46 -11.753 1.909 -7.840 1.00 0.00 C ATOM 2068 CG TRP B 46 -12.031 2.466 -6.472 1.00 0.00 C ATOM 2069 CD1 TRP B 46 -11.275 2.288 -5.347 1.00 0.00 C ATOM 2070 CD2 TRP B 46 -13.149 3.271 -6.075 1.00 0.00 C ATOM 2071 NE1 TRP B 46 -11.851 2.933 -4.283 1.00 0.00 N ATOM 2072 CE2 TRP B 46 -13.000 3.545 -4.702 1.00 0.00 C ATOM 2073 CE3 TRP B 46 -14.259 3.789 -6.747 1.00 0.00 C ATOM 2074 CZ2 TRP B 46 -13.920 4.311 -3.990 1.00 0.00 C ATOM 2075 CZ3 TRP B 46 -15.169 4.551 -6.039 1.00 0.00 C ATOM 2076 CH2 TRP B 46 -14.996 4.804 -4.673 1.00 0.00 C ATOM 0 H TRP B 46 -9.752 3.676 -7.170 1.00 0.00 H new ATOM 0 HA TRP B 46 -10.585 2.225 -9.609 1.00 0.00 H new ATOM 0 HB2 TRP B 46 -12.701 1.751 -8.353 1.00 0.00 H new ATOM 0 HB3 TRP B 46 -11.283 0.931 -7.731 1.00 0.00 H new ATOM 0 HD1 TRP B 46 -10.357 1.721 -5.303 1.00 0.00 H new ATOM 0 HE1 TRP B 46 -11.482 2.953 -3.332 1.00 0.00 H new ATOM 0 HE3 TRP B 46 -14.403 3.598 -7.800 1.00 0.00 H new ATOM 0 HZ2 TRP B 46 -13.788 4.508 -2.936 1.00 0.00 H new ATOM 0 HZ3 TRP B 46 -16.029 4.959 -6.549 1.00 0.00 H new ATOM 0 HH2 TRP B 46 -15.728 5.401 -4.149 1.00 0.00 H new ATOM 2087 N SER B 47 -12.534 3.844 -10.097 1.00 0.00 N ATOM 2088 CA SER B 47 -13.291 4.943 -10.666 1.00 0.00 C ATOM 2089 C SER B 47 -14.785 4.746 -10.419 1.00 0.00 C ATOM 2090 O SER B 47 -15.226 3.638 -10.109 1.00 0.00 O ATOM 2091 CB SER B 47 -13.000 5.040 -12.165 1.00 0.00 C ATOM 2092 OG SER B 47 -11.612 5.201 -12.404 1.00 0.00 O ATOM 0 H SER B 47 -12.781 2.927 -10.470 1.00 0.00 H new ATOM 0 HA SER B 47 -12.990 5.874 -10.185 1.00 0.00 H new ATOM 0 HB2 SER B 47 -13.357 4.141 -12.667 1.00 0.00 H new ATOM 0 HB3 SER B 47 -13.546 5.882 -12.591 1.00 0.00 H new ATOM 0 HG SER B 47 -11.417 6.146 -12.578 1.00 0.00 H new ATOM 2098 N PRO B 48 -15.578 5.826 -10.529 1.00 0.00 N ATOM 2099 CA PRO B 48 -17.026 5.777 -10.300 1.00 0.00 C ATOM 2100 C PRO B 48 -17.756 4.882 -11.304 1.00 0.00 C ATOM 2101 O PRO B 48 -18.117 3.743 -10.991 1.00 0.00 O ATOM 2102 CB PRO B 48 -17.474 7.236 -10.456 1.00 0.00 C ATOM 2103 CG PRO B 48 -16.231 8.052 -10.354 1.00 0.00 C ATOM 2104 CD PRO B 48 -15.122 7.183 -10.862 1.00 0.00 C ATOM 0 HA PRO B 48 -17.259 5.350 -9.324 1.00 0.00 H new ATOM 0 HB2 PRO B 48 -17.968 7.394 -11.415 1.00 0.00 H new ATOM 0 HB3 PRO B 48 -18.188 7.512 -9.680 1.00 0.00 H new ATOM 0 HG2 PRO B 48 -16.314 8.964 -10.945 1.00 0.00 H new ATOM 0 HG3 PRO B 48 -16.047 8.356 -9.323 1.00 0.00 H new ATOM 0 HD2 PRO B 48 -14.974 7.306 -11.935 1.00 0.00 H new ATOM 0 HD3 PRO B 48 -14.173 7.418 -10.380 1.00 0.00 H new ATOM 2112 N ASP B 49 -17.959 5.391 -12.515 1.00 0.00 N ATOM 2113 CA ASP B 49 -18.663 4.637 -13.548 1.00 0.00 C ATOM 2114 C ASP B 49 -17.694 4.089 -14.583 1.00 0.00 C ATOM 2115 O ASP B 49 -17.988 3.111 -15.267 1.00 0.00 O ATOM 2116 CB ASP B 49 -19.721 5.506 -14.230 1.00 0.00 C ATOM 2117 CG ASP B 49 -21.124 5.177 -13.763 1.00 0.00 C ATOM 2118 OD1 ASP B 49 -21.525 5.648 -12.682 1.00 0.00 O ATOM 2119 OD2 ASP B 49 -21.837 4.441 -14.481 1.00 0.00 O ATOM 0 H ASP B 49 -17.648 6.318 -12.805 1.00 0.00 H new ATOM 0 HA ASP B 49 -19.159 3.797 -13.062 1.00 0.00 H new ATOM 0 HB2 ASP B 49 -19.510 6.556 -14.028 1.00 0.00 H new ATOM 0 HB3 ASP B 49 -19.659 5.370 -15.310 1.00 0.00 H new ATOM 2124 N HIS B 50 -16.537 4.726 -14.700 1.00 0.00 N ATOM 2125 CA HIS B 50 -15.510 4.263 -15.619 1.00 0.00 C ATOM 2126 C HIS B 50 -14.851 3.006 -15.082 1.00 0.00 C ATOM 2127 O HIS B 50 -14.387 2.973 -13.944 1.00 0.00 O ATOM 2128 CB HIS B 50 -14.458 5.350 -15.874 1.00 0.00 C ATOM 2129 CG HIS B 50 -14.962 6.470 -16.729 1.00 0.00 C ATOM 2130 ND1 HIS B 50 -14.199 7.560 -17.080 1.00 0.00 N ATOM 2131 CD2 HIS B 50 -16.169 6.655 -17.310 1.00 0.00 C ATOM 2132 CE1 HIS B 50 -14.916 8.368 -17.839 1.00 0.00 C ATOM 2133 NE2 HIS B 50 -16.114 7.840 -17.995 1.00 0.00 N ATOM 0 H HIS B 50 -16.288 5.562 -14.171 1.00 0.00 H new ATOM 0 HA HIS B 50 -15.990 4.032 -16.570 1.00 0.00 H new ATOM 0 HB2 HIS B 50 -14.123 5.754 -14.918 1.00 0.00 H new ATOM 0 HB3 HIS B 50 -13.588 4.900 -16.352 1.00 0.00 H new ATOM 0 HD2 HIS B 50 -17.019 5.992 -17.246 1.00 0.00 H new ATOM 0 HE1 HIS B 50 -14.578 9.303 -18.261 1.00 0.00 H new ATOM 0 HE2 HIS B 50 -16.876 8.247 -18.537 1.00 0.00 H new ATOM 2142 N THR B 51 -14.830 1.974 -15.902 1.00 0.00 N ATOM 2143 CA THR B 51 -14.266 0.698 -15.511 1.00 0.00 C ATOM 2144 C THR B 51 -12.752 0.709 -15.656 1.00 0.00 C ATOM 2145 O THR B 51 -12.040 0.230 -14.770 1.00 0.00 O ATOM 2146 CB THR B 51 -14.865 -0.447 -16.347 1.00 0.00 C ATOM 2147 OG1 THR B 51 -14.946 -0.051 -17.723 1.00 0.00 O ATOM 2148 CG2 THR B 51 -16.249 -0.820 -15.842 1.00 0.00 C ATOM 0 H THR B 51 -15.201 1.996 -16.852 1.00 0.00 H new ATOM 0 HA THR B 51 -14.516 0.532 -14.463 1.00 0.00 H new ATOM 0 HB THR B 51 -14.216 -1.317 -16.253 1.00 0.00 H new ATOM 0 HG1 THR B 51 -15.326 -0.783 -18.252 1.00 0.00 H new ATOM 0 HG21 THR B 51 -16.651 -1.631 -16.449 1.00 0.00 H new ATOM 0 HG22 THR B 51 -16.182 -1.143 -14.803 1.00 0.00 H new ATOM 0 HG23 THR B 51 -16.907 0.046 -15.912 1.00 0.00 H new ATOM 2156 N LYS B 52 -12.284 1.282 -16.777 1.00 0.00 N ATOM 2157 CA LYS B 52 -10.853 1.402 -17.103 1.00 0.00 C ATOM 2158 C LYS B 52 -10.090 0.111 -16.790 1.00 0.00 C ATOM 2159 O LYS B 52 -10.651 -0.986 -16.830 1.00 0.00 O ATOM 2160 CB LYS B 52 -10.210 2.600 -16.372 1.00 0.00 C ATOM 2161 CG LYS B 52 -10.126 2.464 -14.855 1.00 0.00 C ATOM 2162 CD LYS B 52 -9.222 3.524 -14.248 1.00 0.00 C ATOM 2163 CE LYS B 52 -9.129 3.395 -12.735 1.00 0.00 C ATOM 2164 NZ LYS B 52 -8.572 2.083 -12.308 1.00 0.00 N ATOM 0 H LYS B 52 -12.895 1.679 -17.490 1.00 0.00 H new ATOM 0 HA LYS B 52 -10.785 1.579 -18.176 1.00 0.00 H new ATOM 0 HB2 LYS B 52 -9.204 2.747 -16.764 1.00 0.00 H new ATOM 0 HB3 LYS B 52 -10.779 3.499 -16.610 1.00 0.00 H new ATOM 0 HG2 LYS B 52 -11.124 2.547 -14.426 1.00 0.00 H new ATOM 0 HG3 LYS B 52 -9.750 1.474 -14.598 1.00 0.00 H new ATOM 0 HD2 LYS B 52 -8.225 3.441 -14.681 1.00 0.00 H new ATOM 0 HD3 LYS B 52 -9.600 4.513 -14.505 1.00 0.00 H new ATOM 0 HE2 LYS B 52 -8.503 4.197 -12.343 1.00 0.00 H new ATOM 0 HE3 LYS B 52 -10.121 3.524 -12.301 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 -8.154 2.175 -11.360 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 -9.333 1.374 -12.283 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 -7.840 1.781 -12.982 1.00 0.00 H new ATOM 2178 N MET B 53 -8.800 0.244 -16.525 1.00 0.00 N ATOM 2179 CA MET B 53 -8.012 -0.872 -16.034 1.00 0.00 C ATOM 2180 C MET B 53 -7.595 -0.584 -14.601 1.00 0.00 C ATOM 2181 O MET B 53 -7.168 0.530 -14.281 1.00 0.00 O ATOM 2182 CB MET B 53 -6.790 -1.133 -16.922 1.00 0.00 C ATOM 2183 CG MET B 53 -5.874 0.065 -17.099 1.00 0.00 C ATOM 2184 SD MET B 53 -4.367 -0.345 -18.008 1.00 0.00 S ATOM 2185 CE MET B 53 -5.051 -1.032 -19.516 1.00 0.00 C ATOM 0 H MET B 53 -8.278 1.113 -16.642 1.00 0.00 H new ATOM 0 HA MET B 53 -8.619 -1.777 -16.063 1.00 0.00 H new ATOM 0 HB2 MET B 53 -6.215 -1.954 -16.495 1.00 0.00 H new ATOM 0 HB3 MET B 53 -7.133 -1.461 -17.903 1.00 0.00 H new ATOM 0 HG2 MET B 53 -6.410 0.853 -17.627 1.00 0.00 H new ATOM 0 HG3 MET B 53 -5.607 0.462 -16.120 1.00 0.00 H new ATOM 0 HE1 MET B 53 -4.292 -1.019 -20.299 1.00 0.00 H new ATOM 0 HE2 MET B 53 -5.369 -2.059 -19.336 1.00 0.00 H new ATOM 0 HE3 MET B 53 -5.908 -0.437 -19.831 1.00 0.00 H new ATOM 2195 N GLY B 54 -7.748 -1.569 -13.738 1.00 0.00 N ATOM 2196 CA GLY B 54 -7.476 -1.360 -12.335 1.00 0.00 C ATOM 2197 C GLY B 54 -6.099 -1.826 -11.939 1.00 0.00 C ATOM 2198 O GLY B 54 -5.797 -3.020 -11.997 1.00 0.00 O ATOM 0 H GLY B 54 -8.056 -2.510 -13.982 1.00 0.00 H new ATOM 0 HA2 GLY B 54 -7.578 -0.300 -12.102 1.00 0.00 H new ATOM 0 HA3 GLY B 54 -8.220 -1.890 -11.741 1.00 0.00 H new ATOM 2202 N LYS B 55 -5.250 -0.883 -11.572 1.00 0.00 N ATOM 2203 CA LYS B 55 -3.936 -1.211 -11.060 1.00 0.00 C ATOM 2204 C LYS B 55 -3.875 -0.975 -9.562 1.00 0.00 C ATOM 2205 O LYS B 55 -4.581 -0.120 -9.019 1.00 0.00 O ATOM 2206 CB LYS B 55 -2.839 -0.415 -11.775 1.00 0.00 C ATOM 2207 CG LYS B 55 -2.269 -1.124 -12.997 1.00 0.00 C ATOM 2208 CD LYS B 55 -1.731 -2.499 -12.629 1.00 0.00 C ATOM 2209 CE LYS B 55 -0.945 -3.133 -13.772 1.00 0.00 C ATOM 2210 NZ LYS B 55 -1.753 -3.289 -15.009 1.00 0.00 N ATOM 0 H LYS B 55 -5.449 0.116 -11.620 1.00 0.00 H new ATOM 0 HA LYS B 55 -3.758 -2.268 -11.256 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -3.243 0.550 -12.081 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -2.031 -0.214 -11.072 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -3.043 -1.224 -13.758 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -1.471 -0.522 -13.432 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -1.089 -2.414 -11.752 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -2.561 -3.151 -12.355 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -0.071 -2.520 -13.990 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -0.579 -4.110 -13.457 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -1.175 -3.740 -15.747 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -2.583 -3.882 -14.809 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -2.067 -2.354 -15.339 1.00 0.00 H new ATOM 2224 N GLY B 56 -3.036 -1.753 -8.911 1.00 0.00 N ATOM 2225 CA GLY B 56 -2.900 -1.704 -7.477 1.00 0.00 C ATOM 2226 C GLY B 56 -2.085 -2.878 -6.999 1.00 0.00 C ATOM 2227 O GLY B 56 -1.328 -3.461 -7.784 1.00 0.00 O ATOM 0 H GLY B 56 -2.430 -2.437 -9.365 1.00 0.00 H new ATOM 0 HA2 GLY B 56 -2.420 -0.772 -7.180 1.00 0.00 H new ATOM 0 HA3 GLY B 56 -3.884 -1.719 -7.009 1.00 0.00 H new ATOM 2231 N ILE B 57 -2.233 -3.252 -5.744 1.00 0.00 N ATOM 2232 CA ILE B 57 -1.485 -4.375 -5.218 1.00 0.00 C ATOM 2233 C ILE B 57 -2.156 -4.953 -3.972 1.00 0.00 C ATOM 2234 O ILE B 57 -2.616 -4.218 -3.095 1.00 0.00 O ATOM 2235 CB ILE B 57 -0.016 -3.973 -4.935 1.00 0.00 C ATOM 2236 CG1 ILE B 57 0.834 -5.205 -4.628 1.00 0.00 C ATOM 2237 CG2 ILE B 57 0.066 -2.968 -3.793 1.00 0.00 C ATOM 2238 CD1 ILE B 57 2.319 -4.951 -4.751 1.00 0.00 C ATOM 0 H ILE B 57 -2.857 -2.800 -5.076 1.00 0.00 H new ATOM 0 HA ILE B 57 -1.476 -5.159 -5.975 1.00 0.00 H new ATOM 0 HB ILE B 57 0.379 -3.498 -5.833 1.00 0.00 H new ATOM 0 HG12 ILE B 57 0.613 -5.548 -3.617 1.00 0.00 H new ATOM 0 HG13 ILE B 57 0.553 -6.011 -5.306 1.00 0.00 H new ATOM 0 HG21 ILE B 57 1.108 -2.703 -3.616 1.00 0.00 H new ATOM 0 HG22 ILE B 57 -0.496 -2.072 -4.056 1.00 0.00 H new ATOM 0 HG23 ILE B 57 -0.355 -3.409 -2.889 1.00 0.00 H new ATOM 0 HD11 ILE B 57 2.865 -5.866 -4.520 1.00 0.00 H new ATOM 0 HD12 ILE B 57 2.551 -4.637 -5.769 1.00 0.00 H new ATOM 0 HD13 ILE B 57 2.613 -4.167 -4.053 1.00 0.00 H new ATOM 2250 N THR B 58 -2.237 -6.275 -3.932 1.00 0.00 N ATOM 2251 CA THR B 58 -2.864 -6.981 -2.827 1.00 0.00 C ATOM 2252 C THR B 58 -1.803 -7.427 -1.812 1.00 0.00 C ATOM 2253 O THR B 58 -0.680 -7.773 -2.188 1.00 0.00 O ATOM 2254 CB THR B 58 -3.642 -8.210 -3.350 1.00 0.00 C ATOM 2255 OG1 THR B 58 -4.448 -7.830 -4.475 1.00 0.00 O ATOM 2256 CG2 THR B 58 -4.535 -8.798 -2.270 1.00 0.00 C ATOM 0 H THR B 58 -1.871 -6.886 -4.662 1.00 0.00 H new ATOM 0 HA THR B 58 -3.562 -6.305 -2.334 1.00 0.00 H new ATOM 0 HB THR B 58 -2.916 -8.966 -3.648 1.00 0.00 H new ATOM 0 HG1 THR B 58 -4.884 -6.972 -4.290 1.00 0.00 H new ATOM 0 HG21 THR B 58 -5.069 -9.661 -2.669 1.00 0.00 H new ATOM 0 HG22 THR B 58 -3.924 -9.109 -1.422 1.00 0.00 H new ATOM 0 HG23 THR B 58 -5.253 -8.046 -1.943 1.00 0.00 H new ATOM 2264 N LEU B 59 -2.152 -7.399 -0.532 1.00 0.00 N ATOM 2265 CA LEU B 59 -1.236 -7.780 0.531 1.00 0.00 C ATOM 2266 C LEU B 59 -1.879 -8.819 1.442 1.00 0.00 C ATOM 2267 O LEU B 59 -3.091 -8.802 1.662 1.00 0.00 O ATOM 2268 CB LEU B 59 -0.824 -6.562 1.370 1.00 0.00 C ATOM 2269 CG LEU B 59 -0.189 -5.402 0.596 1.00 0.00 C ATOM 2270 CD1 LEU B 59 -1.249 -4.467 0.034 1.00 0.00 C ATOM 2271 CD2 LEU B 59 0.777 -4.643 1.492 1.00 0.00 C ATOM 0 H LEU B 59 -3.074 -7.113 -0.204 1.00 0.00 H new ATOM 0 HA LEU B 59 -0.348 -8.204 0.063 1.00 0.00 H new ATOM 0 HB2 LEU B 59 -1.706 -6.187 1.889 1.00 0.00 H new ATOM 0 HB3 LEU B 59 -0.120 -6.892 2.134 1.00 0.00 H new ATOM 0 HG LEU B 59 0.364 -5.817 -0.247 1.00 0.00 H new ATOM 0 HD11 LEU B 59 -0.766 -3.655 -0.509 1.00 0.00 H new ATOM 0 HD12 LEU B 59 -1.900 -5.020 -0.643 1.00 0.00 H new ATOM 0 HD13 LEU B 59 -1.841 -4.055 0.851 1.00 0.00 H new ATOM 0 HD21 LEU B 59 1.223 -3.821 0.932 1.00 0.00 H new ATOM 0 HD22 LEU B 59 0.239 -4.246 2.353 1.00 0.00 H new ATOM 0 HD23 LEU B 59 1.562 -5.317 1.834 1.00 0.00 H new ATOM 2283 N SER B 60 -1.068 -9.724 1.958 1.00 0.00 N ATOM 2284 CA SER B 60 -1.546 -10.742 2.879 1.00 0.00 C ATOM 2285 C SER B 60 -1.561 -10.202 4.309 1.00 0.00 C ATOM 2286 O SER B 60 -1.078 -9.100 4.571 1.00 0.00 O ATOM 2287 CB SER B 60 -0.653 -11.979 2.791 1.00 0.00 C ATOM 2288 OG SER B 60 -0.415 -12.334 1.437 1.00 0.00 O ATOM 0 H SER B 60 -0.070 -9.776 1.754 1.00 0.00 H new ATOM 0 HA SER B 60 -2.564 -11.017 2.604 1.00 0.00 H new ATOM 0 HB2 SER B 60 0.295 -11.785 3.293 1.00 0.00 H new ATOM 0 HB3 SER B 60 -1.125 -12.812 3.312 1.00 0.00 H new ATOM 0 HG SER B 60 0.338 -11.811 1.089 1.00 0.00 H new ATOM 2294 N ASN B 61 -2.099 -11.000 5.225 1.00 0.00 N ATOM 2295 CA ASN B 61 -2.226 -10.614 6.631 1.00 0.00 C ATOM 2296 C ASN B 61 -0.887 -10.175 7.237 1.00 0.00 C ATOM 2297 O ASN B 61 -0.754 -9.043 7.698 1.00 0.00 O ATOM 2298 CB ASN B 61 -2.839 -11.770 7.440 1.00 0.00 C ATOM 2299 CG ASN B 61 -2.303 -13.140 7.041 1.00 0.00 C ATOM 2300 OD1 ASN B 61 -1.150 -13.287 6.636 1.00 0.00 O ATOM 2301 ND2 ASN B 61 -3.148 -14.153 7.130 1.00 0.00 N ATOM 0 H ASN B 61 -2.459 -11.931 5.017 1.00 0.00 H new ATOM 0 HA ASN B 61 -2.890 -9.751 6.678 1.00 0.00 H new ATOM 0 HB2 ASN B 61 -2.643 -11.606 8.500 1.00 0.00 H new ATOM 0 HB3 ASN B 61 -3.921 -11.760 7.311 1.00 0.00 H new ATOM 0 HD21 ASN B 61 -2.851 -15.090 6.859 1.00 0.00 H new ATOM 0 HD22 ASN B 61 -4.097 -13.997 7.470 1.00 0.00 H new ATOM 2308 N GLU B 62 0.097 -11.064 7.212 1.00 0.00 N ATOM 2309 CA GLU B 62 1.425 -10.784 7.762 1.00 0.00 C ATOM 2310 C GLU B 62 2.079 -9.599 7.053 1.00 0.00 C ATOM 2311 O GLU B 62 2.673 -8.729 7.694 1.00 0.00 O ATOM 2312 CB GLU B 62 2.307 -12.031 7.628 1.00 0.00 C ATOM 2313 CG GLU B 62 3.722 -11.853 8.158 1.00 0.00 C ATOM 2314 CD GLU B 62 3.769 -11.603 9.651 1.00 0.00 C ATOM 2315 OE1 GLU B 62 3.725 -12.584 10.422 1.00 0.00 O ATOM 2316 OE2 GLU B 62 3.870 -10.432 10.061 1.00 0.00 O ATOM 0 H GLU B 62 0.002 -11.998 6.812 1.00 0.00 H new ATOM 0 HA GLU B 62 1.315 -10.524 8.815 1.00 0.00 H new ATOM 0 HB2 GLU B 62 1.833 -12.856 8.159 1.00 0.00 H new ATOM 0 HB3 GLU B 62 2.358 -12.315 6.577 1.00 0.00 H new ATOM 0 HG2 GLU B 62 4.305 -12.744 7.926 1.00 0.00 H new ATOM 0 HG3 GLU B 62 4.195 -11.019 7.641 1.00 0.00 H new ATOM 2323 N GLU B 63 1.952 -9.567 5.734 1.00 0.00 N ATOM 2324 CA GLU B 63 2.571 -8.522 4.925 1.00 0.00 C ATOM 2325 C GLU B 63 2.027 -7.151 5.306 1.00 0.00 C ATOM 2326 O GLU B 63 2.784 -6.207 5.541 1.00 0.00 O ATOM 2327 CB GLU B 63 2.309 -8.776 3.441 1.00 0.00 C ATOM 2328 CG GLU B 63 2.566 -10.209 3.009 1.00 0.00 C ATOM 2329 CD GLU B 63 2.462 -10.386 1.512 1.00 0.00 C ATOM 2330 OE1 GLU B 63 1.333 -10.328 0.974 1.00 0.00 O ATOM 2331 OE2 GLU B 63 3.505 -10.558 0.858 1.00 0.00 O ATOM 0 H GLU B 63 1.424 -10.255 5.198 1.00 0.00 H new ATOM 0 HA GLU B 63 3.645 -8.542 5.113 1.00 0.00 H new ATOM 0 HB2 GLU B 63 1.274 -8.518 3.215 1.00 0.00 H new ATOM 0 HB3 GLU B 63 2.939 -8.110 2.851 1.00 0.00 H new ATOM 0 HG2 GLU B 63 3.559 -10.513 3.340 1.00 0.00 H new ATOM 0 HG3 GLU B 63 1.850 -10.868 3.501 1.00 0.00 H new ATOM 2338 N PHE B 64 0.707 -7.062 5.388 1.00 0.00 N ATOM 2339 CA PHE B 64 0.032 -5.810 5.688 1.00 0.00 C ATOM 2340 C PHE B 64 0.310 -5.387 7.128 1.00 0.00 C ATOM 2341 O PHE B 64 0.504 -4.204 7.412 1.00 0.00 O ATOM 2342 CB PHE B 64 -1.467 -5.977 5.459 1.00 0.00 C ATOM 2343 CG PHE B 64 -2.200 -4.692 5.207 1.00 0.00 C ATOM 2344 CD1 PHE B 64 -2.193 -4.115 3.950 1.00 0.00 C ATOM 2345 CD2 PHE B 64 -2.913 -4.075 6.219 1.00 0.00 C ATOM 2346 CE1 PHE B 64 -2.882 -2.943 3.706 1.00 0.00 C ATOM 2347 CE2 PHE B 64 -3.608 -2.906 5.985 1.00 0.00 C ATOM 2348 CZ PHE B 64 -3.593 -2.340 4.727 1.00 0.00 C ATOM 0 H PHE B 64 0.077 -7.852 5.249 1.00 0.00 H new ATOM 0 HA PHE B 64 0.410 -5.030 5.028 1.00 0.00 H new ATOM 0 HB2 PHE B 64 -1.621 -6.642 4.609 1.00 0.00 H new ATOM 0 HB3 PHE B 64 -1.904 -6.466 6.330 1.00 0.00 H new ATOM 0 HD1 PHE B 64 -1.642 -4.587 3.150 1.00 0.00 H new ATOM 0 HD2 PHE B 64 -2.926 -4.514 7.206 1.00 0.00 H new ATOM 0 HE1 PHE B 64 -2.865 -2.499 2.721 1.00 0.00 H new ATOM 0 HE2 PHE B 64 -4.162 -2.436 6.784 1.00 0.00 H new ATOM 0 HZ PHE B 64 -4.137 -1.426 4.540 1.00 0.00 H new ATOM 2358 N GLN B 65 0.339 -6.367 8.030 1.00 0.00 N ATOM 2359 CA GLN B 65 0.659 -6.115 9.434 1.00 0.00 C ATOM 2360 C GLN B 65 2.067 -5.545 9.561 1.00 0.00 C ATOM 2361 O GLN B 65 2.294 -4.586 10.305 1.00 0.00 O ATOM 2362 CB GLN B 65 0.538 -7.403 10.255 1.00 0.00 C ATOM 2363 CG GLN B 65 0.895 -7.222 11.725 1.00 0.00 C ATOM 2364 CD GLN B 65 -0.039 -6.267 12.444 1.00 0.00 C ATOM 2365 OE1 GLN B 65 -1.045 -6.678 13.016 1.00 0.00 O ATOM 2366 NE2 GLN B 65 0.291 -4.986 12.425 1.00 0.00 N ATOM 0 H GLN B 65 0.144 -7.344 7.813 1.00 0.00 H new ATOM 0 HA GLN B 65 -0.054 -5.387 9.823 1.00 0.00 H new ATOM 0 HB2 GLN B 65 -0.483 -7.777 10.181 1.00 0.00 H new ATOM 0 HB3 GLN B 65 1.189 -8.163 9.822 1.00 0.00 H new ATOM 0 HG2 GLN B 65 0.869 -8.192 12.222 1.00 0.00 H new ATOM 0 HG3 GLN B 65 1.917 -6.851 11.803 1.00 0.00 H new ATOM 0 HE21 GLN B 65 1.135 -4.684 11.939 1.00 0.00 H new ATOM 0 HE22 GLN B 65 -0.299 -4.300 12.897 1.00 0.00 H new ATOM 2375 N THR B 66 3.004 -6.138 8.824 1.00 0.00 N ATOM 2376 CA THR B 66 4.381 -5.660 8.792 1.00 0.00 C ATOM 2377 C THR B 66 4.423 -4.191 8.369 1.00 0.00 C ATOM 2378 O THR B 66 5.109 -3.371 8.985 1.00 0.00 O ATOM 2379 CB THR B 66 5.239 -6.504 7.819 1.00 0.00 C ATOM 2380 OG1 THR B 66 5.179 -7.893 8.183 1.00 0.00 O ATOM 2381 CG2 THR B 66 6.690 -6.042 7.825 1.00 0.00 C ATOM 0 H THR B 66 2.831 -6.955 8.238 1.00 0.00 H new ATOM 0 HA THR B 66 4.793 -5.759 9.796 1.00 0.00 H new ATOM 0 HB THR B 66 4.835 -6.371 6.815 1.00 0.00 H new ATOM 0 HG1 THR B 66 4.413 -8.314 7.741 1.00 0.00 H new ATOM 0 HG21 THR B 66 7.269 -6.653 7.132 1.00 0.00 H new ATOM 0 HG22 THR B 66 6.741 -4.998 7.517 1.00 0.00 H new ATOM 0 HG23 THR B 66 7.100 -6.145 8.830 1.00 0.00 H new ATOM 2389 N MET B 67 3.653 -3.871 7.329 1.00 0.00 N ATOM 2390 CA MET B 67 3.565 -2.510 6.812 1.00 0.00 C ATOM 2391 C MET B 67 3.072 -1.545 7.883 1.00 0.00 C ATOM 2392 O MET B 67 3.746 -0.572 8.216 1.00 0.00 O ATOM 2393 CB MET B 67 2.619 -2.460 5.610 1.00 0.00 C ATOM 2394 CG MET B 67 2.494 -1.075 4.998 1.00 0.00 C ATOM 2395 SD MET B 67 1.181 -0.962 3.771 1.00 0.00 S ATOM 2396 CE MET B 67 -0.266 -1.008 4.824 1.00 0.00 C ATOM 0 H MET B 67 3.077 -4.545 6.825 1.00 0.00 H new ATOM 0 HA MET B 67 4.565 -2.207 6.503 1.00 0.00 H new ATOM 0 HB2 MET B 67 2.974 -3.155 4.849 1.00 0.00 H new ATOM 0 HB3 MET B 67 1.632 -2.803 5.919 1.00 0.00 H new ATOM 0 HG2 MET B 67 2.307 -0.350 5.790 1.00 0.00 H new ATOM 0 HG3 MET B 67 3.442 -0.802 4.534 1.00 0.00 H new ATOM 0 HE1 MET B 67 -1.136 -0.667 4.262 1.00 0.00 H new ATOM 0 HE2 MET B 67 -0.433 -2.029 5.168 1.00 0.00 H new ATOM 0 HE3 MET B 67 -0.111 -0.356 5.684 1.00 0.00 H new ATOM 2406 N VAL B 68 1.893 -1.838 8.419 1.00 0.00 N ATOM 2407 CA VAL B 68 1.244 -0.972 9.396 1.00 0.00 C ATOM 2408 C VAL B 68 2.136 -0.722 10.606 1.00 0.00 C ATOM 2409 O VAL B 68 2.415 0.422 10.945 1.00 0.00 O ATOM 2410 CB VAL B 68 -0.093 -1.576 9.871 1.00 0.00 C ATOM 2411 CG1 VAL B 68 -0.709 -0.738 10.986 1.00 0.00 C ATOM 2412 CG2 VAL B 68 -1.056 -1.703 8.702 1.00 0.00 C ATOM 0 H VAL B 68 1.362 -2.678 8.190 1.00 0.00 H new ATOM 0 HA VAL B 68 1.055 -0.022 8.896 1.00 0.00 H new ATOM 0 HB VAL B 68 0.105 -2.570 10.272 1.00 0.00 H new ATOM 0 HG11 VAL B 68 -1.651 -1.188 11.301 1.00 0.00 H new ATOM 0 HG12 VAL B 68 -0.024 -0.699 11.833 1.00 0.00 H new ATOM 0 HG13 VAL B 68 -0.893 0.273 10.622 1.00 0.00 H new ATOM 0 HG21 VAL B 68 -1.996 -2.131 9.050 1.00 0.00 H new ATOM 0 HG22 VAL B 68 -1.242 -0.718 8.275 1.00 0.00 H new ATOM 0 HG23 VAL B 68 -0.622 -2.352 7.942 1.00 0.00 H new ATOM 2422 N ASP B 69 2.596 -1.801 11.229 1.00 0.00 N ATOM 2423 CA ASP B 69 3.366 -1.715 12.468 1.00 0.00 C ATOM 2424 C ASP B 69 4.632 -0.872 12.295 1.00 0.00 C ATOM 2425 O ASP B 69 4.896 0.050 13.079 1.00 0.00 O ATOM 2426 CB ASP B 69 3.725 -3.119 12.954 1.00 0.00 C ATOM 2427 CG ASP B 69 4.589 -3.103 14.195 1.00 0.00 C ATOM 2428 OD1 ASP B 69 4.097 -2.692 15.267 1.00 0.00 O ATOM 2429 OD2 ASP B 69 5.761 -3.526 14.106 1.00 0.00 O ATOM 0 H ASP B 69 2.448 -2.753 10.894 1.00 0.00 H new ATOM 0 HA ASP B 69 2.745 -1.220 13.214 1.00 0.00 H new ATOM 0 HB2 ASP B 69 2.809 -3.673 13.161 1.00 0.00 H new ATOM 0 HB3 ASP B 69 4.247 -3.652 12.159 1.00 0.00 H new ATOM 2434 N ALA B 70 5.397 -1.162 11.251 1.00 0.00 N ATOM 2435 CA ALA B 70 6.652 -0.462 11.018 1.00 0.00 C ATOM 2436 C ALA B 70 6.414 1.020 10.749 1.00 0.00 C ATOM 2437 O ALA B 70 7.103 1.878 11.302 1.00 0.00 O ATOM 2438 CB ALA B 70 7.414 -1.096 9.870 1.00 0.00 C ATOM 0 H ALA B 70 5.172 -1.873 10.556 1.00 0.00 H new ATOM 0 HA ALA B 70 7.255 -0.547 11.922 1.00 0.00 H new ATOM 0 HB1 ALA B 70 8.349 -0.558 9.712 1.00 0.00 H new ATOM 0 HB2 ALA B 70 7.631 -2.137 10.108 1.00 0.00 H new ATOM 0 HB3 ALA B 70 6.811 -1.049 8.963 1.00 0.00 H new ATOM 2444 N PHE B 71 5.427 1.315 9.909 1.00 0.00 N ATOM 2445 CA PHE B 71 5.104 2.698 9.571 1.00 0.00 C ATOM 2446 C PHE B 71 4.495 3.455 10.748 1.00 0.00 C ATOM 2447 O PHE B 71 4.852 4.607 10.988 1.00 0.00 O ATOM 2448 CB PHE B 71 4.155 2.772 8.374 1.00 0.00 C ATOM 2449 CG PHE B 71 4.833 2.583 7.047 1.00 0.00 C ATOM 2450 CD1 PHE B 71 5.996 3.273 6.742 1.00 0.00 C ATOM 2451 CD2 PHE B 71 4.301 1.726 6.102 1.00 0.00 C ATOM 2452 CE1 PHE B 71 6.613 3.107 5.518 1.00 0.00 C ATOM 2453 CE2 PHE B 71 4.912 1.559 4.877 1.00 0.00 C ATOM 2454 CZ PHE B 71 6.070 2.249 4.583 1.00 0.00 C ATOM 0 H PHE B 71 4.839 0.619 9.451 1.00 0.00 H new ATOM 0 HA PHE B 71 6.049 3.175 9.311 1.00 0.00 H new ATOM 0 HB2 PHE B 71 3.382 2.012 8.488 1.00 0.00 H new ATOM 0 HB3 PHE B 71 3.653 3.740 8.380 1.00 0.00 H new ATOM 0 HD1 PHE B 71 6.424 3.947 7.469 1.00 0.00 H new ATOM 0 HD2 PHE B 71 3.396 1.181 6.326 1.00 0.00 H new ATOM 0 HE1 PHE B 71 7.520 3.648 5.292 1.00 0.00 H new ATOM 0 HE2 PHE B 71 4.484 0.888 4.147 1.00 0.00 H new ATOM 0 HZ PHE B 71 6.550 2.118 3.624 1.00 0.00 H new ATOM 2464 N LYS B 72 3.586 2.819 11.485 1.00 0.00 N ATOM 2465 CA LYS B 72 2.885 3.500 12.574 1.00 0.00 C ATOM 2466 C LYS B 72 3.860 3.932 13.661 1.00 0.00 C ATOM 2467 O LYS B 72 3.610 4.901 14.384 1.00 0.00 O ATOM 2468 CB LYS B 72 1.772 2.614 13.160 1.00 0.00 C ATOM 2469 CG LYS B 72 2.263 1.367 13.883 1.00 0.00 C ATOM 2470 CD LYS B 72 2.222 1.526 15.394 1.00 0.00 C ATOM 2471 CE LYS B 72 0.790 1.630 15.899 1.00 0.00 C ATOM 2472 NZ LYS B 72 0.726 1.686 17.378 1.00 0.00 N ATOM 0 H LYS B 72 3.319 1.844 11.351 1.00 0.00 H new ATOM 0 HA LYS B 72 2.418 4.394 12.161 1.00 0.00 H new ATOM 0 HB2 LYS B 72 1.180 3.210 13.854 1.00 0.00 H new ATOM 0 HB3 LYS B 72 1.106 2.310 12.353 1.00 0.00 H new ATOM 0 HG2 LYS B 72 1.649 0.515 13.592 1.00 0.00 H new ATOM 0 HG3 LYS B 72 3.283 1.146 13.570 1.00 0.00 H new ATOM 0 HD2 LYS B 72 2.715 0.676 15.865 1.00 0.00 H new ATOM 0 HD3 LYS B 72 2.778 2.418 15.683 1.00 0.00 H new ATOM 0 HE2 LYS B 72 0.322 2.522 15.482 1.00 0.00 H new ATOM 0 HE3 LYS B 72 0.217 0.774 15.543 1.00 0.00 H new ATOM 0 HZ1 LYS B 72 -0.262 1.586 17.687 1.00 0.00 H new ATOM 0 HZ2 LYS B 72 1.294 0.913 17.780 1.00 0.00 H new ATOM 0 HZ3 LYS B 72 1.101 2.599 17.707 1.00 0.00 H new ATOM 2486 N GLY B 73 4.974 3.219 13.769 1.00 0.00 N ATOM 2487 CA GLY B 73 6.001 3.598 14.718 1.00 0.00 C ATOM 2488 C GLY B 73 7.119 4.405 14.077 1.00 0.00 C ATOM 2489 O GLY B 73 8.134 4.686 14.717 1.00 0.00 O ATOM 0 H GLY B 73 5.184 2.387 13.217 1.00 0.00 H new ATOM 0 HA2 GLY B 73 5.551 4.181 15.521 1.00 0.00 H new ATOM 0 HA3 GLY B 73 6.420 2.700 15.172 1.00 0.00 H new ATOM 2493 N ASN B 74 6.936 4.800 12.822 1.00 0.00 N ATOM 2494 CA ASN B 74 7.981 5.514 12.089 1.00 0.00 C ATOM 2495 C ASN B 74 7.468 6.833 11.512 1.00 0.00 C ATOM 2496 O ASN B 74 7.927 7.907 11.905 1.00 0.00 O ATOM 2497 CB ASN B 74 8.550 4.634 10.967 1.00 0.00 C ATOM 2498 CG ASN B 74 9.666 5.316 10.191 1.00 0.00 C ATOM 2499 OD1 ASN B 74 10.357 6.193 10.711 1.00 0.00 O ATOM 2500 ND2 ASN B 74 9.876 4.897 8.954 1.00 0.00 N ATOM 0 H ASN B 74 6.080 4.640 12.291 1.00 0.00 H new ATOM 0 HA ASN B 74 8.775 5.746 12.799 1.00 0.00 H new ATOM 0 HB2 ASN B 74 8.927 3.705 11.396 1.00 0.00 H new ATOM 0 HB3 ASN B 74 7.748 4.365 10.280 1.00 0.00 H new ATOM 0 HD21 ASN B 74 10.630 5.302 8.399 1.00 0.00 H new ATOM 0 HD22 ASN B 74 9.284 4.168 8.555 1.00 0.00 H new ATOM 2507 N LEU B 75 6.506 6.756 10.599 1.00 0.00 N ATOM 2508 CA LEU B 75 6.031 7.942 9.894 1.00 0.00 C ATOM 2509 C LEU B 75 4.830 8.554 10.600 1.00 0.00 C ATOM 2510 O LEU B 75 3.681 8.232 10.296 1.00 0.00 O ATOM 2511 CB LEU B 75 5.666 7.604 8.446 1.00 0.00 C ATOM 2512 CG LEU B 75 5.227 8.797 7.591 1.00 0.00 C ATOM 2513 CD1 LEU B 75 6.354 9.811 7.467 1.00 0.00 C ATOM 2514 CD2 LEU B 75 4.769 8.331 6.217 1.00 0.00 C ATOM 0 H LEU B 75 6.041 5.889 10.330 1.00 0.00 H new ATOM 0 HA LEU B 75 6.842 8.671 9.892 1.00 0.00 H new ATOM 0 HB2 LEU B 75 6.527 7.134 7.971 1.00 0.00 H new ATOM 0 HB3 LEU B 75 4.863 6.867 8.453 1.00 0.00 H new ATOM 0 HG LEU B 75 4.385 9.282 8.085 1.00 0.00 H new ATOM 0 HD11 LEU B 75 6.022 10.651 6.856 1.00 0.00 H new ATOM 0 HD12 LEU B 75 6.631 10.170 8.458 1.00 0.00 H new ATOM 0 HD13 LEU B 75 7.218 9.340 6.998 1.00 0.00 H new ATOM 0 HD21 LEU B 75 4.461 9.193 5.625 1.00 0.00 H new ATOM 0 HD22 LEU B 75 5.590 7.819 5.714 1.00 0.00 H new ATOM 0 HD23 LEU B 75 3.928 7.647 6.327 1.00 0.00 H new ATOM 2526 N GLU B 76 5.108 9.430 11.551 1.00 0.00 N ATOM 2527 CA GLU B 76 4.070 10.090 12.320 1.00 0.00 C ATOM 2528 C GLU B 76 4.705 11.232 13.108 1.00 0.00 C ATOM 2529 O GLU B 76 5.471 11.000 14.043 1.00 0.00 O ATOM 2530 CB GLU B 76 3.386 9.074 13.248 1.00 0.00 C ATOM 2531 CG GLU B 76 1.929 9.387 13.551 1.00 0.00 C ATOM 2532 CD GLU B 76 1.758 10.439 14.618 1.00 0.00 C ATOM 2533 OE1 GLU B 76 1.695 11.637 14.273 1.00 0.00 O ATOM 2534 OE2 GLU B 76 1.678 10.061 15.806 1.00 0.00 O ATOM 0 H GLU B 76 6.056 9.702 11.810 1.00 0.00 H new ATOM 0 HA GLU B 76 3.304 10.500 11.662 1.00 0.00 H new ATOM 0 HB2 GLU B 76 3.446 8.085 12.793 1.00 0.00 H new ATOM 0 HB3 GLU B 76 3.938 9.027 14.186 1.00 0.00 H new ATOM 0 HG2 GLU B 76 1.438 9.722 12.637 1.00 0.00 H new ATOM 0 HG3 GLU B 76 1.426 8.473 13.867 1.00 0.00 H new ATOM 2541 N HIS B 77 4.395 12.462 12.714 1.00 0.00 N ATOM 2542 CA HIS B 77 5.122 13.631 13.213 1.00 0.00 C ATOM 2543 C HIS B 77 4.680 14.054 14.614 1.00 0.00 C ATOM 2544 O HIS B 77 5.309 14.923 15.211 1.00 0.00 O ATOM 2545 CB HIS B 77 5.017 14.811 12.231 1.00 0.00 C ATOM 2546 CG HIS B 77 3.625 15.153 11.790 1.00 0.00 C ATOM 2547 ND1 HIS B 77 3.191 14.990 10.493 1.00 0.00 N ATOM 2548 CD2 HIS B 77 2.574 15.677 12.469 1.00 0.00 C ATOM 2549 CE1 HIS B 77 1.942 15.397 10.395 1.00 0.00 C ATOM 2550 NE2 HIS B 77 1.544 15.818 11.579 1.00 0.00 N ATOM 0 H HIS B 77 3.649 12.679 12.053 1.00 0.00 H new ATOM 0 HA HIS B 77 6.167 13.331 13.290 1.00 0.00 H new ATOM 0 HB2 HIS B 77 5.460 15.691 12.697 1.00 0.00 H new ATOM 0 HB3 HIS B 77 5.615 14.583 11.349 1.00 0.00 H new ATOM 0 HD2 HIS B 77 2.554 15.935 13.518 1.00 0.00 H new ATOM 0 HE1 HIS B 77 1.344 15.387 9.495 1.00 0.00 H new ATOM 0 HE2 HIS B 77 0.619 16.189 11.796 1.00 0.00 H new ATOM 2559 N HIS B 78 3.609 13.446 15.123 1.00 0.00 N ATOM 2560 CA HIS B 78 3.146 13.670 16.500 1.00 0.00 C ATOM 2561 C HIS B 78 2.683 15.110 16.739 1.00 0.00 C ATOM 2562 O HIS B 78 1.485 15.386 16.759 1.00 0.00 O ATOM 2563 CB HIS B 78 4.240 13.293 17.506 1.00 0.00 C ATOM 2564 CG HIS B 78 4.553 11.833 17.536 1.00 0.00 C ATOM 2565 ND1 HIS B 78 5.773 11.314 17.158 1.00 0.00 N ATOM 2566 CD2 HIS B 78 3.799 10.776 17.912 1.00 0.00 C ATOM 2567 CE1 HIS B 78 5.755 10.004 17.297 1.00 0.00 C ATOM 2568 NE2 HIS B 78 4.567 9.652 17.753 1.00 0.00 N ATOM 0 H HIS B 78 3.036 12.785 14.597 1.00 0.00 H new ATOM 0 HA HIS B 78 2.281 13.024 16.648 1.00 0.00 H new ATOM 0 HB2 HIS B 78 5.148 13.845 17.265 1.00 0.00 H new ATOM 0 HB3 HIS B 78 3.930 13.609 18.502 1.00 0.00 H new ATOM 0 HD2 HIS B 78 2.781 10.811 18.271 1.00 0.00 H new ATOM 0 HE1 HIS B 78 6.572 9.333 17.076 1.00 0.00 H new ATOM 0 HE2 HIS B 78 4.269 8.698 17.954 1.00 0.00 H new ATOM 2577 N HIS B 79 3.632 16.024 16.910 1.00 0.00 N ATOM 2578 CA HIS B 79 3.308 17.415 17.205 1.00 0.00 C ATOM 2579 C HIS B 79 3.925 18.341 16.157 1.00 0.00 C ATOM 2580 O HIS B 79 4.570 19.335 16.487 1.00 0.00 O ATOM 2581 CB HIS B 79 3.755 17.800 18.634 1.00 0.00 C ATOM 2582 CG HIS B 79 5.239 17.750 18.896 1.00 0.00 C ATOM 2583 ND1 HIS B 79 5.892 16.637 19.382 1.00 0.00 N ATOM 2584 CD2 HIS B 79 6.190 18.707 18.766 1.00 0.00 C ATOM 2585 CE1 HIS B 79 7.175 16.916 19.535 1.00 0.00 C ATOM 2586 NE2 HIS B 79 7.380 18.164 19.168 1.00 0.00 N ATOM 0 H HIS B 79 4.631 15.827 16.849 1.00 0.00 H new ATOM 0 HA HIS B 79 2.225 17.532 17.162 1.00 0.00 H new ATOM 0 HB2 HIS B 79 3.402 18.810 18.844 1.00 0.00 H new ATOM 0 HB3 HIS B 79 3.258 17.135 19.341 1.00 0.00 H new ATOM 0 HD2 HIS B 79 6.036 19.715 18.410 1.00 0.00 H new ATOM 0 HE1 HIS B 79 7.929 16.234 19.900 1.00 0.00 H new ATOM 0 HE2 HIS B 79 8.278 18.647 19.181 1.00 0.00 H new ATOM 2595 N HIS B 80 3.687 18.007 14.887 1.00 0.00 N ATOM 2596 CA HIS B 80 4.259 18.725 13.734 1.00 0.00 C ATOM 2597 C HIS B 80 5.756 18.447 13.611 1.00 0.00 C ATOM 2598 O HIS B 80 6.246 18.083 12.543 1.00 0.00 O ATOM 2599 CB HIS B 80 4.009 20.238 13.817 1.00 0.00 C ATOM 2600 CG HIS B 80 2.561 20.618 13.817 1.00 0.00 C ATOM 2601 ND1 HIS B 80 1.840 20.854 12.671 1.00 0.00 N ATOM 2602 CD2 HIS B 80 1.699 20.793 14.842 1.00 0.00 C ATOM 2603 CE1 HIS B 80 0.597 21.160 12.993 1.00 0.00 C ATOM 2604 NE2 HIS B 80 0.483 21.129 14.307 1.00 0.00 N ATOM 0 H HIS B 80 3.088 17.225 14.622 1.00 0.00 H new ATOM 0 HA HIS B 80 3.753 18.353 12.843 1.00 0.00 H new ATOM 0 HB2 HIS B 80 4.475 20.623 14.724 1.00 0.00 H new ATOM 0 HB3 HIS B 80 4.501 20.724 12.975 1.00 0.00 H new ATOM 0 HD2 HIS B 80 1.927 20.687 15.892 1.00 0.00 H new ATOM 0 HE1 HIS B 80 -0.194 21.396 12.297 1.00 0.00 H new ATOM 0 HE2 HIS B 80 -0.367 21.323 14.836 1.00 0.00 H new ATOM 2613 N HIS B 81 6.472 18.620 14.711 1.00 0.00 N ATOM 2614 CA HIS B 81 7.898 18.336 14.762 1.00 0.00 C ATOM 2615 C HIS B 81 8.109 16.942 15.326 1.00 0.00 C ATOM 2616 O HIS B 81 7.456 16.562 16.300 1.00 0.00 O ATOM 2617 CB HIS B 81 8.622 19.358 15.645 1.00 0.00 C ATOM 2618 CG HIS B 81 8.334 20.786 15.292 1.00 0.00 C ATOM 2619 ND1 HIS B 81 9.133 21.531 14.462 1.00 0.00 N ATOM 2620 CD2 HIS B 81 7.320 21.601 15.667 1.00 0.00 C ATOM 2621 CE1 HIS B 81 8.630 22.741 14.340 1.00 0.00 C ATOM 2622 NE2 HIS B 81 7.527 22.815 15.061 1.00 0.00 N ATOM 0 H HIS B 81 6.083 18.960 15.591 1.00 0.00 H new ATOM 0 HA HIS B 81 8.306 18.398 13.753 1.00 0.00 H new ATOM 0 HB2 HIS B 81 8.340 19.188 16.684 1.00 0.00 H new ATOM 0 HB3 HIS B 81 9.696 19.187 15.574 1.00 0.00 H new ATOM 0 HD2 HIS B 81 6.500 21.344 16.322 1.00 0.00 H new ATOM 0 HE1 HIS B 81 9.050 23.541 13.748 1.00 0.00 H new ATOM 0 HE2 HIS B 81 6.929 23.636 15.152 1.00 0.00 H new ATOM 2631 N HIS B 82 9.007 16.179 14.722 1.00 0.00 N ATOM 2632 CA HIS B 82 9.276 14.823 15.184 1.00 0.00 C ATOM 2633 C HIS B 82 10.596 14.767 15.949 1.00 0.00 C ATOM 2634 O HIS B 82 11.564 14.161 15.450 1.00 0.00 O ATOM 2635 CB HIS B 82 9.261 13.818 14.014 1.00 0.00 C ATOM 2636 CG HIS B 82 10.025 14.241 12.786 1.00 0.00 C ATOM 2637 ND1 HIS B 82 11.316 14.616 12.617 1.00 0.00 N flip ATOM 2638 CD2 HIS B 82 9.453 14.293 11.533 1.00 0.00 C flip ATOM 2639 CE1 HIS B 82 11.493 14.881 11.284 1.00 0.00 C flip ATOM 2640 NE2 HIS B 82 10.356 14.676 10.651 1.00 0.00 N flip ATOM 2641 OXT HIS B 82 10.668 15.363 17.043 1.00 0.00 O ATOM 0 H HIS B 82 9.559 16.472 13.916 1.00 0.00 H new ATOM 0 HA HIS B 82 8.478 14.535 15.868 1.00 0.00 H new ATOM 0 HB2 HIS B 82 9.669 12.871 14.366 1.00 0.00 H new ATOM 0 HB3 HIS B 82 8.225 13.633 13.730 1.00 0.00 H new ATOM 0 HD1 HIS B 82 12.025 14.688 13.347 1.00 0.00 H new ATOM 0 HD2 HIS B 82 8.424 14.056 11.308 1.00 0.00 H new ATOM 0 HE1 HIS B 82 12.416 15.206 10.826 1.00 0.00 H new TER 2650 HIS B 82