USER MOD reduce.3.24.130724 H: found=0, std=0, add=1844, rem=0, adj=56 USER MOD reduce.3.24.130724 removed 1841 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: B 73 ASN : amide:sc= 1.1 K(o=1,f=-0.38) USER MOD Set 1.2: B 95 HIS : no HE2:sc= -0.0941 X(o=1,f=0.6) USER MOD Set 2.1: B 13 ASN : amide:sc= -1.86 K(o=0.81,f=-3.7!) USER MOD Set 2.2: B 18 GLN : amide:sc= 1.77 K(o=0.81,f=-3.6) USER MOD Set 2.3: B 62 GLN : amide:sc= -0.269 K(o=0.81,f=-0.93) USER MOD Set 2.4: B 64 SER OG : rot -80:sc= 1.17 USER MOD Set 3.1: B 45 ASN : amide:sc= 0.087 K(o=0.78,f=-8!) USER MOD Set 3.2: B 47 ASN : amide:sc= 0.696 K(o=0.78,f=-11!) USER MOD Set 4.1: B 33 LYS NZ :NH3+ -148:sc= 0.726 (180deg=0) USER MOD Set 4.2: B 35 TYR OH : rot 180:sc= 0.651 USER MOD Set 5.1: B 10 SER OG : rot -90:sc= 0.835 USER MOD Set 5.2: B 17 SER OG : rot -97:sc= 0.667 USER MOD Set 6.1: A 102 LYS NZ :NH3+ 149:sc= 2.35 (180deg=1.02) USER MOD Set 6.2: A 103 HIS : no HE2:sc= 0.632 K(o=3,f=-7.6!) USER MOD Set 7.1: A 87 SER OG : rot -130:sc= 0.664 USER MOD Set 7.2: A 91 LYS NZ :NH3+ -139:sc= 1.33 (180deg=0.236) USER MOD Set 8.1: A 71 SER OG : rot -76:sc= 1.2 USER MOD Set 8.2: A 74 THR OG1 : rot 110:sc= 1.06 USER MOD Set 9.1: A 7 THR OG1 : rot 43:sc= 1.33 USER MOD Set 9.2: A 60 ASN : amide:sc= 0.897 K(o=2.2,f=0.15) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -131:sc= 2.62 (180deg=-0.0953) USER MOD Single : A 5 LYS NZ :NH3+ 178:sc= 1.26 (180deg=1.25) USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 73:sc= 0.953 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0.0342 USER MOD Single : A 16 SER OG : rot 57:sc= 1.19 USER MOD Single : A 32 SER OG : rot 167:sc= 1.51 USER MOD Single : A 33 LYS NZ :NH3+ -161:sc= 1.37 (180deg=0.983) USER MOD Single : A 34 MET CE :methyl -179:sc= 0 (180deg=-0.00175) USER MOD Single : A 44 GLN : amide:sc= 0.76 K(o=0.76,f=0) USER MOD Single : A 46 MET CE :methyl -156:sc= -0.218 (180deg=-1.16) USER MOD Single : A 49 LYS NZ :NH3+ -145:sc= 1.04 (180deg=0.367) USER MOD Single : A 51 LYS NZ :NH3+ -170:sc= 2.21 (180deg=2.15) USER MOD Single : A 54 LYS NZ :NH3+ 157:sc= 0.533 (180deg=0.177) USER MOD Single : A 61 GLN : amide:sc= -0.94! C(o=-0.94!,f=-1.5!) USER MOD Single : A 63 THR OG1 : rot -147:sc= -0.366 USER MOD Single : A 66 LYS NZ :NH3+ 170:sc= 1.27 (180deg=1.11) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 MET CE :methyl -153:sc= -2.05 (180deg=-4.18!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 1.04 (180deg=1.04) USER MOD Single : A 86 THR OG1 : rot 180:sc= -0.0031 USER MOD Single : A 93 LYS NZ :NH3+ 159:sc= 2.34 (180deg=1.88) USER MOD Single : A 97 GLN : amide:sc= 1.16 K(o=1.2,f=-0.077) USER MOD Single : A 101 ASN : amide:sc= -0.0618 X(o=-0.062,f=-0.0093) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 3 ASN : amide:sc= 0.0331 X(o=0.033,f=0) USER MOD Single : B 4 LYS NZ :NH3+ 151:sc= 2.86 (180deg=2.16) USER MOD Single : B 7 TYR OH : rot 180:sc= 0.278 USER MOD Single : B 11 THR OG1 : rot 140:sc= -0.191 USER MOD Single : B 14 SER OG : rot 180:sc= 0.018 USER MOD Single : B 19 MET CE :methyl -157:sc= 0 (180deg=-0.5) USER MOD Single : B 25 LYS NZ :NH3+ 136:sc= 2.07 (180deg=0.193) USER MOD Single : B 26 GLN : amide:sc= 0.0685 X(o=0.069,f=-0.069) USER MOD Single : B 27 TYR OH : rot 180:sc= 0 USER MOD Single : B 36 SER OG : rot 155:sc= 1.28 USER MOD Single : B 42 HIS : no HE2:sc= 0.911 K(o=0.91,f=-2.7!) USER MOD Single : B 50 LYS NZ :NH3+ -175:sc= 1.26 (180deg=1.23) USER MOD Single : B 52 MET CE :methyl 172:sc= -0.939 (180deg=-1.4) USER MOD Single : B 53 LYS NZ :NH3+ 150:sc= 1.12 (180deg=0.3) USER MOD Single : B 60 SER OG : rot 78:sc= 1.18 USER MOD Single : B 61 ASN : amide:sc= -0.205 X(o=-0.2,f=-0.2) USER MOD Single : B 63 THR OG1 : rot 180:sc= 0 USER MOD Single : B 69 SER OG : rot 150:sc= 0.0345 USER MOD Single : B 74 ASN : amide:sc= 1.03 K(o=1,f=-0.0094) USER MOD Single : B 80 THR OG1 : rot -60:sc= 0.394 USER MOD Single : B 82 SER OG : rot -80:sc= 1.65 USER MOD Single : B 88 LYS NZ :NH3+ 167:sc= 0.903 (180deg=0.824) USER MOD Single : B 91 MET CE :methyl 169:sc= -1.59 (180deg=-2) USER MOD Single : B 92 THR OG1 : rot 120:sc= 0.752 USER MOD Single : B 97 LYS NZ :NH3+ -174:sc= 1.28 (180deg=1.15) USER MOD Single : B 100 HIS : no HD1:sc= -0.225 K(o=-0.23,f=-0.79) USER MOD Single : B 110 GLN : amide:sc= 0.91 K(o=0.91,f=-0.027) USER MOD Single : B 112 THR OG1 : rot -170:sc= 0.364 USER MOD Single : B 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 121 GLN : amide:sc= 0.691 K(o=0.69,f=0) USER MOD Single : B 129 ASN : amide:sc= 0.261 X(o=0.26,f=0) USER MOD Single : B 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 137 THR OG1 : rot -83:sc= 1.08 USER MOD Single : B 139 LYS NZ :NH3+ 173:sc= 1.29 (180deg=1.21) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -24.294 -11.112 -7.921 1.00 0.00 N ATOM 2 CA MET A 1 -24.627 -11.234 -9.353 1.00 0.00 C ATOM 3 C MET A 1 -23.442 -11.855 -10.097 1.00 0.00 C ATOM 4 O MET A 1 -23.530 -13.014 -10.506 1.00 0.00 O ATOM 5 CB MET A 1 -25.095 -9.900 -9.972 1.00 0.00 C ATOM 6 CG MET A 1 -26.380 -9.354 -9.329 1.00 0.00 C ATOM 7 SD MET A 1 -27.805 -10.485 -9.313 1.00 0.00 S ATOM 8 CE MET A 1 -28.220 -10.539 -11.080 1.00 0.00 C ATOM 0 H1 MET A 1 -25.071 -11.501 -7.350 1.00 0.00 H new ATOM 0 H2 MET A 1 -23.420 -11.640 -7.722 1.00 0.00 H new ATOM 0 H3 MET A 1 -24.156 -10.110 -7.681 1.00 0.00 H new ATOM 0 HA MET A 1 -25.484 -11.900 -9.456 1.00 0.00 H new ATOM 0 HB2 MET A 1 -24.301 -9.160 -9.868 1.00 0.00 H new ATOM 0 HB3 MET A 1 -25.262 -10.041 -11.040 1.00 0.00 H new ATOM 0 HG2 MET A 1 -26.156 -9.069 -8.301 1.00 0.00 H new ATOM 0 HG3 MET A 1 -26.669 -8.445 -9.856 1.00 0.00 H new ATOM 0 HE1 MET A 1 -29.078 -11.194 -11.232 1.00 0.00 H new ATOM 0 HE2 MET A 1 -28.464 -9.535 -11.427 1.00 0.00 H new ATOM 0 HE3 MET A 1 -27.368 -10.920 -11.642 1.00 0.00 H new ATOM 20 N ALA A 2 -22.344 -11.112 -10.274 1.00 0.00 N ATOM 21 CA ALA A 2 -21.073 -11.591 -10.799 1.00 0.00 C ATOM 22 C ALA A 2 -19.983 -10.646 -10.301 1.00 0.00 C ATOM 23 O ALA A 2 -20.282 -9.576 -9.761 1.00 0.00 O ATOM 24 CB ALA A 2 -21.113 -11.590 -12.336 1.00 0.00 C ATOM 0 H ALA A 2 -22.322 -10.119 -10.044 1.00 0.00 H new ATOM 0 HA ALA A 2 -20.875 -12.609 -10.463 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -20.160 -11.949 -12.725 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -21.915 -12.244 -12.680 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -21.293 -10.576 -12.695 1.00 0.00 H new ATOM 30 N ILE A 3 -18.726 -11.037 -10.501 1.00 0.00 N ATOM 31 CA ILE A 3 -17.579 -10.180 -10.305 1.00 0.00 C ATOM 32 C ILE A 3 -17.463 -9.422 -11.636 1.00 0.00 C ATOM 33 O ILE A 3 -16.968 -9.952 -12.633 1.00 0.00 O ATOM 34 CB ILE A 3 -16.339 -11.008 -9.862 1.00 0.00 C ATOM 35 CG1 ILE A 3 -16.363 -11.367 -8.360 1.00 0.00 C ATOM 36 CG2 ILE A 3 -15.044 -10.213 -10.090 1.00 0.00 C ATOM 37 CD1 ILE A 3 -17.409 -12.386 -7.930 1.00 0.00 C ATOM 0 H ILE A 3 -18.481 -11.978 -10.810 1.00 0.00 H new ATOM 0 HA ILE A 3 -17.669 -9.462 -9.490 1.00 0.00 H new ATOM 0 HB ILE A 3 -16.372 -11.917 -10.462 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -15.380 -11.747 -8.083 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -16.523 -10.451 -7.791 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -14.189 -10.811 -9.773 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -14.946 -9.973 -11.149 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -15.076 -9.291 -9.510 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -17.330 -12.558 -6.857 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -18.404 -12.007 -8.165 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -17.243 -13.324 -8.461 1.00 0.00 H new ATOM 49 N VAL A 4 -18.021 -8.212 -11.671 1.00 0.00 N ATOM 50 CA VAL A 4 -17.971 -7.298 -12.804 1.00 0.00 C ATOM 51 C VAL A 4 -16.564 -6.681 -12.857 1.00 0.00 C ATOM 52 O VAL A 4 -15.794 -6.765 -11.896 1.00 0.00 O ATOM 53 CB VAL A 4 -19.128 -6.279 -12.667 1.00 0.00 C ATOM 54 CG1 VAL A 4 -19.279 -5.288 -13.836 1.00 0.00 C ATOM 55 CG2 VAL A 4 -20.483 -6.998 -12.515 1.00 0.00 C ATOM 0 H VAL A 4 -18.539 -7.830 -10.879 1.00 0.00 H new ATOM 0 HA VAL A 4 -18.125 -7.796 -13.762 1.00 0.00 H new ATOM 0 HB VAL A 4 -18.856 -5.708 -11.779 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -20.117 -4.619 -13.640 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -18.365 -4.703 -13.938 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -19.462 -5.839 -14.759 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -21.279 -6.259 -12.421 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -20.666 -7.618 -13.392 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -20.464 -7.626 -11.624 1.00 0.00 H new ATOM 65 N LYS A 5 -16.224 -6.039 -13.971 1.00 0.00 N ATOM 66 CA LYS A 5 -14.945 -5.385 -14.204 1.00 0.00 C ATOM 67 C LYS A 5 -15.219 -3.941 -14.614 1.00 0.00 C ATOM 68 O LYS A 5 -15.881 -3.699 -15.624 1.00 0.00 O ATOM 69 CB LYS A 5 -14.147 -6.191 -15.240 1.00 0.00 C ATOM 70 CG LYS A 5 -12.749 -5.609 -15.491 1.00 0.00 C ATOM 71 CD LYS A 5 -11.932 -6.566 -16.374 1.00 0.00 C ATOM 72 CE LYS A 5 -10.555 -5.994 -16.742 1.00 0.00 C ATOM 73 NZ LYS A 5 -10.642 -4.891 -17.729 1.00 0.00 N ATOM 0 H LYS A 5 -16.858 -5.958 -14.766 1.00 0.00 H new ATOM 0 HA LYS A 5 -14.327 -5.353 -13.307 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -14.051 -7.222 -14.898 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -14.700 -6.217 -16.179 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -12.833 -4.636 -15.975 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -12.237 -5.450 -14.542 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -11.801 -7.514 -15.852 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -12.489 -6.779 -17.286 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -10.063 -5.631 -15.839 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -9.931 -6.791 -17.147 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -9.690 -4.518 -17.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -11.055 -5.249 -18.614 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -11.242 -4.132 -17.349 1.00 0.00 H new ATOM 87 N ALA A 6 -14.773 -3.001 -13.786 1.00 0.00 N ATOM 88 CA ALA A 6 -14.965 -1.570 -13.971 1.00 0.00 C ATOM 89 C ALA A 6 -13.890 -0.981 -14.902 1.00 0.00 C ATOM 90 O ALA A 6 -12.915 -1.638 -15.274 1.00 0.00 O ATOM 91 CB ALA A 6 -14.917 -0.871 -12.604 1.00 0.00 C ATOM 0 H ALA A 6 -14.250 -3.225 -12.939 1.00 0.00 H new ATOM 0 HA ALA A 6 -15.937 -1.406 -14.436 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -15.060 0.201 -12.738 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -15.707 -1.266 -11.966 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -13.949 -1.052 -12.137 1.00 0.00 H new ATOM 97 N THR A 7 -14.069 0.298 -15.223 1.00 0.00 N ATOM 98 CA THR A 7 -13.136 1.193 -15.895 1.00 0.00 C ATOM 99 C THR A 7 -13.546 2.619 -15.463 1.00 0.00 C ATOM 100 O THR A 7 -14.515 2.769 -14.709 1.00 0.00 O ATOM 101 CB THR A 7 -13.102 0.903 -17.419 1.00 0.00 C ATOM 102 OG1 THR A 7 -12.258 1.789 -18.122 1.00 0.00 O ATOM 103 CG2 THR A 7 -14.466 0.935 -18.107 1.00 0.00 C ATOM 0 H THR A 7 -14.944 0.772 -15.000 1.00 0.00 H new ATOM 0 HA THR A 7 -12.094 1.050 -15.610 1.00 0.00 H new ATOM 0 HB THR A 7 -12.716 -0.116 -17.460 1.00 0.00 H new ATOM 0 HG1 THR A 7 -11.429 1.921 -17.616 1.00 0.00 H new ATOM 0 HG21 THR A 7 -14.343 0.721 -19.169 1.00 0.00 H new ATOM 0 HG22 THR A 7 -15.117 0.185 -17.659 1.00 0.00 H new ATOM 0 HG23 THR A 7 -14.912 1.922 -17.985 1.00 0.00 H new ATOM 111 N ASP A 8 -12.832 3.649 -15.927 1.00 0.00 N ATOM 112 CA ASP A 8 -12.914 5.047 -15.474 1.00 0.00 C ATOM 113 C ASP A 8 -14.329 5.630 -15.370 1.00 0.00 C ATOM 114 O ASP A 8 -14.570 6.498 -14.529 1.00 0.00 O ATOM 115 CB ASP A 8 -12.060 5.926 -16.396 1.00 0.00 C ATOM 116 CG ASP A 8 -12.119 7.407 -15.984 1.00 0.00 C ATOM 117 OD1 ASP A 8 -11.670 7.755 -14.870 1.00 0.00 O ATOM 118 OD2 ASP A 8 -12.589 8.243 -16.787 1.00 0.00 O ATOM 0 H ASP A 8 -12.143 3.527 -16.669 1.00 0.00 H new ATOM 0 HA ASP A 8 -12.537 5.043 -14.451 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -11.026 5.582 -16.371 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -12.407 5.820 -17.424 1.00 0.00 H new ATOM 123 N GLN A 9 -15.267 5.160 -16.202 1.00 0.00 N ATOM 124 CA GLN A 9 -16.628 5.678 -16.267 1.00 0.00 C ATOM 125 C GLN A 9 -17.677 4.589 -16.042 1.00 0.00 C ATOM 126 O GLN A 9 -18.770 4.891 -15.557 1.00 0.00 O ATOM 127 CB GLN A 9 -16.866 6.383 -17.603 1.00 0.00 C ATOM 128 CG GLN A 9 -15.818 7.470 -17.907 1.00 0.00 C ATOM 129 CD GLN A 9 -16.171 8.246 -19.177 1.00 0.00 C ATOM 130 OE1 GLN A 9 -16.908 9.229 -19.143 1.00 0.00 O ATOM 131 NE2 GLN A 9 -15.669 7.825 -20.328 1.00 0.00 N ATOM 0 H GLN A 9 -15.093 4.397 -16.857 1.00 0.00 H new ATOM 0 HA GLN A 9 -16.737 6.399 -15.457 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -16.857 5.644 -18.404 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -17.858 6.835 -17.597 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -15.751 8.159 -17.065 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -14.837 7.010 -18.021 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -15.058 7.009 -20.350 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -15.893 8.317 -21.193 1.00 0.00 H new ATOM 140 N SER A 10 -17.363 3.327 -16.366 1.00 0.00 N ATOM 141 CA SER A 10 -18.213 2.210 -15.975 1.00 0.00 C ATOM 142 C SER A 10 -18.313 2.184 -14.450 1.00 0.00 C ATOM 143 O SER A 10 -19.407 1.976 -13.933 1.00 0.00 O ATOM 144 CB SER A 10 -17.720 0.888 -16.562 1.00 0.00 C ATOM 145 OG SER A 10 -17.646 1.007 -17.972 1.00 0.00 O ATOM 0 H SER A 10 -16.531 3.062 -16.894 1.00 0.00 H new ATOM 0 HA SER A 10 -19.213 2.347 -16.386 1.00 0.00 H new ATOM 0 HB2 SER A 10 -16.741 0.637 -16.154 1.00 0.00 H new ATOM 0 HB3 SER A 10 -18.397 0.079 -16.288 1.00 0.00 H new ATOM 0 HG SER A 10 -17.329 0.163 -18.355 1.00 0.00 H new ATOM 151 N PHE A 11 -17.227 2.436 -13.704 1.00 0.00 N ATOM 152 CA PHE A 11 -17.382 2.672 -12.281 1.00 0.00 C ATOM 153 C PHE A 11 -18.073 4.024 -12.203 1.00 0.00 C ATOM 154 O PHE A 11 -17.580 5.023 -12.731 1.00 0.00 O ATOM 155 CB PHE A 11 -16.069 2.695 -11.514 1.00 0.00 C ATOM 156 CG PHE A 11 -16.193 2.930 -10.017 1.00 0.00 C ATOM 157 CD1 PHE A 11 -16.467 4.228 -9.534 1.00 0.00 C ATOM 158 CD2 PHE A 11 -15.948 1.883 -9.100 1.00 0.00 C ATOM 159 CE1 PHE A 11 -16.480 4.491 -8.155 1.00 0.00 C ATOM 160 CE2 PHE A 11 -15.937 2.163 -7.720 1.00 0.00 C ATOM 161 CZ PHE A 11 -16.200 3.460 -7.249 1.00 0.00 C ATOM 0 H PHE A 11 -16.270 2.479 -14.055 1.00 0.00 H new ATOM 0 HA PHE A 11 -17.945 1.862 -11.817 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -15.557 1.746 -11.675 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -15.435 3.475 -11.936 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -16.669 5.027 -10.232 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -15.771 0.878 -9.454 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -16.705 5.484 -7.794 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -15.724 1.372 -7.016 1.00 0.00 H new ATOM 0 HZ PHE A 11 -16.186 3.662 -6.188 1.00 0.00 H new ATOM 171 N SER A 12 -19.220 3.981 -11.551 1.00 0.00 N ATOM 172 CA SER A 12 -20.293 4.956 -11.398 1.00 0.00 C ATOM 173 C SER A 12 -21.534 4.314 -11.992 1.00 0.00 C ATOM 174 O SER A 12 -22.505 4.054 -11.282 1.00 0.00 O ATOM 175 CB SER A 12 -20.067 6.321 -12.075 1.00 0.00 C ATOM 176 OG SER A 12 -18.946 6.992 -11.532 1.00 0.00 O ATOM 0 H SER A 12 -19.457 3.132 -11.038 1.00 0.00 H new ATOM 0 HA SER A 12 -20.367 5.189 -10.336 1.00 0.00 H new ATOM 0 HB2 SER A 12 -19.922 6.177 -13.146 1.00 0.00 H new ATOM 0 HB3 SER A 12 -20.956 6.940 -11.954 1.00 0.00 H new ATOM 0 HG SER A 12 -18.124 6.551 -11.832 1.00 0.00 H new ATOM 182 N ALA A 13 -21.491 3.998 -13.289 1.00 0.00 N ATOM 183 CA ALA A 13 -22.641 3.446 -13.976 1.00 0.00 C ATOM 184 C ALA A 13 -23.007 2.078 -13.389 1.00 0.00 C ATOM 185 O ALA A 13 -24.182 1.757 -13.211 1.00 0.00 O ATOM 186 CB ALA A 13 -22.334 3.335 -15.471 1.00 0.00 C ATOM 0 H ALA A 13 -20.667 4.119 -13.877 1.00 0.00 H new ATOM 0 HA ALA A 13 -23.497 4.107 -13.840 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -23.198 2.920 -15.990 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -22.111 4.324 -15.871 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -21.474 2.682 -15.618 1.00 0.00 H new ATOM 192 N GLU A 14 -21.984 1.287 -13.064 1.00 0.00 N ATOM 193 CA GLU A 14 -22.097 -0.043 -12.498 1.00 0.00 C ATOM 194 C GLU A 14 -22.374 -0.010 -10.987 1.00 0.00 C ATOM 195 O GLU A 14 -22.752 -1.048 -10.442 1.00 0.00 O ATOM 196 CB GLU A 14 -20.799 -0.842 -12.740 1.00 0.00 C ATOM 197 CG GLU A 14 -20.495 -1.116 -14.221 1.00 0.00 C ATOM 198 CD GLU A 14 -21.441 -2.110 -14.923 1.00 0.00 C ATOM 199 OE1 GLU A 14 -22.335 -2.692 -14.271 1.00 0.00 O ATOM 200 OE2 GLU A 14 -21.290 -2.310 -16.150 1.00 0.00 O ATOM 0 H GLU A 14 -21.015 1.575 -13.197 1.00 0.00 H new ATOM 0 HA GLU A 14 -22.940 -0.523 -12.996 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -19.963 -0.296 -12.304 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -20.868 -1.793 -12.213 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -20.526 -0.170 -14.761 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -19.476 -1.495 -14.300 1.00 0.00 H new ATOM 207 N THR A 15 -22.219 1.140 -10.315 1.00 0.00 N ATOM 208 CA THR A 15 -22.209 1.227 -8.855 1.00 0.00 C ATOM 209 C THR A 15 -23.298 2.118 -8.238 1.00 0.00 C ATOM 210 O THR A 15 -23.488 2.086 -7.021 1.00 0.00 O ATOM 211 CB THR A 15 -20.805 1.708 -8.436 1.00 0.00 C ATOM 212 OG1 THR A 15 -20.547 2.964 -9.023 1.00 0.00 O ATOM 213 CG2 THR A 15 -19.659 0.825 -8.931 1.00 0.00 C ATOM 0 H THR A 15 -22.096 2.041 -10.777 1.00 0.00 H new ATOM 0 HA THR A 15 -22.441 0.235 -8.468 1.00 0.00 H new ATOM 0 HB THR A 15 -20.829 1.707 -7.346 1.00 0.00 H new ATOM 0 HG1 THR A 15 -19.656 3.273 -8.757 1.00 0.00 H new ATOM 0 HG21 THR A 15 -18.709 1.237 -8.591 1.00 0.00 H new ATOM 0 HG22 THR A 15 -19.780 -0.183 -8.535 1.00 0.00 H new ATOM 0 HG23 THR A 15 -19.670 0.791 -10.020 1.00 0.00 H new ATOM 221 N SER A 16 -24.033 2.897 -9.038 1.00 0.00 N ATOM 222 CA SER A 16 -24.973 3.898 -8.529 1.00 0.00 C ATOM 223 C SER A 16 -26.322 3.303 -8.104 1.00 0.00 C ATOM 224 O SER A 16 -27.199 4.048 -7.666 1.00 0.00 O ATOM 225 CB SER A 16 -25.185 4.995 -9.579 1.00 0.00 C ATOM 226 OG SER A 16 -23.978 5.687 -9.834 1.00 0.00 O ATOM 0 H SER A 16 -23.992 2.851 -10.056 1.00 0.00 H new ATOM 0 HA SER A 16 -24.526 4.322 -7.630 1.00 0.00 H new ATOM 0 HB2 SER A 16 -25.558 4.553 -10.503 1.00 0.00 H new ATOM 0 HB3 SER A 16 -25.944 5.695 -9.231 1.00 0.00 H new ATOM 0 HG SER A 16 -23.292 5.051 -10.126 1.00 0.00 H new ATOM 232 N GLU A 17 -26.515 1.987 -8.222 1.00 0.00 N ATOM 233 CA GLU A 17 -27.773 1.325 -7.896 1.00 0.00 C ATOM 234 C GLU A 17 -27.503 0.020 -7.148 1.00 0.00 C ATOM 235 O GLU A 17 -26.472 -0.619 -7.365 1.00 0.00 O ATOM 236 CB GLU A 17 -28.596 1.051 -9.167 1.00 0.00 C ATOM 237 CG GLU A 17 -29.063 2.326 -9.885 1.00 0.00 C ATOM 238 CD GLU A 17 -29.989 1.997 -11.070 1.00 0.00 C ATOM 239 OE1 GLU A 17 -29.494 1.796 -12.202 1.00 0.00 O ATOM 240 OE2 GLU A 17 -31.228 1.957 -10.888 1.00 0.00 O ATOM 0 H GLU A 17 -25.792 1.347 -8.551 1.00 0.00 H new ATOM 0 HA GLU A 17 -28.352 1.988 -7.253 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -27.997 0.455 -9.856 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -29.468 0.453 -8.903 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -29.587 2.971 -9.180 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -28.196 2.882 -10.242 1.00 0.00 H new ATOM 247 N GLY A 18 -28.444 -0.385 -6.286 1.00 0.00 N ATOM 248 CA GLY A 18 -28.296 -1.524 -5.399 1.00 0.00 C ATOM 249 C GLY A 18 -27.202 -1.255 -4.374 1.00 0.00 C ATOM 250 O GLY A 18 -26.926 -0.105 -4.025 1.00 0.00 O ATOM 0 H GLY A 18 -29.344 0.086 -6.191 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -29.239 -1.723 -4.891 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -28.051 -2.415 -5.977 1.00 0.00 H new ATOM 254 N VAL A 19 -26.580 -2.328 -3.900 1.00 0.00 N ATOM 255 CA VAL A 19 -25.374 -2.290 -3.084 1.00 0.00 C ATOM 256 C VAL A 19 -24.310 -3.001 -3.903 1.00 0.00 C ATOM 257 O VAL A 19 -24.558 -4.072 -4.470 1.00 0.00 O ATOM 258 CB VAL A 19 -25.614 -2.866 -1.670 1.00 0.00 C ATOM 259 CG1 VAL A 19 -24.361 -2.719 -0.793 1.00 0.00 C ATOM 260 CG2 VAL A 19 -26.782 -2.124 -0.999 1.00 0.00 C ATOM 0 H VAL A 19 -26.911 -3.276 -4.079 1.00 0.00 H new ATOM 0 HA VAL A 19 -25.042 -1.274 -2.868 1.00 0.00 H new ATOM 0 HB VAL A 19 -25.849 -3.925 -1.773 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -24.559 -3.133 0.196 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -23.531 -3.256 -1.252 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -24.104 -1.664 -0.700 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -26.948 -2.533 -0.002 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -26.542 -1.064 -0.921 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -27.684 -2.249 -1.598 1.00 0.00 H new ATOM 270 N VAL A 20 -23.145 -2.365 -4.008 1.00 0.00 N ATOM 271 CA VAL A 20 -22.096 -2.768 -4.918 1.00 0.00 C ATOM 272 C VAL A 20 -20.768 -2.690 -4.177 1.00 0.00 C ATOM 273 O VAL A 20 -20.310 -1.625 -3.762 1.00 0.00 O ATOM 274 CB VAL A 20 -22.126 -1.920 -6.206 1.00 0.00 C ATOM 275 CG1 VAL A 20 -21.183 -2.561 -7.225 1.00 0.00 C ATOM 276 CG2 VAL A 20 -23.537 -1.825 -6.808 1.00 0.00 C ATOM 0 H VAL A 20 -22.908 -1.544 -3.451 1.00 0.00 H new ATOM 0 HA VAL A 20 -22.245 -3.797 -5.246 1.00 0.00 H new ATOM 0 HB VAL A 20 -21.811 -0.907 -5.957 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -21.189 -1.976 -8.145 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -20.172 -2.587 -6.819 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -21.515 -3.577 -7.439 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -23.506 -1.218 -7.713 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -23.896 -2.825 -7.053 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -24.211 -1.365 -6.085 1.00 0.00 H new ATOM 286 N LEU A 21 -20.178 -3.862 -3.999 1.00 0.00 N ATOM 287 CA LEU A 21 -18.853 -4.068 -3.440 1.00 0.00 C ATOM 288 C LEU A 21 -17.841 -3.833 -4.560 1.00 0.00 C ATOM 289 O LEU A 21 -17.621 -4.731 -5.373 1.00 0.00 O ATOM 290 CB LEU A 21 -18.814 -5.515 -2.914 1.00 0.00 C ATOM 291 CG LEU A 21 -17.450 -6.037 -2.436 1.00 0.00 C ATOM 292 CD1 LEU A 21 -16.885 -5.201 -1.288 1.00 0.00 C ATOM 293 CD2 LEU A 21 -17.605 -7.486 -1.960 1.00 0.00 C ATOM 0 H LEU A 21 -20.634 -4.738 -4.254 1.00 0.00 H new ATOM 0 HA LEU A 21 -18.616 -3.389 -2.621 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -19.519 -5.596 -2.086 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -19.173 -6.174 -3.704 1.00 0.00 H new ATOM 0 HG LEU A 21 -16.758 -5.972 -3.275 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -15.920 -5.607 -0.983 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -16.757 -4.170 -1.617 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -17.574 -5.229 -0.444 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -16.640 -7.862 -1.619 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -18.320 -7.525 -1.138 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -17.965 -8.103 -2.783 1.00 0.00 H new ATOM 305 N ALA A 22 -17.249 -2.642 -4.652 1.00 0.00 N ATOM 306 CA ALA A 22 -16.139 -2.432 -5.566 1.00 0.00 C ATOM 307 C ALA A 22 -14.846 -2.800 -4.848 1.00 0.00 C ATOM 308 O ALA A 22 -14.707 -2.554 -3.648 1.00 0.00 O ATOM 309 CB ALA A 22 -16.099 -0.997 -6.096 1.00 0.00 C ATOM 0 H ALA A 22 -17.519 -1.821 -4.110 1.00 0.00 H new ATOM 0 HA ALA A 22 -16.267 -3.071 -6.439 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -15.254 -0.883 -6.775 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -17.025 -0.780 -6.629 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -15.989 -0.304 -5.262 1.00 0.00 H new ATOM 315 N ASP A 23 -13.894 -3.350 -5.592 1.00 0.00 N ATOM 316 CA ASP A 23 -12.623 -3.859 -5.096 1.00 0.00 C ATOM 317 C ASP A 23 -11.511 -3.464 -6.061 1.00 0.00 C ATOM 318 O ASP A 23 -11.724 -3.344 -7.268 1.00 0.00 O ATOM 319 CB ASP A 23 -12.688 -5.380 -4.947 1.00 0.00 C ATOM 320 CG ASP A 23 -11.290 -5.997 -4.755 1.00 0.00 C ATOM 321 OD1 ASP A 23 -10.696 -5.813 -3.670 1.00 0.00 O ATOM 322 OD2 ASP A 23 -10.790 -6.647 -5.699 1.00 0.00 O ATOM 0 H ASP A 23 -13.992 -3.458 -6.602 1.00 0.00 H new ATOM 0 HA ASP A 23 -12.415 -3.428 -4.117 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -13.318 -5.635 -4.095 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -13.158 -5.812 -5.831 1.00 0.00 H new ATOM 327 N PHE A 24 -10.322 -3.233 -5.524 1.00 0.00 N ATOM 328 CA PHE A 24 -9.180 -2.691 -6.227 1.00 0.00 C ATOM 329 C PHE A 24 -8.038 -3.648 -5.936 1.00 0.00 C ATOM 330 O PHE A 24 -7.582 -3.734 -4.787 1.00 0.00 O ATOM 331 CB PHE A 24 -8.902 -1.265 -5.734 1.00 0.00 C ATOM 332 CG PHE A 24 -9.971 -0.256 -6.121 1.00 0.00 C ATOM 333 CD1 PHE A 24 -11.240 -0.265 -5.506 1.00 0.00 C ATOM 334 CD2 PHE A 24 -9.712 0.667 -7.147 1.00 0.00 C ATOM 335 CE1 PHE A 24 -12.251 0.605 -5.945 1.00 0.00 C ATOM 336 CE2 PHE A 24 -10.716 1.562 -7.563 1.00 0.00 C ATOM 337 CZ PHE A 24 -11.989 1.526 -6.970 1.00 0.00 C ATOM 0 H PHE A 24 -10.123 -3.429 -4.543 1.00 0.00 H new ATOM 0 HA PHE A 24 -9.335 -2.610 -7.303 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -8.807 -1.279 -4.648 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -7.943 -0.934 -6.134 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -11.436 -0.946 -4.691 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -8.740 0.690 -7.618 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -13.231 0.565 -5.493 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -10.506 2.280 -8.342 1.00 0.00 H new ATOM 0 HZ PHE A 24 -12.762 2.204 -7.302 1.00 0.00 H new ATOM 347 N TRP A 25 -7.613 -4.373 -6.973 1.00 0.00 N ATOM 348 CA TRP A 25 -6.620 -5.437 -6.881 1.00 0.00 C ATOM 349 C TRP A 25 -5.492 -5.075 -7.849 1.00 0.00 C ATOM 350 O TRP A 25 -5.741 -4.422 -8.867 1.00 0.00 O ATOM 351 CB TRP A 25 -7.243 -6.801 -7.217 1.00 0.00 C ATOM 352 CG TRP A 25 -7.374 -7.085 -8.681 1.00 0.00 C ATOM 353 CD1 TRP A 25 -8.205 -6.432 -9.516 1.00 0.00 C ATOM 354 CD2 TRP A 25 -6.551 -7.939 -9.535 1.00 0.00 C ATOM 355 NE1 TRP A 25 -7.993 -6.841 -10.811 1.00 0.00 N ATOM 356 CE2 TRP A 25 -6.912 -7.699 -10.896 1.00 0.00 C ATOM 357 CE3 TRP A 25 -5.503 -8.855 -9.298 1.00 0.00 C ATOM 358 CZ2 TRP A 25 -6.207 -8.285 -11.962 1.00 0.00 C ATOM 359 CZ3 TRP A 25 -4.812 -9.467 -10.360 1.00 0.00 C ATOM 360 CH2 TRP A 25 -5.152 -9.172 -11.690 1.00 0.00 C ATOM 0 H TRP A 25 -7.960 -4.230 -7.921 1.00 0.00 H new ATOM 0 HA TRP A 25 -6.233 -5.524 -5.866 1.00 0.00 H new ATOM 0 HB2 TRP A 25 -6.637 -7.584 -6.762 1.00 0.00 H new ATOM 0 HB3 TRP A 25 -8.231 -6.856 -6.760 1.00 0.00 H new ATOM 0 HD1 TRP A 25 -8.933 -5.694 -9.212 1.00 0.00 H new ATOM 0 HE1 TRP A 25 -8.560 -6.549 -11.607 1.00 0.00 H new ATOM 0 HE3 TRP A 25 -5.226 -9.091 -8.281 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 -6.475 -8.055 -12.983 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 -4.016 -10.167 -10.151 1.00 0.00 H new ATOM 0 HH2 TRP A 25 -4.604 -9.626 -12.502 1.00 0.00 H new ATOM 371 N ALA A 26 -4.258 -5.483 -7.554 1.00 0.00 N ATOM 372 CA ALA A 26 -3.115 -5.156 -8.397 1.00 0.00 C ATOM 373 C ALA A 26 -1.951 -6.120 -8.156 1.00 0.00 C ATOM 374 O ALA A 26 -1.814 -6.629 -7.043 1.00 0.00 O ATOM 375 CB ALA A 26 -2.664 -3.746 -8.048 1.00 0.00 C ATOM 0 H ALA A 26 -4.027 -6.043 -6.733 1.00 0.00 H new ATOM 0 HA ALA A 26 -3.411 -5.235 -9.443 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -1.808 -3.475 -8.665 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -3.480 -3.047 -8.232 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -2.381 -3.704 -6.996 1.00 0.00 H new ATOM 381 N PRO A 27 -1.050 -6.315 -9.133 1.00 0.00 N ATOM 382 CA PRO A 27 0.121 -7.174 -8.975 1.00 0.00 C ATOM 383 C PRO A 27 1.028 -6.843 -7.771 1.00 0.00 C ATOM 384 O PRO A 27 1.764 -7.730 -7.333 1.00 0.00 O ATOM 385 CB PRO A 27 0.874 -7.077 -10.308 1.00 0.00 C ATOM 386 CG PRO A 27 -0.229 -6.739 -11.314 1.00 0.00 C ATOM 387 CD PRO A 27 -1.142 -5.828 -10.504 1.00 0.00 C ATOM 0 HA PRO A 27 -0.204 -8.189 -8.744 1.00 0.00 H new ATOM 0 HB2 PRO A 27 1.643 -6.305 -10.280 1.00 0.00 H new ATOM 0 HB3 PRO A 27 1.372 -8.014 -10.557 1.00 0.00 H new ATOM 0 HG2 PRO A 27 0.166 -6.237 -12.197 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -0.750 -7.631 -11.661 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -0.824 -4.788 -10.575 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -2.168 -5.873 -10.870 1.00 0.00 H new ATOM 395 N TRP A 28 0.965 -5.618 -7.226 1.00 0.00 N ATOM 396 CA TRP A 28 1.800 -5.097 -6.137 1.00 0.00 C ATOM 397 C TRP A 28 1.911 -5.990 -4.898 1.00 0.00 C ATOM 398 O TRP A 28 2.945 -5.913 -4.231 1.00 0.00 O ATOM 399 CB TRP A 28 1.353 -3.676 -5.768 1.00 0.00 C ATOM 400 CG TRP A 28 1.437 -2.675 -6.884 1.00 0.00 C ATOM 401 CD1 TRP A 28 0.385 -2.153 -7.545 1.00 0.00 C ATOM 402 CD2 TRP A 28 2.614 -2.042 -7.481 1.00 0.00 C ATOM 403 NE1 TRP A 28 0.813 -1.329 -8.560 1.00 0.00 N ATOM 404 CE2 TRP A 28 2.183 -1.182 -8.538 1.00 0.00 C ATOM 405 CE3 TRP A 28 4.003 -2.092 -7.227 1.00 0.00 C ATOM 406 CZ2 TRP A 28 3.079 -0.420 -9.302 1.00 0.00 C ATOM 407 CZ3 TRP A 28 4.912 -1.326 -7.983 1.00 0.00 C ATOM 408 CH2 TRP A 28 4.453 -0.490 -9.018 1.00 0.00 C ATOM 0 H TRP A 28 0.291 -4.926 -7.554 1.00 0.00 H new ATOM 0 HA TRP A 28 2.815 -5.081 -6.534 1.00 0.00 H new ATOM 0 HB2 TRP A 28 0.323 -3.716 -5.412 1.00 0.00 H new ATOM 0 HB3 TRP A 28 1.964 -3.323 -4.937 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -0.650 -2.354 -7.311 1.00 0.00 H new ATOM 0 HE1 TRP A 28 0.197 -0.885 -9.240 1.00 0.00 H new ATOM 0 HE3 TRP A 28 4.375 -2.729 -6.438 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 2.717 0.213 -10.099 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 5.969 -1.381 -7.767 1.00 0.00 H new ATOM 0 HH2 TRP A 28 5.155 0.096 -9.592 1.00 0.00 H new ATOM 419 N CYS A 29 0.914 -6.821 -4.561 1.00 0.00 N ATOM 420 CA CYS A 29 0.996 -7.654 -3.357 1.00 0.00 C ATOM 421 C CYS A 29 0.110 -8.894 -3.415 1.00 0.00 C ATOM 422 O CYS A 29 -0.712 -9.051 -4.321 1.00 0.00 O ATOM 423 CB CYS A 29 0.652 -6.791 -2.139 1.00 0.00 C ATOM 424 SG CYS A 29 -0.849 -5.801 -2.331 1.00 0.00 S ATOM 0 H CYS A 29 0.054 -6.932 -5.098 1.00 0.00 H new ATOM 0 HA CYS A 29 2.016 -8.031 -3.281 1.00 0.00 H new ATOM 0 HB2 CYS A 29 0.538 -7.439 -1.270 1.00 0.00 H new ATOM 0 HB3 CYS A 29 1.489 -6.124 -1.932 1.00 0.00 H new ATOM 429 N GLY A 30 0.312 -9.788 -2.443 1.00 0.00 N ATOM 430 CA GLY A 30 -0.380 -11.063 -2.309 1.00 0.00 C ATOM 431 C GLY A 30 -1.893 -10.943 -2.122 1.00 0.00 C ATOM 432 O GLY A 30 -2.607 -11.679 -2.803 1.00 0.00 O ATOM 0 H GLY A 30 0.992 -9.632 -1.699 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -0.182 -11.665 -3.196 1.00 0.00 H new ATOM 0 HA3 GLY A 30 0.038 -11.602 -1.458 1.00 0.00 H new ATOM 436 N PRO A 31 -2.430 -10.051 -1.261 1.00 0.00 N ATOM 437 CA PRO A 31 -3.869 -9.914 -1.056 1.00 0.00 C ATOM 438 C PRO A 31 -4.684 -9.724 -2.328 1.00 0.00 C ATOM 439 O PRO A 31 -5.806 -10.214 -2.378 1.00 0.00 O ATOM 440 CB PRO A 31 -4.059 -8.745 -0.095 1.00 0.00 C ATOM 441 CG PRO A 31 -2.789 -8.809 0.747 1.00 0.00 C ATOM 442 CD PRO A 31 -1.731 -9.240 -0.271 1.00 0.00 C ATOM 0 HA PRO A 31 -4.252 -10.850 -0.650 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -4.150 -7.795 -0.622 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -4.956 -8.860 0.513 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -2.551 -7.844 1.194 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -2.880 -9.525 1.564 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -1.263 -8.373 -0.737 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -0.937 -9.811 0.210 1.00 0.00 H new ATOM 450 N SER A 32 -4.147 -9.123 -3.386 1.00 0.00 N ATOM 451 CA SER A 32 -4.834 -9.027 -4.672 1.00 0.00 C ATOM 452 C SER A 32 -5.198 -10.380 -5.278 1.00 0.00 C ATOM 453 O SER A 32 -6.110 -10.453 -6.098 1.00 0.00 O ATOM 454 CB SER A 32 -3.916 -8.278 -5.627 1.00 0.00 C ATOM 455 OG SER A 32 -3.463 -7.086 -5.025 1.00 0.00 O ATOM 0 H SER A 32 -3.224 -8.689 -3.377 1.00 0.00 H new ATOM 0 HA SER A 32 -5.778 -8.507 -4.509 1.00 0.00 H new ATOM 0 HB2 SER A 32 -3.066 -8.906 -5.895 1.00 0.00 H new ATOM 0 HB3 SER A 32 -4.447 -8.049 -6.551 1.00 0.00 H new ATOM 0 HG SER A 32 -2.721 -6.717 -5.548 1.00 0.00 H new ATOM 461 N LYS A 33 -4.522 -11.451 -4.856 1.00 0.00 N ATOM 462 CA LYS A 33 -4.777 -12.819 -5.299 1.00 0.00 C ATOM 463 C LYS A 33 -5.407 -13.662 -4.180 1.00 0.00 C ATOM 464 O LYS A 33 -5.498 -14.880 -4.320 1.00 0.00 O ATOM 465 CB LYS A 33 -3.517 -13.496 -5.867 1.00 0.00 C ATOM 466 CG LYS A 33 -2.715 -12.687 -6.905 1.00 0.00 C ATOM 467 CD LYS A 33 -1.641 -11.811 -6.246 1.00 0.00 C ATOM 468 CE LYS A 33 -0.786 -11.071 -7.286 1.00 0.00 C ATOM 469 NZ LYS A 33 0.318 -10.316 -6.640 1.00 0.00 N ATOM 0 H LYS A 33 -3.762 -11.386 -4.179 1.00 0.00 H new ATOM 0 HA LYS A 33 -5.496 -12.755 -6.116 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -2.855 -13.738 -5.036 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -3.813 -14.440 -6.324 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -2.243 -13.370 -7.611 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -3.395 -12.057 -7.478 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -2.118 -11.086 -5.587 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -0.998 -12.433 -5.623 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -0.373 -11.787 -7.996 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -1.414 -10.385 -7.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 0.671 -9.589 -7.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -0.033 -9.861 -5.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 1.091 -10.969 -6.399 1.00 0.00 H new ATOM 483 N MET A 34 -5.855 -13.039 -3.082 1.00 0.00 N ATOM 484 CA MET A 34 -6.556 -13.705 -1.980 1.00 0.00 C ATOM 485 C MET A 34 -7.933 -13.066 -1.793 1.00 0.00 C ATOM 486 O MET A 34 -8.933 -13.774 -1.718 1.00 0.00 O ATOM 487 CB MET A 34 -5.733 -13.645 -0.682 1.00 0.00 C ATOM 488 CG MET A 34 -4.361 -14.317 -0.819 1.00 0.00 C ATOM 489 SD MET A 34 -3.461 -14.557 0.742 1.00 0.00 S ATOM 490 CE MET A 34 -3.144 -12.839 1.235 1.00 0.00 C ATOM 0 H MET A 34 -5.737 -12.037 -2.933 1.00 0.00 H new ATOM 0 HA MET A 34 -6.687 -14.758 -2.228 1.00 0.00 H new ATOM 0 HB2 MET A 34 -5.595 -12.603 -0.392 1.00 0.00 H new ATOM 0 HB3 MET A 34 -6.291 -14.128 0.120 1.00 0.00 H new ATOM 0 HG2 MET A 34 -4.495 -15.288 -1.296 1.00 0.00 H new ATOM 0 HG3 MET A 34 -3.744 -13.716 -1.487 1.00 0.00 H new ATOM 0 HE1 MET A 34 -2.582 -12.826 2.169 1.00 0.00 H new ATOM 0 HE2 MET A 34 -2.567 -12.338 0.458 1.00 0.00 H new ATOM 0 HE3 MET A 34 -4.092 -12.320 1.375 1.00 0.00 H new ATOM 500 N ILE A 35 -8.017 -11.733 -1.830 1.00 0.00 N ATOM 501 CA ILE A 35 -9.273 -10.997 -1.879 1.00 0.00 C ATOM 502 C ILE A 35 -10.047 -11.383 -3.150 1.00 0.00 C ATOM 503 O ILE A 35 -11.269 -11.488 -3.113 1.00 0.00 O ATOM 504 CB ILE A 35 -8.994 -9.475 -1.749 1.00 0.00 C ATOM 505 CG1 ILE A 35 -10.084 -8.776 -0.908 1.00 0.00 C ATOM 506 CG2 ILE A 35 -8.798 -8.751 -3.092 1.00 0.00 C ATOM 507 CD1 ILE A 35 -9.819 -8.981 0.590 1.00 0.00 C ATOM 0 H ILE A 35 -7.195 -11.128 -1.826 1.00 0.00 H new ATOM 0 HA ILE A 35 -9.912 -11.263 -1.037 1.00 0.00 H new ATOM 0 HB ILE A 35 -8.038 -9.403 -1.230 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -10.102 -7.711 -1.138 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -11.064 -9.175 -1.168 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -8.608 -7.693 -2.911 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -7.950 -9.187 -3.620 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -9.697 -8.860 -3.698 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -10.596 -8.482 1.169 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -9.825 -10.047 0.818 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -8.847 -8.560 0.849 1.00 0.00 H new ATOM 519 N ALA A 36 -9.335 -11.632 -4.259 1.00 0.00 N ATOM 520 CA ALA A 36 -9.930 -12.026 -5.530 1.00 0.00 C ATOM 521 C ALA A 36 -10.753 -13.323 -5.400 1.00 0.00 C ATOM 522 O ALA A 36 -11.964 -13.270 -5.632 1.00 0.00 O ATOM 523 CB ALA A 36 -8.849 -12.091 -6.624 1.00 0.00 C ATOM 0 H ALA A 36 -8.318 -11.563 -4.291 1.00 0.00 H new ATOM 0 HA ALA A 36 -10.647 -11.264 -5.835 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -9.305 -12.386 -7.569 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -8.385 -11.111 -6.736 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -8.091 -12.822 -6.343 1.00 0.00 H new ATOM 529 N PRO A 37 -10.170 -14.463 -4.978 1.00 0.00 N ATOM 530 CA PRO A 37 -10.936 -15.680 -4.738 1.00 0.00 C ATOM 531 C PRO A 37 -12.004 -15.475 -3.668 1.00 0.00 C ATOM 532 O PRO A 37 -13.109 -15.989 -3.818 1.00 0.00 O ATOM 533 CB PRO A 37 -9.941 -16.767 -4.316 1.00 0.00 C ATOM 534 CG PRO A 37 -8.610 -16.047 -4.111 1.00 0.00 C ATOM 535 CD PRO A 37 -8.749 -14.721 -4.853 1.00 0.00 C ATOM 0 HA PRO A 37 -11.466 -15.970 -5.645 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -10.265 -17.261 -3.400 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -9.856 -17.539 -5.081 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -8.410 -15.886 -3.052 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -7.781 -16.634 -4.506 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -8.256 -13.917 -4.306 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -8.277 -14.775 -5.834 1.00 0.00 H new ATOM 543 N VAL A 38 -11.705 -14.714 -2.611 1.00 0.00 N ATOM 544 CA VAL A 38 -12.665 -14.424 -1.558 1.00 0.00 C ATOM 545 C VAL A 38 -13.914 -13.769 -2.149 1.00 0.00 C ATOM 546 O VAL A 38 -15.014 -14.148 -1.764 1.00 0.00 O ATOM 547 CB VAL A 38 -11.977 -13.597 -0.454 1.00 0.00 C ATOM 548 CG1 VAL A 38 -12.938 -12.729 0.368 1.00 0.00 C ATOM 549 CG2 VAL A 38 -11.187 -14.550 0.456 1.00 0.00 C ATOM 0 H VAL A 38 -10.791 -14.285 -2.467 1.00 0.00 H new ATOM 0 HA VAL A 38 -13.013 -15.342 -1.085 1.00 0.00 H new ATOM 0 HB VAL A 38 -11.309 -12.890 -0.947 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -12.376 -12.179 1.123 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -13.446 -12.025 -0.291 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -13.676 -13.366 0.857 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -10.695 -13.978 1.242 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -11.868 -15.272 0.905 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -10.437 -15.077 -0.133 1.00 0.00 H new ATOM 559 N LEU A 39 -13.776 -12.841 -3.098 1.00 0.00 N ATOM 560 CA LEU A 39 -14.929 -12.195 -3.713 1.00 0.00 C ATOM 561 C LEU A 39 -15.740 -13.189 -4.526 1.00 0.00 C ATOM 562 O LEU A 39 -16.964 -13.154 -4.456 1.00 0.00 O ATOM 563 CB LEU A 39 -14.514 -11.001 -4.590 1.00 0.00 C ATOM 564 CG LEU A 39 -14.749 -9.641 -3.906 1.00 0.00 C ATOM 565 CD1 LEU A 39 -14.237 -9.551 -2.461 1.00 0.00 C ATOM 566 CD2 LEU A 39 -14.087 -8.535 -4.731 1.00 0.00 C ATOM 0 H LEU A 39 -12.875 -12.522 -3.455 1.00 0.00 H new ATOM 0 HA LEU A 39 -15.552 -11.814 -2.904 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -13.459 -11.095 -4.846 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -15.073 -11.033 -5.525 1.00 0.00 H new ATOM 0 HG LEU A 39 -15.831 -9.521 -3.856 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -14.446 -8.558 -2.062 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -14.739 -10.301 -1.850 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -13.162 -9.730 -2.444 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -14.253 -7.572 -4.248 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -13.016 -8.726 -4.802 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -14.520 -8.518 -5.731 1.00 0.00 H new ATOM 578 N GLU A 40 -15.101 -14.088 -5.275 1.00 0.00 N ATOM 579 CA GLU A 40 -15.831 -15.088 -6.037 1.00 0.00 C ATOM 580 C GLU A 40 -16.554 -16.056 -5.082 1.00 0.00 C ATOM 581 O GLU A 40 -17.676 -16.483 -5.358 1.00 0.00 O ATOM 582 CB GLU A 40 -14.907 -15.821 -7.016 1.00 0.00 C ATOM 583 CG GLU A 40 -14.258 -14.888 -8.049 1.00 0.00 C ATOM 584 CD GLU A 40 -13.400 -15.676 -9.056 1.00 0.00 C ATOM 585 OE1 GLU A 40 -13.931 -16.113 -10.103 1.00 0.00 O ATOM 586 OE2 GLU A 40 -12.184 -15.855 -8.824 1.00 0.00 O ATOM 0 H GLU A 40 -14.087 -14.140 -5.367 1.00 0.00 H new ATOM 0 HA GLU A 40 -16.589 -14.588 -6.640 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -14.124 -16.331 -6.454 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -15.477 -16.590 -7.538 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -15.033 -14.337 -8.582 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -13.638 -14.152 -7.538 1.00 0.00 H new ATOM 593 N GLU A 41 -15.951 -16.377 -3.932 1.00 0.00 N ATOM 594 CA GLU A 41 -16.546 -17.190 -2.880 1.00 0.00 C ATOM 595 C GLU A 41 -17.663 -16.450 -2.141 1.00 0.00 C ATOM 596 O GLU A 41 -18.535 -17.082 -1.545 1.00 0.00 O ATOM 597 CB GLU A 41 -15.465 -17.651 -1.889 1.00 0.00 C ATOM 598 CG GLU A 41 -14.537 -18.730 -2.473 1.00 0.00 C ATOM 599 CD GLU A 41 -15.236 -20.072 -2.768 1.00 0.00 C ATOM 600 OE1 GLU A 41 -16.125 -20.499 -1.998 1.00 0.00 O ATOM 601 OE2 GLU A 41 -14.861 -20.739 -3.760 1.00 0.00 O ATOM 0 H GLU A 41 -15.006 -16.066 -3.706 1.00 0.00 H new ATOM 0 HA GLU A 41 -16.995 -18.062 -3.356 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -14.868 -16.791 -1.585 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -15.945 -18.039 -0.991 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -14.095 -18.353 -3.395 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -13.718 -18.905 -1.775 1.00 0.00 H new ATOM 608 N LEU A 42 -17.638 -15.121 -2.155 1.00 0.00 N ATOM 609 CA LEU A 42 -18.625 -14.260 -1.528 1.00 0.00 C ATOM 610 C LEU A 42 -19.827 -14.139 -2.454 1.00 0.00 C ATOM 611 O LEU A 42 -20.963 -14.316 -2.015 1.00 0.00 O ATOM 612 CB LEU A 42 -17.916 -12.916 -1.225 1.00 0.00 C ATOM 613 CG LEU A 42 -18.647 -11.850 -0.406 1.00 0.00 C ATOM 614 CD1 LEU A 42 -19.769 -11.137 -1.158 1.00 0.00 C ATOM 615 CD2 LEU A 42 -19.154 -12.423 0.910 1.00 0.00 C ATOM 0 H LEU A 42 -16.898 -14.597 -2.623 1.00 0.00 H new ATOM 0 HA LEU A 42 -19.012 -14.654 -0.588 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -16.986 -13.147 -0.706 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -17.645 -12.466 -2.180 1.00 0.00 H new ATOM 0 HG LEU A 42 -17.901 -11.083 -0.200 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -20.233 -10.399 -0.504 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -19.359 -10.638 -2.036 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -20.517 -11.865 -1.472 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -19.669 -11.644 1.472 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -19.845 -13.242 0.708 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -18.312 -12.794 1.494 1.00 0.00 H new ATOM 627 N ASP A 43 -19.598 -13.926 -3.746 1.00 0.00 N ATOM 628 CA ASP A 43 -20.667 -13.749 -4.717 1.00 0.00 C ATOM 629 C ASP A 43 -21.474 -15.024 -4.878 1.00 0.00 C ATOM 630 O ASP A 43 -22.699 -14.984 -4.955 1.00 0.00 O ATOM 631 CB ASP A 43 -20.083 -13.358 -6.075 1.00 0.00 C ATOM 632 CG ASP A 43 -21.174 -13.300 -7.155 1.00 0.00 C ATOM 633 OD1 ASP A 43 -22.040 -12.396 -7.098 1.00 0.00 O ATOM 634 OD2 ASP A 43 -21.158 -14.156 -8.066 1.00 0.00 O ATOM 0 H ASP A 43 -18.662 -13.871 -4.148 1.00 0.00 H new ATOM 0 HA ASP A 43 -21.322 -12.958 -4.351 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -19.593 -12.387 -5.997 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -19.318 -14.078 -6.366 1.00 0.00 H new ATOM 639 N GLN A 44 -20.806 -16.174 -4.856 1.00 0.00 N ATOM 640 CA GLN A 44 -21.498 -17.444 -4.966 1.00 0.00 C ATOM 641 C GLN A 44 -22.289 -17.794 -3.696 1.00 0.00 C ATOM 642 O GLN A 44 -23.011 -18.793 -3.701 1.00 0.00 O ATOM 643 CB GLN A 44 -20.520 -18.529 -5.426 1.00 0.00 C ATOM 644 CG GLN A 44 -19.596 -19.064 -4.327 1.00 0.00 C ATOM 645 CD GLN A 44 -18.505 -19.953 -4.922 1.00 0.00 C ATOM 646 OE1 GLN A 44 -18.549 -21.177 -4.826 1.00 0.00 O ATOM 647 NE2 GLN A 44 -17.518 -19.353 -5.570 1.00 0.00 N ATOM 0 H GLN A 44 -19.793 -16.248 -4.763 1.00 0.00 H new ATOM 0 HA GLN A 44 -22.266 -17.366 -5.735 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -21.090 -19.361 -5.840 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -19.908 -18.129 -6.234 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -19.141 -18.231 -3.791 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -20.178 -19.631 -3.600 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -17.498 -18.336 -5.640 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -16.778 -19.908 -5.999 1.00 0.00 H new ATOM 656 N GLU A 45 -22.189 -16.994 -2.622 1.00 0.00 N ATOM 657 CA GLU A 45 -22.930 -17.172 -1.400 1.00 0.00 C ATOM 658 C GLU A 45 -24.055 -16.142 -1.285 1.00 0.00 C ATOM 659 O GLU A 45 -25.202 -16.521 -1.041 1.00 0.00 O ATOM 660 CB GLU A 45 -21.951 -17.235 -0.215 1.00 0.00 C ATOM 661 CG GLU A 45 -22.556 -16.688 1.083 1.00 0.00 C ATOM 662 CD GLU A 45 -21.912 -17.207 2.381 1.00 0.00 C ATOM 663 OE1 GLU A 45 -20.894 -17.931 2.335 1.00 0.00 O ATOM 664 OE2 GLU A 45 -22.442 -16.885 3.469 1.00 0.00 O ATOM 0 H GLU A 45 -21.567 -16.186 -2.597 1.00 0.00 H new ATOM 0 HA GLU A 45 -23.455 -18.127 -1.396 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -21.642 -18.269 -0.059 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -21.053 -16.667 -0.460 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -22.480 -15.601 1.069 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -23.618 -16.933 1.101 1.00 0.00 H new ATOM 671 N MET A 46 -23.759 -14.859 -1.498 1.00 0.00 N ATOM 672 CA MET A 46 -24.687 -13.767 -1.220 1.00 0.00 C ATOM 673 C MET A 46 -24.818 -12.808 -2.401 1.00 0.00 C ATOM 674 O MET A 46 -25.396 -11.727 -2.280 1.00 0.00 O ATOM 675 CB MET A 46 -24.283 -13.051 0.062 1.00 0.00 C ATOM 676 CG MET A 46 -22.855 -12.513 -0.004 1.00 0.00 C ATOM 677 SD MET A 46 -22.408 -11.580 1.469 1.00 0.00 S ATOM 678 CE MET A 46 -23.574 -10.224 1.326 1.00 0.00 C ATOM 0 H MET A 46 -22.862 -14.549 -1.871 1.00 0.00 H new ATOM 0 HA MET A 46 -25.679 -14.193 -1.071 1.00 0.00 H new ATOM 0 HB2 MET A 46 -24.972 -12.227 0.249 1.00 0.00 H new ATOM 0 HB3 MET A 46 -24.372 -13.738 0.904 1.00 0.00 H new ATOM 0 HG2 MET A 46 -22.161 -13.344 -0.129 1.00 0.00 H new ATOM 0 HG3 MET A 46 -22.750 -11.875 -0.881 1.00 0.00 H new ATOM 0 HE1 MET A 46 -23.192 -9.357 1.866 1.00 0.00 H new ATOM 0 HE2 MET A 46 -23.706 -9.967 0.275 1.00 0.00 H new ATOM 0 HE3 MET A 46 -24.533 -10.522 1.750 1.00 0.00 H new ATOM 688 N GLY A 47 -24.362 -13.217 -3.580 1.00 0.00 N ATOM 689 CA GLY A 47 -24.597 -12.487 -4.815 1.00 0.00 C ATOM 690 C GLY A 47 -26.063 -12.435 -5.218 1.00 0.00 C ATOM 691 O GLY A 47 -26.418 -11.741 -6.166 1.00 0.00 O ATOM 0 H GLY A 47 -23.816 -14.070 -3.704 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -24.222 -11.469 -4.703 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -24.024 -12.952 -5.617 1.00 0.00 H new ATOM 695 N ASP A 48 -26.912 -13.145 -4.483 1.00 0.00 N ATOM 696 CA ASP A 48 -28.361 -13.056 -4.563 1.00 0.00 C ATOM 697 C ASP A 48 -28.837 -11.657 -4.179 1.00 0.00 C ATOM 698 O ASP A 48 -29.889 -11.210 -4.638 1.00 0.00 O ATOM 699 CB ASP A 48 -28.964 -14.121 -3.640 1.00 0.00 C ATOM 700 CG ASP A 48 -30.455 -13.919 -3.332 1.00 0.00 C ATOM 701 OD1 ASP A 48 -31.302 -14.090 -4.237 1.00 0.00 O ATOM 702 OD2 ASP A 48 -30.771 -13.658 -2.148 1.00 0.00 O ATOM 0 H ASP A 48 -26.595 -13.823 -3.790 1.00 0.00 H new ATOM 0 HA ASP A 48 -28.689 -13.237 -5.587 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -28.829 -15.101 -4.098 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -28.409 -14.129 -2.702 1.00 0.00 H new ATOM 707 N LYS A 49 -28.037 -10.948 -3.375 1.00 0.00 N ATOM 708 CA LYS A 49 -28.371 -9.653 -2.832 1.00 0.00 C ATOM 709 C LYS A 49 -27.391 -8.573 -3.278 1.00 0.00 C ATOM 710 O LYS A 49 -27.748 -7.396 -3.308 1.00 0.00 O ATOM 711 CB LYS A 49 -28.334 -9.709 -1.297 1.00 0.00 C ATOM 712 CG LYS A 49 -28.943 -10.970 -0.672 1.00 0.00 C ATOM 713 CD LYS A 49 -27.863 -12.010 -0.338 1.00 0.00 C ATOM 714 CE LYS A 49 -28.339 -12.983 0.736 1.00 0.00 C ATOM 715 NZ LYS A 49 -29.244 -14.041 0.211 1.00 0.00 N ATOM 0 H LYS A 49 -27.117 -11.280 -3.084 1.00 0.00 H new ATOM 0 HA LYS A 49 -29.367 -9.403 -3.198 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -27.297 -9.627 -0.972 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -28.861 -8.839 -0.905 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -29.485 -10.702 0.235 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -29.668 -11.405 -1.360 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -27.597 -12.562 -1.239 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -26.961 -11.503 0.003 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -27.472 -13.453 1.200 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -28.857 -12.426 1.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -29.962 -14.270 0.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -29.713 -13.700 -0.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -28.690 -14.893 -0.009 1.00 0.00 H new ATOM 729 N LEU A 50 -26.161 -8.975 -3.612 1.00 0.00 N ATOM 730 CA LEU A 50 -25.026 -8.088 -3.810 1.00 0.00 C ATOM 731 C LEU A 50 -24.469 -8.164 -5.226 1.00 0.00 C ATOM 732 O LEU A 50 -24.532 -9.211 -5.874 1.00 0.00 O ATOM 733 CB LEU A 50 -23.963 -8.501 -2.770 1.00 0.00 C ATOM 734 CG LEU A 50 -22.698 -7.625 -2.703 1.00 0.00 C ATOM 735 CD1 LEU A 50 -23.002 -6.206 -2.216 1.00 0.00 C ATOM 736 CD2 LEU A 50 -21.681 -8.275 -1.771 1.00 0.00 C ATOM 0 H LEU A 50 -25.928 -9.958 -3.755 1.00 0.00 H new ATOM 0 HA LEU A 50 -25.332 -7.050 -3.676 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -24.430 -8.503 -1.785 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -23.659 -9.526 -2.980 1.00 0.00 H new ATOM 0 HG LEU A 50 -22.295 -7.547 -3.713 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -22.079 -5.626 -2.185 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -23.707 -5.730 -2.898 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -23.437 -6.249 -1.217 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -20.785 -7.656 -1.722 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -22.111 -8.371 -0.774 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -21.420 -9.263 -2.150 1.00 0.00 H new ATOM 748 N LYS A 51 -23.846 -7.076 -5.673 1.00 0.00 N ATOM 749 CA LYS A 51 -23.063 -7.011 -6.905 1.00 0.00 C ATOM 750 C LYS A 51 -21.619 -6.715 -6.516 1.00 0.00 C ATOM 751 O LYS A 51 -21.391 -6.012 -5.530 1.00 0.00 O ATOM 752 CB LYS A 51 -23.652 -5.903 -7.782 1.00 0.00 C ATOM 753 CG LYS A 51 -23.008 -5.800 -9.171 1.00 0.00 C ATOM 754 CD LYS A 51 -23.673 -4.644 -9.920 1.00 0.00 C ATOM 755 CE LYS A 51 -23.074 -4.469 -11.314 1.00 0.00 C ATOM 756 NZ LYS A 51 -23.672 -3.294 -11.983 1.00 0.00 N ATOM 0 H LYS A 51 -23.873 -6.188 -5.172 1.00 0.00 H new ATOM 0 HA LYS A 51 -23.091 -7.945 -7.467 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -24.722 -6.077 -7.900 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -23.539 -4.948 -7.268 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -21.935 -5.628 -9.081 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -23.136 -6.733 -9.720 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -24.744 -4.829 -10.003 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -23.552 -3.722 -9.351 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -21.994 -4.344 -11.240 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -23.251 -5.365 -11.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -23.387 -3.282 -12.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -24.709 -3.348 -11.919 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -23.341 -2.424 -11.518 1.00 0.00 H new ATOM 770 N ILE A 52 -20.651 -7.220 -7.276 1.00 0.00 N ATOM 771 CA ILE A 52 -19.241 -6.996 -7.024 1.00 0.00 C ATOM 772 C ILE A 52 -18.676 -6.393 -8.307 1.00 0.00 C ATOM 773 O ILE A 52 -19.088 -6.785 -9.399 1.00 0.00 O ATOM 774 CB ILE A 52 -18.545 -8.323 -6.634 1.00 0.00 C ATOM 775 CG1 ILE A 52 -19.076 -8.974 -5.333 1.00 0.00 C ATOM 776 CG2 ILE A 52 -17.043 -8.075 -6.442 1.00 0.00 C ATOM 777 CD1 ILE A 52 -20.364 -9.794 -5.480 1.00 0.00 C ATOM 0 H ILE A 52 -20.832 -7.803 -8.093 1.00 0.00 H new ATOM 0 HA ILE A 52 -19.073 -6.319 -6.186 1.00 0.00 H new ATOM 0 HB ILE A 52 -18.759 -9.010 -7.453 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -18.298 -9.622 -4.929 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -19.249 -8.187 -4.599 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -16.552 -9.009 -6.167 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -16.615 -7.699 -7.371 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -16.894 -7.340 -5.651 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -20.647 -10.204 -4.511 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -21.164 -9.152 -5.850 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -20.198 -10.609 -6.184 1.00 0.00 H new ATOM 789 N VAL A 53 -17.713 -5.477 -8.200 1.00 0.00 N ATOM 790 CA VAL A 53 -16.988 -4.944 -9.351 1.00 0.00 C ATOM 791 C VAL A 53 -15.507 -4.891 -8.964 1.00 0.00 C ATOM 792 O VAL A 53 -15.191 -4.579 -7.818 1.00 0.00 O ATOM 793 CB VAL A 53 -17.542 -3.556 -9.774 1.00 0.00 C ATOM 794 CG1 VAL A 53 -17.055 -3.188 -11.174 1.00 0.00 C ATOM 795 CG2 VAL A 53 -19.076 -3.437 -9.755 1.00 0.00 C ATOM 0 H VAL A 53 -17.414 -5.083 -7.308 1.00 0.00 H new ATOM 0 HA VAL A 53 -17.118 -5.584 -10.224 1.00 0.00 H new ATOM 0 HB VAL A 53 -17.158 -2.869 -9.020 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -17.453 -2.213 -11.453 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -15.966 -3.151 -11.182 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -17.398 -3.938 -11.887 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -19.367 -2.433 -10.065 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -19.506 -4.167 -10.440 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -19.443 -3.626 -8.746 1.00 0.00 H new ATOM 805 N LYS A 54 -14.589 -5.173 -9.891 1.00 0.00 N ATOM 806 CA LYS A 54 -13.150 -5.048 -9.648 1.00 0.00 C ATOM 807 C LYS A 54 -12.544 -4.001 -10.573 1.00 0.00 C ATOM 808 O LYS A 54 -13.031 -3.812 -11.688 1.00 0.00 O ATOM 809 CB LYS A 54 -12.447 -6.407 -9.799 1.00 0.00 C ATOM 810 CG LYS A 54 -12.770 -7.341 -8.619 1.00 0.00 C ATOM 811 CD LYS A 54 -11.979 -8.657 -8.664 1.00 0.00 C ATOM 812 CE LYS A 54 -10.483 -8.468 -8.344 1.00 0.00 C ATOM 813 NZ LYS A 54 -9.640 -9.484 -9.029 1.00 0.00 N ATOM 0 H LYS A 54 -14.822 -5.494 -10.831 1.00 0.00 H new ATOM 0 HA LYS A 54 -13.000 -4.716 -8.621 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -12.757 -6.877 -10.732 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -11.369 -6.256 -9.861 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -12.553 -6.825 -7.684 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -13.837 -7.564 -8.620 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -12.412 -9.360 -7.952 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -12.080 -9.103 -9.654 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -10.169 -7.470 -8.649 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -10.330 -8.535 -7.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -8.669 -9.123 -9.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -9.631 -10.361 -8.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -10.030 -9.679 -9.973 1.00 0.00 H new ATOM 827 N ILE A 55 -11.455 -3.369 -10.136 1.00 0.00 N ATOM 828 CA ILE A 55 -10.635 -2.454 -10.905 1.00 0.00 C ATOM 829 C ILE A 55 -9.284 -3.160 -11.008 1.00 0.00 C ATOM 830 O ILE A 55 -8.621 -3.389 -9.991 1.00 0.00 O ATOM 831 CB ILE A 55 -10.580 -1.067 -10.200 1.00 0.00 C ATOM 832 CG1 ILE A 55 -11.819 -0.197 -10.490 1.00 0.00 C ATOM 833 CG2 ILE A 55 -9.302 -0.289 -10.548 1.00 0.00 C ATOM 834 CD1 ILE A 55 -11.887 0.387 -11.906 1.00 0.00 C ATOM 0 H ILE A 55 -11.109 -3.493 -9.185 1.00 0.00 H new ATOM 0 HA ILE A 55 -11.020 -2.234 -11.901 1.00 0.00 H new ATOM 0 HB ILE A 55 -10.571 -1.288 -9.133 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -12.713 -0.796 -10.318 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -11.843 0.624 -9.774 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -9.309 0.672 -10.033 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -8.430 -0.863 -10.234 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -9.259 -0.123 -11.624 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -12.794 0.983 -12.011 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -11.016 1.018 -12.081 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -11.900 -0.424 -12.634 1.00 0.00 H new ATOM 846 N ASP A 56 -8.898 -3.525 -12.236 1.00 0.00 N ATOM 847 CA ASP A 56 -7.564 -4.016 -12.583 1.00 0.00 C ATOM 848 C ASP A 56 -6.630 -2.821 -12.722 1.00 0.00 C ATOM 849 O ASP A 56 -6.355 -2.335 -13.818 1.00 0.00 O ATOM 850 CB ASP A 56 -7.589 -4.871 -13.858 1.00 0.00 C ATOM 851 CG ASP A 56 -6.180 -5.332 -14.290 1.00 0.00 C ATOM 852 OD1 ASP A 56 -5.236 -5.332 -13.468 1.00 0.00 O ATOM 853 OD2 ASP A 56 -6.031 -5.756 -15.458 1.00 0.00 O ATOM 0 H ASP A 56 -9.526 -3.485 -13.039 1.00 0.00 H new ATOM 0 HA ASP A 56 -7.199 -4.669 -11.790 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -8.219 -5.745 -13.693 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -8.044 -4.299 -14.666 1.00 0.00 H new ATOM 858 N VAL A 57 -6.235 -2.304 -11.566 1.00 0.00 N ATOM 859 CA VAL A 57 -5.438 -1.119 -11.320 1.00 0.00 C ATOM 860 C VAL A 57 -4.401 -0.818 -12.412 1.00 0.00 C ATOM 861 O VAL A 57 -4.479 0.243 -13.014 1.00 0.00 O ATOM 862 CB VAL A 57 -4.852 -1.303 -9.906 1.00 0.00 C ATOM 863 CG1 VAL A 57 -3.694 -0.389 -9.498 1.00 0.00 C ATOM 864 CG2 VAL A 57 -5.969 -1.157 -8.855 1.00 0.00 C ATOM 0 H VAL A 57 -6.495 -2.755 -10.689 1.00 0.00 H new ATOM 0 HA VAL A 57 -6.052 -0.219 -11.364 1.00 0.00 H new ATOM 0 HB VAL A 57 -4.422 -2.304 -9.945 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -3.382 -0.628 -8.481 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -2.856 -0.537 -10.179 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -4.018 0.651 -9.543 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -5.549 -1.288 -7.858 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -6.415 -0.166 -8.934 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -6.734 -1.914 -9.029 1.00 0.00 H new ATOM 874 N ASP A 58 -3.449 -1.693 -12.728 1.00 0.00 N ATOM 875 CA ASP A 58 -2.342 -1.301 -13.618 1.00 0.00 C ATOM 876 C ASP A 58 -2.824 -0.869 -15.014 1.00 0.00 C ATOM 877 O ASP A 58 -2.150 -0.101 -15.701 1.00 0.00 O ATOM 878 CB ASP A 58 -1.399 -2.493 -13.777 1.00 0.00 C ATOM 879 CG ASP A 58 -0.202 -2.161 -14.683 1.00 0.00 C ATOM 880 OD1 ASP A 58 0.677 -1.371 -14.269 1.00 0.00 O ATOM 881 OD2 ASP A 58 -0.106 -2.725 -15.796 1.00 0.00 O ATOM 0 H ASP A 58 -3.414 -2.656 -12.395 1.00 0.00 H new ATOM 0 HA ASP A 58 -1.842 -0.446 -13.163 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -1.037 -2.803 -12.797 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -1.948 -3.337 -14.195 1.00 0.00 H new ATOM 886 N GLU A 59 -4.010 -1.331 -15.417 1.00 0.00 N ATOM 887 CA GLU A 59 -4.674 -0.973 -16.653 1.00 0.00 C ATOM 888 C GLU A 59 -5.784 0.075 -16.432 1.00 0.00 C ATOM 889 O GLU A 59 -6.012 0.909 -17.311 1.00 0.00 O ATOM 890 CB GLU A 59 -5.200 -2.296 -17.259 1.00 0.00 C ATOM 891 CG GLU A 59 -6.494 -2.132 -18.055 1.00 0.00 C ATOM 892 CD GLU A 59 -7.037 -3.442 -18.644 1.00 0.00 C ATOM 893 OE1 GLU A 59 -6.356 -4.089 -19.473 1.00 0.00 O ATOM 894 OE2 GLU A 59 -8.193 -3.792 -18.312 1.00 0.00 O ATOM 0 H GLU A 59 -4.550 -1.993 -14.860 1.00 0.00 H new ATOM 0 HA GLU A 59 -3.986 -0.489 -17.346 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -4.434 -2.718 -17.910 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -5.366 -3.013 -16.455 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -7.254 -1.695 -17.407 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -6.322 -1.425 -18.866 1.00 0.00 H new ATOM 901 N ASN A 60 -6.461 0.064 -15.276 1.00 0.00 N ATOM 902 CA ASN A 60 -7.692 0.831 -15.042 1.00 0.00 C ATOM 903 C ASN A 60 -7.792 1.554 -13.704 1.00 0.00 C ATOM 904 O ASN A 60 -8.877 1.887 -13.230 1.00 0.00 O ATOM 905 CB ASN A 60 -8.911 -0.076 -15.331 1.00 0.00 C ATOM 906 CG ASN A 60 -9.546 0.291 -16.662 1.00 0.00 C ATOM 907 OD1 ASN A 60 -9.956 1.429 -16.863 1.00 0.00 O ATOM 908 ND2 ASN A 60 -9.657 -0.640 -17.597 1.00 0.00 N ATOM 0 H ASN A 60 -6.166 -0.484 -14.468 1.00 0.00 H new ATOM 0 HA ASN A 60 -7.671 1.666 -15.742 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -8.599 -1.120 -15.346 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -9.645 0.026 -14.531 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -10.087 -0.413 -18.494 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -9.313 -1.584 -17.420 1.00 0.00 H new ATOM 915 N GLN A 61 -6.651 1.872 -13.108 1.00 0.00 N ATOM 916 CA GLN A 61 -6.550 2.584 -11.836 1.00 0.00 C ATOM 917 C GLN A 61 -6.971 4.049 -11.941 1.00 0.00 C ATOM 918 O GLN A 61 -6.901 4.767 -10.949 1.00 0.00 O ATOM 919 CB GLN A 61 -5.133 2.523 -11.245 1.00 0.00 C ATOM 920 CG GLN A 61 -4.053 3.102 -12.169 1.00 0.00 C ATOM 921 CD GLN A 61 -2.635 2.670 -11.756 1.00 0.00 C ATOM 922 OE1 GLN A 61 -1.839 2.231 -12.581 1.00 0.00 O ATOM 923 NE2 GLN A 61 -2.264 2.817 -10.491 1.00 0.00 N ATOM 0 H GLN A 61 -5.742 1.636 -13.506 1.00 0.00 H new ATOM 0 HA GLN A 61 -7.242 2.067 -11.172 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -5.119 3.066 -10.300 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -4.887 1.485 -11.020 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -4.244 2.781 -13.193 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -4.116 4.190 -12.160 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -2.925 3.182 -9.805 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -1.318 2.565 -10.204 1.00 0.00 H new ATOM 932 N GLU A 62 -7.368 4.512 -13.124 1.00 0.00 N ATOM 933 CA GLU A 62 -7.918 5.836 -13.347 1.00 0.00 C ATOM 934 C GLU A 62 -9.049 6.110 -12.348 1.00 0.00 C ATOM 935 O GLU A 62 -9.007 7.128 -11.662 1.00 0.00 O ATOM 936 CB GLU A 62 -8.374 5.903 -14.811 1.00 0.00 C ATOM 937 CG GLU A 62 -7.214 6.301 -15.734 1.00 0.00 C ATOM 938 CD GLU A 62 -7.662 6.390 -17.203 1.00 0.00 C ATOM 939 OE1 GLU A 62 -8.090 7.478 -17.650 1.00 0.00 O ATOM 940 OE2 GLU A 62 -7.561 5.381 -17.937 1.00 0.00 O ATOM 0 H GLU A 62 -7.312 3.955 -13.976 1.00 0.00 H new ATOM 0 HA GLU A 62 -7.176 6.617 -13.179 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -8.770 4.934 -15.116 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -9.185 6.624 -14.910 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -6.810 7.263 -15.418 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -6.409 5.572 -15.642 1.00 0.00 H new ATOM 947 N THR A 63 -9.976 5.163 -12.157 1.00 0.00 N ATOM 948 CA THR A 63 -11.007 5.234 -11.121 1.00 0.00 C ATOM 949 C THR A 63 -10.396 5.397 -9.727 1.00 0.00 C ATOM 950 O THR A 63 -10.877 6.177 -8.905 1.00 0.00 O ATOM 951 CB THR A 63 -11.818 3.928 -11.174 1.00 0.00 C ATOM 952 OG1 THR A 63 -12.321 3.753 -12.481 1.00 0.00 O ATOM 953 CG2 THR A 63 -12.968 3.874 -10.167 1.00 0.00 C ATOM 0 H THR A 63 -10.029 4.318 -12.725 1.00 0.00 H new ATOM 0 HA THR A 63 -11.640 6.102 -11.306 1.00 0.00 H new ATOM 0 HB THR A 63 -11.138 3.121 -10.901 1.00 0.00 H new ATOM 0 HG1 THR A 63 -13.190 3.303 -12.439 1.00 0.00 H new ATOM 0 HG21 THR A 63 -13.493 2.924 -10.265 1.00 0.00 H new ATOM 0 HG22 THR A 63 -12.571 3.967 -9.156 1.00 0.00 H new ATOM 0 HG23 THR A 63 -13.661 4.693 -10.362 1.00 0.00 H new ATOM 961 N ALA A 64 -9.343 4.628 -9.459 1.00 0.00 N ATOM 962 CA ALA A 64 -8.758 4.476 -8.143 1.00 0.00 C ATOM 963 C ALA A 64 -8.081 5.780 -7.726 1.00 0.00 C ATOM 964 O ALA A 64 -8.481 6.411 -6.750 1.00 0.00 O ATOM 965 CB ALA A 64 -7.784 3.288 -8.194 1.00 0.00 C ATOM 0 H ALA A 64 -8.865 4.082 -10.176 1.00 0.00 H new ATOM 0 HA ALA A 64 -9.517 4.266 -7.389 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -7.327 3.150 -7.214 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -8.326 2.384 -8.472 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -7.007 3.486 -8.932 1.00 0.00 H new ATOM 971 N GLY A 65 -7.084 6.212 -8.493 1.00 0.00 N ATOM 972 CA GLY A 65 -6.457 7.524 -8.386 1.00 0.00 C ATOM 973 C GLY A 65 -7.462 8.675 -8.327 1.00 0.00 C ATOM 974 O GLY A 65 -7.314 9.559 -7.483 1.00 0.00 O ATOM 0 H GLY A 65 -6.677 5.638 -9.231 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -5.834 7.549 -7.492 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -5.795 7.673 -9.239 1.00 0.00 H new ATOM 978 N LYS A 66 -8.506 8.654 -9.166 1.00 0.00 N ATOM 979 CA LYS A 66 -9.523 9.703 -9.185 1.00 0.00 C ATOM 980 C LYS A 66 -10.292 9.750 -7.869 1.00 0.00 C ATOM 981 O LYS A 66 -10.551 10.846 -7.370 1.00 0.00 O ATOM 982 CB LYS A 66 -10.452 9.487 -10.388 1.00 0.00 C ATOM 983 CG LYS A 66 -11.563 10.539 -10.527 1.00 0.00 C ATOM 984 CD LYS A 66 -12.334 10.363 -11.845 1.00 0.00 C ATOM 985 CE LYS A 66 -11.481 10.793 -13.048 1.00 0.00 C ATOM 986 NZ LYS A 66 -12.111 10.443 -14.341 1.00 0.00 N ATOM 0 H LYS A 66 -8.665 7.911 -9.846 1.00 0.00 H new ATOM 0 HA LYS A 66 -9.038 10.673 -9.293 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -9.853 9.486 -11.299 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -10.910 8.501 -10.306 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -12.252 10.457 -9.686 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -11.129 11.538 -10.487 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -12.630 9.320 -11.960 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -13.250 10.953 -11.815 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -11.317 11.870 -13.007 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -10.502 10.318 -12.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -11.588 10.898 -15.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -12.091 9.411 -14.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -13.097 10.773 -14.347 1.00 0.00 H new ATOM 1000 N TYR A 67 -10.650 8.595 -7.294 1.00 0.00 N ATOM 1001 CA TYR A 67 -11.331 8.569 -6.011 1.00 0.00 C ATOM 1002 C TYR A 67 -10.368 8.988 -4.895 1.00 0.00 C ATOM 1003 O TYR A 67 -10.766 9.672 -3.950 1.00 0.00 O ATOM 1004 CB TYR A 67 -11.918 7.178 -5.734 1.00 0.00 C ATOM 1005 CG TYR A 67 -12.682 7.120 -4.421 1.00 0.00 C ATOM 1006 CD1 TYR A 67 -14.012 7.580 -4.364 1.00 0.00 C ATOM 1007 CD2 TYR A 67 -12.043 6.691 -3.239 1.00 0.00 C ATOM 1008 CE1 TYR A 67 -14.697 7.626 -3.136 1.00 0.00 C ATOM 1009 CE2 TYR A 67 -12.723 6.726 -2.010 1.00 0.00 C ATOM 1010 CZ TYR A 67 -14.051 7.202 -1.950 1.00 0.00 C ATOM 1011 OH TYR A 67 -14.686 7.268 -0.745 1.00 0.00 O ATOM 0 H TYR A 67 -10.477 7.676 -7.701 1.00 0.00 H new ATOM 0 HA TYR A 67 -12.157 9.280 -6.041 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -12.584 6.899 -6.551 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -11.112 6.444 -5.715 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -14.509 7.899 -5.268 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -11.025 6.333 -3.279 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -15.715 7.985 -3.098 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -12.230 6.389 -1.111 1.00 0.00 H new ATOM 0 HH TYR A 67 -14.090 6.934 -0.042 1.00 0.00 H new ATOM 1021 N GLY A 68 -9.096 8.599 -5.022 1.00 0.00 N ATOM 1022 CA GLY A 68 -8.097 8.716 -3.980 1.00 0.00 C ATOM 1023 C GLY A 68 -8.026 7.375 -3.264 1.00 0.00 C ATOM 1024 O GLY A 68 -8.488 7.265 -2.128 1.00 0.00 O ATOM 0 H GLY A 68 -8.733 8.184 -5.880 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -7.128 8.976 -4.405 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -8.362 9.510 -3.282 1.00 0.00 H new ATOM 1028 N VAL A 69 -7.516 6.344 -3.947 1.00 0.00 N ATOM 1029 CA VAL A 69 -7.400 4.999 -3.388 1.00 0.00 C ATOM 1030 C VAL A 69 -5.924 4.833 -3.071 1.00 0.00 C ATOM 1031 O VAL A 69 -5.545 4.687 -1.913 1.00 0.00 O ATOM 1032 CB VAL A 69 -8.008 3.949 -4.356 1.00 0.00 C ATOM 1033 CG1 VAL A 69 -7.437 2.544 -4.149 1.00 0.00 C ATOM 1034 CG2 VAL A 69 -9.536 3.919 -4.261 1.00 0.00 C ATOM 0 H VAL A 69 -7.172 6.422 -4.904 1.00 0.00 H new ATOM 0 HA VAL A 69 -7.974 4.845 -2.474 1.00 0.00 H new ATOM 0 HB VAL A 69 -7.723 4.268 -5.359 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -7.901 1.855 -4.855 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -6.360 2.561 -4.314 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -7.643 2.214 -3.131 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -9.929 3.173 -4.952 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -9.832 3.663 -3.244 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -9.936 4.899 -4.520 1.00 0.00 H new ATOM 1044 N MET A 70 -5.097 4.927 -4.115 1.00 0.00 N ATOM 1045 CA MET A 70 -3.641 4.854 -4.146 1.00 0.00 C ATOM 1046 C MET A 70 -3.034 3.644 -3.428 1.00 0.00 C ATOM 1047 O MET A 70 -1.814 3.549 -3.339 1.00 0.00 O ATOM 1048 CB MET A 70 -3.011 6.205 -3.764 1.00 0.00 C ATOM 1049 CG MET A 70 -3.193 6.550 -2.281 1.00 0.00 C ATOM 1050 SD MET A 70 -1.962 7.651 -1.544 1.00 0.00 S ATOM 1051 CE MET A 70 -0.486 6.636 -1.827 1.00 0.00 C ATOM 0 H MET A 70 -5.472 5.071 -5.052 1.00 0.00 H new ATOM 0 HA MET A 70 -3.370 4.659 -5.184 1.00 0.00 H new ATOM 0 HB2 MET A 70 -1.947 6.183 -3.999 1.00 0.00 H new ATOM 0 HB3 MET A 70 -3.456 6.993 -4.372 1.00 0.00 H new ATOM 0 HG2 MET A 70 -4.175 7.006 -2.156 1.00 0.00 H new ATOM 0 HG3 MET A 70 -3.199 5.619 -1.714 1.00 0.00 H new ATOM 0 HE1 MET A 70 0.265 6.867 -1.071 1.00 0.00 H new ATOM 0 HE2 MET A 70 -0.752 5.581 -1.763 1.00 0.00 H new ATOM 0 HE3 MET A 70 -0.082 6.849 -2.817 1.00 0.00 H new ATOM 1061 N SER A 71 -3.852 2.696 -2.972 1.00 0.00 N ATOM 1062 CA SER A 71 -3.467 1.581 -2.123 1.00 0.00 C ATOM 1063 C SER A 71 -4.222 0.301 -2.476 1.00 0.00 C ATOM 1064 O SER A 71 -5.224 0.343 -3.194 1.00 0.00 O ATOM 1065 CB SER A 71 -3.657 1.972 -0.663 1.00 0.00 C ATOM 1066 OG SER A 71 -4.916 2.563 -0.413 1.00 0.00 O ATOM 0 H SER A 71 -4.847 2.689 -3.198 1.00 0.00 H new ATOM 0 HA SER A 71 -2.413 1.359 -2.294 1.00 0.00 H new ATOM 0 HB2 SER A 71 -3.546 1.086 -0.037 1.00 0.00 H new ATOM 0 HB3 SER A 71 -2.870 2.668 -0.373 1.00 0.00 H new ATOM 0 HG SER A 71 -4.916 3.486 -0.744 1.00 0.00 H new ATOM 1072 N ILE A 72 -3.734 -0.837 -1.974 1.00 0.00 N ATOM 1073 CA ILE A 72 -4.220 -2.173 -2.294 1.00 0.00 C ATOM 1074 C ILE A 72 -4.153 -3.009 -0.999 1.00 0.00 C ATOM 1075 O ILE A 72 -3.228 -2.790 -0.213 1.00 0.00 O ATOM 1076 CB ILE A 72 -3.294 -2.820 -3.355 1.00 0.00 C ATOM 1077 CG1 ILE A 72 -3.058 -1.981 -4.626 1.00 0.00 C ATOM 1078 CG2 ILE A 72 -3.741 -4.227 -3.791 1.00 0.00 C ATOM 1079 CD1 ILE A 72 -4.266 -1.904 -5.559 1.00 0.00 C ATOM 0 H ILE A 72 -2.961 -0.848 -1.309 1.00 0.00 H new ATOM 0 HA ILE A 72 -5.237 -2.129 -2.685 1.00 0.00 H new ATOM 0 HB ILE A 72 -2.351 -2.881 -2.812 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -2.774 -0.970 -4.333 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -2.216 -2.402 -5.175 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -3.045 -4.616 -4.535 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -3.754 -4.889 -2.925 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -4.741 -4.174 -4.222 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -4.016 -1.296 -6.428 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -4.539 -2.908 -5.885 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -5.106 -1.454 -5.030 1.00 0.00 H new ATOM 1091 N PRO A 73 -5.079 -3.950 -0.742 1.00 0.00 N ATOM 1092 CA PRO A 73 -6.323 -4.141 -1.467 1.00 0.00 C ATOM 1093 C PRO A 73 -7.317 -3.116 -0.909 1.00 0.00 C ATOM 1094 O PRO A 73 -7.439 -2.968 0.312 1.00 0.00 O ATOM 1095 CB PRO A 73 -6.749 -5.578 -1.162 1.00 0.00 C ATOM 1096 CG PRO A 73 -6.229 -5.794 0.258 1.00 0.00 C ATOM 1097 CD PRO A 73 -4.947 -4.954 0.304 1.00 0.00 C ATOM 0 HA PRO A 73 -6.251 -4.000 -2.545 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -7.831 -5.699 -1.219 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -6.311 -6.287 -1.865 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -6.952 -5.464 1.004 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -6.026 -6.847 0.455 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -4.824 -4.485 1.280 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -4.068 -5.576 0.137 1.00 0.00 H new ATOM 1105 N THR A 74 -8.033 -2.421 -1.785 1.00 0.00 N ATOM 1106 CA THR A 74 -9.009 -1.422 -1.339 1.00 0.00 C ATOM 1107 C THR A 74 -10.409 -1.880 -1.716 1.00 0.00 C ATOM 1108 O THR A 74 -10.612 -2.437 -2.794 1.00 0.00 O ATOM 1109 CB THR A 74 -8.643 -0.030 -1.877 1.00 0.00 C ATOM 1110 OG1 THR A 74 -7.352 0.298 -1.410 1.00 0.00 O ATOM 1111 CG2 THR A 74 -9.623 1.062 -1.421 1.00 0.00 C ATOM 0 H THR A 74 -7.961 -2.525 -2.797 1.00 0.00 H new ATOM 0 HA THR A 74 -8.989 -1.330 -0.253 1.00 0.00 H new ATOM 0 HB THR A 74 -8.686 -0.071 -2.965 1.00 0.00 H new ATOM 0 HG1 THR A 74 -6.720 0.284 -2.159 1.00 0.00 H new ATOM 0 HG21 THR A 74 -9.314 2.023 -1.832 1.00 0.00 H new ATOM 0 HG22 THR A 74 -10.626 0.822 -1.775 1.00 0.00 H new ATOM 0 HG23 THR A 74 -9.626 1.117 -0.332 1.00 0.00 H new ATOM 1119 N LEU A 75 -11.373 -1.619 -0.832 1.00 0.00 N ATOM 1120 CA LEU A 75 -12.792 -1.823 -1.077 1.00 0.00 C ATOM 1121 C LEU A 75 -13.476 -0.473 -0.963 1.00 0.00 C ATOM 1122 O LEU A 75 -13.214 0.269 -0.012 1.00 0.00 O ATOM 1123 CB LEU A 75 -13.424 -2.765 -0.038 1.00 0.00 C ATOM 1124 CG LEU A 75 -12.921 -4.216 -0.032 1.00 0.00 C ATOM 1125 CD1 LEU A 75 -13.700 -5.001 1.031 1.00 0.00 C ATOM 1126 CD2 LEU A 75 -13.071 -4.887 -1.399 1.00 0.00 C ATOM 0 H LEU A 75 -11.177 -1.250 0.098 1.00 0.00 H new ATOM 0 HA LEU A 75 -12.914 -2.271 -2.063 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -13.256 -2.342 0.952 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -14.502 -2.778 -0.201 1.00 0.00 H new ATOM 0 HG LEU A 75 -11.856 -4.210 0.201 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -13.353 -6.034 1.047 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -13.537 -4.549 2.009 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -14.764 -4.979 0.793 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -12.702 -5.911 -1.344 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -14.122 -4.895 -1.687 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -12.496 -4.333 -2.141 1.00 0.00 H new ATOM 1138 N LEU A 76 -14.398 -0.202 -1.884 1.00 0.00 N ATOM 1139 CA LEU A 76 -15.313 0.919 -1.846 1.00 0.00 C ATOM 1140 C LEU A 76 -16.694 0.273 -1.950 1.00 0.00 C ATOM 1141 O LEU A 76 -17.056 -0.240 -3.009 1.00 0.00 O ATOM 1142 CB LEU A 76 -15.070 1.941 -2.985 1.00 0.00 C ATOM 1143 CG LEU A 76 -13.641 2.493 -3.200 1.00 0.00 C ATOM 1144 CD1 LEU A 76 -13.653 3.506 -4.351 1.00 0.00 C ATOM 1145 CD2 LEU A 76 -13.083 3.185 -1.957 1.00 0.00 C ATOM 0 H LEU A 76 -14.527 -0.787 -2.709 1.00 0.00 H new ATOM 0 HA LEU A 76 -15.187 1.508 -0.937 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -15.388 1.476 -3.918 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -15.729 2.791 -2.811 1.00 0.00 H new ATOM 0 HG LEU A 76 -13.002 1.640 -3.428 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -12.646 3.896 -4.503 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -13.994 3.016 -5.263 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -14.327 4.327 -4.106 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -12.078 3.553 -2.165 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -13.727 4.022 -1.687 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -13.045 2.475 -1.131 1.00 0.00 H new ATOM 1157 N VAL A 77 -17.442 0.211 -0.851 1.00 0.00 N ATOM 1158 CA VAL A 77 -18.807 -0.307 -0.865 1.00 0.00 C ATOM 1159 C VAL A 77 -19.702 0.889 -1.169 1.00 0.00 C ATOM 1160 O VAL A 77 -19.798 1.811 -0.353 1.00 0.00 O ATOM 1161 CB VAL A 77 -19.159 -1.006 0.466 1.00 0.00 C ATOM 1162 CG1 VAL A 77 -20.624 -1.469 0.488 1.00 0.00 C ATOM 1163 CG2 VAL A 77 -18.258 -2.227 0.703 1.00 0.00 C ATOM 0 H VAL A 77 -17.122 0.516 0.068 1.00 0.00 H new ATOM 0 HA VAL A 77 -18.942 -1.080 -1.622 1.00 0.00 H new ATOM 0 HB VAL A 77 -19.001 -0.272 1.256 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -20.837 -1.957 1.439 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -21.280 -0.607 0.367 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -20.796 -2.172 -0.327 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -18.528 -2.700 1.647 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -18.390 -2.940 -0.111 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -17.216 -1.909 0.741 1.00 0.00 H new ATOM 1173 N LEU A 78 -20.339 0.883 -2.341 1.00 0.00 N ATOM 1174 CA LEU A 78 -21.313 1.889 -2.736 1.00 0.00 C ATOM 1175 C LEU A 78 -22.713 1.330 -2.541 1.00 0.00 C ATOM 1176 O LEU A 78 -22.930 0.119 -2.629 1.00 0.00 O ATOM 1177 CB LEU A 78 -21.119 2.364 -4.189 1.00 0.00 C ATOM 1178 CG LEU A 78 -19.945 3.348 -4.344 1.00 0.00 C ATOM 1179 CD1 LEU A 78 -18.612 2.630 -4.588 1.00 0.00 C ATOM 1180 CD2 LEU A 78 -20.204 4.349 -5.475 1.00 0.00 C ATOM 0 H LEU A 78 -20.187 0.166 -3.050 1.00 0.00 H new ATOM 0 HA LEU A 78 -21.167 2.764 -2.103 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -20.949 1.499 -4.829 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -22.035 2.842 -4.536 1.00 0.00 H new ATOM 0 HG LEU A 78 -19.871 3.887 -3.399 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -17.815 3.367 -4.691 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -18.393 1.974 -3.746 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -18.679 2.039 -5.501 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -19.357 5.030 -5.559 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -20.332 3.811 -6.414 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -21.107 4.919 -5.257 1.00 0.00 H new ATOM 1192 N LYS A 79 -23.671 2.218 -2.289 1.00 0.00 N ATOM 1193 CA LYS A 79 -25.062 1.879 -2.064 1.00 0.00 C ATOM 1194 C LYS A 79 -25.888 3.042 -2.563 1.00 0.00 C ATOM 1195 O LYS A 79 -25.662 4.188 -2.176 1.00 0.00 O ATOM 1196 CB LYS A 79 -25.268 1.599 -0.577 1.00 0.00 C ATOM 1197 CG LYS A 79 -26.711 1.635 -0.057 1.00 0.00 C ATOM 1198 CD LYS A 79 -26.740 1.121 1.392 1.00 0.00 C ATOM 1199 CE LYS A 79 -28.165 0.986 1.945 1.00 0.00 C ATOM 1200 NZ LYS A 79 -28.804 -0.304 1.583 1.00 0.00 N ATOM 0 H LYS A 79 -23.490 3.220 -2.235 1.00 0.00 H new ATOM 0 HA LYS A 79 -25.367 0.980 -2.599 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -24.852 0.616 -0.356 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -24.685 2.326 -0.011 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -27.101 2.652 -0.103 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -27.353 1.019 -0.687 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -26.243 0.152 1.439 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -26.172 1.802 2.026 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -28.139 1.081 3.031 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -28.775 1.807 1.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -29.764 -0.340 1.982 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -28.857 -0.387 0.548 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -28.240 -1.090 1.965 1.00 0.00 H new ATOM 1214 N ASP A 80 -26.829 2.702 -3.434 1.00 0.00 N ATOM 1215 CA ASP A 80 -27.840 3.560 -4.055 1.00 0.00 C ATOM 1216 C ASP A 80 -27.317 4.918 -4.576 1.00 0.00 C ATOM 1217 O ASP A 80 -28.093 5.866 -4.720 1.00 0.00 O ATOM 1218 CB ASP A 80 -29.030 3.694 -3.088 1.00 0.00 C ATOM 1219 CG ASP A 80 -30.283 4.297 -3.750 1.00 0.00 C ATOM 1220 OD1 ASP A 80 -30.717 3.798 -4.814 1.00 0.00 O ATOM 1221 OD2 ASP A 80 -30.890 5.228 -3.171 1.00 0.00 O ATOM 0 H ASP A 80 -26.915 1.737 -3.754 1.00 0.00 H new ATOM 0 HA ASP A 80 -28.168 3.073 -4.973 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -29.276 2.711 -2.686 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -28.736 4.319 -2.244 1.00 0.00 H new ATOM 1226 N GLY A 81 -26.010 5.044 -4.854 1.00 0.00 N ATOM 1227 CA GLY A 81 -25.419 6.244 -5.441 1.00 0.00 C ATOM 1228 C GLY A 81 -24.094 6.683 -4.827 1.00 0.00 C ATOM 1229 O GLY A 81 -23.334 7.385 -5.497 1.00 0.00 O ATOM 0 H GLY A 81 -25.331 4.304 -4.673 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -25.268 6.071 -6.506 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -26.132 7.063 -5.349 1.00 0.00 H new ATOM 1233 N GLU A 82 -23.795 6.289 -3.586 1.00 0.00 N ATOM 1234 CA GLU A 82 -22.683 6.832 -2.822 1.00 0.00 C ATOM 1235 C GLU A 82 -21.930 5.762 -2.038 1.00 0.00 C ATOM 1236 O GLU A 82 -22.477 4.696 -1.768 1.00 0.00 O ATOM 1237 CB GLU A 82 -23.247 7.923 -1.900 1.00 0.00 C ATOM 1238 CG GLU A 82 -24.071 7.404 -0.708 1.00 0.00 C ATOM 1239 CD GLU A 82 -24.704 8.565 0.080 1.00 0.00 C ATOM 1240 OE1 GLU A 82 -24.037 9.150 0.963 1.00 0.00 O ATOM 1241 OE2 GLU A 82 -25.886 8.902 -0.164 1.00 0.00 O ATOM 0 H GLU A 82 -24.327 5.577 -3.084 1.00 0.00 H new ATOM 0 HA GLU A 82 -21.944 7.254 -3.504 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -22.418 8.519 -1.518 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -23.873 8.590 -2.492 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -24.854 6.736 -1.067 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -23.431 6.819 -0.047 1.00 0.00 H new ATOM 1248 N VAL A 83 -20.681 6.046 -1.656 1.00 0.00 N ATOM 1249 CA VAL A 83 -19.903 5.187 -0.768 1.00 0.00 C ATOM 1250 C VAL A 83 -20.547 5.220 0.618 1.00 0.00 C ATOM 1251 O VAL A 83 -20.863 6.289 1.146 1.00 0.00 O ATOM 1252 CB VAL A 83 -18.419 5.625 -0.756 1.00 0.00 C ATOM 1253 CG1 VAL A 83 -17.558 4.726 0.139 1.00 0.00 C ATOM 1254 CG2 VAL A 83 -17.800 5.570 -2.164 1.00 0.00 C ATOM 0 H VAL A 83 -20.182 6.883 -1.957 1.00 0.00 H new ATOM 0 HA VAL A 83 -19.909 4.156 -1.122 1.00 0.00 H new ATOM 0 HB VAL A 83 -18.424 6.646 -0.374 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -16.525 5.072 0.116 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -17.931 4.767 1.162 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -17.605 3.699 -0.224 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -16.757 5.884 -2.116 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -17.854 4.550 -2.546 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -18.349 6.236 -2.829 1.00 0.00 H new ATOM 1264 N VAL A 84 -20.700 4.036 1.206 1.00 0.00 N ATOM 1265 CA VAL A 84 -21.246 3.828 2.540 1.00 0.00 C ATOM 1266 C VAL A 84 -20.263 3.040 3.418 1.00 0.00 C ATOM 1267 O VAL A 84 -20.352 3.127 4.642 1.00 0.00 O ATOM 1268 CB VAL A 84 -22.634 3.161 2.454 1.00 0.00 C ATOM 1269 CG1 VAL A 84 -23.666 4.092 1.792 1.00 0.00 C ATOM 1270 CG2 VAL A 84 -22.611 1.803 1.734 1.00 0.00 C ATOM 0 H VAL A 84 -20.436 3.164 0.747 1.00 0.00 H new ATOM 0 HA VAL A 84 -21.385 4.796 3.022 1.00 0.00 H new ATOM 0 HB VAL A 84 -22.933 2.973 3.485 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -24.633 3.590 1.748 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -23.758 5.007 2.377 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -23.338 4.339 0.782 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -23.619 1.388 1.708 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -22.247 1.937 0.715 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -21.951 1.119 2.268 1.00 0.00 H new ATOM 1280 N GLU A 85 -19.285 2.345 2.825 1.00 0.00 N ATOM 1281 CA GLU A 85 -18.170 1.734 3.525 1.00 0.00 C ATOM 1282 C GLU A 85 -16.918 1.813 2.670 1.00 0.00 C ATOM 1283 O GLU A 85 -16.984 1.837 1.440 1.00 0.00 O ATOM 1284 CB GLU A 85 -18.446 0.260 3.862 1.00 0.00 C ATOM 1285 CG GLU A 85 -18.823 0.043 5.312 1.00 0.00 C ATOM 1286 CD GLU A 85 -17.721 0.331 6.349 1.00 0.00 C ATOM 1287 OE1 GLU A 85 -16.664 0.911 6.007 1.00 0.00 O ATOM 1288 OE2 GLU A 85 -17.938 -0.011 7.534 1.00 0.00 O ATOM 0 H GLU A 85 -19.255 2.193 1.817 1.00 0.00 H new ATOM 0 HA GLU A 85 -18.031 2.282 4.457 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -19.250 -0.108 3.225 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -17.560 -0.331 3.631 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -19.683 0.673 5.541 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -19.145 -0.991 5.432 1.00 0.00 H new ATOM 1295 N THR A 86 -15.775 1.787 3.341 1.00 0.00 N ATOM 1296 CA THR A 86 -14.470 1.941 2.736 1.00 0.00 C ATOM 1297 C THR A 86 -13.494 1.168 3.621 1.00 0.00 C ATOM 1298 O THR A 86 -13.533 1.320 4.848 1.00 0.00 O ATOM 1299 CB THR A 86 -14.080 3.437 2.680 1.00 0.00 C ATOM 1300 OG1 THR A 86 -15.173 4.344 2.769 1.00 0.00 O ATOM 1301 CG2 THR A 86 -13.367 3.713 1.365 1.00 0.00 C ATOM 0 H THR A 86 -15.735 1.654 4.351 1.00 0.00 H new ATOM 0 HA THR A 86 -14.458 1.564 1.713 1.00 0.00 H new ATOM 0 HB THR A 86 -13.451 3.606 3.554 1.00 0.00 H new ATOM 0 HG1 THR A 86 -14.839 5.264 2.727 1.00 0.00 H new ATOM 0 HG21 THR A 86 -13.088 4.766 1.316 1.00 0.00 H new ATOM 0 HG22 THR A 86 -12.470 3.097 1.301 1.00 0.00 H new ATOM 0 HG23 THR A 86 -14.031 3.475 0.534 1.00 0.00 H new ATOM 1309 N SER A 87 -12.611 0.359 3.037 1.00 0.00 N ATOM 1310 CA SER A 87 -11.541 -0.277 3.793 1.00 0.00 C ATOM 1311 C SER A 87 -10.333 -0.507 2.891 1.00 0.00 C ATOM 1312 O SER A 87 -10.450 -0.522 1.664 1.00 0.00 O ATOM 1313 CB SER A 87 -12.048 -1.558 4.469 1.00 0.00 C ATOM 1314 OG SER A 87 -12.562 -2.485 3.529 1.00 0.00 O ATOM 0 H SER A 87 -12.618 0.131 2.043 1.00 0.00 H new ATOM 0 HA SER A 87 -11.213 0.382 4.597 1.00 0.00 H new ATOM 0 HB2 SER A 87 -11.234 -2.021 5.027 1.00 0.00 H new ATOM 0 HB3 SER A 87 -12.825 -1.304 5.190 1.00 0.00 H new ATOM 0 HG SER A 87 -13.447 -2.789 3.820 1.00 0.00 H new ATOM 1320 N VAL A 88 -9.163 -0.654 3.508 1.00 0.00 N ATOM 1321 CA VAL A 88 -7.876 -0.668 2.830 1.00 0.00 C ATOM 1322 C VAL A 88 -6.980 -1.719 3.497 1.00 0.00 C ATOM 1323 O VAL A 88 -6.050 -1.414 4.247 1.00 0.00 O ATOM 1324 CB VAL A 88 -7.334 0.777 2.754 1.00 0.00 C ATOM 1325 CG1 VAL A 88 -7.198 1.506 4.102 1.00 0.00 C ATOM 1326 CG2 VAL A 88 -6.031 0.807 1.974 1.00 0.00 C ATOM 0 H VAL A 88 -9.085 -0.769 4.518 1.00 0.00 H new ATOM 0 HA VAL A 88 -7.937 -0.985 1.789 1.00 0.00 H new ATOM 0 HB VAL A 88 -8.099 1.345 2.225 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -6.810 2.511 3.935 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -8.175 1.570 4.581 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -6.513 0.955 4.746 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -5.659 1.830 1.927 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -5.295 0.175 2.471 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -6.203 0.437 0.963 1.00 0.00 H new ATOM 1336 N GLY A 89 -7.301 -2.990 3.277 1.00 0.00 N ATOM 1337 CA GLY A 89 -6.594 -4.109 3.883 1.00 0.00 C ATOM 1338 C GLY A 89 -7.322 -5.423 3.641 1.00 0.00 C ATOM 1339 O GLY A 89 -8.530 -5.431 3.372 1.00 0.00 O ATOM 0 H GLY A 89 -8.067 -3.273 2.666 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -5.586 -4.169 3.473 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -6.493 -3.940 4.955 1.00 0.00 H new ATOM 1343 N PHE A 90 -6.583 -6.534 3.717 1.00 0.00 N ATOM 1344 CA PHE A 90 -7.129 -7.867 3.496 1.00 0.00 C ATOM 1345 C PHE A 90 -8.227 -8.176 4.518 1.00 0.00 C ATOM 1346 O PHE A 90 -8.161 -7.735 5.669 1.00 0.00 O ATOM 1347 CB PHE A 90 -6.013 -8.924 3.557 1.00 0.00 C ATOM 1348 CG PHE A 90 -6.523 -10.344 3.369 1.00 0.00 C ATOM 1349 CD1 PHE A 90 -6.993 -10.767 2.109 1.00 0.00 C ATOM 1350 CD2 PHE A 90 -6.623 -11.212 4.475 1.00 0.00 C ATOM 1351 CE1 PHE A 90 -7.576 -12.039 1.965 1.00 0.00 C ATOM 1352 CE2 PHE A 90 -7.192 -12.490 4.324 1.00 0.00 C ATOM 1353 CZ PHE A 90 -7.671 -12.902 3.070 1.00 0.00 C ATOM 0 H PHE A 90 -5.586 -6.529 3.935 1.00 0.00 H new ATOM 0 HA PHE A 90 -7.573 -7.897 2.501 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -5.272 -8.706 2.788 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -5.505 -8.852 4.519 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -6.905 -10.114 1.253 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -6.262 -10.895 5.442 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -7.952 -12.353 1.002 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -7.260 -13.154 5.173 1.00 0.00 H new ATOM 0 HZ PHE A 90 -8.112 -13.881 2.955 1.00 0.00 H new ATOM 1363 N LYS A 91 -9.209 -8.980 4.105 1.00 0.00 N ATOM 1364 CA LYS A 91 -10.286 -9.491 4.946 1.00 0.00 C ATOM 1365 C LYS A 91 -10.556 -10.927 4.490 1.00 0.00 C ATOM 1366 O LYS A 91 -10.709 -11.128 3.282 1.00 0.00 O ATOM 1367 CB LYS A 91 -11.543 -8.622 4.755 1.00 0.00 C ATOM 1368 CG LYS A 91 -11.644 -7.498 5.797 1.00 0.00 C ATOM 1369 CD LYS A 91 -12.719 -6.455 5.465 1.00 0.00 C ATOM 1370 CE LYS A 91 -12.419 -5.610 4.216 1.00 0.00 C ATOM 1371 NZ LYS A 91 -11.155 -4.838 4.296 1.00 0.00 N ATOM 0 H LYS A 91 -9.276 -9.303 3.140 1.00 0.00 H new ATOM 0 HA LYS A 91 -10.017 -9.466 6.002 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -11.532 -8.187 3.756 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -12.430 -9.253 4.818 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -11.861 -7.935 6.772 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -10.678 -7.000 5.878 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -13.672 -6.965 5.323 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -12.838 -5.789 6.320 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -12.376 -6.267 3.348 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -13.245 -4.918 4.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -11.302 -3.889 3.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -10.862 -4.754 5.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -10.414 -5.329 3.757 1.00 0.00 H new ATOM 1385 N PRO A 92 -10.631 -11.915 5.400 1.00 0.00 N ATOM 1386 CA PRO A 92 -11.097 -13.249 5.048 1.00 0.00 C ATOM 1387 C PRO A 92 -12.579 -13.194 4.662 1.00 0.00 C ATOM 1388 O PRO A 92 -13.263 -12.204 4.930 1.00 0.00 O ATOM 1389 CB PRO A 92 -10.842 -14.114 6.287 1.00 0.00 C ATOM 1390 CG PRO A 92 -10.942 -13.113 7.434 1.00 0.00 C ATOM 1391 CD PRO A 92 -10.347 -11.842 6.828 1.00 0.00 C ATOM 0 HA PRO A 92 -10.578 -13.668 4.186 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -11.580 -14.910 6.381 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -9.862 -14.590 6.252 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -11.974 -12.965 7.752 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -10.383 -13.444 8.309 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -10.793 -10.951 7.271 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -9.274 -11.786 7.011 1.00 0.00 H new ATOM 1399 N LYS A 93 -13.088 -14.282 4.079 1.00 0.00 N ATOM 1400 CA LYS A 93 -14.452 -14.416 3.561 1.00 0.00 C ATOM 1401 C LYS A 93 -15.504 -13.894 4.542 1.00 0.00 C ATOM 1402 O LYS A 93 -16.390 -13.143 4.134 1.00 0.00 O ATOM 1403 CB LYS A 93 -14.641 -15.899 3.172 1.00 0.00 C ATOM 1404 CG LYS A 93 -16.073 -16.373 2.896 1.00 0.00 C ATOM 1405 CD LYS A 93 -16.772 -15.700 1.704 1.00 0.00 C ATOM 1406 CE LYS A 93 -18.243 -16.137 1.718 1.00 0.00 C ATOM 1407 NZ LYS A 93 -18.444 -17.524 1.232 1.00 0.00 N ATOM 0 H LYS A 93 -12.537 -15.130 3.949 1.00 0.00 H new ATOM 0 HA LYS A 93 -14.596 -13.790 2.680 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -14.043 -16.094 2.282 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -14.230 -16.514 3.973 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -16.055 -17.449 2.724 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -16.673 -16.203 3.790 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -16.695 -14.615 1.778 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -16.296 -15.990 0.768 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -18.630 -16.055 2.734 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -18.824 -15.454 1.099 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -19.353 -17.887 1.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -18.447 -17.530 0.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -17.673 -18.129 1.580 1.00 0.00 H new ATOM 1421 N GLU A 94 -15.405 -14.252 5.822 1.00 0.00 N ATOM 1422 CA GLU A 94 -16.406 -13.857 6.802 1.00 0.00 C ATOM 1423 C GLU A 94 -16.332 -12.361 7.105 1.00 0.00 C ATOM 1424 O GLU A 94 -17.364 -11.697 7.163 1.00 0.00 O ATOM 1425 CB GLU A 94 -16.241 -14.652 8.102 1.00 0.00 C ATOM 1426 CG GLU A 94 -16.522 -16.151 7.915 1.00 0.00 C ATOM 1427 CD GLU A 94 -16.412 -16.915 9.247 1.00 0.00 C ATOM 1428 OE1 GLU A 94 -17.429 -17.051 9.965 1.00 0.00 O ATOM 1429 OE2 GLU A 94 -15.311 -17.407 9.584 1.00 0.00 O ATOM 0 H GLU A 94 -14.642 -14.814 6.200 1.00 0.00 H new ATOM 0 HA GLU A 94 -17.383 -14.076 6.370 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -15.227 -14.520 8.478 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -16.916 -14.251 8.858 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -17.520 -16.286 7.498 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -15.817 -16.568 7.196 1.00 0.00 H new ATOM 1436 N ALA A 95 -15.128 -11.804 7.267 1.00 0.00 N ATOM 1437 CA ALA A 95 -14.955 -10.375 7.484 1.00 0.00 C ATOM 1438 C ALA A 95 -15.416 -9.587 6.264 1.00 0.00 C ATOM 1439 O ALA A 95 -15.976 -8.504 6.410 1.00 0.00 O ATOM 1440 CB ALA A 95 -13.494 -10.070 7.806 1.00 0.00 C ATOM 0 H ALA A 95 -14.255 -12.331 7.251 1.00 0.00 H new ATOM 0 HA ALA A 95 -15.569 -10.071 8.332 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -13.373 -8.999 7.967 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -13.200 -10.608 8.707 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -12.865 -10.385 6.974 1.00 0.00 H new ATOM 1446 N LEU A 96 -15.210 -10.136 5.065 1.00 0.00 N ATOM 1447 CA LEU A 96 -15.654 -9.535 3.820 1.00 0.00 C ATOM 1448 C LEU A 96 -17.173 -9.416 3.826 1.00 0.00 C ATOM 1449 O LEU A 96 -17.712 -8.322 3.652 1.00 0.00 O ATOM 1450 CB LEU A 96 -15.178 -10.379 2.620 1.00 0.00 C ATOM 1451 CG LEU A 96 -14.751 -9.557 1.394 1.00 0.00 C ATOM 1452 CD1 LEU A 96 -15.762 -8.487 0.972 1.00 0.00 C ATOM 1453 CD2 LEU A 96 -13.391 -8.897 1.638 1.00 0.00 C ATOM 0 H LEU A 96 -14.723 -11.023 4.937 1.00 0.00 H new ATOM 0 HA LEU A 96 -15.222 -8.539 3.726 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -14.339 -10.998 2.937 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -15.980 -11.056 2.327 1.00 0.00 H new ATOM 0 HG LEU A 96 -14.691 -10.273 0.574 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -15.384 -7.953 0.100 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -16.711 -8.961 0.724 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -15.911 -7.784 1.792 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -13.104 -8.319 0.760 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -13.457 -8.236 2.502 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -12.642 -9.666 1.827 1.00 0.00 H new ATOM 1465 N GLN A 97 -17.854 -10.542 4.060 1.00 0.00 N ATOM 1466 CA GLN A 97 -19.302 -10.588 4.053 1.00 0.00 C ATOM 1467 C GLN A 97 -19.846 -9.708 5.166 1.00 0.00 C ATOM 1468 O GLN A 97 -20.806 -8.989 4.926 1.00 0.00 O ATOM 1469 CB GLN A 97 -19.817 -12.036 4.040 1.00 0.00 C ATOM 1470 CG GLN A 97 -20.183 -12.704 5.350 1.00 0.00 C ATOM 1471 CD GLN A 97 -20.662 -14.140 5.112 1.00 0.00 C ATOM 1472 OE1 GLN A 97 -20.072 -15.092 5.616 1.00 0.00 O ATOM 1473 NE2 GLN A 97 -21.714 -14.337 4.325 1.00 0.00 N ATOM 0 H GLN A 97 -17.410 -11.439 4.258 1.00 0.00 H new ATOM 0 HA GLN A 97 -19.692 -10.167 3.126 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -20.699 -12.064 3.400 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -19.055 -12.651 3.560 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -19.319 -12.709 6.015 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -20.966 -12.132 5.849 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -22.198 -13.540 3.911 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -22.038 -15.285 4.135 1.00 0.00 H new ATOM 1482 N GLU A 98 -19.212 -9.684 6.340 1.00 0.00 N ATOM 1483 CA GLU A 98 -19.633 -8.819 7.432 1.00 0.00 C ATOM 1484 C GLU A 98 -19.542 -7.345 7.027 1.00 0.00 C ATOM 1485 O GLU A 98 -20.508 -6.603 7.211 1.00 0.00 O ATOM 1486 CB GLU A 98 -18.817 -9.137 8.694 1.00 0.00 C ATOM 1487 CG GLU A 98 -19.206 -8.247 9.881 1.00 0.00 C ATOM 1488 CD GLU A 98 -18.499 -8.689 11.174 1.00 0.00 C ATOM 1489 OE1 GLU A 98 -17.363 -8.236 11.440 1.00 0.00 O ATOM 1490 OE2 GLU A 98 -19.081 -9.479 11.953 1.00 0.00 O ATOM 0 H GLU A 98 -18.399 -10.261 6.555 1.00 0.00 H new ATOM 0 HA GLU A 98 -20.681 -9.011 7.662 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -18.963 -10.183 8.964 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -17.756 -9.009 8.479 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -18.948 -7.211 9.660 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -20.286 -8.283 10.025 1.00 0.00 H new ATOM 1497 N LEU A 99 -18.416 -6.933 6.435 1.00 0.00 N ATOM 1498 CA LEU A 99 -18.137 -5.539 6.103 1.00 0.00 C ATOM 1499 C LEU A 99 -19.235 -4.967 5.211 1.00 0.00 C ATOM 1500 O LEU A 99 -19.728 -3.866 5.455 1.00 0.00 O ATOM 1501 CB LEU A 99 -16.741 -5.450 5.451 1.00 0.00 C ATOM 1502 CG LEU A 99 -16.128 -4.051 5.240 1.00 0.00 C ATOM 1503 CD1 LEU A 99 -16.715 -3.269 4.061 1.00 0.00 C ATOM 1504 CD2 LEU A 99 -16.161 -3.224 6.527 1.00 0.00 C ATOM 0 H LEU A 99 -17.665 -7.570 6.171 1.00 0.00 H new ATOM 0 HA LEU A 99 -18.130 -4.932 7.009 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -16.049 -6.029 6.063 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -16.794 -5.941 4.479 1.00 0.00 H new ATOM 0 HG LEU A 99 -15.088 -4.237 4.970 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -16.225 -2.298 3.988 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -16.554 -3.827 3.138 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -17.784 -3.125 4.216 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -15.721 -2.244 6.341 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -17.193 -3.102 6.855 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -15.592 -3.736 7.303 1.00 0.00 H new ATOM 1516 N VAL A 100 -19.659 -5.736 4.212 1.00 0.00 N ATOM 1517 CA VAL A 100 -20.687 -5.296 3.278 1.00 0.00 C ATOM 1518 C VAL A 100 -22.087 -5.566 3.844 1.00 0.00 C ATOM 1519 O VAL A 100 -22.985 -4.752 3.633 1.00 0.00 O ATOM 1520 CB VAL A 100 -20.404 -5.911 1.893 1.00 0.00 C ATOM 1521 CG1 VAL A 100 -20.548 -7.438 1.832 1.00 0.00 C ATOM 1522 CG2 VAL A 100 -21.269 -5.289 0.795 1.00 0.00 C ATOM 0 H VAL A 100 -19.302 -6.674 4.029 1.00 0.00 H new ATOM 0 HA VAL A 100 -20.658 -4.215 3.140 1.00 0.00 H new ATOM 0 HB VAL A 100 -19.354 -5.675 1.717 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -20.331 -7.784 0.821 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -19.849 -7.898 2.531 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -21.567 -7.718 2.100 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -21.033 -5.755 -0.162 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -22.322 -5.449 1.027 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -21.069 -4.219 0.737 1.00 0.00 H new ATOM 1532 N ASN A 101 -22.292 -6.637 4.623 1.00 0.00 N ATOM 1533 CA ASN A 101 -23.609 -7.034 5.136 1.00 0.00 C ATOM 1534 C ASN A 101 -24.209 -5.954 6.042 1.00 0.00 C ATOM 1535 O ASN A 101 -25.426 -5.820 6.133 1.00 0.00 O ATOM 1536 CB ASN A 101 -23.542 -8.381 5.862 1.00 0.00 C ATOM 1537 CG ASN A 101 -24.846 -8.701 6.581 1.00 0.00 C ATOM 1538 OD1 ASN A 101 -25.785 -9.231 5.996 1.00 0.00 O ATOM 1539 ND2 ASN A 101 -24.924 -8.378 7.861 1.00 0.00 N ATOM 0 H ASN A 101 -21.539 -7.259 4.918 1.00 0.00 H new ATOM 0 HA ASN A 101 -24.269 -7.149 4.276 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -23.320 -9.170 5.144 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -22.724 -8.366 6.582 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -25.779 -8.569 8.384 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -24.129 -7.938 8.325 1.00 0.00 H new ATOM 1546 N LYS A 102 -23.355 -5.149 6.679 1.00 0.00 N ATOM 1547 CA LYS A 102 -23.759 -3.999 7.488 1.00 0.00 C ATOM 1548 C LYS A 102 -24.614 -2.995 6.702 1.00 0.00 C ATOM 1549 O LYS A 102 -25.367 -2.248 7.328 1.00 0.00 O ATOM 1550 CB LYS A 102 -22.493 -3.325 8.037 1.00 0.00 C ATOM 1551 CG LYS A 102 -21.814 -4.177 9.123 1.00 0.00 C ATOM 1552 CD LYS A 102 -20.331 -3.911 9.437 1.00 0.00 C ATOM 1553 CE LYS A 102 -19.569 -2.910 8.561 1.00 0.00 C ATOM 1554 NZ LYS A 102 -19.921 -1.486 8.781 1.00 0.00 N ATOM 0 H LYS A 102 -22.344 -5.282 6.646 1.00 0.00 H new ATOM 0 HA LYS A 102 -24.387 -4.353 8.305 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -21.792 -3.151 7.221 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -22.751 -2.350 8.449 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -22.378 -4.049 10.047 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -21.910 -5.223 8.833 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -20.267 -3.565 10.469 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -19.805 -4.864 9.387 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -18.501 -3.036 8.738 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -19.750 -3.155 7.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -19.089 -0.890 8.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -20.691 -1.215 8.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -20.231 -1.353 9.765 1.00 0.00 H new ATOM 1568 N HIS A 103 -24.523 -2.976 5.365 1.00 0.00 N ATOM 1569 CA HIS A 103 -25.191 -1.979 4.515 1.00 0.00 C ATOM 1570 C HIS A 103 -25.984 -2.624 3.370 1.00 0.00 C ATOM 1571 O HIS A 103 -26.908 -2.014 2.826 1.00 0.00 O ATOM 1572 CB HIS A 103 -24.134 -1.000 3.978 1.00 0.00 C ATOM 1573 CG HIS A 103 -23.267 -0.440 5.081 1.00 0.00 C ATOM 1574 ND1 HIS A 103 -23.628 0.541 5.977 1.00 0.00 N ATOM 1575 CD2 HIS A 103 -22.087 -0.979 5.522 1.00 0.00 C ATOM 1576 CE1 HIS A 103 -22.698 0.582 6.944 1.00 0.00 C ATOM 1577 NE2 HIS A 103 -21.746 -0.344 6.726 1.00 0.00 N ATOM 0 H HIS A 103 -23.979 -3.659 4.838 1.00 0.00 H new ATOM 0 HA HIS A 103 -25.921 -1.440 5.119 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -23.506 -1.510 3.247 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -24.630 -0.182 3.456 1.00 0.00 H new ATOM 0 HD1 HIS A 103 -24.457 1.133 5.917 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -21.520 -1.755 5.030 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -22.712 1.264 7.781 1.00 0.00 H new ATOM 1585 N LEU A 104 -25.632 -3.854 3.007 1.00 0.00 N ATOM 1586 CA LEU A 104 -26.323 -4.719 2.068 1.00 0.00 C ATOM 1587 C LEU A 104 -27.676 -5.097 2.662 1.00 0.00 C ATOM 1588 O LEU A 104 -27.727 -5.550 3.824 1.00 0.00 O ATOM 1589 CB LEU A 104 -25.373 -5.881 1.806 1.00 0.00 C ATOM 1590 CG LEU A 104 -25.848 -7.082 1.005 1.00 0.00 C ATOM 1591 CD1 LEU A 104 -26.705 -8.071 1.801 1.00 0.00 C ATOM 1592 CD2 LEU A 104 -26.494 -6.652 -0.305 1.00 0.00 C ATOM 1593 OXT LEU A 104 -28.700 -4.895 1.978 1.00 0.00 O ATOM 0 H LEU A 104 -24.798 -4.299 3.390 1.00 0.00 H new ATOM 0 HA LEU A 104 -26.559 -4.259 1.109 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -24.498 -5.477 1.297 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -25.036 -6.250 2.775 1.00 0.00 H new ATOM 0 HG LEU A 104 -24.953 -7.652 0.756 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -27.002 -8.897 1.155 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -26.129 -8.457 2.642 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -27.595 -7.564 2.173 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -26.823 -7.534 -0.855 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -27.352 -6.014 -0.095 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -25.770 -6.100 -0.904 1.00 0.00 H new ATOM 1606 N MET B 1 8.309 27.012 -12.186 1.00 0.00 N ATOM 1607 CA MET B 1 7.079 27.261 -11.395 1.00 0.00 C ATOM 1608 C MET B 1 7.425 27.217 -9.908 1.00 0.00 C ATOM 1609 O MET B 1 8.043 26.257 -9.443 1.00 0.00 O ATOM 1610 CB MET B 1 5.953 26.250 -11.705 1.00 0.00 C ATOM 1611 CG MET B 1 5.340 26.418 -13.102 1.00 0.00 C ATOM 1612 SD MET B 1 4.605 28.049 -13.425 1.00 0.00 S ATOM 1613 CE MET B 1 3.975 27.772 -15.103 1.00 0.00 C ATOM 0 H1 MET B 1 8.081 27.040 -13.200 1.00 0.00 H new ATOM 0 H2 MET B 1 9.015 27.744 -11.969 1.00 0.00 H new ATOM 0 H3 MET B 1 8.694 26.077 -11.944 1.00 0.00 H new ATOM 0 HA MET B 1 6.701 28.245 -11.672 1.00 0.00 H new ATOM 0 HB2 MET B 1 6.349 25.239 -11.611 1.00 0.00 H new ATOM 0 HB3 MET B 1 5.166 26.355 -10.958 1.00 0.00 H new ATOM 0 HG2 MET B 1 6.113 26.230 -13.847 1.00 0.00 H new ATOM 0 HG3 MET B 1 4.573 25.656 -13.240 1.00 0.00 H new ATOM 0 HE1 MET B 1 3.488 28.678 -15.463 1.00 0.00 H new ATOM 0 HE2 MET B 1 4.803 27.517 -15.765 1.00 0.00 H new ATOM 0 HE3 MET B 1 3.255 26.954 -15.091 1.00 0.00 H new ATOM 1625 N GLU B 2 7.060 28.255 -9.149 1.00 0.00 N ATOM 1626 CA GLU B 2 7.225 28.261 -7.700 1.00 0.00 C ATOM 1627 C GLU B 2 6.185 27.315 -7.081 1.00 0.00 C ATOM 1628 O GLU B 2 5.010 27.344 -7.459 1.00 0.00 O ATOM 1629 CB GLU B 2 7.084 29.701 -7.177 1.00 0.00 C ATOM 1630 CG GLU B 2 7.398 29.814 -5.679 1.00 0.00 C ATOM 1631 CD GLU B 2 7.355 31.279 -5.206 1.00 0.00 C ATOM 1632 OE1 GLU B 2 6.266 31.778 -4.843 1.00 0.00 O ATOM 1633 OE2 GLU B 2 8.413 31.948 -5.185 1.00 0.00 O ATOM 0 H GLU B 2 6.645 29.108 -9.523 1.00 0.00 H new ATOM 0 HA GLU B 2 8.216 27.906 -7.418 1.00 0.00 H new ATOM 0 HB2 GLU B 2 7.754 30.355 -7.736 1.00 0.00 H new ATOM 0 HB3 GLU B 2 6.069 30.053 -7.360 1.00 0.00 H new ATOM 0 HG2 GLU B 2 6.679 29.225 -5.109 1.00 0.00 H new ATOM 0 HG3 GLU B 2 8.384 29.394 -5.479 1.00 0.00 H new ATOM 1640 N ASN B 3 6.630 26.518 -6.107 1.00 0.00 N ATOM 1641 CA ASN B 3 5.946 25.407 -5.460 1.00 0.00 C ATOM 1642 C ASN B 3 5.736 24.251 -6.420 1.00 0.00 C ATOM 1643 O ASN B 3 5.096 24.340 -7.470 1.00 0.00 O ATOM 1644 CB ASN B 3 4.669 25.739 -4.684 1.00 0.00 C ATOM 1645 CG ASN B 3 4.736 26.988 -3.807 1.00 0.00 C ATOM 1646 OD1 ASN B 3 3.886 27.869 -3.916 1.00 0.00 O ATOM 1647 ND2 ASN B 3 5.712 27.120 -2.921 1.00 0.00 N ATOM 0 H ASN B 3 7.564 26.650 -5.719 1.00 0.00 H new ATOM 0 HA ASN B 3 6.639 25.107 -4.674 1.00 0.00 H new ATOM 0 HB2 ASN B 3 3.853 25.861 -5.397 1.00 0.00 H new ATOM 0 HB3 ASN B 3 4.417 24.887 -4.053 1.00 0.00 H new ATOM 0 HD21 ASN B 3 5.757 27.951 -2.331 1.00 0.00 H new ATOM 0 HD22 ASN B 3 6.419 26.390 -2.828 1.00 0.00 H new ATOM 1654 N LYS B 4 6.315 23.142 -5.991 1.00 0.00 N ATOM 1655 CA LYS B 4 6.480 21.874 -6.671 1.00 0.00 C ATOM 1656 C LYS B 4 6.452 20.847 -5.553 1.00 0.00 C ATOM 1657 O LYS B 4 7.051 21.106 -4.506 1.00 0.00 O ATOM 1658 CB LYS B 4 7.845 21.858 -7.384 1.00 0.00 C ATOM 1659 CG LYS B 4 7.895 22.822 -8.580 1.00 0.00 C ATOM 1660 CD LYS B 4 9.306 22.962 -9.151 1.00 0.00 C ATOM 1661 CE LYS B 4 10.186 23.897 -8.310 1.00 0.00 C ATOM 1662 NZ LYS B 4 11.569 23.968 -8.842 1.00 0.00 N ATOM 0 H LYS B 4 6.724 23.108 -5.057 1.00 0.00 H new ATOM 0 HA LYS B 4 5.716 21.683 -7.424 1.00 0.00 H new ATOM 0 HB2 LYS B 4 8.626 22.126 -6.673 1.00 0.00 H new ATOM 0 HB3 LYS B 4 8.060 20.846 -7.728 1.00 0.00 H new ATOM 0 HG2 LYS B 4 7.223 22.465 -9.360 1.00 0.00 H new ATOM 0 HG3 LYS B 4 7.532 23.802 -8.270 1.00 0.00 H new ATOM 0 HD2 LYS B 4 9.773 21.978 -9.205 1.00 0.00 H new ATOM 0 HD3 LYS B 4 9.247 23.343 -10.171 1.00 0.00 H new ATOM 0 HE2 LYS B 4 9.749 24.895 -8.297 1.00 0.00 H new ATOM 0 HE3 LYS B 4 10.210 23.546 -7.278 1.00 0.00 H new ATOM 0 HZ1 LYS B 4 11.981 24.896 -8.616 1.00 0.00 H new ATOM 0 HZ2 LYS B 4 12.146 23.219 -8.410 1.00 0.00 H new ATOM 0 HZ3 LYS B 4 11.551 23.839 -9.874 1.00 0.00 H new ATOM 1676 N ILE B 5 5.762 19.726 -5.733 1.00 0.00 N ATOM 1677 CA ILE B 5 5.509 18.802 -4.638 1.00 0.00 C ATOM 1678 C ILE B 5 6.164 17.466 -4.951 1.00 0.00 C ATOM 1679 O ILE B 5 6.096 16.960 -6.073 1.00 0.00 O ATOM 1680 CB ILE B 5 3.995 18.719 -4.345 1.00 0.00 C ATOM 1681 CG1 ILE B 5 3.496 20.124 -3.927 1.00 0.00 C ATOM 1682 CG2 ILE B 5 3.717 17.670 -3.257 1.00 0.00 C ATOM 1683 CD1 ILE B 5 2.117 20.147 -3.270 1.00 0.00 C ATOM 0 H ILE B 5 5.368 19.437 -6.628 1.00 0.00 H new ATOM 0 HA ILE B 5 5.961 19.160 -3.713 1.00 0.00 H new ATOM 0 HB ILE B 5 3.455 18.404 -5.238 1.00 0.00 H new ATOM 0 HG12 ILE B 5 4.219 20.560 -3.237 1.00 0.00 H new ATOM 0 HG13 ILE B 5 3.473 20.763 -4.810 1.00 0.00 H new ATOM 0 HG21 ILE B 5 2.646 17.623 -3.062 1.00 0.00 H new ATOM 0 HG22 ILE B 5 4.067 16.694 -3.594 1.00 0.00 H new ATOM 0 HG23 ILE B 5 4.241 17.947 -2.342 1.00 0.00 H new ATOM 0 HD11 ILE B 5 1.854 21.173 -3.013 1.00 0.00 H new ATOM 0 HD12 ILE B 5 1.377 19.745 -3.963 1.00 0.00 H new ATOM 0 HD13 ILE B 5 2.135 19.539 -2.365 1.00 0.00 H new ATOM 1695 N ILE B 6 6.744 16.881 -3.912 1.00 0.00 N ATOM 1696 CA ILE B 6 7.391 15.579 -3.919 1.00 0.00 C ATOM 1697 C ILE B 6 6.949 14.889 -2.623 1.00 0.00 C ATOM 1698 O ILE B 6 6.763 15.543 -1.590 1.00 0.00 O ATOM 1699 CB ILE B 6 8.923 15.753 -4.096 1.00 0.00 C ATOM 1700 CG1 ILE B 6 9.614 14.390 -4.354 1.00 0.00 C ATOM 1701 CG2 ILE B 6 9.557 16.548 -2.933 1.00 0.00 C ATOM 1702 CD1 ILE B 6 11.147 14.464 -4.367 1.00 0.00 C ATOM 0 H ILE B 6 6.777 17.326 -2.995 1.00 0.00 H new ATOM 0 HA ILE B 6 7.102 14.944 -4.757 1.00 0.00 H new ATOM 0 HB ILE B 6 9.089 16.359 -4.986 1.00 0.00 H new ATOM 0 HG12 ILE B 6 9.300 13.683 -3.586 1.00 0.00 H new ATOM 0 HG13 ILE B 6 9.271 13.995 -5.310 1.00 0.00 H new ATOM 0 HG21 ILE B 6 10.630 16.644 -3.100 1.00 0.00 H new ATOM 0 HG22 ILE B 6 9.107 17.540 -2.882 1.00 0.00 H new ATOM 0 HG23 ILE B 6 9.382 16.022 -1.995 1.00 0.00 H new ATOM 0 HD11 ILE B 6 11.558 13.472 -4.553 1.00 0.00 H new ATOM 0 HD12 ILE B 6 11.472 15.145 -5.154 1.00 0.00 H new ATOM 0 HD13 ILE B 6 11.502 14.828 -3.403 1.00 0.00 H new ATOM 1714 N TYR B 7 6.732 13.578 -2.678 1.00 0.00 N ATOM 1715 CA TYR B 7 6.105 12.832 -1.597 1.00 0.00 C ATOM 1716 C TYR B 7 6.862 11.523 -1.426 1.00 0.00 C ATOM 1717 O TYR B 7 7.303 10.934 -2.415 1.00 0.00 O ATOM 1718 CB TYR B 7 4.638 12.599 -1.976 1.00 0.00 C ATOM 1719 CG TYR B 7 3.697 12.210 -0.850 1.00 0.00 C ATOM 1720 CD1 TYR B 7 3.550 10.864 -0.463 1.00 0.00 C ATOM 1721 CD2 TYR B 7 2.866 13.191 -0.275 1.00 0.00 C ATOM 1722 CE1 TYR B 7 2.492 10.487 0.376 1.00 0.00 C ATOM 1723 CE2 TYR B 7 1.877 12.829 0.655 1.00 0.00 C ATOM 1724 CZ TYR B 7 1.651 11.466 0.944 1.00 0.00 C ATOM 1725 OH TYR B 7 0.609 11.091 1.735 1.00 0.00 O ATOM 0 H TYR B 7 6.989 13.002 -3.480 1.00 0.00 H new ATOM 0 HA TYR B 7 6.136 13.371 -0.650 1.00 0.00 H new ATOM 0 HB2 TYR B 7 4.257 13.510 -2.439 1.00 0.00 H new ATOM 0 HB3 TYR B 7 4.602 11.817 -2.735 1.00 0.00 H new ATOM 0 HD1 TYR B 7 4.253 10.122 -0.813 1.00 0.00 H new ATOM 0 HD2 TYR B 7 2.990 14.228 -0.551 1.00 0.00 H new ATOM 0 HE1 TYR B 7 2.320 9.442 0.588 1.00 0.00 H new ATOM 0 HE2 TYR B 7 1.291 13.591 1.147 1.00 0.00 H new ATOM 0 HH TYR B 7 0.131 11.888 2.046 1.00 0.00 H new ATOM 1735 N PHE B 8 7.023 11.063 -0.188 1.00 0.00 N ATOM 1736 CA PHE B 8 7.785 9.863 0.129 1.00 0.00 C ATOM 1737 C PHE B 8 6.836 8.826 0.719 1.00 0.00 C ATOM 1738 O PHE B 8 5.927 9.179 1.475 1.00 0.00 O ATOM 1739 CB PHE B 8 8.912 10.176 1.125 1.00 0.00 C ATOM 1740 CG PHE B 8 9.895 11.283 0.769 1.00 0.00 C ATOM 1741 CD1 PHE B 8 10.104 11.714 -0.559 1.00 0.00 C ATOM 1742 CD2 PHE B 8 10.632 11.888 1.802 1.00 0.00 C ATOM 1743 CE1 PHE B 8 11.038 12.719 -0.851 1.00 0.00 C ATOM 1744 CE2 PHE B 8 11.547 12.905 1.507 1.00 0.00 C ATOM 1745 CZ PHE B 8 11.769 13.310 0.187 1.00 0.00 C ATOM 0 H PHE B 8 6.622 11.520 0.631 1.00 0.00 H new ATOM 0 HA PHE B 8 8.244 9.476 -0.781 1.00 0.00 H new ATOM 0 HB2 PHE B 8 8.452 10.432 2.079 1.00 0.00 H new ATOM 0 HB3 PHE B 8 9.483 9.261 1.282 1.00 0.00 H new ATOM 0 HD1 PHE B 8 9.537 11.264 -1.361 1.00 0.00 H new ATOM 0 HD2 PHE B 8 10.492 11.568 2.824 1.00 0.00 H new ATOM 0 HE1 PHE B 8 11.193 13.036 -1.872 1.00 0.00 H new ATOM 0 HE2 PHE B 8 12.089 13.383 2.309 1.00 0.00 H new ATOM 0 HZ PHE B 8 12.500 14.074 -0.031 1.00 0.00 H new ATOM 1755 N LEU B 9 7.072 7.550 0.413 1.00 0.00 N ATOM 1756 CA LEU B 9 6.273 6.428 0.899 1.00 0.00 C ATOM 1757 C LEU B 9 7.236 5.360 1.395 1.00 0.00 C ATOM 1758 O LEU B 9 8.118 4.936 0.640 1.00 0.00 O ATOM 1759 CB LEU B 9 5.368 5.885 -0.223 1.00 0.00 C ATOM 1760 CG LEU B 9 4.039 6.647 -0.381 1.00 0.00 C ATOM 1761 CD1 LEU B 9 3.306 6.152 -1.633 1.00 0.00 C ATOM 1762 CD2 LEU B 9 3.104 6.465 0.826 1.00 0.00 C ATOM 0 H LEU B 9 7.841 7.263 -0.193 1.00 0.00 H new ATOM 0 HA LEU B 9 5.618 6.744 1.711 1.00 0.00 H new ATOM 0 HB2 LEU B 9 5.912 5.926 -1.166 1.00 0.00 H new ATOM 0 HB3 LEU B 9 5.152 4.835 -0.025 1.00 0.00 H new ATOM 0 HG LEU B 9 4.291 7.704 -0.461 1.00 0.00 H new ATOM 0 HD11 LEU B 9 2.366 6.693 -1.742 1.00 0.00 H new ATOM 0 HD12 LEU B 9 3.928 6.325 -2.511 1.00 0.00 H new ATOM 0 HD13 LEU B 9 3.102 5.086 -1.537 1.00 0.00 H new ATOM 0 HD21 LEU B 9 2.183 7.024 0.660 1.00 0.00 H new ATOM 0 HD22 LEU B 9 2.870 5.408 0.949 1.00 0.00 H new ATOM 0 HD23 LEU B 9 3.596 6.834 1.726 1.00 0.00 H new ATOM 1774 N SER B 10 7.106 4.977 2.669 1.00 0.00 N ATOM 1775 CA SER B 10 7.871 3.903 3.286 1.00 0.00 C ATOM 1776 C SER B 10 7.224 3.509 4.623 1.00 0.00 C ATOM 1777 O SER B 10 6.514 4.318 5.226 1.00 0.00 O ATOM 1778 CB SER B 10 9.321 4.350 3.448 1.00 0.00 C ATOM 1779 OG SER B 10 9.431 5.673 3.964 1.00 0.00 O ATOM 0 H SER B 10 6.448 5.420 3.311 1.00 0.00 H new ATOM 0 HA SER B 10 7.867 3.016 2.653 1.00 0.00 H new ATOM 0 HB2 SER B 10 9.838 3.660 4.115 1.00 0.00 H new ATOM 0 HB3 SER B 10 9.824 4.297 2.482 1.00 0.00 H new ATOM 0 HG SER B 10 9.451 6.313 3.222 1.00 0.00 H new ATOM 1785 N THR B 11 7.471 2.280 5.097 1.00 0.00 N ATOM 1786 CA THR B 11 6.765 1.674 6.224 1.00 0.00 C ATOM 1787 C THR B 11 6.767 2.570 7.448 1.00 0.00 C ATOM 1788 O THR B 11 7.829 2.908 7.985 1.00 0.00 O ATOM 1789 CB THR B 11 7.340 0.293 6.545 1.00 0.00 C ATOM 1790 OG1 THR B 11 7.257 -0.429 5.348 1.00 0.00 O ATOM 1791 CG2 THR B 11 6.542 -0.439 7.631 1.00 0.00 C ATOM 0 H THR B 11 8.183 1.670 4.696 1.00 0.00 H new ATOM 0 HA THR B 11 5.724 1.550 5.927 1.00 0.00 H new ATOM 0 HB THR B 11 8.357 0.389 6.925 1.00 0.00 H new ATOM 0 HG1 THR B 11 8.067 -0.969 5.235 1.00 0.00 H new ATOM 0 HG21 THR B 11 6.993 -1.413 7.820 1.00 0.00 H new ATOM 0 HG22 THR B 11 6.552 0.149 8.549 1.00 0.00 H new ATOM 0 HG23 THR B 11 5.513 -0.574 7.298 1.00 0.00 H new ATOM 1799 N GLY B 12 5.552 2.944 7.856 1.00 0.00 N ATOM 1800 CA GLY B 12 5.286 3.782 9.019 1.00 0.00 C ATOM 1801 C GLY B 12 5.939 5.168 8.951 1.00 0.00 C ATOM 1802 O GLY B 12 5.816 5.932 9.906 1.00 0.00 O ATOM 0 H GLY B 12 4.702 2.661 7.368 1.00 0.00 H new ATOM 0 HA2 GLY B 12 4.208 3.904 9.127 1.00 0.00 H new ATOM 0 HA3 GLY B 12 5.640 3.268 9.913 1.00 0.00 H new ATOM 1806 N ASN B 13 6.611 5.489 7.836 1.00 0.00 N ATOM 1807 CA ASN B 13 7.489 6.640 7.600 1.00 0.00 C ATOM 1808 C ASN B 13 8.397 7.012 8.797 1.00 0.00 C ATOM 1809 O ASN B 13 8.879 8.139 8.930 1.00 0.00 O ATOM 1810 CB ASN B 13 6.678 7.799 6.987 1.00 0.00 C ATOM 1811 CG ASN B 13 6.411 8.954 7.940 1.00 0.00 C ATOM 1812 OD1 ASN B 13 5.684 8.831 8.919 1.00 0.00 O ATOM 1813 ND2 ASN B 13 6.988 10.108 7.663 1.00 0.00 N ATOM 0 H ASN B 13 6.547 4.899 7.007 1.00 0.00 H new ATOM 0 HA ASN B 13 8.233 6.353 6.857 1.00 0.00 H new ATOM 0 HB2 ASN B 13 7.212 8.179 6.116 1.00 0.00 H new ATOM 0 HB3 ASN B 13 5.724 7.410 6.631 1.00 0.00 H new ATOM 0 HD21 ASN B 13 6.832 10.914 8.268 1.00 0.00 H new ATOM 0 HD22 ASN B 13 7.590 10.194 6.844 1.00 0.00 H new ATOM 1820 N SER B 14 8.672 6.040 9.668 1.00 0.00 N ATOM 1821 CA SER B 14 9.297 6.229 10.967 1.00 0.00 C ATOM 1822 C SER B 14 10.664 6.909 10.938 1.00 0.00 C ATOM 1823 O SER B 14 10.919 7.753 11.794 1.00 0.00 O ATOM 1824 CB SER B 14 9.389 4.859 11.658 1.00 0.00 C ATOM 1825 OG SER B 14 8.201 4.102 11.453 1.00 0.00 O ATOM 0 H SER B 14 8.455 5.062 9.475 1.00 0.00 H new ATOM 0 HA SER B 14 8.666 6.922 11.524 1.00 0.00 H new ATOM 0 HB2 SER B 14 10.246 4.309 11.270 1.00 0.00 H new ATOM 0 HB3 SER B 14 9.556 4.997 12.726 1.00 0.00 H new ATOM 0 HG SER B 14 8.285 3.234 11.901 1.00 0.00 H new ATOM 1831 N ALA B 15 11.530 6.585 9.972 1.00 0.00 N ATOM 1832 CA ALA B 15 12.929 7.000 9.996 1.00 0.00 C ATOM 1833 C ALA B 15 13.420 7.595 8.679 1.00 0.00 C ATOM 1834 O ALA B 15 13.635 8.800 8.587 1.00 0.00 O ATOM 1835 CB ALA B 15 13.785 5.786 10.392 1.00 0.00 C ATOM 0 H ALA B 15 11.278 6.029 9.155 1.00 0.00 H new ATOM 0 HA ALA B 15 13.023 7.804 10.726 1.00 0.00 H new ATOM 0 HB1 ALA B 15 14.836 6.074 10.416 1.00 0.00 H new ATOM 0 HB2 ALA B 15 13.483 5.434 11.378 1.00 0.00 H new ATOM 0 HB3 ALA B 15 13.644 4.988 9.663 1.00 0.00 H new ATOM 1841 N ARG B 16 13.626 6.766 7.652 1.00 0.00 N ATOM 1842 CA ARG B 16 14.297 7.192 6.415 1.00 0.00 C ATOM 1843 C ARG B 16 13.584 8.360 5.740 1.00 0.00 C ATOM 1844 O ARG B 16 14.243 9.224 5.176 1.00 0.00 O ATOM 1845 CB ARG B 16 14.557 6.012 5.449 1.00 0.00 C ATOM 1846 CG ARG B 16 13.714 4.740 5.655 1.00 0.00 C ATOM 1847 CD ARG B 16 12.242 4.882 5.246 1.00 0.00 C ATOM 1848 NE ARG B 16 11.359 4.047 6.081 1.00 0.00 N ATOM 1849 CZ ARG B 16 11.217 2.719 5.982 1.00 0.00 C ATOM 1850 NH1 ARG B 16 11.891 2.011 5.089 1.00 0.00 N ATOM 1851 NH2 ARG B 16 10.353 2.064 6.741 1.00 0.00 N ATOM 0 H ARG B 16 13.336 5.788 7.651 1.00 0.00 H new ATOM 0 HA ARG B 16 15.278 7.565 6.708 1.00 0.00 H new ATOM 0 HB2 ARG B 16 14.393 6.365 4.431 1.00 0.00 H new ATOM 0 HB3 ARG B 16 15.609 5.737 5.526 1.00 0.00 H new ATOM 0 HG2 ARG B 16 14.160 3.926 5.083 1.00 0.00 H new ATOM 0 HG3 ARG B 16 13.761 4.454 6.706 1.00 0.00 H new ATOM 0 HD2 ARG B 16 11.941 5.926 5.330 1.00 0.00 H new ATOM 0 HD3 ARG B 16 12.127 4.600 4.200 1.00 0.00 H new ATOM 0 HE ARG B 16 10.808 4.522 6.796 1.00 0.00 H new ATOM 0 HH11 ARG B 16 12.539 2.476 4.453 1.00 0.00 H new ATOM 0 HH12 ARG B 16 11.762 1.000 5.037 1.00 0.00 H new ATOM 0 HH21 ARG B 16 9.781 2.571 7.416 1.00 0.00 H new ATOM 0 HH22 ARG B 16 10.259 1.052 6.651 1.00 0.00 H new ATOM 1865 N SER B 17 12.262 8.433 5.846 1.00 0.00 N ATOM 1866 CA SER B 17 11.453 9.515 5.305 1.00 0.00 C ATOM 1867 C SER B 17 11.723 10.816 6.068 1.00 0.00 C ATOM 1868 O SER B 17 11.940 11.854 5.448 1.00 0.00 O ATOM 1869 CB SER B 17 9.974 9.104 5.368 1.00 0.00 C ATOM 1870 OG SER B 17 9.802 7.760 5.807 1.00 0.00 O ATOM 0 H SER B 17 11.710 7.721 6.324 1.00 0.00 H new ATOM 0 HA SER B 17 11.717 9.700 4.264 1.00 0.00 H new ATOM 0 HB2 SER B 17 9.442 9.775 6.043 1.00 0.00 H new ATOM 0 HB3 SER B 17 9.525 9.222 4.382 1.00 0.00 H new ATOM 0 HG SER B 17 9.686 7.174 5.030 1.00 0.00 H new ATOM 1876 N GLN B 18 11.795 10.743 7.403 1.00 0.00 N ATOM 1877 CA GLN B 18 12.160 11.863 8.269 1.00 0.00 C ATOM 1878 C GLN B 18 13.512 12.431 7.860 1.00 0.00 C ATOM 1879 O GLN B 18 13.697 13.648 7.786 1.00 0.00 O ATOM 1880 CB GLN B 18 12.283 11.434 9.737 1.00 0.00 C ATOM 1881 CG GLN B 18 11.117 10.626 10.305 1.00 0.00 C ATOM 1882 CD GLN B 18 9.816 11.432 10.347 1.00 0.00 C ATOM 1883 OE1 GLN B 18 9.826 12.644 10.564 1.00 0.00 O ATOM 1884 NE2 GLN B 18 8.686 10.791 10.112 1.00 0.00 N ATOM 0 H GLN B 18 11.597 9.885 7.918 1.00 0.00 H new ATOM 0 HA GLN B 18 11.368 12.604 8.163 1.00 0.00 H new ATOM 0 HB2 GLN B 18 13.193 10.845 9.846 1.00 0.00 H new ATOM 0 HB3 GLN B 18 12.408 12.329 10.346 1.00 0.00 H new ATOM 0 HG2 GLN B 18 10.968 9.732 9.699 1.00 0.00 H new ATOM 0 HG3 GLN B 18 11.367 10.291 11.312 1.00 0.00 H new ATOM 0 HE21 GLN B 18 8.697 9.787 9.934 1.00 0.00 H new ATOM 0 HE22 GLN B 18 7.802 11.300 10.108 1.00 0.00 H new ATOM 1893 N MET B 19 14.454 11.519 7.625 1.00 0.00 N ATOM 1894 CA MET B 19 15.807 11.871 7.283 1.00 0.00 C ATOM 1895 C MET B 19 15.814 12.515 5.894 1.00 0.00 C ATOM 1896 O MET B 19 16.421 13.563 5.700 1.00 0.00 O ATOM 1897 CB MET B 19 16.663 10.601 7.317 1.00 0.00 C ATOM 1898 CG MET B 19 18.153 10.929 7.388 1.00 0.00 C ATOM 1899 SD MET B 19 19.211 9.652 6.666 1.00 0.00 S ATOM 1900 CE MET B 19 18.646 8.158 7.526 1.00 0.00 C ATOM 0 H MET B 19 14.287 10.514 7.670 1.00 0.00 H new ATOM 0 HA MET B 19 16.220 12.587 7.993 1.00 0.00 H new ATOM 0 HB2 MET B 19 16.382 9.995 8.178 1.00 0.00 H new ATOM 0 HB3 MET B 19 16.463 10.003 6.428 1.00 0.00 H new ATOM 0 HG2 MET B 19 18.334 11.873 6.873 1.00 0.00 H new ATOM 0 HG3 MET B 19 18.435 11.076 8.431 1.00 0.00 H new ATOM 0 HE1 MET B 19 19.434 7.406 7.504 1.00 0.00 H new ATOM 0 HE2 MET B 19 18.406 8.403 8.561 1.00 0.00 H new ATOM 0 HE3 MET B 19 17.757 7.767 7.030 1.00 0.00 H new ATOM 1910 N ALA B 20 15.117 11.908 4.928 1.00 0.00 N ATOM 1911 CA ALA B 20 15.058 12.394 3.563 1.00 0.00 C ATOM 1912 C ALA B 20 14.430 13.776 3.498 1.00 0.00 C ATOM 1913 O ALA B 20 14.884 14.593 2.707 1.00 0.00 O ATOM 1914 CB ALA B 20 14.306 11.413 2.659 1.00 0.00 C ATOM 0 H ALA B 20 14.576 11.057 5.083 1.00 0.00 H new ATOM 0 HA ALA B 20 16.082 12.472 3.198 1.00 0.00 H new ATOM 0 HB1 ALA B 20 14.278 11.804 1.642 1.00 0.00 H new ATOM 0 HB2 ALA B 20 14.816 10.450 2.664 1.00 0.00 H new ATOM 0 HB3 ALA B 20 13.288 11.286 3.027 1.00 0.00 H new ATOM 1920 N GLU B 21 13.404 14.064 4.299 1.00 0.00 N ATOM 1921 CA GLU B 21 12.715 15.340 4.193 1.00 0.00 C ATOM 1922 C GLU B 21 13.553 16.462 4.824 1.00 0.00 C ATOM 1923 O GLU B 21 13.524 17.593 4.334 1.00 0.00 O ATOM 1924 CB GLU B 21 11.267 15.221 4.693 1.00 0.00 C ATOM 1925 CG GLU B 21 11.110 15.164 6.209 1.00 0.00 C ATOM 1926 CD GLU B 21 9.643 14.948 6.611 1.00 0.00 C ATOM 1927 OE1 GLU B 21 9.193 13.780 6.606 1.00 0.00 O ATOM 1928 OE2 GLU B 21 8.942 15.941 6.919 1.00 0.00 O ATOM 0 H GLU B 21 13.039 13.438 5.017 1.00 0.00 H new ATOM 0 HA GLU B 21 12.615 15.630 3.147 1.00 0.00 H new ATOM 0 HB2 GLU B 21 10.698 16.070 4.316 1.00 0.00 H new ATOM 0 HB3 GLU B 21 10.823 14.323 4.263 1.00 0.00 H new ATOM 0 HG2 GLU B 21 11.722 14.356 6.610 1.00 0.00 H new ATOM 0 HG3 GLU B 21 11.477 16.091 6.650 1.00 0.00 H new ATOM 1935 N GLY B 22 14.387 16.147 5.825 1.00 0.00 N ATOM 1936 CA GLY B 22 15.369 17.093 6.336 1.00 0.00 C ATOM 1937 C GLY B 22 16.507 17.291 5.330 1.00 0.00 C ATOM 1938 O GLY B 22 16.861 18.434 5.029 1.00 0.00 O ATOM 0 H GLY B 22 14.395 15.241 6.293 1.00 0.00 H new ATOM 0 HA2 GLY B 22 14.888 18.049 6.540 1.00 0.00 H new ATOM 0 HA3 GLY B 22 15.772 16.731 7.282 1.00 0.00 H new ATOM 1942 N TRP B 23 17.025 16.205 4.739 1.00 0.00 N ATOM 1943 CA TRP B 23 18.006 16.260 3.653 1.00 0.00 C ATOM 1944 C TRP B 23 17.496 17.118 2.504 1.00 0.00 C ATOM 1945 O TRP B 23 18.254 17.899 1.932 1.00 0.00 O ATOM 1946 CB TRP B 23 18.307 14.853 3.114 1.00 0.00 C ATOM 1947 CG TRP B 23 19.474 14.165 3.734 1.00 0.00 C ATOM 1948 CD1 TRP B 23 19.421 13.061 4.505 1.00 0.00 C ATOM 1949 CD2 TRP B 23 20.889 14.484 3.589 1.00 0.00 C ATOM 1950 NE1 TRP B 23 20.694 12.699 4.882 1.00 0.00 N ATOM 1951 CE2 TRP B 23 21.645 13.534 4.335 1.00 0.00 C ATOM 1952 CE3 TRP B 23 21.608 15.453 2.856 1.00 0.00 C ATOM 1953 CZ2 TRP B 23 23.046 13.563 4.381 1.00 0.00 C ATOM 1954 CZ3 TRP B 23 23.016 15.469 2.866 1.00 0.00 C ATOM 1955 CH2 TRP B 23 23.735 14.532 3.632 1.00 0.00 C ATOM 0 H TRP B 23 16.770 15.254 5.007 1.00 0.00 H new ATOM 0 HA TRP B 23 18.916 16.698 4.063 1.00 0.00 H new ATOM 0 HB2 TRP B 23 17.423 14.231 3.257 1.00 0.00 H new ATOM 0 HB3 TRP B 23 18.477 14.923 2.040 1.00 0.00 H new ATOM 0 HD1 TRP B 23 18.517 12.540 4.784 1.00 0.00 H new ATOM 0 HE1 TRP B 23 20.908 11.910 5.492 1.00 0.00 H new ATOM 0 HE3 TRP B 23 21.071 16.192 2.280 1.00 0.00 H new ATOM 0 HZ2 TRP B 23 23.588 12.850 4.984 1.00 0.00 H new ATOM 0 HZ3 TRP B 23 23.548 16.205 2.282 1.00 0.00 H new ATOM 0 HH2 TRP B 23 24.815 14.558 3.644 1.00 0.00 H new ATOM 1966 N ALA B 24 16.217 16.971 2.164 1.00 0.00 N ATOM 1967 CA ALA B 24 15.617 17.683 1.065 1.00 0.00 C ATOM 1968 C ALA B 24 15.688 19.181 1.320 1.00 0.00 C ATOM 1969 O ALA B 24 16.159 19.919 0.462 1.00 0.00 O ATOM 1970 CB ALA B 24 14.159 17.252 0.903 1.00 0.00 C ATOM 0 H ALA B 24 15.574 16.348 2.653 1.00 0.00 H new ATOM 0 HA ALA B 24 16.161 17.451 0.149 1.00 0.00 H new ATOM 0 HB1 ALA B 24 13.710 17.794 0.070 1.00 0.00 H new ATOM 0 HB2 ALA B 24 14.116 16.181 0.705 1.00 0.00 H new ATOM 0 HB3 ALA B 24 13.610 17.474 1.818 1.00 0.00 H new ATOM 1976 N LYS B 25 15.254 19.652 2.495 1.00 0.00 N ATOM 1977 CA LYS B 25 15.085 21.085 2.702 1.00 0.00 C ATOM 1978 C LYS B 25 16.397 21.858 2.679 1.00 0.00 C ATOM 1979 O LYS B 25 16.363 23.052 2.383 1.00 0.00 O ATOM 1980 CB LYS B 25 14.246 21.385 3.963 1.00 0.00 C ATOM 1981 CG LYS B 25 13.001 22.224 3.616 1.00 0.00 C ATOM 1982 CD LYS B 25 11.971 21.400 2.821 1.00 0.00 C ATOM 1983 CE LYS B 25 10.754 22.190 2.281 1.00 0.00 C ATOM 1984 NZ LYS B 25 11.117 23.283 1.340 1.00 0.00 N ATOM 0 H LYS B 25 15.019 19.071 3.299 1.00 0.00 H new ATOM 0 HA LYS B 25 14.521 21.451 1.844 1.00 0.00 H new ATOM 0 HB2 LYS B 25 13.939 20.449 4.430 1.00 0.00 H new ATOM 0 HB3 LYS B 25 14.857 21.919 4.691 1.00 0.00 H new ATOM 0 HG2 LYS B 25 12.543 22.594 4.533 1.00 0.00 H new ATOM 0 HG3 LYS B 25 13.299 23.096 3.034 1.00 0.00 H new ATOM 0 HD2 LYS B 25 12.480 20.931 1.979 1.00 0.00 H new ATOM 0 HD3 LYS B 25 11.605 20.596 3.460 1.00 0.00 H new ATOM 0 HE2 LYS B 25 10.079 21.499 1.777 1.00 0.00 H new ATOM 0 HE3 LYS B 25 10.206 22.615 3.122 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 10.470 23.269 0.526 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 11.042 24.199 1.826 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 12.093 23.146 1.009 1.00 0.00 H new ATOM 1998 N GLN B 26 17.547 21.212 2.916 1.00 0.00 N ATOM 1999 CA GLN B 26 18.823 21.904 2.769 1.00 0.00 C ATOM 2000 C GLN B 26 19.128 22.303 1.312 1.00 0.00 C ATOM 2001 O GLN B 26 19.985 23.162 1.097 1.00 0.00 O ATOM 2002 CB GLN B 26 19.990 21.160 3.446 1.00 0.00 C ATOM 2003 CG GLN B 26 20.509 19.901 2.725 1.00 0.00 C ATOM 2004 CD GLN B 26 22.042 19.828 2.682 1.00 0.00 C ATOM 2005 OE1 GLN B 26 22.717 20.758 2.248 1.00 0.00 O ATOM 2006 NE2 GLN B 26 22.636 18.727 3.109 1.00 0.00 N ATOM 0 H GLN B 26 17.615 20.236 3.203 1.00 0.00 H new ATOM 0 HA GLN B 26 18.714 22.842 3.313 1.00 0.00 H new ATOM 0 HB2 GLN B 26 20.821 21.857 3.558 1.00 0.00 H new ATOM 0 HB3 GLN B 26 19.677 20.874 4.450 1.00 0.00 H new ATOM 0 HG2 GLN B 26 20.122 19.015 3.228 1.00 0.00 H new ATOM 0 HG3 GLN B 26 20.121 19.885 1.707 1.00 0.00 H new ATOM 0 HE21 GLN B 26 22.078 17.953 3.470 1.00 0.00 H new ATOM 0 HE22 GLN B 26 23.653 18.651 3.078 1.00 0.00 H new ATOM 2015 N TYR B 27 18.437 21.720 0.321 1.00 0.00 N ATOM 2016 CA TYR B 27 18.630 22.000 -1.104 1.00 0.00 C ATOM 2017 C TYR B 27 17.311 22.287 -1.845 1.00 0.00 C ATOM 2018 O TYR B 27 17.339 22.661 -3.017 1.00 0.00 O ATOM 2019 CB TYR B 27 19.409 20.840 -1.757 1.00 0.00 C ATOM 2020 CG TYR B 27 20.824 21.213 -2.160 1.00 0.00 C ATOM 2021 CD1 TYR B 27 21.846 21.245 -1.194 1.00 0.00 C ATOM 2022 CD2 TYR B 27 21.117 21.544 -3.498 1.00 0.00 C ATOM 2023 CE1 TYR B 27 23.158 21.594 -1.560 1.00 0.00 C ATOM 2024 CE2 TYR B 27 22.428 21.884 -3.875 1.00 0.00 C ATOM 2025 CZ TYR B 27 23.458 21.907 -2.905 1.00 0.00 C ATOM 2026 OH TYR B 27 24.737 22.231 -3.250 1.00 0.00 O ATOM 0 H TYR B 27 17.712 21.024 0.496 1.00 0.00 H new ATOM 0 HA TYR B 27 19.215 22.916 -1.186 1.00 0.00 H new ATOM 0 HB2 TYR B 27 19.447 20.001 -1.062 1.00 0.00 H new ATOM 0 HB3 TYR B 27 18.866 20.499 -2.639 1.00 0.00 H new ATOM 0 HD1 TYR B 27 21.622 21.000 -0.166 1.00 0.00 H new ATOM 0 HD2 TYR B 27 20.330 21.536 -4.238 1.00 0.00 H new ATOM 0 HE1 TYR B 27 23.937 21.623 -0.813 1.00 0.00 H new ATOM 0 HE2 TYR B 27 22.649 22.127 -4.904 1.00 0.00 H new ATOM 0 HH TYR B 27 24.779 22.419 -4.211 1.00 0.00 H new ATOM 2036 N LEU B 28 16.163 22.166 -1.173 1.00 0.00 N ATOM 2037 CA LEU B 28 14.827 22.384 -1.691 1.00 0.00 C ATOM 2038 C LEU B 28 14.250 23.486 -0.813 1.00 0.00 C ATOM 2039 O LEU B 28 13.677 23.206 0.243 1.00 0.00 O ATOM 2040 CB LEU B 28 13.921 21.135 -1.597 1.00 0.00 C ATOM 2041 CG LEU B 28 14.274 19.879 -2.404 1.00 0.00 C ATOM 2042 CD1 LEU B 28 13.047 18.955 -2.344 1.00 0.00 C ATOM 2043 CD2 LEU B 28 14.625 20.163 -3.864 1.00 0.00 C ATOM 0 H LEU B 28 16.151 21.895 -0.190 1.00 0.00 H new ATOM 0 HA LEU B 28 14.873 22.634 -2.751 1.00 0.00 H new ATOM 0 HB2 LEU B 28 13.873 20.845 -0.547 1.00 0.00 H new ATOM 0 HB3 LEU B 28 12.916 21.439 -1.890 1.00 0.00 H new ATOM 0 HG LEU B 28 15.166 19.428 -1.968 1.00 0.00 H new ATOM 0 HD11 LEU B 28 13.250 18.044 -2.906 1.00 0.00 H new ATOM 0 HD12 LEU B 28 12.833 18.701 -1.306 1.00 0.00 H new ATOM 0 HD13 LEU B 28 12.186 19.464 -2.777 1.00 0.00 H new ATOM 0 HD21 LEU B 28 14.863 19.227 -4.370 1.00 0.00 H new ATOM 0 HD22 LEU B 28 13.776 20.636 -4.357 1.00 0.00 H new ATOM 0 HD23 LEU B 28 15.487 20.829 -3.908 1.00 0.00 H new ATOM 2055 N GLY B 29 14.454 24.735 -1.218 1.00 0.00 N ATOM 2056 CA GLY B 29 13.872 25.906 -0.567 1.00 0.00 C ATOM 2057 C GLY B 29 12.342 25.895 -0.630 1.00 0.00 C ATOM 2058 O GLY B 29 11.728 24.921 -1.062 1.00 0.00 O ATOM 0 H GLY B 29 15.038 24.967 -2.021 1.00 0.00 H new ATOM 0 HA2 GLY B 29 14.192 25.938 0.474 1.00 0.00 H new ATOM 0 HA3 GLY B 29 14.248 26.811 -1.044 1.00 0.00 H new ATOM 2062 N ASP B 30 11.708 26.997 -0.221 1.00 0.00 N ATOM 2063 CA ASP B 30 10.244 27.174 -0.244 1.00 0.00 C ATOM 2064 C ASP B 30 9.642 26.997 -1.648 1.00 0.00 C ATOM 2065 O ASP B 30 8.452 26.726 -1.806 1.00 0.00 O ATOM 2066 CB ASP B 30 9.890 28.557 0.315 1.00 0.00 C ATOM 2067 CG ASP B 30 8.369 28.783 0.368 1.00 0.00 C ATOM 2068 OD1 ASP B 30 7.691 28.154 1.213 1.00 0.00 O ATOM 2069 OD2 ASP B 30 7.853 29.636 -0.388 1.00 0.00 O ATOM 0 H ASP B 30 12.203 27.811 0.144 1.00 0.00 H new ATOM 0 HA ASP B 30 9.810 26.393 0.380 1.00 0.00 H new ATOM 0 HB2 ASP B 30 10.308 28.661 1.316 1.00 0.00 H new ATOM 0 HB3 ASP B 30 10.350 29.327 -0.304 1.00 0.00 H new ATOM 2074 N GLU B 31 10.494 27.090 -2.673 1.00 0.00 N ATOM 2075 CA GLU B 31 10.216 26.759 -4.064 1.00 0.00 C ATOM 2076 C GLU B 31 9.667 25.327 -4.236 1.00 0.00 C ATOM 2077 O GLU B 31 9.031 25.046 -5.253 1.00 0.00 O ATOM 2078 CB GLU B 31 11.524 26.994 -4.847 1.00 0.00 C ATOM 2079 CG GLU B 31 11.405 26.680 -6.341 1.00 0.00 C ATOM 2080 CD GLU B 31 12.686 26.972 -7.138 1.00 0.00 C ATOM 2081 OE1 GLU B 31 13.237 28.094 -7.064 1.00 0.00 O ATOM 2082 OE2 GLU B 31 13.116 26.068 -7.890 1.00 0.00 O ATOM 0 H GLU B 31 11.451 27.418 -2.541 1.00 0.00 H new ATOM 0 HA GLU B 31 9.422 27.396 -4.454 1.00 0.00 H new ATOM 0 HB2 GLU B 31 11.830 28.033 -4.725 1.00 0.00 H new ATOM 0 HB3 GLU B 31 12.312 26.377 -4.416 1.00 0.00 H new ATOM 0 HG2 GLU B 31 11.144 25.629 -6.463 1.00 0.00 H new ATOM 0 HG3 GLU B 31 10.585 27.263 -6.761 1.00 0.00 H new ATOM 2089 N TRP B 32 9.852 24.437 -3.256 1.00 0.00 N ATOM 2090 CA TRP B 32 9.374 23.060 -3.281 1.00 0.00 C ATOM 2091 C TRP B 32 8.809 22.687 -1.908 1.00 0.00 C ATOM 2092 O TRP B 32 9.205 23.252 -0.881 1.00 0.00 O ATOM 2093 CB TRP B 32 10.502 22.077 -3.654 1.00 0.00 C ATOM 2094 CG TRP B 32 11.620 22.528 -4.557 1.00 0.00 C ATOM 2095 CD1 TRP B 32 12.552 23.459 -4.245 1.00 0.00 C ATOM 2096 CD2 TRP B 32 12.022 22.005 -5.863 1.00 0.00 C ATOM 2097 NE1 TRP B 32 13.482 23.559 -5.256 1.00 0.00 N ATOM 2098 CE2 TRP B 32 13.231 22.652 -6.258 1.00 0.00 C ATOM 2099 CE3 TRP B 32 11.521 21.018 -6.739 1.00 0.00 C ATOM 2100 CZ2 TRP B 32 13.917 22.325 -7.436 1.00 0.00 C ATOM 2101 CZ3 TRP B 32 12.199 20.681 -7.929 1.00 0.00 C ATOM 2102 CH2 TRP B 32 13.404 21.323 -8.273 1.00 0.00 C ATOM 0 H TRP B 32 10.355 24.667 -2.399 1.00 0.00 H new ATOM 0 HA TRP B 32 8.595 22.988 -4.040 1.00 0.00 H new ATOM 0 HB2 TRP B 32 10.954 21.733 -2.724 1.00 0.00 H new ATOM 0 HB3 TRP B 32 10.036 21.210 -4.122 1.00 0.00 H new ATOM 0 HD1 TRP B 32 12.564 24.040 -3.334 1.00 0.00 H new ATOM 0 HE1 TRP B 32 14.258 24.221 -5.261 1.00 0.00 H new ATOM 0 HE3 TRP B 32 10.600 20.511 -6.493 1.00 0.00 H new ATOM 0 HZ2 TRP B 32 14.831 22.839 -7.696 1.00 0.00 H new ATOM 0 HZ3 TRP B 32 11.790 19.924 -8.582 1.00 0.00 H new ATOM 0 HH2 TRP B 32 13.930 21.046 -9.175 1.00 0.00 H new ATOM 2113 N LYS B 33 7.947 21.667 -1.868 1.00 0.00 N ATOM 2114 CA LYS B 33 7.418 21.094 -0.636 1.00 0.00 C ATOM 2115 C LYS B 33 7.583 19.589 -0.694 1.00 0.00 C ATOM 2116 O LYS B 33 7.238 18.952 -1.688 1.00 0.00 O ATOM 2117 CB LYS B 33 5.934 21.446 -0.443 1.00 0.00 C ATOM 2118 CG LYS B 33 5.688 22.928 -0.116 1.00 0.00 C ATOM 2119 CD LYS B 33 6.239 23.419 1.233 1.00 0.00 C ATOM 2120 CE LYS B 33 5.702 22.666 2.463 1.00 0.00 C ATOM 2121 NZ LYS B 33 4.263 22.918 2.734 1.00 0.00 N ATOM 0 H LYS B 33 7.593 21.211 -2.709 1.00 0.00 H new ATOM 0 HA LYS B 33 7.968 21.508 0.209 1.00 0.00 H new ATOM 0 HB2 LYS B 33 5.387 21.188 -1.350 1.00 0.00 H new ATOM 0 HB3 LYS B 33 5.526 20.833 0.361 1.00 0.00 H new ATOM 0 HG2 LYS B 33 6.129 23.533 -0.908 1.00 0.00 H new ATOM 0 HG3 LYS B 33 4.614 23.111 -0.136 1.00 0.00 H new ATOM 0 HD2 LYS B 33 7.326 23.334 1.218 1.00 0.00 H new ATOM 0 HD3 LYS B 33 6.004 24.478 1.342 1.00 0.00 H new ATOM 0 HE2 LYS B 33 5.854 21.596 2.318 1.00 0.00 H new ATOM 0 HE3 LYS B 33 6.284 22.955 3.338 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 4.090 22.874 3.759 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 4.003 23.860 2.379 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 3.688 22.196 2.254 1.00 0.00 H new ATOM 2135 N VAL B 34 8.085 19.041 0.402 1.00 0.00 N ATOM 2136 CA VAL B 34 8.326 17.633 0.604 1.00 0.00 C ATOM 2137 C VAL B 34 7.357 17.155 1.682 1.00 0.00 C ATOM 2138 O VAL B 34 7.085 17.883 2.644 1.00 0.00 O ATOM 2139 CB VAL B 34 9.815 17.468 0.956 1.00 0.00 C ATOM 2140 CG1 VAL B 34 10.260 18.206 2.230 1.00 0.00 C ATOM 2141 CG2 VAL B 34 10.215 15.998 1.066 1.00 0.00 C ATOM 0 H VAL B 34 8.347 19.602 1.213 1.00 0.00 H new ATOM 0 HA VAL B 34 8.143 17.018 -0.277 1.00 0.00 H new ATOM 0 HB VAL B 34 10.334 17.936 0.119 1.00 0.00 H new ATOM 0 HG11 VAL B 34 11.323 18.032 2.399 1.00 0.00 H new ATOM 0 HG12 VAL B 34 10.081 19.275 2.113 1.00 0.00 H new ATOM 0 HG13 VAL B 34 9.692 17.834 3.083 1.00 0.00 H new ATOM 0 HG21 VAL B 34 11.274 15.927 1.316 1.00 0.00 H new ATOM 0 HG22 VAL B 34 9.625 15.518 1.847 1.00 0.00 H new ATOM 0 HG23 VAL B 34 10.032 15.499 0.114 1.00 0.00 H new ATOM 2151 N TYR B 35 6.848 15.936 1.530 1.00 0.00 N ATOM 2152 CA TYR B 35 5.967 15.297 2.496 1.00 0.00 C ATOM 2153 C TYR B 35 6.344 13.819 2.579 1.00 0.00 C ATOM 2154 O TYR B 35 6.925 13.273 1.639 1.00 0.00 O ATOM 2155 CB TYR B 35 4.503 15.453 2.058 1.00 0.00 C ATOM 2156 CG TYR B 35 4.027 16.883 1.871 1.00 0.00 C ATOM 2157 CD1 TYR B 35 3.533 17.620 2.966 1.00 0.00 C ATOM 2158 CD2 TYR B 35 4.081 17.477 0.596 1.00 0.00 C ATOM 2159 CE1 TYR B 35 3.091 18.945 2.787 1.00 0.00 C ATOM 2160 CE2 TYR B 35 3.629 18.795 0.409 1.00 0.00 C ATOM 2161 CZ TYR B 35 3.130 19.536 1.504 1.00 0.00 C ATOM 2162 OH TYR B 35 2.699 20.819 1.328 1.00 0.00 O ATOM 0 H TYR B 35 7.042 15.355 0.714 1.00 0.00 H new ATOM 0 HA TYR B 35 6.077 15.764 3.475 1.00 0.00 H new ATOM 0 HB2 TYR B 35 4.363 14.916 1.120 1.00 0.00 H new ATOM 0 HB3 TYR B 35 3.866 14.970 2.800 1.00 0.00 H new ATOM 0 HD1 TYR B 35 3.493 17.167 3.946 1.00 0.00 H new ATOM 0 HD2 TYR B 35 4.471 16.918 -0.242 1.00 0.00 H new ATOM 0 HE1 TYR B 35 2.722 19.510 3.630 1.00 0.00 H new ATOM 0 HE2 TYR B 35 3.663 19.242 -0.573 1.00 0.00 H new ATOM 0 HH TYR B 35 2.795 21.070 0.386 1.00 0.00 H new ATOM 2172 N SER B 36 5.965 13.164 3.672 1.00 0.00 N ATOM 2173 CA SER B 36 6.291 11.774 3.934 1.00 0.00 C ATOM 2174 C SER B 36 5.075 11.097 4.549 1.00 0.00 C ATOM 2175 O SER B 36 4.370 11.706 5.360 1.00 0.00 O ATOM 2176 CB SER B 36 7.453 11.694 4.922 1.00 0.00 C ATOM 2177 OG SER B 36 8.600 12.392 4.500 1.00 0.00 O ATOM 0 H SER B 36 5.412 13.597 4.412 1.00 0.00 H new ATOM 0 HA SER B 36 6.572 11.282 3.003 1.00 0.00 H new ATOM 0 HB2 SER B 36 7.129 12.092 5.884 1.00 0.00 H new ATOM 0 HB3 SER B 36 7.713 10.647 5.081 1.00 0.00 H new ATOM 0 HG SER B 36 9.133 12.648 5.281 1.00 0.00 H new ATOM 2183 N ALA B 37 4.843 9.841 4.176 1.00 0.00 N ATOM 2184 CA ALA B 37 3.676 9.080 4.569 1.00 0.00 C ATOM 2185 C ALA B 37 3.975 7.584 4.471 1.00 0.00 C ATOM 2186 O ALA B 37 5.061 7.183 4.045 1.00 0.00 O ATOM 2187 CB ALA B 37 2.542 9.440 3.617 1.00 0.00 C ATOM 0 H ALA B 37 5.482 9.318 3.577 1.00 0.00 H new ATOM 0 HA ALA B 37 3.400 9.312 5.598 1.00 0.00 H new ATOM 0 HB1 ALA B 37 1.647 8.880 3.889 1.00 0.00 H new ATOM 0 HB2 ALA B 37 2.336 10.508 3.684 1.00 0.00 H new ATOM 0 HB3 ALA B 37 2.830 9.189 2.596 1.00 0.00 H new ATOM 2193 N GLY B 38 2.999 6.759 4.839 1.00 0.00 N ATOM 2194 CA GLY B 38 3.092 5.315 4.757 1.00 0.00 C ATOM 2195 C GLY B 38 1.849 4.659 5.342 1.00 0.00 C ATOM 2196 O GLY B 38 0.919 5.351 5.763 1.00 0.00 O ATOM 0 H GLY B 38 2.107 7.087 5.209 1.00 0.00 H new ATOM 0 HA2 GLY B 38 3.213 5.012 3.717 1.00 0.00 H new ATOM 0 HA3 GLY B 38 3.977 4.972 5.294 1.00 0.00 H new ATOM 2200 N ILE B 39 1.845 3.328 5.363 1.00 0.00 N ATOM 2201 CA ILE B 39 0.728 2.463 5.746 1.00 0.00 C ATOM 2202 C ILE B 39 -0.012 2.916 7.015 1.00 0.00 C ATOM 2203 O ILE B 39 -1.219 3.149 6.977 1.00 0.00 O ATOM 2204 CB ILE B 39 1.224 0.999 5.830 1.00 0.00 C ATOM 2205 CG1 ILE B 39 0.122 0.096 6.429 1.00 0.00 C ATOM 2206 CG2 ILE B 39 2.560 0.816 6.585 1.00 0.00 C ATOM 2207 CD1 ILE B 39 0.136 -1.340 5.904 1.00 0.00 C ATOM 0 H ILE B 39 2.670 2.791 5.097 1.00 0.00 H new ATOM 0 HA ILE B 39 -0.031 2.539 4.967 1.00 0.00 H new ATOM 0 HB ILE B 39 1.435 0.696 4.804 1.00 0.00 H new ATOM 0 HG12 ILE B 39 0.233 0.076 7.513 1.00 0.00 H new ATOM 0 HG13 ILE B 39 -0.851 0.539 6.217 1.00 0.00 H new ATOM 0 HG21 ILE B 39 2.831 -0.240 6.595 1.00 0.00 H new ATOM 0 HG22 ILE B 39 3.342 1.387 6.084 1.00 0.00 H new ATOM 0 HG23 ILE B 39 2.451 1.172 7.609 1.00 0.00 H new ATOM 0 HD11 ILE B 39 -0.668 -1.907 6.374 1.00 0.00 H new ATOM 0 HD12 ILE B 39 -0.008 -1.334 4.824 1.00 0.00 H new ATOM 0 HD13 ILE B 39 1.093 -1.804 6.140 1.00 0.00 H new ATOM 2219 N GLU B 40 0.712 3.036 8.128 1.00 0.00 N ATOM 2220 CA GLU B 40 0.181 3.370 9.453 1.00 0.00 C ATOM 2221 C GLU B 40 1.036 4.505 10.049 1.00 0.00 C ATOM 2222 O GLU B 40 1.274 4.593 11.254 1.00 0.00 O ATOM 2223 CB GLU B 40 0.090 2.105 10.334 1.00 0.00 C ATOM 2224 CG GLU B 40 1.408 1.332 10.542 1.00 0.00 C ATOM 2225 CD GLU B 40 1.274 0.295 11.672 1.00 0.00 C ATOM 2226 OE1 GLU B 40 0.762 -0.822 11.428 1.00 0.00 O ATOM 2227 OE2 GLU B 40 1.698 0.574 12.817 1.00 0.00 O ATOM 0 H GLU B 40 1.723 2.898 8.133 1.00 0.00 H new ATOM 0 HA GLU B 40 -0.842 3.740 9.389 1.00 0.00 H new ATOM 0 HB2 GLU B 40 -0.297 2.394 11.311 1.00 0.00 H new ATOM 0 HB3 GLU B 40 -0.639 1.428 9.889 1.00 0.00 H new ATOM 0 HG2 GLU B 40 1.688 0.830 9.616 1.00 0.00 H new ATOM 0 HG3 GLU B 40 2.209 2.032 10.780 1.00 0.00 H new ATOM 2234 N ALA B 41 1.578 5.326 9.146 1.00 0.00 N ATOM 2235 CA ALA B 41 2.580 6.339 9.397 1.00 0.00 C ATOM 2236 C ALA B 41 2.096 7.484 10.286 1.00 0.00 C ATOM 2237 O ALA B 41 0.908 7.806 10.291 1.00 0.00 O ATOM 2238 CB ALA B 41 3.016 6.857 8.032 1.00 0.00 C ATOM 0 H ALA B 41 1.306 5.291 8.164 1.00 0.00 H new ATOM 0 HA ALA B 41 3.405 5.895 9.954 1.00 0.00 H new ATOM 0 HB1 ALA B 41 3.776 7.628 8.161 1.00 0.00 H new ATOM 0 HB2 ALA B 41 3.429 6.036 7.446 1.00 0.00 H new ATOM 0 HB3 ALA B 41 2.156 7.278 7.511 1.00 0.00 H new ATOM 2244 N HIS B 42 3.067 8.098 10.979 1.00 0.00 N ATOM 2245 CA HIS B 42 2.997 9.167 11.975 1.00 0.00 C ATOM 2246 C HIS B 42 4.045 8.783 13.017 1.00 0.00 C ATOM 2247 O HIS B 42 3.839 7.831 13.777 1.00 0.00 O ATOM 2248 CB HIS B 42 1.605 9.365 12.613 1.00 0.00 C ATOM 2249 CG HIS B 42 1.592 10.331 13.771 1.00 0.00 C ATOM 2250 ND1 HIS B 42 1.543 11.701 13.680 1.00 0.00 N ATOM 2251 CD2 HIS B 42 1.599 10.014 15.103 1.00 0.00 C ATOM 2252 CE1 HIS B 42 1.525 12.204 14.924 1.00 0.00 C ATOM 2253 NE2 HIS B 42 1.559 11.210 15.835 1.00 0.00 N ATOM 0 H HIS B 42 4.037 7.819 10.833 1.00 0.00 H new ATOM 0 HA HIS B 42 3.186 10.133 11.506 1.00 0.00 H new ATOM 0 HB2 HIS B 42 0.914 9.721 11.849 1.00 0.00 H new ATOM 0 HB3 HIS B 42 1.233 8.399 12.955 1.00 0.00 H new ATOM 0 HD1 HIS B 42 1.524 12.242 12.816 1.00 0.00 H new ATOM 0 HD2 HIS B 42 1.630 9.017 15.518 1.00 0.00 H new ATOM 0 HE1 HIS B 42 1.488 13.257 15.162 1.00 0.00 H new ATOM 2261 N GLY B 43 5.194 9.458 13.017 1.00 0.00 N ATOM 2262 CA GLY B 43 6.328 9.060 13.833 1.00 0.00 C ATOM 2263 C GLY B 43 7.504 10.016 13.656 1.00 0.00 C ATOM 2264 O GLY B 43 7.427 10.950 12.853 1.00 0.00 O ATOM 0 H GLY B 43 5.359 10.291 12.452 1.00 0.00 H new ATOM 0 HA2 GLY B 43 6.032 9.035 14.882 1.00 0.00 H new ATOM 0 HA3 GLY B 43 6.635 8.049 13.564 1.00 0.00 H new ATOM 2268 N LEU B 44 8.579 9.776 14.412 1.00 0.00 N ATOM 2269 CA LEU B 44 9.890 10.412 14.280 1.00 0.00 C ATOM 2270 C LEU B 44 10.882 9.537 15.050 1.00 0.00 C ATOM 2271 O LEU B 44 10.984 9.649 16.274 1.00 0.00 O ATOM 2272 CB LEU B 44 9.884 11.859 14.819 1.00 0.00 C ATOM 2273 CG LEU B 44 11.284 12.514 14.864 1.00 0.00 C ATOM 2274 CD1 LEU B 44 11.966 12.526 13.492 1.00 0.00 C ATOM 2275 CD2 LEU B 44 11.183 13.948 15.388 1.00 0.00 C ATOM 0 H LEU B 44 8.555 9.097 15.172 1.00 0.00 H new ATOM 0 HA LEU B 44 10.171 10.489 13.230 1.00 0.00 H new ATOM 0 HB2 LEU B 44 9.229 12.467 14.195 1.00 0.00 H new ATOM 0 HB3 LEU B 44 9.460 11.861 15.823 1.00 0.00 H new ATOM 0 HG LEU B 44 11.893 11.911 15.537 1.00 0.00 H new ATOM 0 HD11 LEU B 44 12.946 12.996 13.577 1.00 0.00 H new ATOM 0 HD12 LEU B 44 12.084 11.503 13.135 1.00 0.00 H new ATOM 0 HD13 LEU B 44 11.354 13.088 12.786 1.00 0.00 H new ATOM 0 HD21 LEU B 44 12.176 14.397 15.414 1.00 0.00 H new ATOM 0 HD22 LEU B 44 10.539 14.531 14.730 1.00 0.00 H new ATOM 0 HD23 LEU B 44 10.762 13.939 16.393 1.00 0.00 H new ATOM 2287 N ASN B 45 11.562 8.616 14.365 1.00 0.00 N ATOM 2288 CA ASN B 45 12.555 7.749 14.995 1.00 0.00 C ATOM 2289 C ASN B 45 13.773 8.597 15.402 1.00 0.00 C ATOM 2290 O ASN B 45 14.349 9.276 14.540 1.00 0.00 O ATOM 2291 CB ASN B 45 12.943 6.619 14.021 1.00 0.00 C ATOM 2292 CG ASN B 45 13.779 5.512 14.665 1.00 0.00 C ATOM 2293 OD1 ASN B 45 14.476 5.728 15.649 1.00 0.00 O ATOM 2294 ND2 ASN B 45 13.723 4.297 14.138 1.00 0.00 N ATOM 0 H ASN B 45 11.440 8.452 13.366 1.00 0.00 H new ATOM 0 HA ASN B 45 12.146 7.286 15.893 1.00 0.00 H new ATOM 0 HB2 ASN B 45 12.035 6.182 13.606 1.00 0.00 H new ATOM 0 HB3 ASN B 45 13.501 7.045 13.188 1.00 0.00 H new ATOM 0 HD21 ASN B 45 14.262 3.536 14.552 1.00 0.00 H new ATOM 0 HD22 ASN B 45 13.141 4.123 13.319 1.00 0.00 H new ATOM 2301 N PRO B 46 14.228 8.563 16.670 1.00 0.00 N ATOM 2302 CA PRO B 46 15.423 9.291 17.082 1.00 0.00 C ATOM 2303 C PRO B 46 16.677 8.861 16.312 1.00 0.00 C ATOM 2304 O PRO B 46 17.619 9.645 16.210 1.00 0.00 O ATOM 2305 CB PRO B 46 15.555 9.082 18.595 1.00 0.00 C ATOM 2306 CG PRO B 46 14.756 7.808 18.859 1.00 0.00 C ATOM 2307 CD PRO B 46 13.647 7.871 17.813 1.00 0.00 C ATOM 0 HA PRO B 46 15.325 10.351 16.848 1.00 0.00 H new ATOM 0 HB2 PRO B 46 16.597 8.969 18.894 1.00 0.00 H new ATOM 0 HB3 PRO B 46 15.153 9.928 19.152 1.00 0.00 H new ATOM 0 HG2 PRO B 46 15.370 6.915 18.742 1.00 0.00 H new ATOM 0 HG3 PRO B 46 14.354 7.787 19.872 1.00 0.00 H new ATOM 0 HD2 PRO B 46 13.311 6.872 17.537 1.00 0.00 H new ATOM 0 HD3 PRO B 46 12.777 8.406 18.195 1.00 0.00 H new ATOM 2315 N ASN B 47 16.701 7.668 15.704 1.00 0.00 N ATOM 2316 CA ASN B 47 17.782 7.266 14.818 1.00 0.00 C ATOM 2317 C ASN B 47 17.867 8.186 13.594 1.00 0.00 C ATOM 2318 O ASN B 47 18.966 8.500 13.148 1.00 0.00 O ATOM 2319 CB ASN B 47 17.595 5.798 14.404 1.00 0.00 C ATOM 2320 CG ASN B 47 17.098 5.638 12.976 1.00 0.00 C ATOM 2321 OD1 ASN B 47 15.928 5.833 12.684 1.00 0.00 O ATOM 2322 ND2 ASN B 47 17.986 5.367 12.048 1.00 0.00 N ATOM 0 H ASN B 47 15.972 6.963 15.817 1.00 0.00 H new ATOM 0 HA ASN B 47 18.727 7.358 15.353 1.00 0.00 H new ATOM 0 HB2 ASN B 47 18.544 5.273 14.513 1.00 0.00 H new ATOM 0 HB3 ASN B 47 16.888 5.323 15.084 1.00 0.00 H new ATOM 0 HD21 ASN B 47 17.702 5.317 11.070 1.00 0.00 H new ATOM 0 HD22 ASN B 47 18.960 5.206 12.305 1.00 0.00 H new ATOM 2329 N ALA B 48 16.728 8.634 13.059 1.00 0.00 N ATOM 2330 CA ALA B 48 16.692 9.515 11.902 1.00 0.00 C ATOM 2331 C ALA B 48 17.115 10.918 12.317 1.00 0.00 C ATOM 2332 O ALA B 48 17.781 11.617 11.555 1.00 0.00 O ATOM 2333 CB ALA B 48 15.281 9.537 11.318 1.00 0.00 C ATOM 0 H ALA B 48 15.806 8.392 13.421 1.00 0.00 H new ATOM 0 HA ALA B 48 17.382 9.149 11.141 1.00 0.00 H new ATOM 0 HB1 ALA B 48 15.256 10.198 10.451 1.00 0.00 H new ATOM 0 HB2 ALA B 48 14.997 8.529 11.014 1.00 0.00 H new ATOM 0 HB3 ALA B 48 14.581 9.900 12.071 1.00 0.00 H new ATOM 2339 N VAL B 49 16.765 11.311 13.545 1.00 0.00 N ATOM 2340 CA VAL B 49 17.274 12.548 14.133 1.00 0.00 C ATOM 2341 C VAL B 49 18.805 12.455 14.184 1.00 0.00 C ATOM 2342 O VAL B 49 19.479 13.318 13.628 1.00 0.00 O ATOM 2343 CB VAL B 49 16.644 12.839 15.517 1.00 0.00 C ATOM 2344 CG1 VAL B 49 17.067 14.224 16.030 1.00 0.00 C ATOM 2345 CG2 VAL B 49 15.107 12.795 15.495 1.00 0.00 C ATOM 0 H VAL B 49 16.131 10.789 14.149 1.00 0.00 H new ATOM 0 HA VAL B 49 16.988 13.398 13.513 1.00 0.00 H new ATOM 0 HB VAL B 49 17.009 12.052 16.177 1.00 0.00 H new ATOM 0 HG11 VAL B 49 16.612 14.406 17.004 1.00 0.00 H new ATOM 0 HG12 VAL B 49 18.152 14.261 16.124 1.00 0.00 H new ATOM 0 HG13 VAL B 49 16.737 14.989 15.327 1.00 0.00 H new ATOM 0 HG21 VAL B 49 14.723 13.007 16.493 1.00 0.00 H new ATOM 0 HG22 VAL B 49 14.732 13.542 14.796 1.00 0.00 H new ATOM 0 HG23 VAL B 49 14.776 11.805 15.181 1.00 0.00 H new ATOM 2355 N LYS B 50 19.369 11.382 14.752 1.00 0.00 N ATOM 2356 CA LYS B 50 20.820 11.190 14.828 1.00 0.00 C ATOM 2357 C LYS B 50 21.442 11.248 13.435 1.00 0.00 C ATOM 2358 O LYS B 50 22.420 11.965 13.231 1.00 0.00 O ATOM 2359 CB LYS B 50 21.136 9.866 15.549 1.00 0.00 C ATOM 2360 CG LYS B 50 22.645 9.575 15.602 1.00 0.00 C ATOM 2361 CD LYS B 50 22.946 8.286 16.379 1.00 0.00 C ATOM 2362 CE LYS B 50 24.436 7.908 16.329 1.00 0.00 C ATOM 2363 NZ LYS B 50 25.299 8.857 17.079 1.00 0.00 N ATOM 0 H LYS B 50 18.831 10.623 15.171 1.00 0.00 H new ATOM 0 HA LYS B 50 21.262 11.999 15.409 1.00 0.00 H new ATOM 0 HB2 LYS B 50 20.740 9.904 16.564 1.00 0.00 H new ATOM 0 HB3 LYS B 50 20.628 9.047 15.039 1.00 0.00 H new ATOM 0 HG2 LYS B 50 23.035 9.488 14.588 1.00 0.00 H new ATOM 0 HG3 LYS B 50 23.161 10.412 16.072 1.00 0.00 H new ATOM 0 HD2 LYS B 50 22.640 8.411 17.418 1.00 0.00 H new ATOM 0 HD3 LYS B 50 22.352 7.470 15.968 1.00 0.00 H new ATOM 0 HE2 LYS B 50 24.565 6.906 16.738 1.00 0.00 H new ATOM 0 HE3 LYS B 50 24.762 7.872 15.289 1.00 0.00 H new ATOM 0 HZ1 LYS B 50 26.298 8.602 16.941 1.00 0.00 H new ATOM 0 HZ2 LYS B 50 25.137 9.823 16.730 1.00 0.00 H new ATOM 0 HZ3 LYS B 50 25.067 8.811 18.092 1.00 0.00 H new ATOM 2377 N ALA B 51 20.845 10.547 12.473 1.00 0.00 N ATOM 2378 CA ALA B 51 21.301 10.507 11.095 1.00 0.00 C ATOM 2379 C ALA B 51 21.388 11.914 10.480 1.00 0.00 C ATOM 2380 O ALA B 51 22.253 12.163 9.642 1.00 0.00 O ATOM 2381 CB ALA B 51 20.337 9.633 10.293 1.00 0.00 C ATOM 0 H ALA B 51 20.013 9.980 12.639 1.00 0.00 H new ATOM 0 HA ALA B 51 22.307 10.087 11.067 1.00 0.00 H new ATOM 0 HB1 ALA B 51 20.663 9.591 9.254 1.00 0.00 H new ATOM 0 HB2 ALA B 51 20.325 8.626 10.711 1.00 0.00 H new ATOM 0 HB3 ALA B 51 19.334 10.058 10.342 1.00 0.00 H new ATOM 2387 N MET B 52 20.514 12.842 10.883 1.00 0.00 N ATOM 2388 CA MET B 52 20.527 14.220 10.416 1.00 0.00 C ATOM 2389 C MET B 52 21.555 15.040 11.183 1.00 0.00 C ATOM 2390 O MET B 52 22.253 15.855 10.579 1.00 0.00 O ATOM 2391 CB MET B 52 19.131 14.836 10.594 1.00 0.00 C ATOM 2392 CG MET B 52 18.079 14.208 9.680 1.00 0.00 C ATOM 2393 SD MET B 52 17.734 15.151 8.176 1.00 0.00 S ATOM 2394 CE MET B 52 19.299 15.001 7.285 1.00 0.00 C ATOM 0 H MET B 52 19.769 12.648 11.553 1.00 0.00 H new ATOM 0 HA MET B 52 20.799 14.228 9.361 1.00 0.00 H new ATOM 0 HB2 MET B 52 18.818 14.720 11.632 1.00 0.00 H new ATOM 0 HB3 MET B 52 19.184 15.906 10.395 1.00 0.00 H new ATOM 0 HG2 MET B 52 18.410 13.208 9.399 1.00 0.00 H new ATOM 0 HG3 MET B 52 17.152 14.091 10.241 1.00 0.00 H new ATOM 0 HE1 MET B 52 19.187 15.411 6.281 1.00 0.00 H new ATOM 0 HE2 MET B 52 20.075 15.551 7.817 1.00 0.00 H new ATOM 0 HE3 MET B 52 19.580 13.950 7.218 1.00 0.00 H new ATOM 2404 N LYS B 53 21.705 14.816 12.492 1.00 0.00 N ATOM 2405 CA LYS B 53 22.694 15.527 13.298 1.00 0.00 C ATOM 2406 C LYS B 53 24.113 15.210 12.828 1.00 0.00 C ATOM 2407 O LYS B 53 24.976 16.076 12.955 1.00 0.00 O ATOM 2408 CB LYS B 53 22.534 15.190 14.794 1.00 0.00 C ATOM 2409 CG LYS B 53 21.179 15.585 15.408 1.00 0.00 C ATOM 2410 CD LYS B 53 20.995 17.089 15.649 1.00 0.00 C ATOM 2411 CE LYS B 53 19.538 17.327 16.072 1.00 0.00 C ATOM 2412 NZ LYS B 53 19.283 18.721 16.508 1.00 0.00 N ATOM 0 H LYS B 53 21.148 14.142 13.017 1.00 0.00 H new ATOM 0 HA LYS B 53 22.521 16.595 13.168 1.00 0.00 H new ATOM 0 HB2 LYS B 53 22.677 14.118 14.927 1.00 0.00 H new ATOM 0 HB3 LYS B 53 23.327 15.689 15.350 1.00 0.00 H new ATOM 0 HG2 LYS B 53 20.383 15.237 14.750 1.00 0.00 H new ATOM 0 HG3 LYS B 53 21.060 15.062 16.357 1.00 0.00 H new ATOM 0 HD2 LYS B 53 21.678 17.437 16.423 1.00 0.00 H new ATOM 0 HD3 LYS B 53 21.226 17.651 14.744 1.00 0.00 H new ATOM 0 HE2 LYS B 53 18.879 17.087 15.238 1.00 0.00 H new ATOM 0 HE3 LYS B 53 19.285 16.646 16.884 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 18.297 18.976 16.298 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 19.451 18.801 17.531 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 19.923 19.366 16.001 1.00 0.00 H new ATOM 2426 N GLU B 54 24.363 14.036 12.227 1.00 0.00 N ATOM 2427 CA GLU B 54 25.660 13.721 11.614 1.00 0.00 C ATOM 2428 C GLU B 54 26.072 14.776 10.575 1.00 0.00 C ATOM 2429 O GLU B 54 27.261 15.062 10.431 1.00 0.00 O ATOM 2430 CB GLU B 54 25.650 12.352 10.919 1.00 0.00 C ATOM 2431 CG GLU B 54 25.609 11.130 11.843 1.00 0.00 C ATOM 2432 CD GLU B 54 25.900 9.865 11.024 1.00 0.00 C ATOM 2433 OE1 GLU B 54 27.089 9.592 10.720 1.00 0.00 O ATOM 2434 OE2 GLU B 54 24.954 9.202 10.556 1.00 0.00 O ATOM 0 H GLU B 54 23.677 13.285 12.153 1.00 0.00 H new ATOM 0 HA GLU B 54 26.377 13.710 12.435 1.00 0.00 H new ATOM 0 HB2 GLU B 54 24.786 12.310 10.255 1.00 0.00 H new ATOM 0 HB3 GLU B 54 26.538 12.279 10.292 1.00 0.00 H new ATOM 0 HG2 GLU B 54 26.344 11.238 12.641 1.00 0.00 H new ATOM 0 HG3 GLU B 54 24.631 11.052 12.319 1.00 0.00 H new ATOM 2441 N VAL B 55 25.099 15.370 9.879 1.00 0.00 N ATOM 2442 CA VAL B 55 25.304 16.394 8.854 1.00 0.00 C ATOM 2443 C VAL B 55 24.761 17.756 9.318 1.00 0.00 C ATOM 2444 O VAL B 55 24.628 18.684 8.517 1.00 0.00 O ATOM 2445 CB VAL B 55 24.736 15.902 7.503 1.00 0.00 C ATOM 2446 CG1 VAL B 55 25.529 14.675 7.025 1.00 0.00 C ATOM 2447 CG2 VAL B 55 23.238 15.550 7.553 1.00 0.00 C ATOM 0 H VAL B 55 24.115 15.143 10.019 1.00 0.00 H new ATOM 0 HA VAL B 55 26.370 16.558 8.695 1.00 0.00 H new ATOM 0 HB VAL B 55 24.841 16.733 6.805 1.00 0.00 H new ATOM 0 HG11 VAL B 55 25.127 14.330 6.073 1.00 0.00 H new ATOM 0 HG12 VAL B 55 26.577 14.946 6.899 1.00 0.00 H new ATOM 0 HG13 VAL B 55 25.446 13.878 7.764 1.00 0.00 H new ATOM 0 HG21 VAL B 55 22.910 15.213 6.570 1.00 0.00 H new ATOM 0 HG22 VAL B 55 23.075 14.756 8.282 1.00 0.00 H new ATOM 0 HG23 VAL B 55 22.667 16.432 7.843 1.00 0.00 H new ATOM 2457 N GLY B 56 24.481 17.896 10.619 1.00 0.00 N ATOM 2458 CA GLY B 56 24.053 19.138 11.237 1.00 0.00 C ATOM 2459 C GLY B 56 22.706 19.635 10.716 1.00 0.00 C ATOM 2460 O GLY B 56 22.534 20.851 10.602 1.00 0.00 O ATOM 0 H GLY B 56 24.550 17.123 11.281 1.00 0.00 H new ATOM 0 HA2 GLY B 56 23.988 18.996 12.316 1.00 0.00 H new ATOM 0 HA3 GLY B 56 24.809 19.904 11.061 1.00 0.00 H new ATOM 2464 N ILE B 57 21.758 18.742 10.398 1.00 0.00 N ATOM 2465 CA ILE B 57 20.383 19.141 10.099 1.00 0.00 C ATOM 2466 C ILE B 57 19.580 18.751 11.342 1.00 0.00 C ATOM 2467 O ILE B 57 19.883 17.752 12.001 1.00 0.00 O ATOM 2468 CB ILE B 57 19.900 18.513 8.763 1.00 0.00 C ATOM 2469 CG1 ILE B 57 20.790 19.026 7.602 1.00 0.00 C ATOM 2470 CG2 ILE B 57 18.415 18.815 8.457 1.00 0.00 C ATOM 2471 CD1 ILE B 57 20.521 18.391 6.233 1.00 0.00 C ATOM 0 H ILE B 57 21.923 17.737 10.342 1.00 0.00 H new ATOM 0 HA ILE B 57 20.263 20.209 9.920 1.00 0.00 H new ATOM 0 HB ILE B 57 19.988 17.431 8.864 1.00 0.00 H new ATOM 0 HG12 ILE B 57 20.657 20.104 7.515 1.00 0.00 H new ATOM 0 HG13 ILE B 57 21.834 18.853 7.864 1.00 0.00 H new ATOM 0 HG21 ILE B 57 18.137 18.350 7.511 1.00 0.00 H new ATOM 0 HG22 ILE B 57 17.790 18.415 9.256 1.00 0.00 H new ATOM 0 HG23 ILE B 57 18.270 19.893 8.388 1.00 0.00 H new ATOM 0 HD11 ILE B 57 21.197 18.820 5.494 1.00 0.00 H new ATOM 0 HD12 ILE B 57 20.685 17.315 6.293 1.00 0.00 H new ATOM 0 HD13 ILE B 57 19.490 18.585 5.938 1.00 0.00 H new ATOM 2483 N ASP B 58 18.571 19.549 11.684 1.00 0.00 N ATOM 2484 CA ASP B 58 17.698 19.298 12.824 1.00 0.00 C ATOM 2485 C ASP B 58 16.295 19.026 12.313 1.00 0.00 C ATOM 2486 O ASP B 58 15.795 19.744 11.443 1.00 0.00 O ATOM 2487 CB ASP B 58 17.667 20.488 13.789 1.00 0.00 C ATOM 2488 CG ASP B 58 16.634 20.231 14.898 1.00 0.00 C ATOM 2489 OD1 ASP B 58 16.686 19.130 15.499 1.00 0.00 O ATOM 2490 OD2 ASP B 58 15.779 21.105 15.155 1.00 0.00 O ATOM 0 H ASP B 58 18.335 20.398 11.170 1.00 0.00 H new ATOM 0 HA ASP B 58 18.084 18.438 13.371 1.00 0.00 H new ATOM 0 HB2 ASP B 58 18.654 20.639 14.226 1.00 0.00 H new ATOM 0 HB3 ASP B 58 17.415 21.400 13.248 1.00 0.00 H new ATOM 2495 N ILE B 59 15.665 18.005 12.886 1.00 0.00 N ATOM 2496 CA ILE B 59 14.298 17.603 12.592 1.00 0.00 C ATOM 2497 C ILE B 59 13.553 17.244 13.878 1.00 0.00 C ATOM 2498 O ILE B 59 12.532 16.565 13.813 1.00 0.00 O ATOM 2499 CB ILE B 59 14.264 16.433 11.589 1.00 0.00 C ATOM 2500 CG1 ILE B 59 14.988 15.173 12.118 1.00 0.00 C ATOM 2501 CG2 ILE B 59 14.866 16.845 10.236 1.00 0.00 C ATOM 2502 CD1 ILE B 59 14.613 13.915 11.333 1.00 0.00 C ATOM 0 H ILE B 59 16.109 17.417 13.591 1.00 0.00 H new ATOM 0 HA ILE B 59 13.791 18.449 12.129 1.00 0.00 H new ATOM 0 HB ILE B 59 13.212 16.180 11.455 1.00 0.00 H new ATOM 0 HG12 ILE B 59 16.066 15.326 12.062 1.00 0.00 H new ATOM 0 HG13 ILE B 59 14.741 15.029 13.170 1.00 0.00 H new ATOM 0 HG21 ILE B 59 14.829 16.000 9.549 1.00 0.00 H new ATOM 0 HG22 ILE B 59 14.295 17.676 9.821 1.00 0.00 H new ATOM 0 HG23 ILE B 59 15.902 17.152 10.377 1.00 0.00 H new ATOM 0 HD11 ILE B 59 15.147 13.058 11.743 1.00 0.00 H new ATOM 0 HD12 ILE B 59 13.539 13.744 11.411 1.00 0.00 H new ATOM 0 HD13 ILE B 59 14.885 14.045 10.286 1.00 0.00 H new ATOM 2514 N SER B 60 14.047 17.652 15.051 1.00 0.00 N ATOM 2515 CA SER B 60 13.505 17.196 16.327 1.00 0.00 C ATOM 2516 C SER B 60 12.016 17.560 16.526 1.00 0.00 C ATOM 2517 O SER B 60 11.361 17.019 17.417 1.00 0.00 O ATOM 2518 CB SER B 60 14.374 17.746 17.466 1.00 0.00 C ATOM 2519 OG SER B 60 15.747 17.457 17.250 1.00 0.00 O ATOM 0 H SER B 60 14.828 18.303 15.139 1.00 0.00 H new ATOM 0 HA SER B 60 13.536 16.106 16.331 1.00 0.00 H new ATOM 0 HB2 SER B 60 14.235 18.824 17.545 1.00 0.00 H new ATOM 0 HB3 SER B 60 14.053 17.313 18.413 1.00 0.00 H new ATOM 0 HG SER B 60 16.113 18.081 16.589 1.00 0.00 H new ATOM 2525 N ASN B 61 11.476 18.463 15.695 1.00 0.00 N ATOM 2526 CA ASN B 61 10.086 18.898 15.698 1.00 0.00 C ATOM 2527 C ASN B 61 9.189 18.073 14.756 1.00 0.00 C ATOM 2528 O ASN B 61 7.965 18.199 14.835 1.00 0.00 O ATOM 2529 CB ASN B 61 10.047 20.384 15.297 1.00 0.00 C ATOM 2530 CG ASN B 61 8.635 20.965 15.348 1.00 0.00 C ATOM 2531 OD1 ASN B 61 8.037 21.081 16.414 1.00 0.00 O ATOM 2532 ND2 ASN B 61 8.082 21.356 14.211 1.00 0.00 N ATOM 0 H ASN B 61 12.027 18.926 14.973 1.00 0.00 H new ATOM 0 HA ASN B 61 9.688 18.748 16.702 1.00 0.00 H new ATOM 0 HB2 ASN B 61 10.696 20.954 15.962 1.00 0.00 H new ATOM 0 HB3 ASN B 61 10.447 20.496 14.289 1.00 0.00 H new ATOM 0 HD21 ASN B 61 7.146 21.761 14.212 1.00 0.00 H new ATOM 0 HD22 ASN B 61 8.592 21.253 13.334 1.00 0.00 H new ATOM 2539 N GLN B 62 9.753 17.274 13.837 1.00 0.00 N ATOM 2540 CA GLN B 62 8.999 16.611 12.782 1.00 0.00 C ATOM 2541 C GLN B 62 7.911 15.685 13.335 1.00 0.00 C ATOM 2542 O GLN B 62 8.027 15.094 14.411 1.00 0.00 O ATOM 2543 CB GLN B 62 9.918 15.871 11.793 1.00 0.00 C ATOM 2544 CG GLN B 62 10.415 16.852 10.719 1.00 0.00 C ATOM 2545 CD GLN B 62 11.339 16.252 9.657 1.00 0.00 C ATOM 2546 OE1 GLN B 62 12.009 16.998 8.952 1.00 0.00 O ATOM 2547 NE2 GLN B 62 11.433 14.938 9.506 1.00 0.00 N ATOM 0 H GLN B 62 10.753 17.074 13.812 1.00 0.00 H new ATOM 0 HA GLN B 62 8.492 17.400 12.227 1.00 0.00 H new ATOM 0 HB2 GLN B 62 10.765 15.437 12.323 1.00 0.00 H new ATOM 0 HB3 GLN B 62 9.378 15.047 11.326 1.00 0.00 H new ATOM 0 HG2 GLN B 62 9.549 17.286 10.219 1.00 0.00 H new ATOM 0 HG3 GLN B 62 10.940 17.669 11.213 1.00 0.00 H new ATOM 0 HE21 GLN B 62 10.876 14.316 10.092 1.00 0.00 H new ATOM 0 HE22 GLN B 62 12.062 14.549 8.804 1.00 0.00 H new ATOM 2556 N THR B 63 6.866 15.543 12.531 1.00 0.00 N ATOM 2557 CA THR B 63 5.774 14.598 12.689 1.00 0.00 C ATOM 2558 C THR B 63 5.219 14.309 11.284 1.00 0.00 C ATOM 2559 O THR B 63 5.638 14.945 10.307 1.00 0.00 O ATOM 2560 CB THR B 63 4.742 15.159 13.690 1.00 0.00 C ATOM 2561 OG1 THR B 63 3.824 14.151 14.060 1.00 0.00 O ATOM 2562 CG2 THR B 63 3.955 16.368 13.168 1.00 0.00 C ATOM 0 H THR B 63 6.753 16.122 11.699 1.00 0.00 H new ATOM 0 HA THR B 63 6.093 13.648 13.118 1.00 0.00 H new ATOM 0 HB THR B 63 5.324 15.499 14.546 1.00 0.00 H new ATOM 0 HG1 THR B 63 3.175 14.517 14.696 1.00 0.00 H new ATOM 0 HG21 THR B 63 3.252 16.701 13.931 1.00 0.00 H new ATOM 0 HG22 THR B 63 4.646 17.178 12.933 1.00 0.00 H new ATOM 0 HG23 THR B 63 3.408 16.085 12.269 1.00 0.00 H new ATOM 2570 N SER B 64 4.313 13.337 11.154 1.00 0.00 N ATOM 2571 CA SER B 64 3.863 12.809 9.865 1.00 0.00 C ATOM 2572 C SER B 64 2.443 12.228 9.972 1.00 0.00 C ATOM 2573 O SER B 64 1.755 12.463 10.969 1.00 0.00 O ATOM 2574 CB SER B 64 4.870 11.756 9.386 1.00 0.00 C ATOM 2575 OG SER B 64 6.213 12.218 9.443 1.00 0.00 O ATOM 0 H SER B 64 3.865 12.888 11.953 1.00 0.00 H new ATOM 0 HA SER B 64 3.816 13.616 9.134 1.00 0.00 H new ATOM 0 HB2 SER B 64 4.772 10.860 9.998 1.00 0.00 H new ATOM 0 HB3 SER B 64 4.631 11.470 8.362 1.00 0.00 H new ATOM 0 HG SER B 64 6.399 12.781 8.663 1.00 0.00 H new ATOM 2581 N ASP B 65 1.991 11.490 8.953 1.00 0.00 N ATOM 2582 CA ASP B 65 0.617 11.011 8.785 1.00 0.00 C ATOM 2583 C ASP B 65 0.603 9.819 7.819 1.00 0.00 C ATOM 2584 O ASP B 65 1.610 9.568 7.154 1.00 0.00 O ATOM 2585 CB ASP B 65 -0.226 12.149 8.189 1.00 0.00 C ATOM 2586 CG ASP B 65 -1.731 11.838 8.165 1.00 0.00 C ATOM 2587 OD1 ASP B 65 -2.212 11.083 9.038 1.00 0.00 O ATOM 2588 OD2 ASP B 65 -2.445 12.387 7.296 1.00 0.00 O ATOM 0 H ASP B 65 2.601 11.198 8.189 1.00 0.00 H new ATOM 0 HA ASP B 65 0.211 10.701 9.748 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -0.058 13.058 8.767 1.00 0.00 H new ATOM 0 HB3 ASP B 65 0.113 12.350 7.173 1.00 0.00 H new ATOM 2593 N ILE B 66 -0.516 9.095 7.714 1.00 0.00 N ATOM 2594 CA ILE B 66 -0.720 7.996 6.775 1.00 0.00 C ATOM 2595 C ILE B 66 -0.738 8.477 5.316 1.00 0.00 C ATOM 2596 O ILE B 66 -0.749 9.684 5.060 1.00 0.00 O ATOM 2597 CB ILE B 66 -2.024 7.253 7.131 1.00 0.00 C ATOM 2598 CG1 ILE B 66 -3.236 8.204 7.176 1.00 0.00 C ATOM 2599 CG2 ILE B 66 -1.826 6.498 8.450 1.00 0.00 C ATOM 2600 CD1 ILE B 66 -4.577 7.486 7.328 1.00 0.00 C ATOM 0 H ILE B 66 -1.331 9.267 8.303 1.00 0.00 H new ATOM 0 HA ILE B 66 0.122 7.310 6.864 1.00 0.00 H new ATOM 0 HB ILE B 66 -2.248 6.531 6.346 1.00 0.00 H new ATOM 0 HG12 ILE B 66 -3.110 8.899 8.006 1.00 0.00 H new ATOM 0 HG13 ILE B 66 -3.254 8.798 6.263 1.00 0.00 H new ATOM 0 HG21 ILE B 66 -2.744 5.970 8.708 1.00 0.00 H new ATOM 0 HG22 ILE B 66 -1.013 5.780 8.340 1.00 0.00 H new ATOM 0 HG23 ILE B 66 -1.580 7.206 9.241 1.00 0.00 H new ATOM 0 HD11 ILE B 66 -5.382 8.220 7.352 1.00 0.00 H new ATOM 0 HD12 ILE B 66 -4.726 6.811 6.485 1.00 0.00 H new ATOM 0 HD13 ILE B 66 -4.580 6.914 8.256 1.00 0.00 H new ATOM 2612 N ILE B 67 -0.764 7.526 4.368 1.00 0.00 N ATOM 2613 CA ILE B 67 -0.962 7.804 2.948 1.00 0.00 C ATOM 2614 C ILE B 67 -2.171 8.745 2.801 1.00 0.00 C ATOM 2615 O ILE B 67 -3.221 8.516 3.411 1.00 0.00 O ATOM 2616 CB ILE B 67 -1.042 6.511 2.072 1.00 0.00 C ATOM 2617 CG1 ILE B 67 -2.486 6.014 1.803 1.00 0.00 C ATOM 2618 CG2 ILE B 67 -0.138 5.374 2.597 1.00 0.00 C ATOM 2619 CD1 ILE B 67 -2.632 4.841 0.822 1.00 0.00 C ATOM 0 H ILE B 67 -0.646 6.534 4.575 1.00 0.00 H new ATOM 0 HA ILE B 67 -0.083 8.313 2.551 1.00 0.00 H new ATOM 0 HB ILE B 67 -0.649 6.818 1.103 1.00 0.00 H new ATOM 0 HG12 ILE B 67 -2.929 5.721 2.755 1.00 0.00 H new ATOM 0 HG13 ILE B 67 -3.071 6.852 1.423 1.00 0.00 H new ATOM 0 HG21 ILE B 67 -0.236 4.503 1.949 1.00 0.00 H new ATOM 0 HG22 ILE B 67 0.900 5.708 2.603 1.00 0.00 H new ATOM 0 HG23 ILE B 67 -0.439 5.108 3.610 1.00 0.00 H new ATOM 0 HD11 ILE B 67 -3.686 4.584 0.716 1.00 0.00 H new ATOM 0 HD12 ILE B 67 -2.229 5.127 -0.149 1.00 0.00 H new ATOM 0 HD13 ILE B 67 -2.085 3.978 1.202 1.00 0.00 H new ATOM 2631 N ASP B 68 -2.024 9.799 2.005 1.00 0.00 N ATOM 2632 CA ASP B 68 -3.067 10.794 1.781 1.00 0.00 C ATOM 2633 C ASP B 68 -3.014 11.267 0.337 1.00 0.00 C ATOM 2634 O ASP B 68 -2.194 12.106 -0.054 1.00 0.00 O ATOM 2635 CB ASP B 68 -2.980 11.967 2.765 1.00 0.00 C ATOM 2636 CG ASP B 68 -4.195 12.915 2.642 1.00 0.00 C ATOM 2637 OD1 ASP B 68 -5.004 12.787 1.694 1.00 0.00 O ATOM 2638 OD2 ASP B 68 -4.363 13.774 3.536 1.00 0.00 O ATOM 0 H ASP B 68 -1.164 9.989 1.490 1.00 0.00 H new ATOM 0 HA ASP B 68 -4.032 10.323 1.966 1.00 0.00 H new ATOM 0 HB2 ASP B 68 -2.921 11.583 3.783 1.00 0.00 H new ATOM 0 HB3 ASP B 68 -2.063 12.527 2.582 1.00 0.00 H new ATOM 2643 N SER B 69 -3.921 10.698 -0.448 1.00 0.00 N ATOM 2644 CA SER B 69 -4.186 11.001 -1.839 1.00 0.00 C ATOM 2645 C SER B 69 -4.248 12.497 -2.148 1.00 0.00 C ATOM 2646 O SER B 69 -3.842 12.895 -3.240 1.00 0.00 O ATOM 2647 CB SER B 69 -5.521 10.341 -2.193 1.00 0.00 C ATOM 2648 OG SER B 69 -5.598 9.021 -1.671 1.00 0.00 O ATOM 0 H SER B 69 -4.532 9.960 -0.098 1.00 0.00 H new ATOM 0 HA SER B 69 -3.359 10.618 -2.437 1.00 0.00 H new ATOM 0 HB2 SER B 69 -6.341 10.940 -1.797 1.00 0.00 H new ATOM 0 HB3 SER B 69 -5.640 10.314 -3.276 1.00 0.00 H new ATOM 0 HG SER B 69 -6.532 8.802 -1.472 1.00 0.00 H new ATOM 2654 N ASP B 70 -4.708 13.336 -1.214 1.00 0.00 N ATOM 2655 CA ASP B 70 -4.913 14.769 -1.443 1.00 0.00 C ATOM 2656 C ASP B 70 -3.608 15.504 -1.718 1.00 0.00 C ATOM 2657 O ASP B 70 -3.631 16.602 -2.272 1.00 0.00 O ATOM 2658 CB ASP B 70 -5.603 15.412 -0.236 1.00 0.00 C ATOM 2659 CG ASP B 70 -6.001 16.873 -0.512 1.00 0.00 C ATOM 2660 OD1 ASP B 70 -6.851 17.114 -1.399 1.00 0.00 O ATOM 2661 OD2 ASP B 70 -5.523 17.782 0.204 1.00 0.00 O ATOM 0 H ASP B 70 -4.950 13.036 -0.270 1.00 0.00 H new ATOM 0 HA ASP B 70 -5.545 14.856 -2.327 1.00 0.00 H new ATOM 0 HB2 ASP B 70 -6.492 14.837 0.023 1.00 0.00 H new ATOM 0 HB3 ASP B 70 -4.937 15.374 0.626 1.00 0.00 H new ATOM 2666 N ILE B 71 -2.472 14.890 -1.377 1.00 0.00 N ATOM 2667 CA ILE B 71 -1.147 15.452 -1.585 1.00 0.00 C ATOM 2668 C ILE B 71 -0.301 14.446 -2.364 1.00 0.00 C ATOM 2669 O ILE B 71 0.459 14.866 -3.230 1.00 0.00 O ATOM 2670 CB ILE B 71 -0.489 15.817 -0.242 1.00 0.00 C ATOM 2671 CG1 ILE B 71 -1.433 16.537 0.752 1.00 0.00 C ATOM 2672 CG2 ILE B 71 0.767 16.677 -0.412 1.00 0.00 C ATOM 2673 CD1 ILE B 71 -1.827 15.577 1.867 1.00 0.00 C ATOM 0 H ILE B 71 -2.454 13.969 -0.940 1.00 0.00 H new ATOM 0 HA ILE B 71 -1.227 16.373 -2.162 1.00 0.00 H new ATOM 0 HB ILE B 71 -0.222 14.847 0.178 1.00 0.00 H new ATOM 0 HG12 ILE B 71 -0.938 17.413 1.171 1.00 0.00 H new ATOM 0 HG13 ILE B 71 -2.323 16.892 0.232 1.00 0.00 H new ATOM 0 HG21 ILE B 71 1.188 16.904 0.567 1.00 0.00 H new ATOM 0 HG22 ILE B 71 1.502 16.134 -1.006 1.00 0.00 H new ATOM 0 HG23 ILE B 71 0.506 17.606 -0.918 1.00 0.00 H new ATOM 0 HD11 ILE B 71 -2.491 16.085 2.566 1.00 0.00 H new ATOM 0 HD12 ILE B 71 -2.339 14.715 1.440 1.00 0.00 H new ATOM 0 HD13 ILE B 71 -0.932 15.244 2.393 1.00 0.00 H new ATOM 2685 N LEU B 72 -0.459 13.133 -2.139 1.00 0.00 N ATOM 2686 CA LEU B 72 0.273 12.126 -2.902 1.00 0.00 C ATOM 2687 C LEU B 72 -0.114 12.203 -4.367 1.00 0.00 C ATOM 2688 O LEU B 72 0.754 12.424 -5.205 1.00 0.00 O ATOM 2689 CB LEU B 72 0.015 10.717 -2.353 1.00 0.00 C ATOM 2690 CG LEU B 72 0.722 9.566 -3.104 1.00 0.00 C ATOM 2691 CD1 LEU B 72 -0.046 9.025 -4.322 1.00 0.00 C ATOM 2692 CD2 LEU B 72 2.154 9.850 -3.549 1.00 0.00 C ATOM 0 H LEU B 72 -1.088 12.750 -1.434 1.00 0.00 H new ATOM 0 HA LEU B 72 1.339 12.331 -2.804 1.00 0.00 H new ATOM 0 HB2 LEU B 72 0.327 10.691 -1.309 1.00 0.00 H new ATOM 0 HB3 LEU B 72 -1.059 10.531 -2.369 1.00 0.00 H new ATOM 0 HG LEU B 72 0.746 8.808 -2.321 1.00 0.00 H new ATOM 0 HD11 LEU B 72 0.526 8.221 -4.785 1.00 0.00 H new ATOM 0 HD12 LEU B 72 -1.015 8.643 -4.001 1.00 0.00 H new ATOM 0 HD13 LEU B 72 -0.194 9.828 -5.045 1.00 0.00 H new ATOM 0 HD21 LEU B 72 2.554 8.977 -4.065 1.00 0.00 H new ATOM 0 HD22 LEU B 72 2.162 10.706 -4.224 1.00 0.00 H new ATOM 0 HD23 LEU B 72 2.769 10.070 -2.677 1.00 0.00 H new ATOM 2704 N ASN B 73 -1.406 12.063 -4.694 1.00 0.00 N ATOM 2705 CA ASN B 73 -1.833 12.091 -6.093 1.00 0.00 C ATOM 2706 C ASN B 73 -1.552 13.482 -6.705 1.00 0.00 C ATOM 2707 O ASN B 73 -1.459 13.632 -7.921 1.00 0.00 O ATOM 2708 CB ASN B 73 -3.310 11.665 -6.258 1.00 0.00 C ATOM 2709 CG ASN B 73 -4.235 12.795 -6.718 1.00 0.00 C ATOM 2710 OD1 ASN B 73 -4.588 12.886 -7.889 1.00 0.00 O ATOM 2711 ND2 ASN B 73 -4.629 13.679 -5.818 1.00 0.00 N ATOM 0 H ASN B 73 -2.160 11.932 -4.019 1.00 0.00 H new ATOM 0 HA ASN B 73 -1.248 11.355 -6.644 1.00 0.00 H new ATOM 0 HB2 ASN B 73 -3.364 10.849 -6.978 1.00 0.00 H new ATOM 0 HB3 ASN B 73 -3.674 11.276 -5.307 1.00 0.00 H new ATOM 0 HD21 ASN B 73 -5.236 14.451 -6.093 1.00 0.00 H new ATOM 0 HD22 ASN B 73 -4.326 13.589 -4.848 1.00 0.00 H new ATOM 2718 N ASN B 74 -1.441 14.496 -5.838 1.00 0.00 N ATOM 2719 CA ASN B 74 -1.174 15.894 -6.151 1.00 0.00 C ATOM 2720 C ASN B 74 0.309 16.163 -6.442 1.00 0.00 C ATOM 2721 O ASN B 74 0.628 17.153 -7.104 1.00 0.00 O ATOM 2722 CB ASN B 74 -1.626 16.752 -4.955 1.00 0.00 C ATOM 2723 CG ASN B 74 -2.450 17.973 -5.343 1.00 0.00 C ATOM 2724 OD1 ASN B 74 -2.182 18.654 -6.329 1.00 0.00 O ATOM 2725 ND2 ASN B 74 -3.487 18.260 -4.572 1.00 0.00 N ATOM 0 H ASN B 74 -1.543 14.345 -4.834 1.00 0.00 H new ATOM 0 HA ASN B 74 -1.726 16.150 -7.055 1.00 0.00 H new ATOM 0 HB2 ASN B 74 -2.212 16.132 -4.277 1.00 0.00 H new ATOM 0 HB3 ASN B 74 -0.745 17.081 -4.404 1.00 0.00 H new ATOM 0 HD21 ASN B 74 -4.081 19.060 -4.793 1.00 0.00 H new ATOM 0 HD22 ASN B 74 -3.692 17.682 -3.757 1.00 0.00 H new ATOM 2732 N ALA B 75 1.212 15.323 -5.922 1.00 0.00 N ATOM 2733 CA ALA B 75 2.648 15.426 -6.113 1.00 0.00 C ATOM 2734 C ALA B 75 3.023 15.305 -7.590 1.00 0.00 C ATOM 2735 O ALA B 75 2.226 14.882 -8.431 1.00 0.00 O ATOM 2736 CB ALA B 75 3.376 14.362 -5.270 1.00 0.00 C ATOM 0 H ALA B 75 0.946 14.530 -5.339 1.00 0.00 H new ATOM 0 HA ALA B 75 2.966 16.413 -5.776 1.00 0.00 H new ATOM 0 HB1 ALA B 75 4.452 14.450 -5.423 1.00 0.00 H new ATOM 0 HB2 ALA B 75 3.145 14.513 -4.215 1.00 0.00 H new ATOM 0 HB3 ALA B 75 3.047 13.369 -5.575 1.00 0.00 H new ATOM 2742 N ASP B 76 4.277 15.641 -7.882 1.00 0.00 N ATOM 2743 CA ASP B 76 4.891 15.391 -9.186 1.00 0.00 C ATOM 2744 C ASP B 76 5.655 14.062 -9.197 1.00 0.00 C ATOM 2745 O ASP B 76 5.704 13.391 -10.231 1.00 0.00 O ATOM 2746 CB ASP B 76 5.841 16.537 -9.544 1.00 0.00 C ATOM 2747 CG ASP B 76 6.451 16.328 -10.940 1.00 0.00 C ATOM 2748 OD1 ASP B 76 5.717 16.446 -11.947 1.00 0.00 O ATOM 2749 OD2 ASP B 76 7.676 16.099 -11.039 1.00 0.00 O ATOM 0 H ASP B 76 4.901 16.098 -7.217 1.00 0.00 H new ATOM 0 HA ASP B 76 4.094 15.331 -9.927 1.00 0.00 H new ATOM 0 HB2 ASP B 76 5.302 17.484 -9.516 1.00 0.00 H new ATOM 0 HB3 ASP B 76 6.636 16.601 -8.801 1.00 0.00 H new ATOM 2754 N LEU B 77 6.211 13.644 -8.049 1.00 0.00 N ATOM 2755 CA LEU B 77 7.099 12.494 -7.945 1.00 0.00 C ATOM 2756 C LEU B 77 6.956 11.828 -6.573 1.00 0.00 C ATOM 2757 O LEU B 77 6.923 12.506 -5.543 1.00 0.00 O ATOM 2758 CB LEU B 77 8.534 12.968 -8.262 1.00 0.00 C ATOM 2759 CG LEU B 77 9.691 11.944 -8.252 1.00 0.00 C ATOM 2760 CD1 LEU B 77 10.361 11.830 -6.890 1.00 0.00 C ATOM 2761 CD2 LEU B 77 9.337 10.538 -8.738 1.00 0.00 C ATOM 0 H LEU B 77 6.048 14.109 -7.156 1.00 0.00 H new ATOM 0 HA LEU B 77 6.835 11.722 -8.667 1.00 0.00 H new ATOM 0 HB2 LEU B 77 8.515 13.430 -9.249 1.00 0.00 H new ATOM 0 HB3 LEU B 77 8.785 13.752 -7.547 1.00 0.00 H new ATOM 0 HG LEU B 77 10.381 12.368 -8.981 1.00 0.00 H new ATOM 0 HD11 LEU B 77 11.166 11.097 -6.941 1.00 0.00 H new ATOM 0 HD12 LEU B 77 10.770 12.799 -6.603 1.00 0.00 H new ATOM 0 HD13 LEU B 77 9.627 11.512 -6.149 1.00 0.00 H new ATOM 0 HD21 LEU B 77 10.221 9.903 -8.689 1.00 0.00 H new ATOM 0 HD22 LEU B 77 8.555 10.120 -8.104 1.00 0.00 H new ATOM 0 HD23 LEU B 77 8.982 10.587 -9.768 1.00 0.00 H new ATOM 2773 N VAL B 78 6.882 10.497 -6.583 1.00 0.00 N ATOM 2774 CA VAL B 78 6.794 9.604 -5.433 1.00 0.00 C ATOM 2775 C VAL B 78 8.137 8.905 -5.277 1.00 0.00 C ATOM 2776 O VAL B 78 8.496 8.047 -6.087 1.00 0.00 O ATOM 2777 CB VAL B 78 5.613 8.628 -5.591 1.00 0.00 C ATOM 2778 CG1 VAL B 78 5.344 7.913 -4.261 1.00 0.00 C ATOM 2779 CG2 VAL B 78 4.340 9.350 -6.059 1.00 0.00 C ATOM 0 H VAL B 78 6.882 9.979 -7.462 1.00 0.00 H new ATOM 0 HA VAL B 78 6.590 10.161 -4.519 1.00 0.00 H new ATOM 0 HB VAL B 78 5.885 7.898 -6.353 1.00 0.00 H new ATOM 0 HG11 VAL B 78 4.507 7.225 -4.381 1.00 0.00 H new ATOM 0 HG12 VAL B 78 6.232 7.356 -3.961 1.00 0.00 H new ATOM 0 HG13 VAL B 78 5.101 8.649 -3.495 1.00 0.00 H new ATOM 0 HG21 VAL B 78 3.529 8.629 -6.159 1.00 0.00 H new ATOM 0 HG22 VAL B 78 4.063 10.109 -5.328 1.00 0.00 H new ATOM 0 HG23 VAL B 78 4.524 9.825 -7.023 1.00 0.00 H new ATOM 2789 N VAL B 79 8.891 9.284 -4.247 1.00 0.00 N ATOM 2790 CA VAL B 79 10.092 8.559 -3.880 1.00 0.00 C ATOM 2791 C VAL B 79 9.655 7.385 -3.022 1.00 0.00 C ATOM 2792 O VAL B 79 9.233 7.575 -1.875 1.00 0.00 O ATOM 2793 CB VAL B 79 11.103 9.422 -3.102 1.00 0.00 C ATOM 2794 CG1 VAL B 79 12.418 8.654 -2.934 1.00 0.00 C ATOM 2795 CG2 VAL B 79 11.394 10.755 -3.792 1.00 0.00 C ATOM 0 H VAL B 79 8.686 10.090 -3.656 1.00 0.00 H new ATOM 0 HA VAL B 79 10.603 8.240 -4.788 1.00 0.00 H new ATOM 0 HB VAL B 79 10.654 9.639 -2.133 1.00 0.00 H new ATOM 0 HG11 VAL B 79 13.130 9.268 -2.383 1.00 0.00 H new ATOM 0 HG12 VAL B 79 12.233 7.731 -2.384 1.00 0.00 H new ATOM 0 HG13 VAL B 79 12.828 8.415 -3.915 1.00 0.00 H new ATOM 0 HG21 VAL B 79 12.112 11.322 -3.200 1.00 0.00 H new ATOM 0 HG22 VAL B 79 11.807 10.569 -4.783 1.00 0.00 H new ATOM 0 HG23 VAL B 79 10.470 11.326 -3.885 1.00 0.00 H new ATOM 2805 N THR B 80 9.691 6.175 -3.571 1.00 0.00 N ATOM 2806 CA THR B 80 9.541 5.026 -2.700 1.00 0.00 C ATOM 2807 C THR B 80 10.870 4.949 -1.945 1.00 0.00 C ATOM 2808 O THR B 80 11.934 4.885 -2.574 1.00 0.00 O ATOM 2809 CB THR B 80 9.270 3.759 -3.507 1.00 0.00 C ATOM 2810 OG1 THR B 80 8.160 3.968 -4.361 1.00 0.00 O ATOM 2811 CG2 THR B 80 8.956 2.568 -2.606 1.00 0.00 C ATOM 0 H THR B 80 9.816 5.973 -4.563 1.00 0.00 H new ATOM 0 HA THR B 80 8.693 5.120 -2.021 1.00 0.00 H new ATOM 0 HB THR B 80 10.171 3.540 -4.080 1.00 0.00 H new ATOM 0 HG1 THR B 80 7.370 4.185 -3.823 1.00 0.00 H new ATOM 0 HG21 THR B 80 8.769 1.687 -3.220 1.00 0.00 H new ATOM 0 HG22 THR B 80 9.802 2.378 -1.946 1.00 0.00 H new ATOM 0 HG23 THR B 80 8.072 2.787 -2.008 1.00 0.00 H new ATOM 2819 N LEU B 81 10.838 4.999 -0.615 1.00 0.00 N ATOM 2820 CA LEU B 81 12.055 4.893 0.175 1.00 0.00 C ATOM 2821 C LEU B 81 12.188 3.450 0.628 1.00 0.00 C ATOM 2822 O LEU B 81 11.225 2.809 1.053 1.00 0.00 O ATOM 2823 CB LEU B 81 12.075 5.892 1.342 1.00 0.00 C ATOM 2824 CG LEU B 81 12.344 7.346 0.904 1.00 0.00 C ATOM 2825 CD1 LEU B 81 12.175 8.267 2.111 1.00 0.00 C ATOM 2826 CD2 LEU B 81 13.754 7.556 0.331 1.00 0.00 C ATOM 0 H LEU B 81 9.985 5.112 -0.067 1.00 0.00 H new ATOM 0 HA LEU B 81 12.921 5.160 -0.431 1.00 0.00 H new ATOM 0 HB2 LEU B 81 11.118 5.849 1.863 1.00 0.00 H new ATOM 0 HB3 LEU B 81 12.841 5.589 2.056 1.00 0.00 H new ATOM 0 HG LEU B 81 11.630 7.575 0.113 1.00 0.00 H new ATOM 0 HD11 LEU B 81 12.363 9.298 1.811 1.00 0.00 H new ATOM 0 HD12 LEU B 81 11.159 8.181 2.495 1.00 0.00 H new ATOM 0 HD13 LEU B 81 12.882 7.980 2.889 1.00 0.00 H new ATOM 0 HD21 LEU B 81 13.878 8.600 0.042 1.00 0.00 H new ATOM 0 HD22 LEU B 81 14.496 7.298 1.087 1.00 0.00 H new ATOM 0 HD23 LEU B 81 13.890 6.919 -0.543 1.00 0.00 H new ATOM 2838 N SER B 82 13.398 2.933 0.447 1.00 0.00 N ATOM 2839 CA SER B 82 13.866 1.605 0.845 1.00 0.00 C ATOM 2840 C SER B 82 13.289 0.471 -0.022 1.00 0.00 C ATOM 2841 O SER B 82 13.808 -0.643 0.025 1.00 0.00 O ATOM 2842 CB SER B 82 13.562 1.331 2.321 1.00 0.00 C ATOM 2843 OG SER B 82 13.997 2.401 3.139 1.00 0.00 O ATOM 0 H SER B 82 14.133 3.468 -0.015 1.00 0.00 H new ATOM 0 HA SER B 82 14.945 1.614 0.690 1.00 0.00 H new ATOM 0 HB2 SER B 82 12.490 1.181 2.453 1.00 0.00 H new ATOM 0 HB3 SER B 82 14.053 0.409 2.631 1.00 0.00 H new ATOM 0 HG SER B 82 14.962 2.324 3.292 1.00 0.00 H new ATOM 2878 N ALA B 86 6.816 -3.622 3.773 1.00 0.00 N ATOM 2879 CA ALA B 86 5.801 -3.540 4.819 1.00 0.00 C ATOM 2880 C ALA B 86 4.863 -2.331 4.632 1.00 0.00 C ATOM 2881 O ALA B 86 3.850 -2.247 5.326 1.00 0.00 O ATOM 2882 CB ALA B 86 6.487 -3.564 6.197 1.00 0.00 C ATOM 0 HA ALA B 86 5.150 -4.411 4.749 1.00 0.00 H new ATOM 0 HB1 ALA B 86 5.732 -3.503 6.981 1.00 0.00 H new ATOM 0 HB2 ALA B 86 7.050 -4.491 6.307 1.00 0.00 H new ATOM 0 HB3 ALA B 86 7.166 -2.715 6.280 1.00 0.00 H new ATOM 2888 N ASP B 87 5.145 -1.415 3.698 1.00 0.00 N ATOM 2889 CA ASP B 87 4.462 -0.123 3.538 1.00 0.00 C ATOM 2890 C ASP B 87 3.126 -0.264 2.786 1.00 0.00 C ATOM 2891 O ASP B 87 2.819 0.528 1.896 1.00 0.00 O ATOM 2892 CB ASP B 87 5.370 0.863 2.790 1.00 0.00 C ATOM 2893 CG ASP B 87 4.766 2.278 2.864 1.00 0.00 C ATOM 2894 OD1 ASP B 87 4.200 2.628 3.928 1.00 0.00 O ATOM 2895 OD2 ASP B 87 4.889 3.028 1.872 1.00 0.00 O ATOM 0 H ASP B 87 5.882 -1.557 3.007 1.00 0.00 H new ATOM 0 HA ASP B 87 4.245 0.255 4.537 1.00 0.00 H new ATOM 0 HB2 ASP B 87 6.368 0.859 3.229 1.00 0.00 H new ATOM 0 HB3 ASP B 87 5.478 0.556 1.750 1.00 0.00 H new ATOM 2900 N LYS B 88 2.316 -1.286 3.090 1.00 0.00 N ATOM 2901 CA LYS B 88 1.147 -1.647 2.275 1.00 0.00 C ATOM 2902 C LYS B 88 1.671 -2.021 0.872 1.00 0.00 C ATOM 2903 O LYS B 88 2.794 -2.518 0.738 1.00 0.00 O ATOM 2904 CB LYS B 88 0.077 -0.514 2.298 1.00 0.00 C ATOM 2905 CG LYS B 88 -1.358 -1.036 2.136 1.00 0.00 C ATOM 2906 CD LYS B 88 -2.433 0.055 2.307 1.00 0.00 C ATOM 2907 CE LYS B 88 -2.812 0.444 3.755 1.00 0.00 C ATOM 2908 NZ LYS B 88 -3.337 -0.688 4.568 1.00 0.00 N ATOM 0 H LYS B 88 2.451 -1.885 3.905 1.00 0.00 H new ATOM 0 HA LYS B 88 0.617 -2.511 2.677 1.00 0.00 H new ATOM 0 HB2 LYS B 88 0.155 0.032 3.238 1.00 0.00 H new ATOM 0 HB3 LYS B 88 0.291 0.196 1.499 1.00 0.00 H new ATOM 0 HG2 LYS B 88 -1.463 -1.486 1.149 1.00 0.00 H new ATOM 0 HG3 LYS B 88 -1.534 -1.825 2.867 1.00 0.00 H new ATOM 0 HD2 LYS B 88 -2.089 0.953 1.794 1.00 0.00 H new ATOM 0 HD3 LYS B 88 -3.337 -0.277 1.797 1.00 0.00 H new ATOM 0 HE2 LYS B 88 -1.934 0.858 4.251 1.00 0.00 H new ATOM 0 HE3 LYS B 88 -3.562 1.234 3.724 1.00 0.00 H new ATOM 0 HZ1 LYS B 88 -3.361 -0.413 5.571 1.00 0.00 H new ATOM 0 HZ2 LYS B 88 -4.298 -0.926 4.251 1.00 0.00 H new ATOM 0 HZ3 LYS B 88 -2.719 -1.516 4.450 1.00 0.00 H new ATOM 2922 N CYS B 89 0.879 -1.795 -0.173 1.00 0.00 N ATOM 2923 CA CYS B 89 1.267 -1.924 -1.573 1.00 0.00 C ATOM 2924 C CYS B 89 0.619 -0.746 -2.307 1.00 0.00 C ATOM 2925 O CYS B 89 -0.399 -0.933 -2.976 1.00 0.00 O ATOM 2926 CB CYS B 89 0.864 -3.305 -2.137 1.00 0.00 C ATOM 2927 SG CYS B 89 -0.413 -4.196 -1.185 1.00 0.00 S ATOM 0 H CYS B 89 -0.092 -1.504 -0.061 1.00 0.00 H new ATOM 0 HA CYS B 89 2.348 -1.883 -1.705 1.00 0.00 H new ATOM 0 HB2 CYS B 89 0.505 -3.171 -3.158 1.00 0.00 H new ATOM 0 HB3 CYS B 89 1.755 -3.930 -2.192 1.00 0.00 H new ATOM 2932 N PRO B 90 1.095 0.499 -2.102 1.00 0.00 N ATOM 2933 CA PRO B 90 0.559 1.648 -2.800 1.00 0.00 C ATOM 2934 C PRO B 90 0.737 1.446 -4.297 1.00 0.00 C ATOM 2935 O PRO B 90 1.847 1.144 -4.745 1.00 0.00 O ATOM 2936 CB PRO B 90 1.308 2.885 -2.296 1.00 0.00 C ATOM 2937 CG PRO B 90 1.961 2.403 -1.001 1.00 0.00 C ATOM 2938 CD PRO B 90 2.221 0.924 -1.291 1.00 0.00 C ATOM 0 HA PRO B 90 -0.507 1.778 -2.611 1.00 0.00 H new ATOM 0 HB2 PRO B 90 2.051 3.226 -3.017 1.00 0.00 H new ATOM 0 HB3 PRO B 90 0.630 3.720 -2.117 1.00 0.00 H new ATOM 0 HG2 PRO B 90 2.883 2.943 -0.787 1.00 0.00 H new ATOM 0 HG3 PRO B 90 1.305 2.539 -0.141 1.00 0.00 H new ATOM 0 HD2 PRO B 90 3.164 0.785 -1.820 1.00 0.00 H new ATOM 0 HD3 PRO B 90 2.285 0.346 -0.369 1.00 0.00 H new ATOM 2946 N MET B 91 -0.334 1.620 -5.070 1.00 0.00 N ATOM 2947 CA MET B 91 -0.279 1.358 -6.507 1.00 0.00 C ATOM 2948 C MET B 91 0.120 2.581 -7.346 1.00 0.00 C ATOM 2949 O MET B 91 0.100 2.488 -8.573 1.00 0.00 O ATOM 2950 CB MET B 91 -1.563 0.671 -6.966 1.00 0.00 C ATOM 2951 CG MET B 91 -2.830 1.387 -6.560 1.00 0.00 C ATOM 2952 SD MET B 91 -3.070 2.973 -7.390 1.00 0.00 S ATOM 2953 CE MET B 91 -4.768 3.065 -6.872 1.00 0.00 C ATOM 0 H MET B 91 -1.241 1.938 -4.730 1.00 0.00 H new ATOM 0 HA MET B 91 0.540 0.662 -6.687 1.00 0.00 H new ATOM 0 HB2 MET B 91 -1.544 0.579 -8.052 1.00 0.00 H new ATOM 0 HB3 MET B 91 -1.585 -0.340 -6.560 1.00 0.00 H new ATOM 0 HG2 MET B 91 -3.684 0.744 -6.773 1.00 0.00 H new ATOM 0 HG3 MET B 91 -2.814 1.550 -5.482 1.00 0.00 H new ATOM 0 HE1 MET B 91 -5.158 4.062 -7.078 1.00 0.00 H new ATOM 0 HE2 MET B 91 -5.355 2.326 -7.417 1.00 0.00 H new ATOM 0 HE3 MET B 91 -4.834 2.864 -5.803 1.00 0.00 H new ATOM 2963 N THR B 92 0.484 3.690 -6.681 1.00 0.00 N ATOM 2964 CA THR B 92 0.918 4.976 -7.240 1.00 0.00 C ATOM 2965 C THR B 92 0.123 5.387 -8.496 1.00 0.00 C ATOM 2966 O THR B 92 0.526 5.048 -9.613 1.00 0.00 O ATOM 2967 CB THR B 92 2.447 5.019 -7.431 1.00 0.00 C ATOM 2968 OG1 THR B 92 2.942 3.842 -8.048 1.00 0.00 O ATOM 2969 CG2 THR B 92 3.135 5.181 -6.067 1.00 0.00 C ATOM 0 H THR B 92 0.481 3.710 -5.661 1.00 0.00 H new ATOM 0 HA THR B 92 0.679 5.744 -6.504 1.00 0.00 H new ATOM 0 HB THR B 92 2.667 5.866 -8.080 1.00 0.00 H new ATOM 0 HG1 THR B 92 3.384 4.076 -8.891 1.00 0.00 H new ATOM 0 HG21 THR B 92 4.216 5.211 -6.206 1.00 0.00 H new ATOM 0 HG22 THR B 92 2.803 6.108 -5.600 1.00 0.00 H new ATOM 0 HG23 THR B 92 2.875 4.339 -5.426 1.00 0.00 H new ATOM 2977 N PRO B 93 -1.012 6.098 -8.335 1.00 0.00 N ATOM 2978 CA PRO B 93 -1.900 6.412 -9.446 1.00 0.00 C ATOM 2979 C PRO B 93 -1.100 7.204 -10.512 1.00 0.00 C ATOM 2980 O PRO B 93 -0.308 8.074 -10.140 1.00 0.00 O ATOM 2981 CB PRO B 93 -3.080 7.166 -8.800 1.00 0.00 C ATOM 2982 CG PRO B 93 -2.453 7.844 -7.586 1.00 0.00 C ATOM 2983 CD PRO B 93 -1.446 6.791 -7.128 1.00 0.00 C ATOM 0 HA PRO B 93 -2.295 5.553 -9.988 1.00 0.00 H new ATOM 0 HB2 PRO B 93 -3.514 7.894 -9.486 1.00 0.00 H new ATOM 0 HB3 PRO B 93 -3.880 6.485 -8.510 1.00 0.00 H new ATOM 0 HG2 PRO B 93 -1.970 8.786 -7.847 1.00 0.00 H new ATOM 0 HG3 PRO B 93 -3.191 8.067 -6.815 1.00 0.00 H new ATOM 0 HD2 PRO B 93 -0.601 7.255 -6.619 1.00 0.00 H new ATOM 0 HD3 PRO B 93 -1.901 6.097 -6.422 1.00 0.00 H new ATOM 2991 N PRO B 94 -1.280 6.937 -11.826 1.00 0.00 N ATOM 2992 CA PRO B 94 -0.439 7.458 -12.915 1.00 0.00 C ATOM 2993 C PRO B 94 -0.440 8.986 -13.077 1.00 0.00 C ATOM 2994 O PRO B 94 0.258 9.511 -13.947 1.00 0.00 O ATOM 2995 CB PRO B 94 -0.904 6.741 -14.191 1.00 0.00 C ATOM 2996 CG PRO B 94 -2.327 6.304 -13.862 1.00 0.00 C ATOM 2997 CD PRO B 94 -2.215 5.973 -12.379 1.00 0.00 C ATOM 0 HA PRO B 94 0.605 7.251 -12.681 1.00 0.00 H new ATOM 0 HB2 PRO B 94 -0.879 7.405 -15.055 1.00 0.00 H new ATOM 0 HB3 PRO B 94 -0.267 5.888 -14.426 1.00 0.00 H new ATOM 0 HG2 PRO B 94 -3.052 7.096 -14.051 1.00 0.00 H new ATOM 0 HG3 PRO B 94 -2.637 5.441 -14.452 1.00 0.00 H new ATOM 0 HD2 PRO B 94 -3.186 6.044 -11.888 1.00 0.00 H new ATOM 0 HD3 PRO B 94 -1.858 4.954 -12.232 1.00 0.00 H new ATOM 3005 N HIS B 95 -1.189 9.711 -12.242 1.00 0.00 N ATOM 3006 CA HIS B 95 -1.123 11.162 -12.124 1.00 0.00 C ATOM 3007 C HIS B 95 0.276 11.623 -11.661 1.00 0.00 C ATOM 3008 O HIS B 95 0.573 12.817 -11.733 1.00 0.00 O ATOM 3009 CB HIS B 95 -2.200 11.638 -11.130 1.00 0.00 C ATOM 3010 CG HIS B 95 -3.568 11.011 -11.313 1.00 0.00 C ATOM 3011 ND1 HIS B 95 -4.228 10.788 -12.504 1.00 0.00 N ATOM 3012 CD2 HIS B 95 -4.367 10.516 -10.316 1.00 0.00 C ATOM 3013 CE1 HIS B 95 -5.388 10.166 -12.227 1.00 0.00 C ATOM 3014 NE2 HIS B 95 -5.518 9.974 -10.901 1.00 0.00 N ATOM 0 H HIS B 95 -1.874 9.290 -11.615 1.00 0.00 H new ATOM 0 HA HIS B 95 -1.307 11.602 -13.104 1.00 0.00 H new ATOM 0 HB2 HIS B 95 -1.855 11.430 -10.117 1.00 0.00 H new ATOM 0 HB3 HIS B 95 -2.299 12.720 -11.217 1.00 0.00 H new ATOM 0 HD1 HIS B 95 -3.895 11.049 -13.432 1.00 0.00 H new ATOM 0 HD2 HIS B 95 -4.147 10.540 -9.259 1.00 0.00 H new ATOM 0 HE1 HIS B 95 -6.115 9.863 -12.966 1.00 0.00 H new ATOM 3022 N VAL B 96 1.133 10.705 -11.188 1.00 0.00 N ATOM 3023 CA VAL B 96 2.424 10.990 -10.571 1.00 0.00 C ATOM 3024 C VAL B 96 3.478 10.025 -11.134 1.00 0.00 C ATOM 3025 O VAL B 96 3.158 8.881 -11.471 1.00 0.00 O ATOM 3026 CB VAL B 96 2.315 10.837 -9.033 1.00 0.00 C ATOM 3027 CG1 VAL B 96 3.391 11.692 -8.358 1.00 0.00 C ATOM 3028 CG2 VAL B 96 0.958 11.241 -8.433 1.00 0.00 C ATOM 0 H VAL B 96 0.931 9.706 -11.230 1.00 0.00 H new ATOM 0 HA VAL B 96 2.723 12.014 -10.797 1.00 0.00 H new ATOM 0 HB VAL B 96 2.442 9.771 -8.846 1.00 0.00 H new ATOM 0 HG11 VAL B 96 3.315 11.585 -7.276 1.00 0.00 H new ATOM 0 HG12 VAL B 96 4.377 11.363 -8.687 1.00 0.00 H new ATOM 0 HG13 VAL B 96 3.248 12.738 -8.630 1.00 0.00 H new ATOM 0 HG21 VAL B 96 0.981 11.098 -7.353 1.00 0.00 H new ATOM 0 HG22 VAL B 96 0.759 12.289 -8.657 1.00 0.00 H new ATOM 0 HG23 VAL B 96 0.171 10.622 -8.864 1.00 0.00 H new ATOM 3038 N LYS B 97 4.739 10.468 -11.221 1.00 0.00 N ATOM 3039 CA LYS B 97 5.884 9.611 -11.532 1.00 0.00 C ATOM 3040 C LYS B 97 6.327 8.938 -10.230 1.00 0.00 C ATOM 3041 O LYS B 97 6.119 9.497 -9.153 1.00 0.00 O ATOM 3042 CB LYS B 97 6.959 10.511 -12.175 1.00 0.00 C ATOM 3043 CG LYS B 97 8.085 9.765 -12.912 1.00 0.00 C ATOM 3044 CD LYS B 97 9.396 9.632 -12.124 1.00 0.00 C ATOM 3045 CE LYS B 97 10.130 10.969 -11.868 1.00 0.00 C ATOM 3046 NZ LYS B 97 10.444 11.700 -13.123 1.00 0.00 N ATOM 0 H LYS B 97 4.993 11.445 -11.075 1.00 0.00 H new ATOM 0 HA LYS B 97 5.661 8.812 -12.239 1.00 0.00 H new ATOM 0 HB2 LYS B 97 6.471 11.186 -12.879 1.00 0.00 H new ATOM 0 HB3 LYS B 97 7.405 11.130 -11.396 1.00 0.00 H new ATOM 0 HG2 LYS B 97 7.731 8.767 -13.171 1.00 0.00 H new ATOM 0 HG3 LYS B 97 8.292 10.283 -13.848 1.00 0.00 H new ATOM 0 HD2 LYS B 97 9.182 9.160 -11.165 1.00 0.00 H new ATOM 0 HD3 LYS B 97 10.065 8.963 -12.666 1.00 0.00 H new ATOM 0 HE2 LYS B 97 9.513 11.601 -11.229 1.00 0.00 H new ATOM 0 HE3 LYS B 97 11.055 10.773 -11.325 1.00 0.00 H new ATOM 0 HZ1 LYS B 97 11.023 12.535 -12.903 1.00 0.00 H new ATOM 0 HZ2 LYS B 97 10.969 11.075 -13.767 1.00 0.00 H new ATOM 0 HZ3 LYS B 97 9.560 12.002 -13.579 1.00 0.00 H new ATOM 3060 N ARG B 98 6.988 7.783 -10.290 1.00 0.00 N ATOM 3061 CA ARG B 98 7.559 7.126 -9.109 1.00 0.00 C ATOM 3062 C ARG B 98 8.918 6.557 -9.484 1.00 0.00 C ATOM 3063 O ARG B 98 9.093 6.073 -10.602 1.00 0.00 O ATOM 3064 CB ARG B 98 6.620 6.006 -8.600 1.00 0.00 C ATOM 3065 CG ARG B 98 7.111 5.304 -7.306 1.00 0.00 C ATOM 3066 CD ARG B 98 7.037 3.769 -7.398 1.00 0.00 C ATOM 3067 NE ARG B 98 5.680 3.240 -7.188 1.00 0.00 N ATOM 3068 CZ ARG B 98 5.260 2.452 -6.188 1.00 0.00 C ATOM 3069 NH1 ARG B 98 6.021 2.191 -5.127 1.00 0.00 N ATOM 3070 NH2 ARG B 98 4.039 1.945 -6.278 1.00 0.00 N ATOM 0 H ARG B 98 7.145 7.273 -11.159 1.00 0.00 H new ATOM 0 HA ARG B 98 7.673 7.851 -8.303 1.00 0.00 H new ATOM 0 HB2 ARG B 98 5.633 6.430 -8.418 1.00 0.00 H new ATOM 0 HB3 ARG B 98 6.506 5.258 -9.385 1.00 0.00 H new ATOM 0 HG2 ARG B 98 8.140 5.603 -7.104 1.00 0.00 H new ATOM 0 HG3 ARG B 98 6.509 5.643 -6.463 1.00 0.00 H new ATOM 0 HD2 ARG B 98 7.396 3.453 -8.377 1.00 0.00 H new ATOM 0 HD3 ARG B 98 7.708 3.334 -6.657 1.00 0.00 H new ATOM 0 HE ARG B 98 4.980 3.503 -7.882 1.00 0.00 H new ATOM 0 HH11 ARG B 98 6.955 2.595 -5.057 1.00 0.00 H new ATOM 0 HH12 ARG B 98 5.670 1.587 -4.384 1.00 0.00 H new ATOM 0 HH21 ARG B 98 3.456 2.159 -7.087 1.00 0.00 H new ATOM 0 HH22 ARG B 98 3.682 1.341 -5.538 1.00 0.00 H new ATOM 3084 N GLU B 99 9.858 6.588 -8.544 1.00 0.00 N ATOM 3085 CA GLU B 99 11.134 5.898 -8.632 1.00 0.00 C ATOM 3086 C GLU B 99 11.556 5.568 -7.194 1.00 0.00 C ATOM 3087 O GLU B 99 11.206 6.293 -6.259 1.00 0.00 O ATOM 3088 CB GLU B 99 12.148 6.783 -9.373 1.00 0.00 C ATOM 3089 CG GLU B 99 13.445 6.027 -9.684 1.00 0.00 C ATOM 3090 CD GLU B 99 14.382 6.863 -10.565 1.00 0.00 C ATOM 3091 OE1 GLU B 99 14.855 7.915 -10.082 1.00 0.00 O ATOM 3092 OE2 GLU B 99 14.660 6.468 -11.721 1.00 0.00 O ATOM 0 H GLU B 99 9.746 7.111 -7.675 1.00 0.00 H new ATOM 0 HA GLU B 99 11.071 4.972 -9.203 1.00 0.00 H new ATOM 0 HB2 GLU B 99 11.706 7.143 -10.302 1.00 0.00 H new ATOM 0 HB3 GLU B 99 12.375 7.660 -8.767 1.00 0.00 H new ATOM 0 HG2 GLU B 99 13.951 5.771 -8.753 1.00 0.00 H new ATOM 0 HG3 GLU B 99 13.210 5.089 -10.188 1.00 0.00 H new ATOM 3099 N HIS B 100 12.258 4.450 -6.996 1.00 0.00 N ATOM 3100 CA HIS B 100 12.826 4.087 -5.700 1.00 0.00 C ATOM 3101 C HIS B 100 14.234 4.672 -5.580 1.00 0.00 C ATOM 3102 O HIS B 100 15.053 4.457 -6.478 1.00 0.00 O ATOM 3103 CB HIS B 100 12.915 2.556 -5.542 1.00 0.00 C ATOM 3104 CG HIS B 100 11.624 1.767 -5.559 1.00 0.00 C ATOM 3105 ND1 HIS B 100 10.473 2.034 -6.270 1.00 0.00 N ATOM 3106 CD2 HIS B 100 11.428 0.570 -4.924 1.00 0.00 C ATOM 3107 CE1 HIS B 100 9.603 1.031 -6.051 1.00 0.00 C ATOM 3108 NE2 HIS B 100 10.141 0.109 -5.232 1.00 0.00 N ATOM 0 H HIS B 100 12.448 3.771 -7.733 1.00 0.00 H new ATOM 0 HA HIS B 100 12.176 4.486 -4.921 1.00 0.00 H new ATOM 0 HB2 HIS B 100 13.551 2.174 -6.340 1.00 0.00 H new ATOM 0 HB3 HIS B 100 13.423 2.346 -4.601 1.00 0.00 H new ATOM 0 HD2 HIS B 100 12.144 0.066 -4.292 1.00 0.00 H new ATOM 0 HE1 HIS B 100 8.611 0.974 -6.474 1.00 0.00 H new ATOM 0 HE2 HIS B 100 9.702 -0.750 -4.902 1.00 0.00 H new ATOM 3116 N TRP B 101 14.544 5.350 -4.467 1.00 0.00 N ATOM 3117 CA TRP B 101 15.850 5.994 -4.233 1.00 0.00 C ATOM 3118 C TRP B 101 16.592 5.380 -3.038 1.00 0.00 C ATOM 3119 O TRP B 101 17.529 5.977 -2.506 1.00 0.00 O ATOM 3120 CB TRP B 101 15.696 7.524 -4.112 1.00 0.00 C ATOM 3121 CG TRP B 101 15.204 8.262 -5.326 1.00 0.00 C ATOM 3122 CD1 TRP B 101 15.084 7.756 -6.572 1.00 0.00 C ATOM 3123 CD2 TRP B 101 14.796 9.662 -5.449 1.00 0.00 C ATOM 3124 NE1 TRP B 101 14.525 8.682 -7.411 1.00 0.00 N ATOM 3125 CE2 TRP B 101 14.333 9.889 -6.781 1.00 0.00 C ATOM 3126 CE3 TRP B 101 14.773 10.766 -4.571 1.00 0.00 C ATOM 3127 CZ2 TRP B 101 13.827 11.128 -7.204 1.00 0.00 C ATOM 3128 CZ3 TRP B 101 14.290 12.022 -4.990 1.00 0.00 C ATOM 3129 CH2 TRP B 101 13.800 12.197 -6.296 1.00 0.00 C ATOM 0 H TRP B 101 13.890 5.470 -3.693 1.00 0.00 H new ATOM 0 HA TRP B 101 16.476 5.800 -5.104 1.00 0.00 H new ATOM 0 HB2 TRP B 101 15.011 7.731 -3.290 1.00 0.00 H new ATOM 0 HB3 TRP B 101 16.664 7.940 -3.833 1.00 0.00 H new ATOM 0 HD1 TRP B 101 15.386 6.761 -6.865 1.00 0.00 H new ATOM 0 HE1 TRP B 101 14.281 8.499 -8.384 1.00 0.00 H new ATOM 0 HE3 TRP B 101 15.132 10.647 -3.559 1.00 0.00 H new ATOM 0 HZ2 TRP B 101 13.464 11.256 -8.213 1.00 0.00 H new ATOM 0 HZ3 TRP B 101 14.296 12.856 -4.303 1.00 0.00 H new ATOM 0 HH2 TRP B 101 13.403 13.154 -6.600 1.00 0.00 H new ATOM 3140 N GLY B 102 16.203 4.175 -2.621 1.00 0.00 N ATOM 3141 CA GLY B 102 16.933 3.378 -1.651 1.00 0.00 C ATOM 3142 C GLY B 102 16.426 1.945 -1.706 1.00 0.00 C ATOM 3143 O GLY B 102 15.331 1.693 -2.216 1.00 0.00 O ATOM 0 H GLY B 102 15.354 3.722 -2.958 1.00 0.00 H new ATOM 0 HA2 GLY B 102 18.001 3.408 -1.866 1.00 0.00 H new ATOM 0 HA3 GLY B 102 16.798 3.787 -0.650 1.00 0.00 H new ATOM 3147 N PHE B 103 17.210 1.016 -1.162 1.00 0.00 N ATOM 3148 CA PHE B 103 16.919 -0.419 -1.162 1.00 0.00 C ATOM 3149 C PHE B 103 17.247 -1.027 0.215 1.00 0.00 C ATOM 3150 O PHE B 103 17.449 -2.234 0.350 1.00 0.00 O ATOM 3151 CB PHE B 103 17.681 -1.080 -2.325 1.00 0.00 C ATOM 3152 CG PHE B 103 17.165 -2.452 -2.725 1.00 0.00 C ATOM 3153 CD1 PHE B 103 15.882 -2.580 -3.294 1.00 0.00 C ATOM 3154 CD2 PHE B 103 17.964 -3.600 -2.546 1.00 0.00 C ATOM 3155 CE1 PHE B 103 15.399 -3.846 -3.673 1.00 0.00 C ATOM 3156 CE2 PHE B 103 17.479 -4.864 -2.926 1.00 0.00 C ATOM 3157 CZ PHE B 103 16.197 -4.989 -3.488 1.00 0.00 C ATOM 0 H PHE B 103 18.088 1.245 -0.697 1.00 0.00 H new ATOM 0 HA PHE B 103 15.857 -0.602 -1.324 1.00 0.00 H new ATOM 0 HB2 PHE B 103 17.634 -0.422 -3.193 1.00 0.00 H new ATOM 0 HB3 PHE B 103 18.732 -1.168 -2.049 1.00 0.00 H new ATOM 0 HD1 PHE B 103 15.268 -1.704 -3.440 1.00 0.00 H new ATOM 0 HD2 PHE B 103 18.951 -3.508 -2.116 1.00 0.00 H new ATOM 0 HE1 PHE B 103 14.414 -3.940 -4.106 1.00 0.00 H new ATOM 0 HE2 PHE B 103 18.093 -5.741 -2.786 1.00 0.00 H new ATOM 0 HZ PHE B 103 15.825 -5.961 -3.777 1.00 0.00 H new ATOM 3167 N ASP B 104 17.342 -0.179 1.245 1.00 0.00 N ATOM 3168 CA ASP B 104 17.693 -0.527 2.617 1.00 0.00 C ATOM 3169 C ASP B 104 16.970 0.455 3.541 1.00 0.00 C ATOM 3170 O ASP B 104 16.576 1.539 3.097 1.00 0.00 O ATOM 3171 CB ASP B 104 19.216 -0.432 2.798 1.00 0.00 C ATOM 3172 CG ASP B 104 19.673 -0.794 4.218 1.00 0.00 C ATOM 3173 OD1 ASP B 104 19.065 -1.694 4.843 1.00 0.00 O ATOM 3174 OD2 ASP B 104 20.672 -0.200 4.681 1.00 0.00 O ATOM 0 H ASP B 104 17.166 0.819 1.133 1.00 0.00 H new ATOM 0 HA ASP B 104 17.392 -1.547 2.854 1.00 0.00 H new ATOM 0 HB2 ASP B 104 19.704 -1.096 2.085 1.00 0.00 H new ATOM 0 HB3 ASP B 104 19.542 0.581 2.564 1.00 0.00 H new ATOM 3179 N ASP B 105 16.776 0.090 4.805 1.00 0.00 N ATOM 3180 CA ASP B 105 16.006 0.851 5.785 1.00 0.00 C ATOM 3181 C ASP B 105 16.822 0.899 7.082 1.00 0.00 C ATOM 3182 O ASP B 105 17.150 -0.151 7.640 1.00 0.00 O ATOM 3183 CB ASP B 105 14.623 0.218 5.998 1.00 0.00 C ATOM 3184 CG ASP B 105 13.834 0.772 7.205 1.00 0.00 C ATOM 3185 OD1 ASP B 105 14.225 1.786 7.823 1.00 0.00 O ATOM 3186 OD2 ASP B 105 12.790 0.164 7.528 1.00 0.00 O ATOM 0 H ASP B 105 17.163 -0.772 5.188 1.00 0.00 H new ATOM 0 HA ASP B 105 15.827 1.867 5.432 1.00 0.00 H new ATOM 0 HB2 ASP B 105 14.029 0.365 5.096 1.00 0.00 H new ATOM 0 HB3 ASP B 105 14.747 -0.857 6.126 1.00 0.00 H new ATOM 3191 N PRO B 106 17.197 2.093 7.568 1.00 0.00 N ATOM 3192 CA PRO B 106 18.090 2.248 8.700 1.00 0.00 C ATOM 3193 C PRO B 106 17.466 1.761 10.012 1.00 0.00 C ATOM 3194 O PRO B 106 18.202 1.295 10.882 1.00 0.00 O ATOM 3195 CB PRO B 106 18.448 3.734 8.729 1.00 0.00 C ATOM 3196 CG PRO B 106 17.265 4.423 8.051 1.00 0.00 C ATOM 3197 CD PRO B 106 16.787 3.380 7.045 1.00 0.00 C ATOM 0 HA PRO B 106 18.981 1.630 8.593 1.00 0.00 H new ATOM 0 HB2 PRO B 106 18.583 4.090 9.750 1.00 0.00 H new ATOM 0 HB3 PRO B 106 19.379 3.929 8.197 1.00 0.00 H new ATOM 0 HG2 PRO B 106 16.484 4.680 8.767 1.00 0.00 H new ATOM 0 HG3 PRO B 106 17.565 5.349 7.560 1.00 0.00 H new ATOM 0 HD2 PRO B 106 15.705 3.424 6.924 1.00 0.00 H new ATOM 0 HD3 PRO B 106 17.225 3.558 6.063 1.00 0.00 H new ATOM 3205 N ALA B 107 16.133 1.781 10.160 1.00 0.00 N ATOM 3206 CA ALA B 107 15.449 1.231 11.323 1.00 0.00 C ATOM 3207 C ALA B 107 15.614 -0.295 11.443 1.00 0.00 C ATOM 3208 O ALA B 107 15.165 -0.881 12.430 1.00 0.00 O ATOM 3209 CB ALA B 107 13.966 1.617 11.269 1.00 0.00 C ATOM 0 H ALA B 107 15.502 2.184 9.467 1.00 0.00 H new ATOM 0 HA ALA B 107 15.910 1.658 12.214 1.00 0.00 H new ATOM 0 HB1 ALA B 107 13.451 1.207 12.138 1.00 0.00 H new ATOM 0 HB2 ALA B 107 13.872 2.703 11.271 1.00 0.00 H new ATOM 0 HB3 ALA B 107 13.519 1.216 10.360 1.00 0.00 H new ATOM 3215 N ARG B 108 16.243 -0.952 10.459 1.00 0.00 N ATOM 3216 CA ARG B 108 16.459 -2.403 10.431 1.00 0.00 C ATOM 3217 C ARG B 108 17.887 -2.762 10.848 1.00 0.00 C ATOM 3218 O ARG B 108 18.282 -3.920 10.685 1.00 0.00 O ATOM 3219 CB ARG B 108 16.192 -2.973 9.028 1.00 0.00 C ATOM 3220 CG ARG B 108 14.900 -2.502 8.349 1.00 0.00 C ATOM 3221 CD ARG B 108 13.604 -2.910 9.062 1.00 0.00 C ATOM 3222 NE ARG B 108 12.442 -2.447 8.292 1.00 0.00 N ATOM 3223 CZ ARG B 108 11.377 -3.154 7.907 1.00 0.00 C ATOM 3224 NH1 ARG B 108 11.167 -4.393 8.350 1.00 0.00 N ATOM 3225 NH2 ARG B 108 10.522 -2.604 7.060 1.00 0.00 N ATOM 0 H ARG B 108 16.625 -0.477 9.641 1.00 0.00 H new ATOM 0 HA ARG B 108 15.758 -2.842 11.141 1.00 0.00 H new ATOM 0 HB2 ARG B 108 17.033 -2.713 8.385 1.00 0.00 H new ATOM 0 HB3 ARG B 108 16.168 -4.061 9.097 1.00 0.00 H new ATOM 0 HG2 ARG B 108 14.925 -1.415 8.269 1.00 0.00 H new ATOM 0 HG3 ARG B 108 14.877 -2.896 7.333 1.00 0.00 H new ATOM 0 HD2 ARG B 108 13.567 -3.993 9.176 1.00 0.00 H new ATOM 0 HD3 ARG B 108 13.580 -2.483 10.065 1.00 0.00 H new ATOM 0 HE ARG B 108 12.450 -1.465 8.018 1.00 0.00 H new ATOM 0 HH11 ARG B 108 11.828 -4.822 8.998 1.00 0.00 H new ATOM 0 HH12 ARG B 108 10.346 -4.913 8.041 1.00 0.00 H new ATOM 0 HH21 ARG B 108 10.683 -1.658 6.715 1.00 0.00 H new ATOM 0 HH22 ARG B 108 9.701 -3.126 6.752 1.00 0.00 H new ATOM 3239 N ALA B 109 18.669 -1.789 11.330 1.00 0.00 N ATOM 3240 CA ALA B 109 20.029 -1.993 11.794 1.00 0.00 C ATOM 3241 C ALA B 109 20.114 -3.212 12.710 1.00 0.00 C ATOM 3242 O ALA B 109 19.201 -3.463 13.502 1.00 0.00 O ATOM 3243 CB ALA B 109 20.526 -0.750 12.533 1.00 0.00 C ATOM 0 H ALA B 109 18.359 -0.820 11.406 1.00 0.00 H new ATOM 0 HA ALA B 109 20.662 -2.170 10.925 1.00 0.00 H new ATOM 0 HB1 ALA B 109 21.547 -0.915 12.876 1.00 0.00 H new ATOM 0 HB2 ALA B 109 20.503 0.107 11.860 1.00 0.00 H new ATOM 0 HB3 ALA B 109 19.882 -0.555 13.390 1.00 0.00 H new ATOM 3249 N GLN B 110 21.232 -3.937 12.609 1.00 0.00 N ATOM 3250 CA GLN B 110 21.435 -5.200 13.313 1.00 0.00 C ATOM 3251 C GLN B 110 21.223 -5.002 14.810 1.00 0.00 C ATOM 3252 O GLN B 110 20.530 -5.798 15.443 1.00 0.00 O ATOM 3253 CB GLN B 110 22.836 -5.768 13.012 1.00 0.00 C ATOM 3254 CG GLN B 110 23.235 -7.014 13.823 1.00 0.00 C ATOM 3255 CD GLN B 110 22.278 -8.201 13.675 1.00 0.00 C ATOM 3256 OE1 GLN B 110 22.453 -9.064 12.819 1.00 0.00 O ATOM 3257 NE2 GLN B 110 21.257 -8.281 14.515 1.00 0.00 N ATOM 0 H GLN B 110 22.025 -3.659 12.031 1.00 0.00 H new ATOM 0 HA GLN B 110 20.703 -5.927 12.960 1.00 0.00 H new ATOM 0 HB2 GLN B 110 22.889 -6.014 11.951 1.00 0.00 H new ATOM 0 HB3 GLN B 110 23.573 -4.986 13.195 1.00 0.00 H new ATOM 0 HG2 GLN B 110 24.233 -7.328 13.516 1.00 0.00 H new ATOM 0 HG3 GLN B 110 23.296 -6.742 14.877 1.00 0.00 H new ATOM 0 HE21 GLN B 110 21.121 -7.559 15.222 1.00 0.00 H new ATOM 0 HE22 GLN B 110 20.607 -9.065 14.455 1.00 0.00 H new ATOM 3266 N GLY B 111 21.800 -3.938 15.367 1.00 0.00 N ATOM 3267 CA GLY B 111 21.487 -3.538 16.726 1.00 0.00 C ATOM 3268 C GLY B 111 22.682 -3.162 17.579 1.00 0.00 C ATOM 3269 O GLY B 111 22.514 -2.549 18.635 1.00 0.00 O ATOM 0 H GLY B 111 22.482 -3.344 14.896 1.00 0.00 H new ATOM 0 HA2 GLY B 111 20.805 -2.689 16.690 1.00 0.00 H new ATOM 0 HA3 GLY B 111 20.954 -4.354 17.214 1.00 0.00 H new ATOM 3273 N THR B 112 23.875 -3.539 17.136 1.00 0.00 N ATOM 3274 CA THR B 112 25.107 -3.120 17.782 1.00 0.00 C ATOM 3275 C THR B 112 25.267 -1.627 17.542 1.00 0.00 C ATOM 3276 O THR B 112 24.659 -1.059 16.629 1.00 0.00 O ATOM 3277 CB THR B 112 26.309 -3.909 17.250 1.00 0.00 C ATOM 3278 OG1 THR B 112 26.538 -3.596 15.902 1.00 0.00 O ATOM 3279 CG2 THR B 112 26.065 -5.407 17.317 1.00 0.00 C ATOM 0 H THR B 112 24.013 -4.140 16.324 1.00 0.00 H new ATOM 0 HA THR B 112 25.060 -3.322 18.852 1.00 0.00 H new ATOM 0 HB THR B 112 27.162 -3.638 17.872 1.00 0.00 H new ATOM 0 HG1 THR B 112 27.200 -4.215 15.530 1.00 0.00 H new ATOM 0 HG21 THR B 112 26.937 -5.935 16.932 1.00 0.00 H new ATOM 0 HG22 THR B 112 25.890 -5.701 18.352 1.00 0.00 H new ATOM 0 HG23 THR B 112 25.192 -5.661 16.715 1.00 0.00 H new ATOM 3287 N GLU B 113 26.112 -0.980 18.333 1.00 0.00 N ATOM 3288 CA GLU B 113 26.282 0.456 18.222 1.00 0.00 C ATOM 3289 C GLU B 113 26.879 0.828 16.865 1.00 0.00 C ATOM 3290 O GLU B 113 26.491 1.819 16.243 1.00 0.00 O ATOM 3291 CB GLU B 113 27.241 0.919 19.324 1.00 0.00 C ATOM 3292 CG GLU B 113 26.673 0.657 20.724 1.00 0.00 C ATOM 3293 CD GLU B 113 27.592 1.217 21.825 1.00 0.00 C ATOM 3294 OE1 GLU B 113 28.506 0.499 22.288 1.00 0.00 O ATOM 3295 OE2 GLU B 113 27.398 2.378 22.256 1.00 0.00 O ATOM 0 H GLU B 113 26.684 -1.424 19.051 1.00 0.00 H new ATOM 0 HA GLU B 113 25.309 0.937 18.322 1.00 0.00 H new ATOM 0 HB2 GLU B 113 28.194 0.402 19.216 1.00 0.00 H new ATOM 0 HB3 GLU B 113 27.441 1.984 19.207 1.00 0.00 H new ATOM 0 HG2 GLU B 113 25.686 1.112 20.807 1.00 0.00 H new ATOM 0 HG3 GLU B 113 26.543 -0.415 20.869 1.00 0.00 H new ATOM 3302 N GLU B 114 27.817 0.001 16.407 1.00 0.00 N ATOM 3303 CA GLU B 114 28.465 0.129 15.131 1.00 0.00 C ATOM 3304 C GLU B 114 27.464 -0.164 14.032 1.00 0.00 C ATOM 3305 O GLU B 114 27.450 0.595 13.075 1.00 0.00 O ATOM 3306 CB GLU B 114 29.699 -0.784 15.025 1.00 0.00 C ATOM 3307 CG GLU B 114 29.492 -2.198 15.573 1.00 0.00 C ATOM 3308 CD GLU B 114 30.798 -3.013 15.546 1.00 0.00 C ATOM 3309 OE1 GLU B 114 31.137 -3.608 14.497 1.00 0.00 O ATOM 3310 OE2 GLU B 114 31.501 -3.080 16.581 1.00 0.00 O ATOM 0 H GLU B 114 28.149 -0.801 16.944 1.00 0.00 H new ATOM 0 HA GLU B 114 28.827 1.151 15.021 1.00 0.00 H new ATOM 0 HB2 GLU B 114 29.995 -0.853 13.978 1.00 0.00 H new ATOM 0 HB3 GLU B 114 30.527 -0.318 15.560 1.00 0.00 H new ATOM 0 HG2 GLU B 114 29.119 -2.142 16.596 1.00 0.00 H new ATOM 0 HG3 GLU B 114 28.731 -2.709 14.984 1.00 0.00 H new ATOM 3317 N GLU B 115 26.605 -1.186 14.138 1.00 0.00 N ATOM 3318 CA GLU B 115 25.727 -1.513 13.027 1.00 0.00 C ATOM 3319 C GLU B 115 24.608 -0.481 12.940 1.00 0.00 C ATOM 3320 O GLU B 115 24.179 -0.153 11.840 1.00 0.00 O ATOM 3321 CB GLU B 115 25.217 -2.947 13.124 1.00 0.00 C ATOM 3322 CG GLU B 115 26.355 -3.955 12.860 1.00 0.00 C ATOM 3323 CD GLU B 115 26.586 -4.192 11.357 1.00 0.00 C ATOM 3324 OE1 GLU B 115 27.350 -3.430 10.723 1.00 0.00 O ATOM 3325 OE2 GLU B 115 26.028 -5.163 10.799 1.00 0.00 O ATOM 0 H GLU B 115 26.506 -1.781 14.961 1.00 0.00 H new ATOM 0 HA GLU B 115 26.289 -1.466 12.094 1.00 0.00 H new ATOM 0 HB2 GLU B 115 24.794 -3.121 14.114 1.00 0.00 H new ATOM 0 HB3 GLU B 115 24.414 -3.101 12.403 1.00 0.00 H new ATOM 0 HG2 GLU B 115 27.276 -3.588 13.314 1.00 0.00 H new ATOM 0 HG3 GLU B 115 26.118 -4.903 13.343 1.00 0.00 H new ATOM 3332 N LYS B 116 24.176 0.086 14.072 1.00 0.00 N ATOM 3333 CA LYS B 116 23.283 1.233 14.087 1.00 0.00 C ATOM 3334 C LYS B 116 23.905 2.365 13.300 1.00 0.00 C ATOM 3335 O LYS B 116 23.377 2.739 12.253 1.00 0.00 O ATOM 3336 CB LYS B 116 22.967 1.675 15.529 1.00 0.00 C ATOM 3337 CG LYS B 116 21.868 0.823 16.171 1.00 0.00 C ATOM 3338 CD LYS B 116 21.308 1.481 17.442 1.00 0.00 C ATOM 3339 CE LYS B 116 19.901 0.934 17.724 1.00 0.00 C ATOM 3340 NZ LYS B 116 19.347 1.437 19.006 1.00 0.00 N ATOM 0 H LYS B 116 24.440 -0.243 15.001 1.00 0.00 H new ATOM 0 HA LYS B 116 22.339 0.950 13.621 1.00 0.00 H new ATOM 0 HB2 LYS B 116 23.872 1.611 16.133 1.00 0.00 H new ATOM 0 HB3 LYS B 116 22.658 2.720 15.527 1.00 0.00 H new ATOM 0 HG2 LYS B 116 21.061 0.670 15.455 1.00 0.00 H new ATOM 0 HG3 LYS B 116 22.267 -0.161 16.416 1.00 0.00 H new ATOM 0 HD2 LYS B 116 21.965 1.279 18.288 1.00 0.00 H new ATOM 0 HD3 LYS B 116 21.271 2.563 17.318 1.00 0.00 H new ATOM 0 HE2 LYS B 116 19.235 1.214 16.908 1.00 0.00 H new ATOM 0 HE3 LYS B 116 19.935 -0.155 17.748 1.00 0.00 H new ATOM 0 HZ1 LYS B 116 18.397 1.041 19.153 1.00 0.00 H new ATOM 0 HZ2 LYS B 116 19.967 1.148 19.789 1.00 0.00 H new ATOM 0 HZ3 LYS B 116 19.288 2.475 18.975 1.00 0.00 H new ATOM 3354 N TRP B 117 25.046 2.872 13.765 1.00 0.00 N ATOM 3355 CA TRP B 117 25.665 4.022 13.128 1.00 0.00 C ATOM 3356 C TRP B 117 25.952 3.701 11.659 1.00 0.00 C ATOM 3357 O TRP B 117 25.696 4.527 10.789 1.00 0.00 O ATOM 3358 CB TRP B 117 26.915 4.465 13.907 1.00 0.00 C ATOM 3359 CG TRP B 117 27.278 5.913 13.786 1.00 0.00 C ATOM 3360 CD1 TRP B 117 27.240 6.651 12.656 1.00 0.00 C ATOM 3361 CD2 TRP B 117 27.715 6.831 14.836 1.00 0.00 C ATOM 3362 NE1 TRP B 117 27.579 7.952 12.929 1.00 0.00 N ATOM 3363 CE2 TRP B 117 27.876 8.124 14.259 1.00 0.00 C ATOM 3364 CE3 TRP B 117 27.982 6.712 16.218 1.00 0.00 C ATOM 3365 CZ2 TRP B 117 28.256 9.239 15.010 1.00 0.00 C ATOM 3366 CZ3 TRP B 117 28.399 7.824 16.980 1.00 0.00 C ATOM 3367 CH2 TRP B 117 28.534 9.089 16.379 1.00 0.00 C ATOM 0 H TRP B 117 25.552 2.506 14.572 1.00 0.00 H new ATOM 0 HA TRP B 117 24.981 4.871 13.146 1.00 0.00 H new ATOM 0 HB2 TRP B 117 26.764 4.235 14.962 1.00 0.00 H new ATOM 0 HB3 TRP B 117 27.762 3.868 13.569 1.00 0.00 H new ATOM 0 HD1 TRP B 117 26.980 6.272 11.679 1.00 0.00 H new ATOM 0 HE1 TRP B 117 27.607 8.697 12.233 1.00 0.00 H new ATOM 0 HE3 TRP B 117 27.865 5.753 16.700 1.00 0.00 H new ATOM 0 HZ2 TRP B 117 28.335 10.209 14.542 1.00 0.00 H new ATOM 0 HZ3 TRP B 117 28.616 7.703 18.031 1.00 0.00 H new ATOM 0 HH2 TRP B 117 28.849 9.939 16.966 1.00 0.00 H new ATOM 3378 N ALA B 118 26.398 2.482 11.359 1.00 0.00 N ATOM 3379 CA ALA B 118 26.718 2.049 10.014 1.00 0.00 C ATOM 3380 C ALA B 118 25.498 2.066 9.096 1.00 0.00 C ATOM 3381 O ALA B 118 25.598 2.574 7.978 1.00 0.00 O ATOM 3382 CB ALA B 118 27.355 0.653 10.091 1.00 0.00 C ATOM 0 H ALA B 118 26.547 1.759 12.063 1.00 0.00 H new ATOM 0 HA ALA B 118 27.427 2.750 9.572 1.00 0.00 H new ATOM 0 HB1 ALA B 118 27.603 0.310 9.086 1.00 0.00 H new ATOM 0 HB2 ALA B 118 28.263 0.700 10.693 1.00 0.00 H new ATOM 0 HB3 ALA B 118 26.652 -0.043 10.549 1.00 0.00 H new ATOM 3388 N PHE B 119 24.347 1.562 9.546 1.00 0.00 N ATOM 3389 CA PHE B 119 23.131 1.578 8.742 1.00 0.00 C ATOM 3390 C PHE B 119 22.696 3.021 8.502 1.00 0.00 C ATOM 3391 O PHE B 119 22.381 3.391 7.370 1.00 0.00 O ATOM 3392 CB PHE B 119 22.008 0.775 9.420 1.00 0.00 C ATOM 3393 CG PHE B 119 21.909 -0.680 8.988 1.00 0.00 C ATOM 3394 CD1 PHE B 119 22.970 -1.577 9.222 1.00 0.00 C ATOM 3395 CD2 PHE B 119 20.741 -1.145 8.351 1.00 0.00 C ATOM 3396 CE1 PHE B 119 22.858 -2.926 8.840 1.00 0.00 C ATOM 3397 CE2 PHE B 119 20.635 -2.491 7.960 1.00 0.00 C ATOM 3398 CZ PHE B 119 21.690 -3.384 8.209 1.00 0.00 C ATOM 0 H PHE B 119 24.235 1.137 10.467 1.00 0.00 H new ATOM 0 HA PHE B 119 23.339 1.104 7.783 1.00 0.00 H new ATOM 0 HB2 PHE B 119 22.158 0.809 10.499 1.00 0.00 H new ATOM 0 HB3 PHE B 119 21.056 1.265 9.215 1.00 0.00 H new ATOM 0 HD1 PHE B 119 23.874 -1.227 9.697 1.00 0.00 H new ATOM 0 HD2 PHE B 119 19.924 -0.464 8.162 1.00 0.00 H new ATOM 0 HE1 PHE B 119 23.671 -3.610 9.032 1.00 0.00 H new ATOM 0 HE2 PHE B 119 19.740 -2.839 7.467 1.00 0.00 H new ATOM 0 HZ PHE B 119 21.603 -4.420 7.916 1.00 0.00 H new ATOM 3408 N PHE B 120 22.704 3.847 9.551 1.00 0.00 N ATOM 3409 CA PHE B 120 22.224 5.220 9.460 1.00 0.00 C ATOM 3410 C PHE B 120 23.129 6.010 8.511 1.00 0.00 C ATOM 3411 O PHE B 120 22.640 6.732 7.642 1.00 0.00 O ATOM 3412 CB PHE B 120 22.179 5.881 10.851 1.00 0.00 C ATOM 3413 CG PHE B 120 21.518 5.130 12.006 1.00 0.00 C ATOM 3414 CD1 PHE B 120 20.707 3.988 11.816 1.00 0.00 C ATOM 3415 CD2 PHE B 120 21.774 5.572 13.319 1.00 0.00 C ATOM 3416 CE1 PHE B 120 20.200 3.281 12.921 1.00 0.00 C ATOM 3417 CE2 PHE B 120 21.261 4.869 14.422 1.00 0.00 C ATOM 3418 CZ PHE B 120 20.484 3.714 14.223 1.00 0.00 C ATOM 0 H PHE B 120 23.041 3.583 10.477 1.00 0.00 H new ATOM 0 HA PHE B 120 21.208 5.217 9.066 1.00 0.00 H new ATOM 0 HB2 PHE B 120 23.206 6.100 11.145 1.00 0.00 H new ATOM 0 HB3 PHE B 120 21.667 6.838 10.745 1.00 0.00 H new ATOM 0 HD1 PHE B 120 20.475 3.656 10.815 1.00 0.00 H new ATOM 0 HD2 PHE B 120 22.370 6.459 13.479 1.00 0.00 H new ATOM 0 HE1 PHE B 120 19.591 2.403 12.766 1.00 0.00 H new ATOM 0 HE2 PHE B 120 21.464 5.216 15.424 1.00 0.00 H new ATOM 0 HZ PHE B 120 20.107 3.162 15.071 1.00 0.00 H new ATOM 3428 N GLN B 121 24.447 5.825 8.633 1.00 0.00 N ATOM 3429 CA GLN B 121 25.432 6.527 7.837 1.00 0.00 C ATOM 3430 C GLN B 121 25.354 6.107 6.369 1.00 0.00 C ATOM 3431 O GLN B 121 25.422 6.953 5.476 1.00 0.00 O ATOM 3432 CB GLN B 121 26.817 6.272 8.433 1.00 0.00 C ATOM 3433 CG GLN B 121 27.889 7.058 7.680 1.00 0.00 C ATOM 3434 CD GLN B 121 29.180 7.142 8.495 1.00 0.00 C ATOM 3435 OE1 GLN B 121 30.206 6.578 8.125 1.00 0.00 O ATOM 3436 NE2 GLN B 121 29.159 7.839 9.625 1.00 0.00 N ATOM 0 H GLN B 121 24.856 5.171 9.301 1.00 0.00 H new ATOM 0 HA GLN B 121 25.230 7.598 7.861 1.00 0.00 H new ATOM 0 HB2 GLN B 121 26.823 6.558 9.485 1.00 0.00 H new ATOM 0 HB3 GLN B 121 27.045 5.207 8.391 1.00 0.00 H new ATOM 0 HG2 GLN B 121 28.090 6.579 6.722 1.00 0.00 H new ATOM 0 HG3 GLN B 121 27.525 8.062 7.464 1.00 0.00 H new ATOM 0 HE21 GLN B 121 28.301 8.303 9.922 1.00 0.00 H new ATOM 0 HE22 GLN B 121 30.001 7.910 10.196 1.00 0.00 H new ATOM 3445 N ARG B 122 25.187 4.809 6.108 1.00 0.00 N ATOM 3446 CA ARG B 122 25.066 4.299 4.749 1.00 0.00 C ATOM 3447 C ARG B 122 23.859 4.957 4.077 1.00 0.00 C ATOM 3448 O ARG B 122 23.964 5.523 2.985 1.00 0.00 O ATOM 3449 CB ARG B 122 24.901 2.766 4.837 1.00 0.00 C ATOM 3450 CG ARG B 122 24.621 2.027 3.514 1.00 0.00 C ATOM 3451 CD ARG B 122 23.930 0.677 3.775 1.00 0.00 C ATOM 3452 NE ARG B 122 24.719 -0.198 4.664 1.00 0.00 N ATOM 3453 CZ ARG B 122 24.253 -0.954 5.671 1.00 0.00 C ATOM 3454 NH1 ARG B 122 22.955 -1.045 5.942 1.00 0.00 N ATOM 3455 NH2 ARG B 122 25.115 -1.628 6.427 1.00 0.00 N ATOM 0 H ARG B 122 25.133 4.090 6.829 1.00 0.00 H new ATOM 0 HA ARG B 122 25.948 4.530 4.151 1.00 0.00 H new ATOM 0 HB2 ARG B 122 25.808 2.350 5.275 1.00 0.00 H new ATOM 0 HB3 ARG B 122 24.086 2.550 5.528 1.00 0.00 H new ATOM 0 HG2 ARG B 122 23.991 2.645 2.874 1.00 0.00 H new ATOM 0 HG3 ARG B 122 25.556 1.864 2.979 1.00 0.00 H new ATOM 0 HD2 ARG B 122 22.951 0.854 4.220 1.00 0.00 H new ATOM 0 HD3 ARG B 122 23.762 0.169 2.826 1.00 0.00 H new ATOM 0 HE ARG B 122 25.724 -0.232 4.496 1.00 0.00 H new ATOM 0 HH11 ARG B 122 22.279 -0.531 5.377 1.00 0.00 H new ATOM 0 HH12 ARG B 122 22.635 -1.629 6.715 1.00 0.00 H new ATOM 0 HH21 ARG B 122 26.115 -1.566 6.238 1.00 0.00 H new ATOM 0 HH22 ARG B 122 24.776 -2.206 7.196 1.00 0.00 H new ATOM 3469 N VAL B 123 22.706 4.889 4.745 1.00 0.00 N ATOM 3470 CA VAL B 123 21.456 5.373 4.193 1.00 0.00 C ATOM 3471 C VAL B 123 21.509 6.890 4.003 1.00 0.00 C ATOM 3472 O VAL B 123 21.062 7.360 2.958 1.00 0.00 O ATOM 3473 CB VAL B 123 20.284 4.899 5.074 1.00 0.00 C ATOM 3474 CG1 VAL B 123 18.971 5.578 4.664 1.00 0.00 C ATOM 3475 CG2 VAL B 123 20.115 3.374 4.953 1.00 0.00 C ATOM 0 H VAL B 123 22.621 4.496 5.682 1.00 0.00 H new ATOM 0 HA VAL B 123 21.293 4.953 3.200 1.00 0.00 H new ATOM 0 HB VAL B 123 20.514 5.169 6.105 1.00 0.00 H new ATOM 0 HG11 VAL B 123 18.163 5.223 5.304 1.00 0.00 H new ATOM 0 HG12 VAL B 123 19.071 6.658 4.771 1.00 0.00 H new ATOM 0 HG13 VAL B 123 18.745 5.336 3.626 1.00 0.00 H new ATOM 0 HG21 VAL B 123 19.284 3.049 5.579 1.00 0.00 H new ATOM 0 HG22 VAL B 123 19.911 3.112 3.915 1.00 0.00 H new ATOM 0 HG23 VAL B 123 21.030 2.880 5.279 1.00 0.00 H new ATOM 3485 N ARG B 124 22.058 7.668 4.949 1.00 0.00 N ATOM 3486 CA ARG B 124 22.054 9.124 4.795 1.00 0.00 C ATOM 3487 C ARG B 124 22.842 9.556 3.569 1.00 0.00 C ATOM 3488 O ARG B 124 22.431 10.497 2.898 1.00 0.00 O ATOM 3489 CB ARG B 124 22.519 9.851 6.069 1.00 0.00 C ATOM 3490 CG ARG B 124 24.025 9.855 6.333 1.00 0.00 C ATOM 3491 CD ARG B 124 24.345 10.709 7.557 1.00 0.00 C ATOM 3492 NE ARG B 124 25.698 10.454 8.064 1.00 0.00 N ATOM 3493 CZ ARG B 124 26.862 10.947 7.624 1.00 0.00 C ATOM 3494 NH1 ARG B 124 26.942 11.611 6.475 1.00 0.00 N ATOM 3495 NH2 ARG B 124 27.947 10.763 8.366 1.00 0.00 N ATOM 0 H ARG B 124 22.497 7.323 5.803 1.00 0.00 H new ATOM 0 HA ARG B 124 21.018 9.423 4.636 1.00 0.00 H new ATOM 0 HB2 ARG B 124 22.178 10.885 6.017 1.00 0.00 H new ATOM 0 HB3 ARG B 124 22.022 9.394 6.925 1.00 0.00 H new ATOM 0 HG2 ARG B 124 24.376 8.835 6.490 1.00 0.00 H new ATOM 0 HG3 ARG B 124 24.553 10.243 5.462 1.00 0.00 H new ATOM 0 HD2 ARG B 124 24.247 11.764 7.300 1.00 0.00 H new ATOM 0 HD3 ARG B 124 23.618 10.504 8.343 1.00 0.00 H new ATOM 0 HE ARG B 124 25.760 9.816 8.857 1.00 0.00 H new ATOM 0 HH11 ARG B 124 26.105 11.754 5.909 1.00 0.00 H new ATOM 0 HH12 ARG B 124 27.840 11.978 6.159 1.00 0.00 H new ATOM 0 HH21 ARG B 124 27.881 10.256 9.249 1.00 0.00 H new ATOM 0 HH22 ARG B 124 28.847 11.129 8.054 1.00 0.00 H new ATOM 3509 N ASP B 125 23.952 8.879 3.275 1.00 0.00 N ATOM 3510 CA ASP B 125 24.767 9.210 2.112 1.00 0.00 C ATOM 3511 C ASP B 125 23.974 8.978 0.825 1.00 0.00 C ATOM 3512 O ASP B 125 23.971 9.840 -0.055 1.00 0.00 O ATOM 3513 CB ASP B 125 26.057 8.386 2.101 1.00 0.00 C ATOM 3514 CG ASP B 125 26.877 8.686 0.835 1.00 0.00 C ATOM 3515 OD1 ASP B 125 27.499 9.768 0.758 1.00 0.00 O ATOM 3516 OD2 ASP B 125 26.932 7.828 -0.073 1.00 0.00 O ATOM 0 H ASP B 125 24.305 8.098 3.828 1.00 0.00 H new ATOM 0 HA ASP B 125 25.037 10.264 2.171 1.00 0.00 H new ATOM 0 HB2 ASP B 125 26.649 8.614 2.987 1.00 0.00 H new ATOM 0 HB3 ASP B 125 25.817 7.324 2.143 1.00 0.00 H new ATOM 3521 N GLU B 126 23.257 7.852 0.740 1.00 0.00 N ATOM 3522 CA GLU B 126 22.411 7.539 -0.409 1.00 0.00 C ATOM 3523 C GLU B 126 21.285 8.577 -0.538 1.00 0.00 C ATOM 3524 O GLU B 126 21.169 9.253 -1.564 1.00 0.00 O ATOM 3525 CB GLU B 126 21.855 6.111 -0.243 1.00 0.00 C ATOM 3526 CG GLU B 126 20.996 5.637 -1.425 1.00 0.00 C ATOM 3527 CD GLU B 126 21.846 5.275 -2.652 1.00 0.00 C ATOM 3528 OE1 GLU B 126 22.204 6.187 -3.427 1.00 0.00 O ATOM 3529 OE2 GLU B 126 22.154 4.076 -2.853 1.00 0.00 O ATOM 0 H GLU B 126 23.249 7.136 1.466 1.00 0.00 H new ATOM 0 HA GLU B 126 22.995 7.581 -1.329 1.00 0.00 H new ATOM 0 HB2 GLU B 126 22.688 5.420 -0.112 1.00 0.00 H new ATOM 0 HB3 GLU B 126 21.258 6.068 0.668 1.00 0.00 H new ATOM 0 HG2 GLU B 126 20.411 4.769 -1.122 1.00 0.00 H new ATOM 0 HG3 GLU B 126 20.288 6.420 -1.694 1.00 0.00 H new ATOM 3536 N ILE B 127 20.474 8.722 0.515 1.00 0.00 N ATOM 3537 CA ILE B 127 19.295 9.582 0.534 1.00 0.00 C ATOM 3538 C ILE B 127 19.700 11.021 0.207 1.00 0.00 C ATOM 3539 O ILE B 127 19.072 11.648 -0.647 1.00 0.00 O ATOM 3540 CB ILE B 127 18.565 9.429 1.896 1.00 0.00 C ATOM 3541 CG1 ILE B 127 17.711 8.137 1.864 1.00 0.00 C ATOM 3542 CG2 ILE B 127 17.691 10.640 2.253 1.00 0.00 C ATOM 3543 CD1 ILE B 127 16.891 7.848 3.130 1.00 0.00 C ATOM 0 H ILE B 127 20.626 8.232 1.396 1.00 0.00 H new ATOM 0 HA ILE B 127 18.583 9.283 -0.235 1.00 0.00 H new ATOM 0 HB ILE B 127 19.326 9.367 2.674 1.00 0.00 H new ATOM 0 HG12 ILE B 127 17.028 8.196 1.017 1.00 0.00 H new ATOM 0 HG13 ILE B 127 18.373 7.291 1.681 1.00 0.00 H new ATOM 0 HG21 ILE B 127 17.209 10.470 3.216 1.00 0.00 H new ATOM 0 HG22 ILE B 127 18.313 11.533 2.312 1.00 0.00 H new ATOM 0 HG23 ILE B 127 16.930 10.778 1.485 1.00 0.00 H new ATOM 0 HD11 ILE B 127 16.332 6.921 2.998 1.00 0.00 H new ATOM 0 HD12 ILE B 127 17.562 7.749 3.983 1.00 0.00 H new ATOM 0 HD13 ILE B 127 16.196 8.668 3.308 1.00 0.00 H new ATOM 3555 N GLY B 128 20.747 11.535 0.854 1.00 0.00 N ATOM 3556 CA GLY B 128 21.168 12.911 0.696 1.00 0.00 C ATOM 3557 C GLY B 128 21.591 13.198 -0.734 1.00 0.00 C ATOM 3558 O GLY B 128 21.166 14.211 -1.290 1.00 0.00 O ATOM 0 H GLY B 128 21.323 10.999 1.503 1.00 0.00 H new ATOM 0 HA2 GLY B 128 20.353 13.578 0.977 1.00 0.00 H new ATOM 0 HA3 GLY B 128 21.997 13.120 1.372 1.00 0.00 H new ATOM 3562 N ASN B 129 22.370 12.309 -1.364 1.00 0.00 N ATOM 3563 CA ASN B 129 22.823 12.552 -2.728 1.00 0.00 C ATOM 3564 C ASN B 129 21.646 12.566 -3.693 1.00 0.00 C ATOM 3565 O ASN B 129 21.557 13.459 -4.532 1.00 0.00 O ATOM 3566 CB ASN B 129 23.885 11.542 -3.185 1.00 0.00 C ATOM 3567 CG ASN B 129 24.767 12.137 -4.285 1.00 0.00 C ATOM 3568 OD1 ASN B 129 25.961 12.333 -4.076 1.00 0.00 O ATOM 3569 ND2 ASN B 129 24.243 12.473 -5.455 1.00 0.00 N ATOM 0 H ASN B 129 22.692 11.432 -0.955 1.00 0.00 H new ATOM 0 HA ASN B 129 23.296 13.534 -2.733 1.00 0.00 H new ATOM 0 HB2 ASN B 129 24.503 11.249 -2.336 1.00 0.00 H new ATOM 0 HB3 ASN B 129 23.399 10.638 -3.552 1.00 0.00 H new ATOM 0 HD21 ASN B 129 24.831 12.892 -6.176 1.00 0.00 H new ATOM 0 HD22 ASN B 129 23.252 12.313 -5.635 1.00 0.00 H new ATOM 3576 N ARG B 130 20.722 11.609 -3.568 1.00 0.00 N ATOM 3577 CA ARG B 130 19.555 11.558 -4.449 1.00 0.00 C ATOM 3578 C ARG B 130 18.648 12.772 -4.233 1.00 0.00 C ATOM 3579 O ARG B 130 18.153 13.325 -5.214 1.00 0.00 O ATOM 3580 CB ARG B 130 18.784 10.237 -4.274 1.00 0.00 C ATOM 3581 CG ARG B 130 19.259 9.097 -5.196 1.00 0.00 C ATOM 3582 CD ARG B 130 20.674 8.556 -4.940 1.00 0.00 C ATOM 3583 NE ARG B 130 21.721 9.288 -5.674 1.00 0.00 N ATOM 3584 CZ ARG B 130 22.965 8.849 -5.890 1.00 0.00 C ATOM 3585 NH1 ARG B 130 23.427 7.743 -5.315 1.00 0.00 N ATOM 3586 NH2 ARG B 130 23.743 9.551 -6.699 1.00 0.00 N ATOM 0 H ARG B 130 20.760 10.865 -2.871 1.00 0.00 H new ATOM 0 HA ARG B 130 19.910 11.594 -5.479 1.00 0.00 H new ATOM 0 HB2 ARG B 130 18.875 9.912 -3.238 1.00 0.00 H new ATOM 0 HB3 ARG B 130 17.726 10.421 -4.459 1.00 0.00 H new ATOM 0 HG2 ARG B 130 18.555 8.269 -5.106 1.00 0.00 H new ATOM 0 HG3 ARG B 130 19.209 9.448 -6.227 1.00 0.00 H new ATOM 0 HD2 ARG B 130 20.887 8.606 -3.872 1.00 0.00 H new ATOM 0 HD3 ARG B 130 20.710 7.504 -5.223 1.00 0.00 H new ATOM 0 HE ARG B 130 21.477 10.205 -6.048 1.00 0.00 H new ATOM 0 HH11 ARG B 130 22.827 7.205 -4.690 1.00 0.00 H new ATOM 0 HH12 ARG B 130 24.381 7.433 -5.499 1.00 0.00 H new ATOM 0 HH21 ARG B 130 23.388 10.401 -7.137 1.00 0.00 H new ATOM 0 HH22 ARG B 130 24.697 9.242 -6.884 1.00 0.00 H new ATOM 3600 N LEU B 131 18.441 13.233 -2.993 1.00 0.00 N ATOM 3601 CA LEU B 131 17.609 14.415 -2.761 1.00 0.00 C ATOM 3602 C LEU B 131 18.287 15.682 -3.279 1.00 0.00 C ATOM 3603 O LEU B 131 17.616 16.541 -3.854 1.00 0.00 O ATOM 3604 CB LEU B 131 17.212 14.570 -1.275 1.00 0.00 C ATOM 3605 CG LEU B 131 15.733 14.237 -0.988 1.00 0.00 C ATOM 3606 CD1 LEU B 131 14.789 15.145 -1.800 1.00 0.00 C ATOM 3607 CD2 LEU B 131 15.424 12.761 -1.258 1.00 0.00 C ATOM 0 H LEU B 131 18.832 12.813 -2.150 1.00 0.00 H new ATOM 0 HA LEU B 131 16.689 14.266 -3.326 1.00 0.00 H new ATOM 0 HB2 LEU B 131 17.845 13.921 -0.670 1.00 0.00 H new ATOM 0 HB3 LEU B 131 17.412 15.594 -0.960 1.00 0.00 H new ATOM 0 HG LEU B 131 15.561 14.426 0.072 1.00 0.00 H new ATOM 0 HD11 LEU B 131 13.754 14.886 -1.576 1.00 0.00 H new ATOM 0 HD12 LEU B 131 14.968 16.187 -1.534 1.00 0.00 H new ATOM 0 HD13 LEU B 131 14.976 15.005 -2.865 1.00 0.00 H new ATOM 0 HD21 LEU B 131 14.373 12.564 -1.045 1.00 0.00 H new ATOM 0 HD22 LEU B 131 15.631 12.531 -2.303 1.00 0.00 H new ATOM 0 HD23 LEU B 131 16.047 12.136 -0.618 1.00 0.00 H new ATOM 3619 N LYS B 132 19.609 15.804 -3.121 1.00 0.00 N ATOM 3620 CA LYS B 132 20.362 16.911 -3.692 1.00 0.00 C ATOM 3621 C LYS B 132 20.265 16.865 -5.214 1.00 0.00 C ATOM 3622 O LYS B 132 20.046 17.904 -5.828 1.00 0.00 O ATOM 3623 CB LYS B 132 21.803 16.821 -3.178 1.00 0.00 C ATOM 3624 CG LYS B 132 22.673 18.002 -3.622 1.00 0.00 C ATOM 3625 CD LYS B 132 24.091 17.897 -3.044 1.00 0.00 C ATOM 3626 CE LYS B 132 24.132 18.132 -1.526 1.00 0.00 C ATOM 3627 NZ LYS B 132 25.521 18.128 -1.000 1.00 0.00 N ATOM 0 H LYS B 132 20.178 15.140 -2.596 1.00 0.00 H new ATOM 0 HA LYS B 132 19.954 17.874 -3.386 1.00 0.00 H new ATOM 0 HB2 LYS B 132 21.792 16.774 -2.089 1.00 0.00 H new ATOM 0 HB3 LYS B 132 22.252 15.893 -3.532 1.00 0.00 H new ATOM 0 HG2 LYS B 132 22.723 18.031 -4.710 1.00 0.00 H new ATOM 0 HG3 LYS B 132 22.214 18.936 -3.299 1.00 0.00 H new ATOM 0 HD2 LYS B 132 24.497 16.910 -3.266 1.00 0.00 H new ATOM 0 HD3 LYS B 132 24.735 18.625 -3.538 1.00 0.00 H new ATOM 0 HE2 LYS B 132 23.659 19.086 -1.294 1.00 0.00 H new ATOM 0 HE3 LYS B 132 23.552 17.358 -1.023 1.00 0.00 H new ATOM 0 HZ1 LYS B 132 25.504 18.290 0.027 1.00 0.00 H new ATOM 0 HZ2 LYS B 132 25.965 17.208 -1.198 1.00 0.00 H new ATOM 0 HZ3 LYS B 132 26.069 18.883 -1.460 1.00 0.00 H new ATOM 3641 N GLU B 133 20.350 15.685 -5.834 1.00 0.00 N ATOM 3642 CA GLU B 133 20.130 15.562 -7.265 1.00 0.00 C ATOM 3643 C GLU B 133 18.735 16.000 -7.637 1.00 0.00 C ATOM 3644 O GLU B 133 18.615 16.656 -8.656 1.00 0.00 O ATOM 3645 CB GLU B 133 20.331 14.131 -7.782 1.00 0.00 C ATOM 3646 CG GLU B 133 21.796 13.867 -8.112 1.00 0.00 C ATOM 3647 CD GLU B 133 22.083 12.361 -8.192 1.00 0.00 C ATOM 3648 OE1 GLU B 133 22.091 11.694 -7.130 1.00 0.00 O ATOM 3649 OE2 GLU B 133 22.344 11.840 -9.301 1.00 0.00 O ATOM 0 H GLU B 133 20.569 14.807 -5.363 1.00 0.00 H new ATOM 0 HA GLU B 133 20.874 16.208 -7.730 1.00 0.00 H new ATOM 0 HB2 GLU B 133 19.990 13.418 -7.031 1.00 0.00 H new ATOM 0 HB3 GLU B 133 19.721 13.973 -8.671 1.00 0.00 H new ATOM 0 HG2 GLU B 133 22.049 14.339 -9.061 1.00 0.00 H new ATOM 0 HG3 GLU B 133 22.431 14.321 -7.351 1.00 0.00 H new ATOM 3656 N PHE B 134 17.680 15.700 -6.883 1.00 0.00 N ATOM 3657 CA PHE B 134 16.346 16.136 -7.285 1.00 0.00 C ATOM 3658 C PHE B 134 16.275 17.662 -7.413 1.00 0.00 C ATOM 3659 O PHE B 134 15.676 18.173 -8.359 1.00 0.00 O ATOM 3660 CB PHE B 134 15.300 15.595 -6.312 1.00 0.00 C ATOM 3661 CG PHE B 134 13.922 16.205 -6.491 1.00 0.00 C ATOM 3662 CD1 PHE B 134 13.183 15.987 -7.669 1.00 0.00 C ATOM 3663 CD2 PHE B 134 13.397 17.038 -5.488 1.00 0.00 C ATOM 3664 CE1 PHE B 134 11.927 16.598 -7.836 1.00 0.00 C ATOM 3665 CE2 PHE B 134 12.138 17.643 -5.655 1.00 0.00 C ATOM 3666 CZ PHE B 134 11.400 17.423 -6.829 1.00 0.00 C ATOM 0 H PHE B 134 17.719 15.170 -6.012 1.00 0.00 H new ATOM 0 HA PHE B 134 16.128 15.728 -8.272 1.00 0.00 H new ATOM 0 HB2 PHE B 134 15.227 14.514 -6.435 1.00 0.00 H new ATOM 0 HB3 PHE B 134 15.638 15.777 -5.292 1.00 0.00 H new ATOM 0 HD1 PHE B 134 13.581 15.350 -8.445 1.00 0.00 H new ATOM 0 HD2 PHE B 134 13.963 17.214 -4.585 1.00 0.00 H new ATOM 0 HE1 PHE B 134 11.365 16.432 -8.743 1.00 0.00 H new ATOM 0 HE2 PHE B 134 11.738 18.278 -4.878 1.00 0.00 H new ATOM 0 HZ PHE B 134 10.433 17.886 -6.957 1.00 0.00 H new ATOM 3676 N ALA B 135 16.958 18.385 -6.523 1.00 0.00 N ATOM 3677 CA ALA B 135 17.062 19.834 -6.588 1.00 0.00 C ATOM 3678 C ALA B 135 17.762 20.317 -7.870 1.00 0.00 C ATOM 3679 O ALA B 135 17.466 21.405 -8.364 1.00 0.00 O ATOM 3680 CB ALA B 135 17.820 20.336 -5.358 1.00 0.00 C ATOM 0 H ALA B 135 17.456 17.973 -5.734 1.00 0.00 H new ATOM 0 HA ALA B 135 16.051 20.241 -6.606 1.00 0.00 H new ATOM 0 HB1 ALA B 135 17.902 21.422 -5.399 1.00 0.00 H new ATOM 0 HB2 ALA B 135 17.281 20.047 -4.456 1.00 0.00 H new ATOM 0 HB3 ALA B 135 18.818 19.897 -5.341 1.00 0.00 H new ATOM 3686 N GLU B 136 18.698 19.523 -8.396 1.00 0.00 N ATOM 3687 CA GLU B 136 19.549 19.854 -9.530 1.00 0.00 C ATOM 3688 C GLU B 136 18.898 19.433 -10.852 1.00 0.00 C ATOM 3689 O GLU B 136 18.916 20.172 -11.838 1.00 0.00 O ATOM 3690 CB GLU B 136 20.903 19.133 -9.384 1.00 0.00 C ATOM 3691 CG GLU B 136 21.746 19.598 -8.190 1.00 0.00 C ATOM 3692 CD GLU B 136 22.489 20.915 -8.479 1.00 0.00 C ATOM 3693 OE1 GLU B 136 21.903 22.007 -8.300 1.00 0.00 O ATOM 3694 OE2 GLU B 136 23.675 20.872 -8.881 1.00 0.00 O ATOM 0 H GLU B 136 18.888 18.593 -8.023 1.00 0.00 H new ATOM 0 HA GLU B 136 19.694 20.934 -9.542 1.00 0.00 H new ATOM 0 HB2 GLU B 136 20.722 18.062 -9.290 1.00 0.00 H new ATOM 0 HB3 GLU B 136 21.479 19.279 -10.298 1.00 0.00 H new ATOM 0 HG2 GLU B 136 21.101 19.730 -7.322 1.00 0.00 H new ATOM 0 HG3 GLU B 136 22.469 18.824 -7.935 1.00 0.00 H new ATOM 3701 N THR B 137 18.330 18.233 -10.856 1.00 0.00 N ATOM 3702 CA THR B 137 17.836 17.519 -12.025 1.00 0.00 C ATOM 3703 C THR B 137 16.365 17.866 -12.292 1.00 0.00 C ATOM 3704 O THR B 137 15.905 17.761 -13.432 1.00 0.00 O ATOM 3705 CB THR B 137 18.042 16.002 -11.787 1.00 0.00 C ATOM 3706 OG1 THR B 137 17.312 15.560 -10.659 1.00 0.00 O ATOM 3707 CG2 THR B 137 19.527 15.642 -11.600 1.00 0.00 C ATOM 0 H THR B 137 18.195 17.703 -9.995 1.00 0.00 H new ATOM 0 HA THR B 137 18.389 17.818 -12.915 1.00 0.00 H new ATOM 0 HB THR B 137 17.674 15.497 -12.680 1.00 0.00 H new ATOM 0 HG1 THR B 137 17.828 15.737 -9.845 1.00 0.00 H new ATOM 0 HG21 THR B 137 19.623 14.569 -11.436 1.00 0.00 H new ATOM 0 HG22 THR B 137 20.085 15.924 -12.493 1.00 0.00 H new ATOM 0 HG23 THR B 137 19.926 16.178 -10.739 1.00 0.00 H new ATOM 3715 N GLY B 138 15.628 18.296 -11.257 1.00 0.00 N ATOM 3716 CA GLY B 138 14.181 18.460 -11.297 1.00 0.00 C ATOM 3717 C GLY B 138 13.479 17.168 -11.720 1.00 0.00 C ATOM 3718 O GLY B 138 12.466 17.232 -12.419 1.00 0.00 O ATOM 0 H GLY B 138 16.036 18.542 -10.355 1.00 0.00 H new ATOM 0 HA2 GLY B 138 13.822 18.765 -10.314 1.00 0.00 H new ATOM 0 HA3 GLY B 138 13.924 19.259 -11.993 1.00 0.00 H new ATOM 3722 N LYS B 139 14.063 16.013 -11.371 1.00 0.00 N ATOM 3723 CA LYS B 139 13.615 14.704 -11.827 1.00 0.00 C ATOM 3724 C LYS B 139 12.137 14.483 -11.524 1.00 0.00 C ATOM 3725 O LYS B 139 11.744 14.532 -10.344 1.00 0.00 O ATOM 3726 CB LYS B 139 14.523 13.614 -11.245 1.00 0.00 C ATOM 3727 CG LYS B 139 13.977 12.225 -11.591 1.00 0.00 C ATOM 3728 CD LYS B 139 15.021 11.109 -11.523 1.00 0.00 C ATOM 3729 CE LYS B 139 15.846 11.114 -10.227 1.00 0.00 C ATOM 3730 NZ LYS B 139 16.721 9.922 -10.134 1.00 0.00 N ATOM 3731 OXT LYS B 139 11.392 14.191 -12.484 1.00 0.00 O ATOM 0 H LYS B 139 14.873 15.969 -10.753 1.00 0.00 H new ATOM 0 HA LYS B 139 13.700 14.652 -12.912 1.00 0.00 H new ATOM 0 HB2 LYS B 139 15.533 13.724 -11.640 1.00 0.00 H new ATOM 0 HB3 LYS B 139 14.590 13.727 -10.163 1.00 0.00 H new ATOM 0 HG2 LYS B 139 13.161 11.987 -10.909 1.00 0.00 H new ATOM 0 HG3 LYS B 139 13.555 12.252 -12.596 1.00 0.00 H new ATOM 0 HD2 LYS B 139 14.518 10.147 -11.620 1.00 0.00 H new ATOM 0 HD3 LYS B 139 15.696 11.203 -12.374 1.00 0.00 H new ATOM 0 HE2 LYS B 139 16.455 12.017 -10.186 1.00 0.00 H new ATOM 0 HE3 LYS B 139 15.176 11.142 -9.368 1.00 0.00 H new ATOM 0 HZ1 LYS B 139 17.348 10.015 -9.310 1.00 0.00 H new ATOM 0 HZ2 LYS B 139 16.135 9.069 -10.029 1.00 0.00 H new ATOM 0 HZ3 LYS B 139 17.295 9.844 -10.998 1.00 0.00 H new