USER MOD reduce.3.24.130724 H: found=0, std=0, add=1207, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1208 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 99 THR OG1 : rot 17:sc= 0.51 USER MOD Set 1.2: A 114 LYS NZ :NH3+ 134:sc= 0.369 (180deg=-0.256) USER MOD Set 2.1: A 77 MET CE :methyl 154:sc= -0.551 (180deg=-2.17!) USER MOD Set 2.2: A 111 MET CE :methyl 134:sc= -0.298 (180deg=-0.718) USER MOD Set 3.1: A 46 THR OG1 : rot -6:sc= 1.3 USER MOD Set 3.2: A 72 HIS : no HE2:sc= -2.47! C(o=-1.2!,f=-11!) USER MOD Set 4.1: A 33 ASN : amide:sc= -1.4 X(o=-1.8,f=-1.6!) USER MOD Set 4.2: A 39 THR OG1 : rot -116:sc= -0.43 USER MOD Set 5.1: A 35 MET CE :methyl -108:sc= -2.01 (180deg=-3.05!) USER MOD Set 5.2: A 86 ASN : amide:sc= -2.63! K(o=-4.6!,f=-2.3) USER MOD Set 6.1: A 27 GLN : amide:sc= -0.109 K(o=0.31,f=-3.2) USER MOD Set 6.2: A 74 LYS NZ :NH3+ 179:sc= 0.415 (180deg=0) USER MOD Set 7.1: A 23 TYR OH : rot -112:sc= 1.28 USER MOD Set 7.2: A 95 TYR OH : rot 134:sc= -2.13! USER MOD Single : A 10 CYS SG : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot -34:sc= 0.14 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 18 HIS : no HD1:sc= -1.41 X(o=-1.4,f=-1.5) USER MOD Single : A 19 ASN : amide:sc= -2.02! C(o=-2!,f=-6.6!) USER MOD Single : A 25 SER OG : rot 100:sc= 0.746 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 51 GLN : amide:sc= -0.837 K(o=-0.84,f=-5.4!) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 TYR OH : rot 8:sc= 1.25 USER MOD Single : A 62 CYS SG : rot 180:sc= -0.123 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 146:sc= 1.23 (180deg=1.17) USER MOD Single : A 80 THR OG1 : rot -76:sc= 0.721 USER MOD Single : A 81 SER OG : rot 140:sc= -1.29 USER MOD Single : A 93 ASN : amide:sc= 1.12 K(o=1.1,f=0) USER MOD Single : A 107 ASN : amide:sc= -1.86 K(o=-1.9,f=-6.4!) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 THR OG1 : rot 72:sc= 1.18 USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 117 MET CE :methyl -110:sc= -1.01 (180deg=-4.73!) USER MOD Single : A 120 ASN : amide:sc= 0.478 K(o=0.48,f=-0.55) USER MOD Single : A 121 LYS NZ :NH3+ 152:sc= 1.21 (180deg=0.721) USER MOD Single : A 126 MET CE :methyl 173:sc= -3.27! (180deg=-3.35!) USER MOD Single : A 131 ASN : amide:sc= -0.0325 X(o=-0.032,f=-0.31) USER MOD Single : A 136 LYS NZ :NH3+ 160:sc= 0.266 (180deg=-0.615) USER MOD Single : A 139 HIS : no HD1:sc= 0 X(o=0,f=-0.0065) USER MOD Single : A 140 LYS NZ :NH3+ 178:sc= 1.27 (180deg=1.23) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 LYS NZ :NH3+ -175:sc= 1.9 (180deg=1.79) USER MOD Single : A 146 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 LYS NZ :NH3+ -170:sc= -0.0108 (180deg=-0.126) USER MOD Single : A 151 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 153 CYS SG : rot 180:sc= 0 USER MOD Single : A 154 LYS NZ :NH3+ -166:sc= -0.0126 (180deg=-0.269) USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 158 GLN : amide:sc= 0 K(o=0,f=-0.57) USER MOD ----------------------------------------------------------------- ATOM 1 N CYS A 10 -26.853 -20.309 -14.314 1.00 54.44 N ATOM 2 CA CYS A 10 -28.255 -20.268 -14.619 1.00 32.03 C ATOM 3 C CYS A 10 -28.623 -18.906 -15.175 1.00 5.43 C ATOM 4 O CYS A 10 -27.986 -17.899 -14.838 1.00 1.12 O ATOM 5 CB CYS A 10 -29.064 -20.508 -13.331 1.00 42.34 C ATOM 6 SG CYS A 10 -28.701 -22.059 -12.471 1.00 43.31 S ATOM 0 HA CYS A 10 -28.480 -21.039 -15.356 1.00 32.03 H new ATOM 0 HB2 CYS A 10 -28.881 -19.680 -12.646 1.00 42.34 H new ATOM 0 HB3 CYS A 10 -30.125 -20.488 -13.579 1.00 42.34 H new ATOM 0 HG CYS A 10 -29.439 -22.147 -11.405 1.00 43.31 H new ATOM 12 N SER A 11 -29.613 -18.869 -16.033 1.00 62.31 N ATOM 13 CA SER A 11 -30.138 -17.624 -16.493 1.00 34.12 C ATOM 14 C SER A 11 -31.013 -17.089 -15.356 1.00 31.23 C ATOM 15 O SER A 11 -32.125 -17.549 -15.147 1.00 41.33 O ATOM 16 CB SER A 11 -30.945 -17.830 -17.797 1.00 10.41 C ATOM 17 OG SER A 11 -31.433 -16.595 -18.334 1.00 14.23 O ATOM 0 H SER A 11 -30.067 -19.695 -16.423 1.00 62.31 H new ATOM 0 HA SER A 11 -29.350 -16.911 -16.734 1.00 34.12 H new ATOM 0 HB2 SER A 11 -30.315 -18.322 -18.538 1.00 10.41 H new ATOM 0 HB3 SER A 11 -31.785 -18.496 -17.600 1.00 10.41 H new ATOM 0 HG SER A 11 -31.935 -16.772 -19.157 1.00 14.23 H new ATOM 23 N SER A 12 -30.475 -16.161 -14.604 1.00 0.33 N ATOM 24 CA SER A 12 -31.101 -15.676 -13.389 1.00 4.12 C ATOM 25 C SER A 12 -32.205 -14.643 -13.666 1.00 22.51 C ATOM 26 O SER A 12 -32.955 -14.280 -12.751 1.00 31.24 O ATOM 27 CB SER A 12 -30.007 -15.096 -12.451 1.00 61.20 C ATOM 28 OG SER A 12 -30.524 -14.707 -11.178 1.00 33.14 O ATOM 0 H SER A 12 -29.583 -15.714 -14.816 1.00 0.33 H new ATOM 0 HA SER A 12 -31.594 -16.516 -12.900 1.00 4.12 H new ATOM 0 HB2 SER A 12 -29.224 -15.841 -12.309 1.00 61.20 H new ATOM 0 HB3 SER A 12 -29.543 -14.233 -12.930 1.00 61.20 H new ATOM 0 HG SER A 12 -31.438 -14.370 -11.285 1.00 33.14 H new ATOM 34 N ASP A 13 -32.300 -14.180 -14.926 1.00 63.45 N ATOM 35 CA ASP A 13 -33.212 -13.076 -15.340 1.00 51.32 C ATOM 36 C ASP A 13 -32.618 -11.769 -14.938 1.00 23.34 C ATOM 37 O ASP A 13 -32.479 -10.860 -15.758 1.00 65.52 O ATOM 38 CB ASP A 13 -34.672 -13.205 -14.842 1.00 13.31 C ATOM 39 CG ASP A 13 -35.447 -14.309 -15.510 1.00 33.44 C ATOM 40 OD1 ASP A 13 -35.436 -15.470 -15.021 1.00 64.23 O ATOM 41 OD2 ASP A 13 -36.097 -14.036 -16.543 1.00 64.10 O ATOM 0 H ASP A 13 -31.747 -14.557 -15.696 1.00 63.45 H new ATOM 0 HA ASP A 13 -33.296 -13.142 -16.425 1.00 51.32 H new ATOM 0 HB2 ASP A 13 -34.665 -13.379 -13.766 1.00 13.31 H new ATOM 0 HB3 ASP A 13 -35.188 -12.259 -15.009 1.00 13.31 H new ATOM 46 N SER A 14 -32.278 -11.669 -13.677 1.00 0.14 N ATOM 47 CA SER A 14 -31.508 -10.583 -13.181 1.00 32.24 C ATOM 48 C SER A 14 -30.146 -10.709 -13.861 1.00 33.32 C ATOM 49 O SER A 14 -29.606 -11.820 -13.954 1.00 4.22 O ATOM 50 CB SER A 14 -31.370 -10.743 -11.678 1.00 52.31 C ATOM 51 OG SER A 14 -32.650 -10.874 -11.060 1.00 64.51 O ATOM 0 H SER A 14 -32.537 -12.354 -12.967 1.00 0.14 H new ATOM 0 HA SER A 14 -31.958 -9.611 -13.381 1.00 32.24 H new ATOM 0 HB2 SER A 14 -30.763 -11.621 -11.456 1.00 52.31 H new ATOM 0 HB3 SER A 14 -30.848 -9.881 -11.263 1.00 52.31 H new ATOM 0 HG SER A 14 -32.537 -10.978 -10.092 1.00 64.51 H new ATOM 57 N LEU A 15 -29.597 -9.625 -14.338 1.00 20.14 N ATOM 58 CA LEU A 15 -28.438 -9.696 -15.144 1.00 64.55 C ATOM 59 C LEU A 15 -27.161 -9.956 -14.373 1.00 24.22 C ATOM 60 O LEU A 15 -26.482 -9.018 -13.945 1.00 53.41 O ATOM 61 CB LEU A 15 -28.309 -8.483 -16.076 1.00 64.51 C ATOM 62 CG LEU A 15 -29.363 -8.327 -17.210 1.00 44.21 C ATOM 63 CD1 LEU A 15 -29.431 -9.569 -18.085 1.00 53.24 C ATOM 64 CD2 LEU A 15 -30.740 -7.959 -16.675 1.00 24.43 C ATOM 0 H LEU A 15 -29.947 -8.681 -14.173 1.00 20.14 H new ATOM 0 HA LEU A 15 -28.580 -10.579 -15.767 1.00 64.55 H new ATOM 0 HB2 LEU A 15 -28.342 -7.583 -15.462 1.00 64.51 H new ATOM 0 HB3 LEU A 15 -27.322 -8.518 -16.538 1.00 64.51 H new ATOM 0 HG LEU A 15 -29.029 -7.496 -17.831 1.00 44.21 H new ATOM 0 HD11 LEU A 15 -30.178 -9.424 -18.866 1.00 53.24 H new ATOM 0 HD12 LEU A 15 -28.457 -9.746 -18.542 1.00 53.24 H new ATOM 0 HD13 LEU A 15 -29.707 -10.429 -17.475 1.00 53.24 H new ATOM 0 HD21 LEU A 15 -31.439 -7.862 -17.506 1.00 24.43 H new ATOM 0 HD22 LEU A 15 -31.088 -8.739 -15.998 1.00 24.43 H new ATOM 0 HD23 LEU A 15 -30.681 -7.012 -16.138 1.00 24.43 H new ATOM 76 N GLN A 16 -26.904 -11.253 -14.132 1.00 32.23 N ATOM 77 CA GLN A 16 -25.639 -11.767 -13.588 1.00 33.14 C ATOM 78 C GLN A 16 -25.296 -11.203 -12.203 1.00 51.40 C ATOM 79 O GLN A 16 -26.052 -10.399 -11.615 1.00 32.35 O ATOM 80 CB GLN A 16 -24.515 -11.386 -14.547 1.00 53.33 C ATOM 81 CG GLN A 16 -24.700 -11.875 -15.967 1.00 5.55 C ATOM 82 CD GLN A 16 -23.587 -11.422 -16.883 1.00 54.41 C ATOM 83 OE1 GLN A 16 -22.981 -10.357 -16.684 1.00 5.54 O ATOM 84 NE2 GLN A 16 -23.314 -12.199 -17.890 1.00 54.20 N ATOM 0 H GLN A 16 -27.587 -11.988 -14.315 1.00 32.23 H new ATOM 0 HA GLN A 16 -25.750 -12.846 -13.481 1.00 33.14 H new ATOM 0 HB2 GLN A 16 -24.421 -10.300 -14.561 1.00 53.33 H new ATOM 0 HB3 GLN A 16 -23.576 -11.783 -14.160 1.00 53.33 H new ATOM 0 HG2 GLN A 16 -24.748 -12.964 -15.970 1.00 5.55 H new ATOM 0 HG3 GLN A 16 -25.653 -11.513 -16.352 1.00 5.55 H new ATOM 0 HE21 GLN A 16 -23.834 -13.067 -18.020 1.00 54.20 H new ATOM 0 HE22 GLN A 16 -22.580 -11.941 -18.549 1.00 54.20 H new ATOM 93 N LEU A 17 -24.185 -11.658 -11.661 1.00 73.32 N ATOM 94 CA LEU A 17 -23.620 -11.041 -10.521 1.00 11.51 C ATOM 95 C LEU A 17 -22.719 -9.966 -11.020 1.00 35.32 C ATOM 96 O LEU A 17 -22.246 -10.019 -12.169 1.00 41.42 O ATOM 97 CB LEU A 17 -22.832 -11.991 -9.628 1.00 4.33 C ATOM 98 CG LEU A 17 -23.577 -13.169 -9.022 1.00 14.13 C ATOM 99 CD1 LEU A 17 -24.823 -12.727 -8.269 1.00 44.12 C ATOM 100 CD2 LEU A 17 -23.874 -14.234 -10.046 1.00 65.42 C ATOM 0 H LEU A 17 -23.665 -12.463 -12.010 1.00 73.32 H new ATOM 0 HA LEU A 17 -24.431 -10.662 -9.898 1.00 11.51 H new ATOM 0 HB2 LEU A 17 -21.998 -12.384 -10.209 1.00 4.33 H new ATOM 0 HB3 LEU A 17 -22.405 -11.408 -8.812 1.00 4.33 H new ATOM 0 HG LEU A 17 -22.913 -13.622 -8.286 1.00 14.13 H new ATOM 0 HD11 LEU A 17 -25.325 -13.600 -7.852 1.00 44.12 H new ATOM 0 HD12 LEU A 17 -24.540 -12.051 -7.462 1.00 44.12 H new ATOM 0 HD13 LEU A 17 -25.498 -12.212 -8.953 1.00 44.12 H new ATOM 0 HD21 LEU A 17 -24.407 -15.057 -9.571 1.00 65.42 H new ATOM 0 HD22 LEU A 17 -24.490 -13.813 -10.840 1.00 65.42 H new ATOM 0 HD23 LEU A 17 -22.940 -14.603 -10.469 1.00 65.42 H new ATOM 112 N HIS A 18 -22.511 -8.995 -10.231 1.00 11.32 N ATOM 113 CA HIS A 18 -21.735 -7.865 -10.643 1.00 2.13 C ATOM 114 C HIS A 18 -20.557 -7.731 -9.746 1.00 52.00 C ATOM 115 O HIS A 18 -20.560 -8.248 -8.624 1.00 72.13 O ATOM 116 CB HIS A 18 -22.576 -6.574 -10.565 1.00 1.14 C ATOM 117 CG HIS A 18 -23.904 -6.680 -11.239 1.00 71.43 C ATOM 118 ND1 HIS A 18 -24.173 -6.192 -12.487 1.00 50.34 N ATOM 119 CD2 HIS A 18 -25.039 -7.252 -10.809 1.00 52.01 C ATOM 120 CE1 HIS A 18 -25.415 -6.459 -12.804 1.00 15.52 C ATOM 121 NE2 HIS A 18 -25.975 -7.114 -11.802 1.00 42.31 N ATOM 0 H HIS A 18 -22.866 -8.944 -9.276 1.00 11.32 H new ATOM 0 HA HIS A 18 -21.412 -8.015 -11.673 1.00 2.13 H new ATOM 0 HB2 HIS A 18 -22.730 -6.314 -9.518 1.00 1.14 H new ATOM 0 HB3 HIS A 18 -22.014 -5.757 -11.017 1.00 1.14 H new ATOM 0 HD2 HIS A 18 -25.188 -7.734 -9.854 1.00 52.01 H new ATOM 0 HE1 HIS A 18 -25.901 -6.189 -13.730 1.00 15.52 H new ATOM 0 HE2 HIS A 18 -26.935 -7.457 -11.772 1.00 42.31 H new ATOM 130 N ASN A 19 -19.566 -7.076 -10.234 1.00 41.42 N ATOM 131 CA ASN A 19 -18.412 -6.758 -9.464 1.00 41.53 C ATOM 132 C ASN A 19 -18.116 -5.284 -9.501 1.00 74.33 C ATOM 133 O ASN A 19 -18.034 -4.668 -10.565 1.00 52.05 O ATOM 134 CB ASN A 19 -17.189 -7.672 -9.722 1.00 0.13 C ATOM 135 CG ASN A 19 -17.024 -8.161 -11.149 1.00 23.44 C ATOM 136 OD1 ASN A 19 -16.444 -7.505 -11.996 1.00 4.22 O ATOM 137 ND2 ASN A 19 -17.498 -9.349 -11.396 1.00 34.14 N ATOM 0 H ASN A 19 -19.531 -6.739 -11.196 1.00 41.42 H new ATOM 0 HA ASN A 19 -18.661 -6.993 -8.429 1.00 41.53 H new ATOM 0 HB2 ASN A 19 -16.287 -7.131 -9.436 1.00 0.13 H new ATOM 0 HB3 ASN A 19 -17.262 -8.539 -9.066 1.00 0.13 H new ATOM 0 HD21 ASN A 19 -17.389 -9.759 -12.324 1.00 34.14 H new ATOM 0 HD22 ASN A 19 -17.978 -9.869 -10.662 1.00 34.14 H new ATOM 144 N VAL A 20 -18.009 -4.717 -8.325 1.00 65.21 N ATOM 145 CA VAL A 20 -17.853 -3.284 -8.144 1.00 10.44 C ATOM 146 C VAL A 20 -16.579 -2.996 -7.366 1.00 42.11 C ATOM 147 O VAL A 20 -16.270 -3.689 -6.404 1.00 22.21 O ATOM 148 CB VAL A 20 -19.080 -2.696 -7.363 1.00 33.43 C ATOM 149 CG1 VAL A 20 -18.942 -1.196 -7.136 1.00 51.14 C ATOM 150 CG2 VAL A 20 -20.385 -2.998 -8.095 1.00 52.43 C ATOM 0 H VAL A 20 -18.027 -5.241 -7.450 1.00 65.21 H new ATOM 0 HA VAL A 20 -17.796 -2.815 -9.126 1.00 10.44 H new ATOM 0 HB VAL A 20 -19.101 -3.181 -6.387 1.00 33.43 H new ATOM 0 HG11 VAL A 20 -19.812 -0.829 -6.592 1.00 51.14 H new ATOM 0 HG12 VAL A 20 -18.041 -0.997 -6.556 1.00 51.14 H new ATOM 0 HG13 VAL A 20 -18.874 -0.687 -8.098 1.00 51.14 H new ATOM 0 HG21 VAL A 20 -21.222 -2.581 -7.535 1.00 52.43 H new ATOM 0 HG22 VAL A 20 -20.356 -2.552 -9.089 1.00 52.43 H new ATOM 0 HG23 VAL A 20 -20.511 -4.077 -8.184 1.00 52.43 H new ATOM 160 N PHE A 21 -15.852 -1.995 -7.793 1.00 52.23 N ATOM 161 CA PHE A 21 -14.630 -1.596 -7.142 1.00 1.42 C ATOM 162 C PHE A 21 -14.933 -0.426 -6.223 1.00 63.43 C ATOM 163 O PHE A 21 -15.445 0.611 -6.666 1.00 23.43 O ATOM 164 CB PHE A 21 -13.602 -1.207 -8.210 1.00 65.24 C ATOM 165 CG PHE A 21 -12.250 -0.786 -7.709 1.00 61.20 C ATOM 166 CD1 PHE A 21 -11.330 -1.728 -7.289 1.00 65.45 C ATOM 167 CD2 PHE A 21 -11.887 0.550 -7.689 1.00 11.42 C ATOM 168 CE1 PHE A 21 -10.081 -1.349 -6.858 1.00 12.42 C ATOM 169 CE2 PHE A 21 -10.638 0.933 -7.255 1.00 34.21 C ATOM 170 CZ PHE A 21 -9.735 -0.019 -6.841 1.00 22.44 C ATOM 0 H PHE A 21 -16.093 -1.430 -8.607 1.00 52.23 H new ATOM 0 HA PHE A 21 -14.218 -2.412 -6.549 1.00 1.42 H new ATOM 0 HB2 PHE A 21 -13.469 -2.055 -8.882 1.00 65.24 H new ATOM 0 HB3 PHE A 21 -14.016 -0.392 -8.803 1.00 65.24 H new ATOM 0 HD1 PHE A 21 -11.596 -2.775 -7.300 1.00 65.45 H new ATOM 0 HD2 PHE A 21 -12.591 1.300 -8.017 1.00 11.42 H new ATOM 0 HE1 PHE A 21 -9.372 -2.096 -6.533 1.00 12.42 H new ATOM 0 HE2 PHE A 21 -10.368 1.978 -7.240 1.00 34.21 H new ATOM 0 HZ PHE A 21 -8.754 0.279 -6.502 1.00 22.44 H new ATOM 180 N VAL A 22 -14.624 -0.587 -4.968 1.00 1.22 N ATOM 181 CA VAL A 22 -14.914 0.426 -3.977 1.00 15.05 C ATOM 182 C VAL A 22 -13.665 1.212 -3.587 1.00 13.11 C ATOM 183 O VAL A 22 -12.584 0.646 -3.395 1.00 13.32 O ATOM 184 CB VAL A 22 -15.617 -0.166 -2.729 1.00 24.15 C ATOM 185 CG1 VAL A 22 -16.997 -0.691 -3.108 1.00 22.23 C ATOM 186 CG2 VAL A 22 -14.791 -1.293 -2.133 1.00 31.31 C ATOM 0 H VAL A 22 -14.165 -1.419 -4.597 1.00 1.22 H new ATOM 0 HA VAL A 22 -15.610 1.125 -4.440 1.00 15.05 H new ATOM 0 HB VAL A 22 -15.720 0.625 -1.986 1.00 24.15 H new ATOM 0 HG11 VAL A 22 -17.484 -1.105 -2.225 1.00 22.23 H new ATOM 0 HG12 VAL A 22 -17.600 0.125 -3.506 1.00 22.23 H new ATOM 0 HG13 VAL A 22 -16.895 -1.469 -3.865 1.00 22.23 H new ATOM 0 HG21 VAL A 22 -15.302 -1.695 -1.258 1.00 31.31 H new ATOM 0 HG22 VAL A 22 -14.664 -2.082 -2.874 1.00 31.31 H new ATOM 0 HG23 VAL A 22 -13.813 -0.911 -1.839 1.00 31.31 H new ATOM 196 N TYR A 23 -13.831 2.521 -3.459 1.00 4.21 N ATOM 197 CA TYR A 23 -12.718 3.422 -3.194 1.00 40.41 C ATOM 198 C TYR A 23 -12.288 3.502 -1.737 1.00 0.53 C ATOM 199 O TYR A 23 -11.195 4.013 -1.435 1.00 33.34 O ATOM 200 CB TYR A 23 -12.988 4.813 -3.763 1.00 45.54 C ATOM 201 CG TYR A 23 -14.257 5.512 -3.305 1.00 70.30 C ATOM 202 CD1 TYR A 23 -14.298 6.219 -2.113 1.00 51.31 C ATOM 203 CD2 TYR A 23 -15.405 5.485 -4.090 1.00 24.14 C ATOM 204 CE1 TYR A 23 -15.437 6.876 -1.714 1.00 4.34 C ATOM 205 CE2 TYR A 23 -16.551 6.145 -3.696 1.00 10.01 C ATOM 206 CZ TYR A 23 -16.559 6.839 -2.507 1.00 30.11 C ATOM 207 OH TYR A 23 -17.689 7.503 -2.110 1.00 71.55 O ATOM 0 H TYR A 23 -14.735 2.986 -3.535 1.00 4.21 H new ATOM 0 HA TYR A 23 -11.869 2.977 -3.714 1.00 40.41 H new ATOM 0 HB2 TYR A 23 -12.141 5.451 -3.513 1.00 45.54 H new ATOM 0 HB3 TYR A 23 -13.018 4.734 -4.850 1.00 45.54 H new ATOM 0 HD1 TYR A 23 -13.419 6.254 -1.487 1.00 51.31 H new ATOM 0 HD2 TYR A 23 -15.399 4.939 -5.022 1.00 24.14 H new ATOM 0 HE1 TYR A 23 -15.451 7.419 -0.781 1.00 4.34 H new ATOM 0 HE2 TYR A 23 -17.435 6.117 -4.316 1.00 10.01 H new ATOM 0 HH TYR A 23 -18.391 6.854 -1.893 1.00 71.55 H new ATOM 217 N GLY A 24 -13.108 3.023 -0.840 1.00 4.34 N ATOM 218 CA GLY A 24 -12.729 3.089 0.547 1.00 43.24 C ATOM 219 C GLY A 24 -13.888 2.965 1.484 1.00 34.22 C ATOM 220 O GLY A 24 -13.837 2.187 2.412 1.00 43.50 O ATOM 0 H GLY A 24 -14.014 2.596 -1.034 1.00 4.34 H new ATOM 0 HA2 GLY A 24 -12.013 2.295 0.759 1.00 43.24 H new ATOM 0 HA3 GLY A 24 -12.220 4.035 0.733 1.00 43.24 H new ATOM 224 N SER A 25 -14.947 3.701 1.214 1.00 51.25 N ATOM 225 CA SER A 25 -16.117 3.752 2.088 1.00 21.34 C ATOM 226 C SER A 25 -16.752 2.370 2.310 1.00 44.41 C ATOM 227 O SER A 25 -17.277 2.082 3.379 1.00 65.43 O ATOM 228 CB SER A 25 -17.134 4.687 1.471 1.00 11.44 C ATOM 229 OG SER A 25 -16.527 5.924 1.153 1.00 4.13 O ATOM 0 H SER A 25 -15.027 4.285 0.381 1.00 51.25 H new ATOM 0 HA SER A 25 -15.794 4.111 3.065 1.00 21.34 H new ATOM 0 HB2 SER A 25 -17.554 4.237 0.571 1.00 11.44 H new ATOM 0 HB3 SER A 25 -17.960 4.846 2.164 1.00 11.44 H new ATOM 0 HG SER A 25 -16.307 5.945 0.198 1.00 4.13 H new ATOM 235 N PHE A 26 -16.664 1.512 1.318 1.00 73.54 N ATOM 236 CA PHE A 26 -17.287 0.205 1.398 1.00 55.52 C ATOM 237 C PHE A 26 -16.274 -0.910 1.178 1.00 12.33 C ATOM 238 O PHE A 26 -16.621 -1.972 0.697 1.00 61.21 O ATOM 239 CB PHE A 26 -18.424 0.106 0.371 1.00 31.33 C ATOM 240 CG PHE A 26 -19.523 1.111 0.577 1.00 21.53 C ATOM 241 CD1 PHE A 26 -20.312 1.066 1.716 1.00 22.04 C ATOM 242 CD2 PHE A 26 -19.758 2.104 -0.358 1.00 3.44 C ATOM 243 CE1 PHE A 26 -21.313 1.991 1.915 1.00 20.33 C ATOM 244 CE2 PHE A 26 -20.762 3.032 -0.161 1.00 35.33 C ATOM 245 CZ PHE A 26 -21.538 2.975 0.977 1.00 73.33 C ATOM 0 H PHE A 26 -16.168 1.694 0.446 1.00 73.54 H new ATOM 0 HA PHE A 26 -17.696 0.084 2.401 1.00 55.52 H new ATOM 0 HB2 PHE A 26 -18.009 0.236 -0.629 1.00 31.33 H new ATOM 0 HB3 PHE A 26 -18.850 -0.896 0.411 1.00 31.33 H new ATOM 0 HD1 PHE A 26 -20.140 0.298 2.455 1.00 22.04 H new ATOM 0 HD2 PHE A 26 -19.151 2.154 -1.250 1.00 3.44 H new ATOM 0 HE1 PHE A 26 -21.921 1.945 2.806 1.00 20.33 H new ATOM 0 HE2 PHE A 26 -20.939 3.802 -0.898 1.00 35.33 H new ATOM 0 HZ PHE A 26 -22.322 3.701 1.133 1.00 73.33 H new ATOM 255 N GLN A 27 -15.025 -0.694 1.572 1.00 2.22 N ATOM 256 CA GLN A 27 -14.023 -1.741 1.377 1.00 65.43 C ATOM 257 C GLN A 27 -13.899 -2.653 2.590 1.00 63.33 C ATOM 258 O GLN A 27 -13.115 -3.614 2.594 1.00 45.03 O ATOM 259 CB GLN A 27 -12.659 -1.190 0.872 1.00 15.23 C ATOM 260 CG GLN A 27 -11.900 -0.182 1.752 1.00 4.12 C ATOM 261 CD GLN A 27 -11.340 -0.751 3.042 1.00 22.33 C ATOM 262 OE1 GLN A 27 -10.213 -1.269 3.063 1.00 63.35 O ATOM 263 NE2 GLN A 27 -12.071 -0.620 4.116 1.00 54.43 N ATOM 0 H GLN A 27 -14.687 0.162 2.012 1.00 2.22 H new ATOM 0 HA GLN A 27 -14.389 -2.372 0.567 1.00 65.43 H new ATOM 0 HB2 GLN A 27 -12.001 -2.042 0.702 1.00 15.23 H new ATOM 0 HB3 GLN A 27 -12.830 -0.721 -0.097 1.00 15.23 H new ATOM 0 HG2 GLN A 27 -11.079 0.238 1.171 1.00 4.12 H new ATOM 0 HG3 GLN A 27 -12.571 0.641 1.997 1.00 4.12 H new ATOM 0 HE21 GLN A 27 -12.993 -0.188 4.056 1.00 54.43 H new ATOM 0 HE22 GLN A 27 -11.720 -0.950 5.015 1.00 54.43 H new ATOM 272 N ASP A 28 -14.666 -2.342 3.608 1.00 0.02 N ATOM 273 CA ASP A 28 -14.710 -3.126 4.821 1.00 63.21 C ATOM 274 C ASP A 28 -15.929 -4.030 4.787 1.00 35.15 C ATOM 275 O ASP A 28 -17.057 -3.547 4.647 1.00 54.43 O ATOM 276 CB ASP A 28 -14.768 -2.213 6.046 1.00 21.34 C ATOM 277 CG ASP A 28 -14.896 -2.975 7.342 1.00 21.21 C ATOM 278 OD1 ASP A 28 -13.865 -3.340 7.929 1.00 34.31 O ATOM 279 OD2 ASP A 28 -16.025 -3.198 7.797 1.00 63.31 O ATOM 0 H ASP A 28 -15.283 -1.530 3.618 1.00 0.02 H new ATOM 0 HA ASP A 28 -13.807 -3.732 4.889 1.00 63.21 H new ATOM 0 HB2 ASP A 28 -13.867 -1.600 6.079 1.00 21.34 H new ATOM 0 HB3 ASP A 28 -15.614 -1.532 5.946 1.00 21.34 H new ATOM 284 N PRO A 29 -15.730 -5.355 4.915 1.00 0.54 N ATOM 285 CA PRO A 29 -16.820 -6.326 4.834 1.00 12.30 C ATOM 286 C PRO A 29 -17.864 -6.158 5.936 1.00 21.33 C ATOM 287 O PRO A 29 -19.049 -6.407 5.722 1.00 1.12 O ATOM 288 CB PRO A 29 -16.126 -7.681 4.957 1.00 33.01 C ATOM 289 CG PRO A 29 -14.807 -7.395 5.572 1.00 31.31 C ATOM 290 CD PRO A 29 -14.430 -6.007 5.142 1.00 21.12 C ATOM 0 HA PRO A 29 -17.379 -6.204 3.906 1.00 12.30 H new ATOM 0 HB2 PRO A 29 -16.707 -8.365 5.575 1.00 33.01 H new ATOM 0 HB3 PRO A 29 -16.010 -8.153 3.981 1.00 33.01 H new ATOM 0 HG2 PRO A 29 -14.862 -7.463 6.658 1.00 31.31 H new ATOM 0 HG3 PRO A 29 -14.061 -8.119 5.245 1.00 31.31 H new ATOM 0 HD2 PRO A 29 -13.851 -5.492 5.909 1.00 21.12 H new ATOM 0 HD3 PRO A 29 -13.822 -6.018 4.237 1.00 21.12 H new ATOM 298 N ASP A 30 -17.441 -5.708 7.098 1.00 62.51 N ATOM 299 CA ASP A 30 -18.366 -5.526 8.201 1.00 4.21 C ATOM 300 C ASP A 30 -19.333 -4.399 7.867 1.00 51.42 C ATOM 301 O ASP A 30 -20.538 -4.507 8.108 1.00 51.02 O ATOM 302 CB ASP A 30 -17.627 -5.258 9.505 1.00 61.13 C ATOM 303 CG ASP A 30 -18.561 -5.091 10.669 1.00 52.35 C ATOM 304 OD1 ASP A 30 -18.946 -6.116 11.288 1.00 62.41 O ATOM 305 OD2 ASP A 30 -18.922 -3.951 10.998 1.00 64.42 O ATOM 0 H ASP A 30 -16.473 -5.463 7.305 1.00 62.51 H new ATOM 0 HA ASP A 30 -18.933 -6.446 8.344 1.00 4.21 H new ATOM 0 HB2 ASP A 30 -16.942 -6.082 9.707 1.00 61.13 H new ATOM 0 HB3 ASP A 30 -17.021 -4.359 9.397 1.00 61.13 H new ATOM 310 N VAL A 31 -18.799 -3.345 7.255 1.00 1.14 N ATOM 311 CA VAL A 31 -19.605 -2.224 6.768 1.00 30.12 C ATOM 312 C VAL A 31 -20.616 -2.720 5.745 1.00 10.41 C ATOM 313 O VAL A 31 -21.763 -2.272 5.720 1.00 61.22 O ATOM 314 CB VAL A 31 -18.720 -1.120 6.108 1.00 10.14 C ATOM 315 CG1 VAL A 31 -19.573 -0.037 5.462 1.00 40.01 C ATOM 316 CG2 VAL A 31 -17.801 -0.499 7.131 1.00 62.43 C ATOM 0 H VAL A 31 -17.799 -3.242 7.082 1.00 1.14 H new ATOM 0 HA VAL A 31 -20.116 -1.790 7.628 1.00 30.12 H new ATOM 0 HB VAL A 31 -18.124 -1.598 5.330 1.00 10.14 H new ATOM 0 HG11 VAL A 31 -18.926 0.716 5.012 1.00 40.01 H new ATOM 0 HG12 VAL A 31 -20.203 -0.481 4.692 1.00 40.01 H new ATOM 0 HG13 VAL A 31 -20.202 0.431 6.219 1.00 40.01 H new ATOM 0 HG21 VAL A 31 -17.191 0.268 6.654 1.00 62.43 H new ATOM 0 HG22 VAL A 31 -18.394 -0.049 7.927 1.00 62.43 H new ATOM 0 HG23 VAL A 31 -17.153 -1.268 7.552 1.00 62.43 H new ATOM 326 N ILE A 32 -20.194 -3.666 4.937 1.00 31.01 N ATOM 327 CA ILE A 32 -21.022 -4.227 3.908 1.00 3.54 C ATOM 328 C ILE A 32 -22.246 -4.937 4.521 1.00 14.31 C ATOM 329 O ILE A 32 -23.377 -4.736 4.075 1.00 10.24 O ATOM 330 CB ILE A 32 -20.179 -5.167 3.019 1.00 30.53 C ATOM 331 CG1 ILE A 32 -19.076 -4.374 2.313 1.00 53.54 C ATOM 332 CG2 ILE A 32 -21.018 -5.886 1.997 1.00 73.14 C ATOM 333 CD1 ILE A 32 -19.599 -3.268 1.418 1.00 53.22 C ATOM 0 H ILE A 32 -19.257 -4.067 4.981 1.00 31.01 H new ATOM 0 HA ILE A 32 -21.409 -3.429 3.274 1.00 3.54 H new ATOM 0 HB ILE A 32 -19.736 -5.918 3.672 1.00 30.53 H new ATOM 0 HG12 ILE A 32 -18.415 -3.940 3.064 1.00 53.54 H new ATOM 0 HG13 ILE A 32 -18.474 -5.059 1.716 1.00 53.54 H new ATOM 0 HG21 ILE A 32 -20.382 -6.535 1.395 1.00 73.14 H new ATOM 0 HG22 ILE A 32 -21.773 -6.487 2.504 1.00 73.14 H new ATOM 0 HG23 ILE A 32 -21.507 -5.158 1.351 1.00 73.14 H new ATOM 0 HD11 ILE A 32 -18.761 -2.750 0.952 1.00 53.22 H new ATOM 0 HD12 ILE A 32 -20.236 -3.697 0.644 1.00 53.22 H new ATOM 0 HD13 ILE A 32 -20.177 -2.561 2.013 1.00 53.22 H new ATOM 345 N ASN A 33 -22.028 -5.711 5.574 1.00 23.23 N ATOM 346 CA ASN A 33 -23.141 -6.362 6.279 1.00 3.33 C ATOM 347 C ASN A 33 -24.121 -5.340 6.814 1.00 32.22 C ATOM 348 O ASN A 33 -25.325 -5.559 6.811 1.00 64.11 O ATOM 349 CB ASN A 33 -22.669 -7.233 7.448 1.00 14.54 C ATOM 350 CG ASN A 33 -21.950 -8.488 7.039 1.00 64.41 C ATOM 351 OD1 ASN A 33 -22.569 -9.518 6.806 1.00 3.05 O ATOM 352 ND2 ASN A 33 -20.656 -8.433 6.980 1.00 62.01 N ATOM 0 H ASN A 33 -21.105 -5.907 5.962 1.00 23.23 H new ATOM 0 HA ASN A 33 -23.626 -7.000 5.540 1.00 3.33 H new ATOM 0 HB2 ASN A 33 -22.009 -6.641 8.082 1.00 14.54 H new ATOM 0 HB3 ASN A 33 -23.533 -7.505 8.054 1.00 14.54 H new ATOM 0 HD21 ASN A 33 -20.121 -9.265 6.733 1.00 62.01 H new ATOM 0 HD22 ASN A 33 -20.173 -7.557 7.181 1.00 62.01 H new ATOM 359 N VAL A 34 -23.604 -4.219 7.247 1.00 64.44 N ATOM 360 CA VAL A 34 -24.423 -3.194 7.849 1.00 72.03 C ATOM 361 C VAL A 34 -25.133 -2.326 6.797 1.00 2.41 C ATOM 362 O VAL A 34 -26.274 -1.899 7.007 1.00 14.52 O ATOM 363 CB VAL A 34 -23.598 -2.301 8.826 1.00 3.22 C ATOM 364 CG1 VAL A 34 -24.467 -1.235 9.490 1.00 11.11 C ATOM 365 CG2 VAL A 34 -22.913 -3.154 9.882 1.00 75.34 C ATOM 0 H VAL A 34 -22.611 -3.990 7.194 1.00 64.44 H new ATOM 0 HA VAL A 34 -25.191 -3.711 8.424 1.00 72.03 H new ATOM 0 HB VAL A 34 -22.838 -1.790 8.236 1.00 3.22 H new ATOM 0 HG11 VAL A 34 -23.855 -0.634 10.163 1.00 11.11 H new ATOM 0 HG12 VAL A 34 -24.903 -0.593 8.725 1.00 11.11 H new ATOM 0 HG13 VAL A 34 -25.264 -1.716 10.057 1.00 11.11 H new ATOM 0 HG21 VAL A 34 -22.343 -2.513 10.554 1.00 75.34 H new ATOM 0 HG22 VAL A 34 -23.664 -3.700 10.452 1.00 75.34 H new ATOM 0 HG23 VAL A 34 -22.240 -3.862 9.398 1.00 75.34 H new ATOM 375 N MET A 35 -24.480 -2.062 5.676 1.00 15.10 N ATOM 376 CA MET A 35 -25.073 -1.213 4.673 1.00 61.22 C ATOM 377 C MET A 35 -26.166 -1.970 3.922 1.00 61.22 C ATOM 378 O MET A 35 -27.210 -1.405 3.622 1.00 74.42 O ATOM 379 CB MET A 35 -23.991 -0.684 3.710 1.00 44.12 C ATOM 380 CG MET A 35 -24.391 0.550 2.877 1.00 0.02 C ATOM 381 SD MET A 35 -25.721 0.314 1.669 1.00 42.32 S ATOM 382 CE MET A 35 -24.931 -0.788 0.523 1.00 21.32 C ATOM 0 H MET A 35 -23.553 -2.421 5.446 1.00 15.10 H new ATOM 0 HA MET A 35 -25.533 -0.354 5.160 1.00 61.22 H new ATOM 0 HB2 MET A 35 -23.102 -0.436 4.290 1.00 44.12 H new ATOM 0 HB3 MET A 35 -23.713 -1.487 3.027 1.00 44.12 H new ATOM 0 HG2 MET A 35 -24.690 1.342 3.563 1.00 0.02 H new ATOM 0 HG3 MET A 35 -23.507 0.904 2.346 1.00 0.02 H new ATOM 0 HE1 MET A 35 -24.705 -0.253 -0.399 1.00 21.32 H new ATOM 0 HE2 MET A 35 -24.006 -1.165 0.960 1.00 21.32 H new ATOM 0 HE3 MET A 35 -25.596 -1.623 0.304 1.00 21.32 H new ATOM 392 N LEU A 36 -25.967 -3.253 3.670 1.00 13.35 N ATOM 393 CA LEU A 36 -26.992 -4.000 2.969 1.00 41.21 C ATOM 394 C LEU A 36 -27.560 -5.176 3.750 1.00 33.42 C ATOM 395 O LEU A 36 -28.750 -5.170 4.082 1.00 12.50 O ATOM 396 CB LEU A 36 -26.626 -4.389 1.505 1.00 14.03 C ATOM 397 CG LEU A 36 -25.297 -5.109 1.229 1.00 1.21 C ATOM 398 CD1 LEU A 36 -25.333 -5.692 -0.151 1.00 14.35 C ATOM 399 CD2 LEU A 36 -24.150 -4.137 1.263 1.00 72.12 C ATOM 0 H LEU A 36 -25.135 -3.783 3.930 1.00 13.35 H new ATOM 0 HA LEU A 36 -27.803 -3.277 2.887 1.00 41.21 H new ATOM 0 HB2 LEU A 36 -27.427 -5.022 1.124 1.00 14.03 H new ATOM 0 HB3 LEU A 36 -26.633 -3.475 0.911 1.00 14.03 H new ATOM 0 HG LEU A 36 -25.163 -5.878 1.990 1.00 1.21 H new ATOM 0 HD11 LEU A 36 -24.393 -6.205 -0.354 1.00 14.35 H new ATOM 0 HD12 LEU A 36 -26.157 -6.402 -0.225 1.00 14.35 H new ATOM 0 HD13 LEU A 36 -25.476 -4.894 -0.880 1.00 14.35 H new ATOM 0 HD21 LEU A 36 -23.218 -4.667 1.065 1.00 72.12 H new ATOM 0 HD22 LEU A 36 -24.300 -3.370 0.503 1.00 72.12 H new ATOM 0 HD23 LEU A 36 -24.099 -3.668 2.246 1.00 72.12 H new ATOM 411 N ASP A 37 -26.727 -6.159 4.077 1.00 61.12 N ATOM 412 CA ASP A 37 -27.209 -7.401 4.733 1.00 3.42 C ATOM 413 C ASP A 37 -26.079 -8.372 4.971 1.00 64.43 C ATOM 414 O ASP A 37 -25.834 -8.797 6.098 1.00 24.15 O ATOM 415 CB ASP A 37 -28.312 -8.082 3.885 1.00 23.10 C ATOM 416 CG ASP A 37 -28.731 -9.442 4.401 1.00 61.43 C ATOM 417 OD1 ASP A 37 -29.255 -9.542 5.541 1.00 13.10 O ATOM 418 OD2 ASP A 37 -28.526 -10.436 3.673 1.00 23.42 O ATOM 0 H ASP A 37 -25.722 -6.135 3.907 1.00 61.12 H new ATOM 0 HA ASP A 37 -27.628 -7.115 5.698 1.00 3.42 H new ATOM 0 HB2 ASP A 37 -29.186 -7.431 3.853 1.00 23.10 H new ATOM 0 HB3 ASP A 37 -27.956 -8.187 2.860 1.00 23.10 H new ATOM 423 N ARG A 38 -25.378 -8.701 3.919 1.00 42.11 N ATOM 424 CA ARG A 38 -24.286 -9.663 3.982 1.00 52.53 C ATOM 425 C ARG A 38 -23.125 -9.128 3.202 1.00 63.22 C ATOM 426 O ARG A 38 -23.169 -7.989 2.752 1.00 50.31 O ATOM 427 CB ARG A 38 -24.709 -11.046 3.436 1.00 1.13 C ATOM 428 CG ARG A 38 -25.786 -11.741 4.245 1.00 65.21 C ATOM 429 CD ARG A 38 -26.151 -13.094 3.653 1.00 41.02 C ATOM 430 NE ARG A 38 -26.696 -13.000 2.285 1.00 61.44 N ATOM 431 CZ ARG A 38 -27.044 -14.061 1.533 1.00 45.31 C ATOM 432 NH1 ARG A 38 -26.906 -15.293 2.014 1.00 10.24 N ATOM 433 NH2 ARG A 38 -27.532 -13.888 0.303 1.00 65.34 N ATOM 0 H ARG A 38 -25.540 -8.315 2.989 1.00 42.11 H new ATOM 0 HA ARG A 38 -24.004 -9.803 5.026 1.00 52.53 H new ATOM 0 HB2 ARG A 38 -25.063 -10.925 2.412 1.00 1.13 H new ATOM 0 HB3 ARG A 38 -23.831 -11.690 3.396 1.00 1.13 H new ATOM 0 HG2 ARG A 38 -25.442 -11.874 5.271 1.00 65.21 H new ATOM 0 HG3 ARG A 38 -26.674 -11.110 4.286 1.00 65.21 H new ATOM 0 HD2 ARG A 38 -25.266 -13.730 3.642 1.00 41.02 H new ATOM 0 HD3 ARG A 38 -26.884 -13.580 4.297 1.00 41.02 H new ATOM 0 HE ARG A 38 -26.817 -12.070 1.883 1.00 61.44 H new ATOM 0 HH11 ARG A 38 -26.536 -15.435 2.954 1.00 10.24 H new ATOM 0 HH12 ARG A 38 -27.170 -16.096 1.443 1.00 10.24 H new ATOM 0 HH21 ARG A 38 -27.644 -12.947 -0.074 1.00 65.34 H new ATOM 0 HH22 ARG A 38 -27.793 -14.697 -0.260 1.00 65.34 H new ATOM 447 N THR A 39 -22.089 -9.911 3.059 1.00 52.13 N ATOM 448 CA THR A 39 -20.938 -9.481 2.325 1.00 41.01 C ATOM 449 C THR A 39 -20.679 -10.371 1.111 1.00 40.32 C ATOM 450 O THR A 39 -20.367 -11.564 1.260 1.00 41.30 O ATOM 451 CB THR A 39 -19.702 -9.509 3.222 1.00 55.14 C ATOM 452 OG1 THR A 39 -20.017 -8.831 4.409 1.00 40.50 O ATOM 453 CG2 THR A 39 -18.540 -8.785 2.571 1.00 64.43 C ATOM 0 H THR A 39 -22.022 -10.853 3.444 1.00 52.13 H new ATOM 0 HA THR A 39 -21.135 -8.466 1.981 1.00 41.01 H new ATOM 0 HB THR A 39 -19.419 -10.546 3.403 1.00 55.14 H new ATOM 0 HG1 THR A 39 -19.449 -8.036 4.492 1.00 40.50 H new ATOM 0 HG21 THR A 39 -17.673 -8.820 3.231 1.00 64.43 H new ATOM 0 HG22 THR A 39 -18.295 -9.267 1.625 1.00 64.43 H new ATOM 0 HG23 THR A 39 -18.815 -7.746 2.388 1.00 64.43 H new ATOM 461 N PRO A 40 -20.848 -9.821 -0.100 1.00 45.23 N ATOM 462 CA PRO A 40 -20.437 -10.480 -1.338 1.00 1.22 C ATOM 463 C PRO A 40 -18.924 -10.700 -1.315 1.00 41.01 C ATOM 464 O PRO A 40 -18.203 -9.962 -0.622 1.00 2.54 O ATOM 465 CB PRO A 40 -20.811 -9.460 -2.421 1.00 40.25 C ATOM 466 CG PRO A 40 -21.873 -8.645 -1.803 1.00 62.13 C ATOM 467 CD PRO A 40 -21.480 -8.522 -0.370 1.00 54.05 C ATOM 0 HA PRO A 40 -20.902 -11.453 -1.494 1.00 1.22 H new ATOM 0 HB2 PRO A 40 -19.954 -8.848 -2.704 1.00 40.25 H new ATOM 0 HB3 PRO A 40 -21.164 -9.953 -3.327 1.00 40.25 H new ATOM 0 HG2 PRO A 40 -21.946 -7.666 -2.278 1.00 62.13 H new ATOM 0 HG3 PRO A 40 -22.847 -9.123 -1.906 1.00 62.13 H new ATOM 0 HD2 PRO A 40 -20.790 -7.694 -0.208 1.00 54.05 H new ATOM 0 HD3 PRO A 40 -22.342 -8.349 0.274 1.00 54.05 H new ATOM 475 N GLU A 41 -18.450 -11.721 -2.004 1.00 34.24 N ATOM 476 CA GLU A 41 -17.024 -12.031 -2.004 1.00 32.05 C ATOM 477 C GLU A 41 -16.181 -10.858 -2.492 1.00 32.51 C ATOM 478 O GLU A 41 -16.313 -10.399 -3.623 1.00 24.54 O ATOM 479 CB GLU A 41 -16.704 -13.284 -2.799 1.00 64.32 C ATOM 480 CG GLU A 41 -15.217 -13.597 -2.813 1.00 12.12 C ATOM 481 CD GLU A 41 -14.900 -14.861 -3.515 1.00 14.44 C ATOM 482 OE1 GLU A 41 -14.774 -14.848 -4.738 1.00 50.02 O ATOM 483 OE2 GLU A 41 -14.783 -15.901 -2.835 1.00 31.23 O ATOM 0 H GLU A 41 -19.023 -12.348 -2.568 1.00 34.24 H new ATOM 0 HA GLU A 41 -16.761 -12.224 -0.964 1.00 32.05 H new ATOM 0 HB2 GLU A 41 -17.246 -14.129 -2.374 1.00 64.32 H new ATOM 0 HB3 GLU A 41 -17.056 -13.161 -3.823 1.00 64.32 H new ATOM 0 HG2 GLU A 41 -14.683 -12.777 -3.293 1.00 12.12 H new ATOM 0 HG3 GLU A 41 -14.854 -13.656 -1.787 1.00 12.12 H new ATOM 490 N ILE A 42 -15.331 -10.392 -1.631 1.00 1.42 N ATOM 491 CA ILE A 42 -14.490 -9.261 -1.905 1.00 33.24 C ATOM 492 C ILE A 42 -13.103 -9.749 -2.284 1.00 30.52 C ATOM 493 O ILE A 42 -12.567 -10.688 -1.670 1.00 55.33 O ATOM 494 CB ILE A 42 -14.354 -8.376 -0.639 1.00 60.33 C ATOM 495 CG1 ILE A 42 -15.719 -8.008 -0.077 1.00 1.52 C ATOM 496 CG2 ILE A 42 -13.587 -7.124 -0.960 1.00 53.41 C ATOM 497 CD1 ILE A 42 -15.658 -7.171 1.190 1.00 41.55 C ATOM 0 H ILE A 42 -15.197 -10.791 -0.702 1.00 1.42 H new ATOM 0 HA ILE A 42 -14.935 -8.685 -2.716 1.00 33.24 H new ATOM 0 HB ILE A 42 -13.813 -8.950 0.113 1.00 60.33 H new ATOM 0 HG12 ILE A 42 -16.278 -7.460 -0.836 1.00 1.52 H new ATOM 0 HG13 ILE A 42 -16.274 -8.923 0.130 1.00 1.52 H new ATOM 0 HG21 ILE A 42 -13.499 -6.511 -0.063 1.00 53.41 H new ATOM 0 HG22 ILE A 42 -12.592 -7.389 -1.318 1.00 53.41 H new ATOM 0 HG23 ILE A 42 -14.113 -6.563 -1.732 1.00 53.41 H new ATOM 0 HD11 ILE A 42 -16.670 -6.950 1.529 1.00 41.55 H new ATOM 0 HD12 ILE A 42 -15.128 -7.724 1.966 1.00 41.55 H new ATOM 0 HD13 ILE A 42 -15.132 -6.239 0.985 1.00 41.55 H new ATOM 509 N VAL A 43 -12.541 -9.142 -3.281 1.00 64.23 N ATOM 510 CA VAL A 43 -11.202 -9.443 -3.695 1.00 72.30 C ATOM 511 C VAL A 43 -10.413 -8.144 -3.838 1.00 30.53 C ATOM 512 O VAL A 43 -10.976 -7.105 -4.172 1.00 15.31 O ATOM 513 CB VAL A 43 -11.155 -10.235 -5.035 1.00 65.11 C ATOM 514 CG1 VAL A 43 -11.642 -9.389 -6.209 1.00 62.34 C ATOM 515 CG2 VAL A 43 -9.761 -10.784 -5.288 1.00 53.35 C ATOM 0 H VAL A 43 -12.999 -8.419 -3.836 1.00 64.23 H new ATOM 0 HA VAL A 43 -10.757 -10.078 -2.929 1.00 72.30 H new ATOM 0 HB VAL A 43 -11.839 -11.079 -4.945 1.00 65.11 H new ATOM 0 HG11 VAL A 43 -11.594 -9.977 -7.126 1.00 62.34 H new ATOM 0 HG12 VAL A 43 -12.671 -9.078 -6.031 1.00 62.34 H new ATOM 0 HG13 VAL A 43 -11.009 -8.508 -6.310 1.00 62.34 H new ATOM 0 HG21 VAL A 43 -9.752 -11.334 -6.229 1.00 53.35 H new ATOM 0 HG22 VAL A 43 -9.050 -9.960 -5.342 1.00 53.35 H new ATOM 0 HG23 VAL A 43 -9.480 -11.453 -4.475 1.00 53.35 H new ATOM 525 N SER A 44 -9.154 -8.193 -3.549 1.00 11.43 N ATOM 526 CA SER A 44 -8.301 -7.056 -3.703 1.00 60.22 C ATOM 527 C SER A 44 -7.944 -6.878 -5.192 1.00 42.22 C ATOM 528 O SER A 44 -7.564 -7.851 -5.867 1.00 41.14 O ATOM 529 CB SER A 44 -7.048 -7.271 -2.868 1.00 3.30 C ATOM 530 OG SER A 44 -7.377 -7.459 -1.493 1.00 73.42 O ATOM 0 H SER A 44 -8.684 -9.027 -3.197 1.00 11.43 H new ATOM 0 HA SER A 44 -8.806 -6.152 -3.363 1.00 60.22 H new ATOM 0 HB2 SER A 44 -6.505 -8.141 -3.238 1.00 3.30 H new ATOM 0 HB3 SER A 44 -6.385 -6.412 -2.973 1.00 3.30 H new ATOM 0 HG SER A 44 -6.556 -7.597 -0.976 1.00 73.42 H new ATOM 536 N ALA A 45 -8.097 -5.672 -5.701 1.00 50.14 N ATOM 537 CA ALA A 45 -7.777 -5.369 -7.090 1.00 73.12 C ATOM 538 C ALA A 45 -7.124 -3.996 -7.253 1.00 40.34 C ATOM 539 O ALA A 45 -7.244 -3.125 -6.386 1.00 42.03 O ATOM 540 CB ALA A 45 -9.016 -5.444 -7.935 1.00 22.32 C ATOM 0 H ALA A 45 -8.445 -4.874 -5.169 1.00 50.14 H new ATOM 0 HA ALA A 45 -7.056 -6.116 -7.421 1.00 73.12 H new ATOM 0 HB1 ALA A 45 -8.764 -5.216 -8.971 1.00 22.32 H new ATOM 0 HB2 ALA A 45 -9.436 -6.448 -7.876 1.00 22.32 H new ATOM 0 HB3 ALA A 45 -9.748 -4.723 -7.572 1.00 22.32 H new ATOM 546 N THR A 46 -6.437 -3.828 -8.358 1.00 73.02 N ATOM 547 CA THR A 46 -5.765 -2.596 -8.709 1.00 54.41 C ATOM 548 C THR A 46 -6.520 -1.898 -9.839 1.00 65.22 C ATOM 549 O THR A 46 -6.874 -2.530 -10.829 1.00 4.44 O ATOM 550 CB THR A 46 -4.334 -2.874 -9.249 1.00 45.40 C ATOM 551 OG1 THR A 46 -3.570 -3.632 -8.320 1.00 55.52 O ATOM 552 CG2 THR A 46 -3.596 -1.564 -9.551 1.00 33.31 C ATOM 0 H THR A 46 -6.326 -4.563 -9.057 1.00 73.02 H new ATOM 0 HA THR A 46 -5.724 -1.984 -7.808 1.00 54.41 H new ATOM 0 HB THR A 46 -4.446 -3.447 -10.170 1.00 45.40 H new ATOM 0 HG1 THR A 46 -4.080 -3.742 -7.490 1.00 55.52 H new ATOM 0 HG21 THR A 46 -2.598 -1.787 -9.927 1.00 33.31 H new ATOM 0 HG22 THR A 46 -4.149 -1.000 -10.302 1.00 33.31 H new ATOM 0 HG23 THR A 46 -3.516 -0.973 -8.639 1.00 33.31 H new ATOM 560 N LEU A 47 -6.759 -0.629 -9.685 1.00 50.32 N ATOM 561 CA LEU A 47 -7.314 0.187 -10.730 1.00 13.04 C ATOM 562 C LEU A 47 -6.245 1.180 -11.189 1.00 11.12 C ATOM 563 O LEU A 47 -6.016 2.193 -10.541 1.00 53.43 O ATOM 564 CB LEU A 47 -8.575 0.915 -10.242 1.00 42.23 C ATOM 565 CG LEU A 47 -9.250 1.857 -11.236 1.00 50.41 C ATOM 566 CD1 LEU A 47 -9.594 1.137 -12.528 1.00 0.40 C ATOM 567 CD2 LEU A 47 -10.498 2.473 -10.622 1.00 64.12 C ATOM 0 H LEU A 47 -6.572 -0.123 -8.819 1.00 50.32 H new ATOM 0 HA LEU A 47 -7.612 -0.440 -11.570 1.00 13.04 H new ATOM 0 HB2 LEU A 47 -9.304 0.165 -9.935 1.00 42.23 H new ATOM 0 HB3 LEU A 47 -8.314 1.489 -9.353 1.00 42.23 H new ATOM 0 HG LEU A 47 -8.546 2.655 -11.473 1.00 50.41 H new ATOM 0 HD11 LEU A 47 -10.073 1.833 -13.216 1.00 0.40 H new ATOM 0 HD12 LEU A 47 -8.682 0.748 -12.982 1.00 0.40 H new ATOM 0 HD13 LEU A 47 -10.274 0.312 -12.315 1.00 0.40 H new ATOM 0 HD21 LEU A 47 -10.967 3.142 -11.344 1.00 64.12 H new ATOM 0 HD22 LEU A 47 -11.198 1.683 -10.351 1.00 64.12 H new ATOM 0 HD23 LEU A 47 -10.224 3.037 -9.730 1.00 64.12 H new ATOM 579 N PRO A 48 -5.527 0.864 -12.269 1.00 12.34 N ATOM 580 CA PRO A 48 -4.445 1.704 -12.761 1.00 73.52 C ATOM 581 C PRO A 48 -4.943 2.845 -13.654 1.00 33.04 C ATOM 582 O PRO A 48 -5.870 2.667 -14.461 1.00 43.44 O ATOM 583 CB PRO A 48 -3.587 0.725 -13.557 1.00 64.14 C ATOM 584 CG PRO A 48 -4.546 -0.309 -14.068 1.00 13.24 C ATOM 585 CD PRO A 48 -5.716 -0.341 -13.110 1.00 44.45 C ATOM 0 HA PRO A 48 -3.911 2.204 -11.953 1.00 73.52 H new ATOM 0 HB2 PRO A 48 -3.074 1.227 -14.378 1.00 64.14 H new ATOM 0 HB3 PRO A 48 -2.818 0.274 -12.929 1.00 64.14 H new ATOM 0 HG2 PRO A 48 -4.880 -0.061 -15.076 1.00 13.24 H new ATOM 0 HG3 PRO A 48 -4.066 -1.286 -14.123 1.00 13.24 H new ATOM 0 HD2 PRO A 48 -6.667 -0.311 -13.641 1.00 44.45 H new ATOM 0 HD3 PRO A 48 -5.715 -1.251 -12.509 1.00 44.45 H new ATOM 593 N GLY A 49 -4.331 4.008 -13.507 1.00 73.32 N ATOM 594 CA GLY A 49 -4.726 5.152 -14.292 1.00 32.42 C ATOM 595 C GLY A 49 -5.740 5.995 -13.574 1.00 4.55 C ATOM 596 O GLY A 49 -6.331 6.911 -14.151 1.00 4.34 O ATOM 0 H GLY A 49 -3.565 4.179 -12.855 1.00 73.32 H new ATOM 0 HA2 GLY A 49 -3.848 5.756 -14.522 1.00 32.42 H new ATOM 0 HA3 GLY A 49 -5.140 4.816 -15.243 1.00 32.42 H new ATOM 600 N PHE A 50 -5.933 5.698 -12.316 1.00 14.30 N ATOM 601 CA PHE A 50 -6.868 6.387 -11.466 1.00 42.53 C ATOM 602 C PHE A 50 -6.208 6.549 -10.144 1.00 75.01 C ATOM 603 O PHE A 50 -5.300 5.817 -9.847 1.00 20.14 O ATOM 604 CB PHE A 50 -8.178 5.587 -11.306 1.00 11.15 C ATOM 605 CG PHE A 50 -8.998 5.452 -12.568 1.00 32.53 C ATOM 606 CD1 PHE A 50 -8.709 4.476 -13.511 1.00 45.21 C ATOM 607 CD2 PHE A 50 -10.052 6.312 -12.808 1.00 62.01 C ATOM 608 CE1 PHE A 50 -9.456 4.363 -14.663 1.00 33.32 C ATOM 609 CE2 PHE A 50 -10.802 6.205 -13.960 1.00 71.35 C ATOM 610 CZ PHE A 50 -10.504 5.228 -14.889 1.00 43.31 C ATOM 0 H PHE A 50 -5.430 4.949 -11.841 1.00 14.30 H new ATOM 0 HA PHE A 50 -7.133 7.350 -11.902 1.00 42.53 H new ATOM 0 HB2 PHE A 50 -7.935 4.590 -10.939 1.00 11.15 H new ATOM 0 HB3 PHE A 50 -8.789 6.068 -10.542 1.00 11.15 H new ATOM 0 HD1 PHE A 50 -7.888 3.796 -13.340 1.00 45.21 H new ATOM 0 HD2 PHE A 50 -10.291 7.077 -12.085 1.00 62.01 H new ATOM 0 HE1 PHE A 50 -9.220 3.598 -15.388 1.00 33.32 H new ATOM 0 HE2 PHE A 50 -11.622 6.885 -14.136 1.00 71.35 H new ATOM 0 HZ PHE A 50 -11.091 5.142 -15.791 1.00 43.31 H new ATOM 620 N GLN A 51 -6.648 7.470 -9.349 1.00 14.10 N ATOM 621 CA GLN A 51 -6.021 7.685 -8.066 1.00 33.32 C ATOM 622 C GLN A 51 -7.072 7.949 -7.021 1.00 3.25 C ATOM 623 O GLN A 51 -8.096 8.584 -7.307 1.00 23.23 O ATOM 624 CB GLN A 51 -5.055 8.873 -8.137 1.00 55.01 C ATOM 625 CG GLN A 51 -4.291 9.172 -6.844 1.00 61.23 C ATOM 626 CD GLN A 51 -3.290 8.096 -6.443 1.00 42.54 C ATOM 627 OE1 GLN A 51 -3.470 6.915 -6.723 1.00 41.35 O ATOM 628 NE2 GLN A 51 -2.230 8.509 -5.796 1.00 33.04 N ATOM 0 H GLN A 51 -7.434 8.087 -9.555 1.00 14.10 H new ATOM 0 HA GLN A 51 -5.460 6.790 -7.797 1.00 33.32 H new ATOM 0 HB2 GLN A 51 -4.333 8.686 -8.932 1.00 55.01 H new ATOM 0 HB3 GLN A 51 -5.618 9.762 -8.421 1.00 55.01 H new ATOM 0 HG2 GLN A 51 -3.763 10.118 -6.959 1.00 61.23 H new ATOM 0 HG3 GLN A 51 -5.009 9.304 -6.034 1.00 61.23 H new ATOM 0 HE21 GLN A 51 -2.117 9.500 -5.582 1.00 33.04 H new ATOM 0 HE22 GLN A 51 -1.517 7.840 -5.506 1.00 33.04 H new ATOM 637 N ARG A 52 -6.849 7.426 -5.834 1.00 61.12 N ATOM 638 CA ARG A 52 -7.730 7.676 -4.736 1.00 53.34 C ATOM 639 C ARG A 52 -7.122 8.700 -3.826 1.00 33.03 C ATOM 640 O ARG A 52 -5.993 8.545 -3.355 1.00 72.31 O ATOM 641 CB ARG A 52 -8.121 6.397 -3.961 1.00 75.24 C ATOM 642 CG ARG A 52 -6.979 5.560 -3.391 1.00 63.50 C ATOM 643 CD ARG A 52 -7.542 4.404 -2.559 1.00 32.11 C ATOM 644 NE ARG A 52 -6.509 3.470 -2.103 1.00 41.31 N ATOM 645 CZ ARG A 52 -6.625 2.634 -1.049 1.00 3.40 C ATOM 646 NH1 ARG A 52 -7.737 2.634 -0.312 1.00 62.35 N ATOM 647 NH2 ARG A 52 -5.622 1.795 -0.739 1.00 33.42 N ATOM 0 H ARG A 52 -6.057 6.822 -5.614 1.00 61.12 H new ATOM 0 HA ARG A 52 -8.662 8.063 -5.149 1.00 53.34 H new ATOM 0 HB2 ARG A 52 -8.774 6.685 -3.138 1.00 75.24 H new ATOM 0 HB3 ARG A 52 -8.707 5.763 -4.626 1.00 75.24 H new ATOM 0 HG2 ARG A 52 -6.363 5.170 -4.201 1.00 63.50 H new ATOM 0 HG3 ARG A 52 -6.334 6.184 -2.772 1.00 63.50 H new ATOM 0 HD2 ARG A 52 -8.066 4.809 -1.693 1.00 32.11 H new ATOM 0 HD3 ARG A 52 -8.278 3.862 -3.152 1.00 32.11 H new ATOM 0 HE ARG A 52 -5.632 3.450 -2.624 1.00 41.31 H new ATOM 0 HH11 ARG A 52 -8.503 3.267 -0.544 1.00 62.35 H new ATOM 0 HH12 ARG A 52 -7.822 2.001 0.484 1.00 62.35 H new ATOM 0 HH21 ARG A 52 -4.770 1.789 -1.300 1.00 33.42 H new ATOM 0 HH22 ARG A 52 -5.712 1.165 0.058 1.00 33.42 H new ATOM 661 N PHE A 53 -7.865 9.717 -3.566 1.00 0.03 N ATOM 662 CA PHE A 53 -7.405 10.803 -2.756 1.00 74.14 C ATOM 663 C PHE A 53 -8.122 10.745 -1.445 1.00 13.31 C ATOM 664 O PHE A 53 -9.119 10.046 -1.333 1.00 1.43 O ATOM 665 CB PHE A 53 -7.698 12.129 -3.467 1.00 33.22 C ATOM 666 CG PHE A 53 -7.007 12.245 -4.792 1.00 63.51 C ATOM 667 CD1 PHE A 53 -7.597 11.768 -5.947 1.00 52.01 C ATOM 668 CD2 PHE A 53 -5.761 12.810 -4.879 1.00 44.02 C ATOM 669 CE1 PHE A 53 -6.947 11.862 -7.153 1.00 3.31 C ATOM 670 CE2 PHE A 53 -5.113 12.906 -6.082 1.00 1.51 C ATOM 671 CZ PHE A 53 -5.706 12.431 -7.220 1.00 71.04 C ATOM 0 H PHE A 53 -8.819 9.825 -3.910 1.00 0.03 H new ATOM 0 HA PHE A 53 -6.330 10.730 -2.590 1.00 74.14 H new ATOM 0 HB2 PHE A 53 -8.774 12.227 -3.614 1.00 33.22 H new ATOM 0 HB3 PHE A 53 -7.387 12.955 -2.827 1.00 33.22 H new ATOM 0 HD1 PHE A 53 -8.577 11.318 -5.901 1.00 52.01 H new ATOM 0 HD2 PHE A 53 -5.283 13.185 -3.986 1.00 44.02 H new ATOM 0 HE1 PHE A 53 -7.417 11.486 -8.050 1.00 3.31 H new ATOM 0 HE2 PHE A 53 -4.133 13.357 -6.132 1.00 1.51 H new ATOM 0 HZ PHE A 53 -5.195 12.505 -8.169 1.00 71.04 H new ATOM 681 N ARG A 54 -7.610 11.409 -0.443 1.00 34.50 N ATOM 682 CA ARG A 54 -8.276 11.447 0.840 1.00 74.14 C ATOM 683 C ARG A 54 -8.664 12.827 1.227 1.00 14.44 C ATOM 684 O ARG A 54 -7.849 13.740 1.232 1.00 11.35 O ATOM 685 CB ARG A 54 -7.510 10.720 1.977 1.00 3.41 C ATOM 686 CG ARG A 54 -7.957 9.295 2.196 1.00 32.44 C ATOM 687 CD ARG A 54 -7.739 8.444 0.978 1.00 15.11 C ATOM 688 NE ARG A 54 -8.378 7.128 1.114 1.00 51.12 N ATOM 689 CZ ARG A 54 -9.101 6.526 0.165 1.00 1.13 C ATOM 690 NH1 ARG A 54 -9.332 7.146 -0.997 1.00 72.42 N ATOM 691 NH2 ARG A 54 -9.635 5.331 0.396 1.00 12.11 N ATOM 0 H ARG A 54 -6.735 11.932 -0.486 1.00 34.50 H new ATOM 0 HA ARG A 54 -9.192 10.873 0.700 1.00 74.14 H new ATOM 0 HB2 ARG A 54 -6.445 10.726 1.747 1.00 3.41 H new ATOM 0 HB3 ARG A 54 -7.639 11.278 2.904 1.00 3.41 H new ATOM 0 HG2 ARG A 54 -7.412 8.869 3.038 1.00 32.44 H new ATOM 0 HG3 ARG A 54 -9.014 9.283 2.462 1.00 32.44 H new ATOM 0 HD2 ARG A 54 -8.139 8.954 0.101 1.00 15.11 H new ATOM 0 HD3 ARG A 54 -6.670 8.314 0.811 1.00 15.11 H new ATOM 0 HE ARG A 54 -8.261 6.637 2.000 1.00 51.12 H new ATOM 0 HH11 ARG A 54 -8.956 8.080 -1.160 1.00 72.42 H new ATOM 0 HH12 ARG A 54 -9.884 6.685 -1.720 1.00 72.42 H new ATOM 0 HH21 ARG A 54 -9.493 4.874 1.297 1.00 12.11 H new ATOM 0 HH22 ARG A 54 -10.187 4.871 -0.328 1.00 12.11 H new ATOM 705 N LEU A 55 -9.914 12.967 1.523 1.00 0.31 N ATOM 706 CA LEU A 55 -10.488 14.183 1.962 1.00 64.43 C ATOM 707 C LEU A 55 -11.616 13.724 2.872 1.00 51.22 C ATOM 708 O LEU A 55 -12.330 12.780 2.525 1.00 53.41 O ATOM 709 CB LEU A 55 -11.007 14.980 0.734 1.00 42.24 C ATOM 710 CG LEU A 55 -11.245 16.500 0.904 1.00 73.45 C ATOM 711 CD1 LEU A 55 -12.272 16.813 1.960 1.00 52.14 C ATOM 712 CD2 LEU A 55 -9.938 17.215 1.207 1.00 75.33 C ATOM 0 H LEU A 55 -10.586 12.202 1.461 1.00 0.31 H new ATOM 0 HA LEU A 55 -9.798 14.850 2.479 1.00 64.43 H new ATOM 0 HB2 LEU A 55 -10.295 14.842 -0.079 1.00 42.24 H new ATOM 0 HB3 LEU A 55 -11.946 14.528 0.415 1.00 42.24 H new ATOM 0 HG LEU A 55 -11.642 16.864 -0.043 1.00 73.45 H new ATOM 0 HD11 LEU A 55 -12.398 17.893 2.036 1.00 52.14 H new ATOM 0 HD12 LEU A 55 -13.223 16.355 1.690 1.00 52.14 H new ATOM 0 HD13 LEU A 55 -11.939 16.418 2.920 1.00 52.14 H new ATOM 0 HD21 LEU A 55 -10.126 18.282 1.323 1.00 75.33 H new ATOM 0 HD22 LEU A 55 -9.512 16.819 2.129 1.00 75.33 H new ATOM 0 HD23 LEU A 55 -9.238 17.057 0.387 1.00 75.33 H new ATOM 724 N LYS A 56 -11.740 14.313 4.027 1.00 14.20 N ATOM 725 CA LYS A 56 -12.689 13.821 5.006 1.00 12.15 C ATOM 726 C LYS A 56 -13.965 14.652 5.120 1.00 11.05 C ATOM 727 O LYS A 56 -15.046 14.094 5.304 1.00 55.53 O ATOM 728 CB LYS A 56 -12.009 13.692 6.367 1.00 43.22 C ATOM 729 CG LYS A 56 -10.841 12.709 6.366 1.00 70.54 C ATOM 730 CD LYS A 56 -10.111 12.678 7.698 1.00 14.52 C ATOM 731 CE LYS A 56 -9.470 14.022 8.019 1.00 63.41 C ATOM 732 NZ LYS A 56 -8.723 13.988 9.293 1.00 53.43 N ATOM 0 H LYS A 56 -11.204 15.130 4.320 1.00 14.20 H new ATOM 0 HA LYS A 56 -13.013 12.843 4.650 1.00 12.15 H new ATOM 0 HB2 LYS A 56 -11.650 14.672 6.681 1.00 43.22 H new ATOM 0 HB3 LYS A 56 -12.745 13.371 7.104 1.00 43.22 H new ATOM 0 HG2 LYS A 56 -11.210 11.710 6.133 1.00 70.54 H new ATOM 0 HG3 LYS A 56 -10.140 12.982 5.577 1.00 70.54 H new ATOM 0 HD2 LYS A 56 -10.810 12.409 8.490 1.00 14.52 H new ATOM 0 HD3 LYS A 56 -9.343 11.905 7.675 1.00 14.52 H new ATOM 0 HE2 LYS A 56 -8.796 14.304 7.211 1.00 63.41 H new ATOM 0 HE3 LYS A 56 -10.243 14.789 8.072 1.00 63.41 H new ATOM 0 HZ1 LYS A 56 -8.303 14.922 9.474 1.00 53.43 H new ATOM 0 HZ2 LYS A 56 -9.371 13.744 10.069 1.00 53.43 H new ATOM 0 HZ3 LYS A 56 -7.969 13.274 9.234 1.00 53.43 H new ATOM 746 N GLY A 57 -13.862 15.953 5.031 1.00 31.45 N ATOM 747 CA GLY A 57 -15.045 16.771 5.219 1.00 62.43 C ATOM 748 C GLY A 57 -15.446 17.536 3.991 1.00 52.34 C ATOM 749 O GLY A 57 -14.622 18.226 3.397 1.00 0.13 O ATOM 0 H GLY A 57 -13.000 16.463 4.836 1.00 31.45 H new ATOM 0 HA2 GLY A 57 -15.873 16.133 5.526 1.00 62.43 H new ATOM 0 HA3 GLY A 57 -14.865 17.474 6.033 1.00 62.43 H new ATOM 753 N ARG A 58 -16.710 17.365 3.581 1.00 73.11 N ATOM 754 CA ARG A 58 -17.340 18.074 2.461 1.00 70.54 C ATOM 755 C ARG A 58 -17.034 17.383 1.145 1.00 71.44 C ATOM 756 O ARG A 58 -17.778 17.494 0.161 1.00 11.22 O ATOM 757 CB ARG A 58 -17.042 19.622 2.509 1.00 63.24 C ATOM 758 CG ARG A 58 -17.611 20.483 1.379 1.00 33.31 C ATOM 759 CD ARG A 58 -16.799 20.375 0.104 1.00 41.45 C ATOM 760 NE ARG A 58 -17.390 21.133 -0.993 1.00 44.11 N ATOM 761 CZ ARG A 58 -16.709 21.658 -2.008 1.00 22.34 C ATOM 762 NH1 ARG A 58 -15.382 21.627 -2.010 1.00 61.13 N ATOM 763 NH2 ARG A 58 -17.354 22.229 -3.008 1.00 42.24 N ATOM 0 H ARG A 58 -17.343 16.707 4.036 1.00 73.11 H new ATOM 0 HA ARG A 58 -18.424 18.017 2.558 1.00 70.54 H new ATOM 0 HB2 ARG A 58 -17.424 20.010 3.453 1.00 63.24 H new ATOM 0 HB3 ARG A 58 -15.960 19.757 2.524 1.00 63.24 H new ATOM 0 HG2 ARG A 58 -18.639 20.181 1.178 1.00 33.31 H new ATOM 0 HG3 ARG A 58 -17.642 21.524 1.700 1.00 33.31 H new ATOM 0 HD2 ARG A 58 -15.787 20.736 0.288 1.00 41.45 H new ATOM 0 HD3 ARG A 58 -16.716 19.327 -0.184 1.00 41.45 H new ATOM 0 HE ARG A 58 -18.401 21.271 -0.981 1.00 44.11 H new ATOM 0 HH11 ARG A 58 -14.881 21.199 -1.231 1.00 61.13 H new ATOM 0 HH12 ARG A 58 -14.864 22.031 -2.790 1.00 61.13 H new ATOM 0 HH21 ARG A 58 -18.373 22.267 -3.002 1.00 42.24 H new ATOM 0 HH22 ARG A 58 -16.833 22.632 -3.787 1.00 42.24 H new ATOM 777 N LEU A 59 -15.972 16.652 1.145 1.00 51.03 N ATOM 778 CA LEU A 59 -15.602 15.860 0.042 1.00 34.35 C ATOM 779 C LEU A 59 -15.127 14.519 0.579 1.00 0.53 C ATOM 780 O LEU A 59 -14.838 14.407 1.768 1.00 64.22 O ATOM 781 CB LEU A 59 -14.578 16.565 -0.855 1.00 5.04 C ATOM 782 CG LEU A 59 -14.221 15.837 -2.136 1.00 24.40 C ATOM 783 CD1 LEU A 59 -15.484 15.536 -2.903 1.00 72.31 C ATOM 784 CD2 LEU A 59 -13.306 16.684 -2.978 1.00 62.33 C ATOM 0 H LEU A 59 -15.328 16.593 1.934 1.00 51.03 H new ATOM 0 HA LEU A 59 -16.456 15.693 -0.615 1.00 34.35 H new ATOM 0 HB2 LEU A 59 -14.965 17.550 -1.114 1.00 5.04 H new ATOM 0 HB3 LEU A 59 -13.665 16.722 -0.281 1.00 5.04 H new ATOM 0 HG LEU A 59 -13.709 14.907 -1.890 1.00 24.40 H new ATOM 0 HD11 LEU A 59 -15.233 15.012 -3.826 1.00 72.31 H new ATOM 0 HD12 LEU A 59 -16.138 14.909 -2.296 1.00 72.31 H new ATOM 0 HD13 LEU A 59 -15.995 16.468 -3.142 1.00 72.31 H new ATOM 0 HD21 LEU A 59 -13.057 16.150 -3.895 1.00 62.33 H new ATOM 0 HD22 LEU A 59 -13.804 17.621 -3.228 1.00 62.33 H new ATOM 0 HD23 LEU A 59 -12.393 16.896 -2.422 1.00 62.33 H new ATOM 796 N TYR A 60 -15.056 13.531 -0.270 1.00 52.44 N ATOM 797 CA TYR A 60 -14.847 12.170 0.160 1.00 70.14 C ATOM 798 C TYR A 60 -13.549 11.626 -0.445 1.00 60.21 C ATOM 799 O TYR A 60 -12.937 12.286 -1.293 1.00 43.22 O ATOM 800 CB TYR A 60 -16.035 11.326 -0.357 1.00 1.42 C ATOM 801 CG TYR A 60 -17.376 11.981 -0.156 1.00 20.34 C ATOM 802 CD1 TYR A 60 -17.875 12.832 -1.129 1.00 1.31 C ATOM 803 CD2 TYR A 60 -18.129 11.781 0.989 1.00 24.12 C ATOM 804 CE1 TYR A 60 -19.065 13.464 -0.976 1.00 32.21 C ATOM 805 CE2 TYR A 60 -19.345 12.416 1.147 1.00 23.31 C ATOM 806 CZ TYR A 60 -19.801 13.262 0.153 1.00 63.22 C ATOM 807 OH TYR A 60 -21.000 13.911 0.288 1.00 4.42 O ATOM 0 H TYR A 60 -15.141 13.643 -1.280 1.00 52.44 H new ATOM 0 HA TYR A 60 -14.777 12.125 1.247 1.00 70.14 H new ATOM 0 HB2 TYR A 60 -15.893 11.128 -1.419 1.00 1.42 H new ATOM 0 HB3 TYR A 60 -16.032 10.361 0.151 1.00 1.42 H new ATOM 0 HD1 TYR A 60 -17.303 12.996 -2.030 1.00 1.31 H new ATOM 0 HD2 TYR A 60 -17.763 11.124 1.764 1.00 24.12 H new ATOM 0 HE1 TYR A 60 -19.429 14.126 -1.748 1.00 32.21 H new ATOM 0 HE2 TYR A 60 -19.934 12.254 2.038 1.00 23.31 H new ATOM 0 HH TYR A 60 -21.224 14.363 -0.552 1.00 4.42 H new ATOM 817 N PRO A 61 -13.110 10.421 -0.014 1.00 53.15 N ATOM 818 CA PRO A 61 -11.928 9.711 -0.581 1.00 53.13 C ATOM 819 C PRO A 61 -12.163 9.214 -2.050 1.00 30.41 C ATOM 820 O PRO A 61 -11.800 8.076 -2.403 1.00 25.12 O ATOM 821 CB PRO A 61 -11.807 8.494 0.362 1.00 33.15 C ATOM 822 CG PRO A 61 -12.526 8.881 1.593 1.00 1.30 C ATOM 823 CD PRO A 61 -13.686 9.661 1.117 1.00 64.24 C ATOM 0 HA PRO A 61 -11.048 10.351 -0.636 1.00 53.13 H new ATOM 0 HB2 PRO A 61 -12.247 7.603 -0.087 1.00 33.15 H new ATOM 0 HB3 PRO A 61 -10.763 8.262 0.573 1.00 33.15 H new ATOM 0 HG2 PRO A 61 -12.843 8.005 2.159 1.00 1.30 H new ATOM 0 HG3 PRO A 61 -11.893 9.475 2.252 1.00 1.30 H new ATOM 0 HD2 PRO A 61 -14.506 9.017 0.799 1.00 64.24 H new ATOM 0 HD3 PRO A 61 -14.079 10.319 1.892 1.00 64.24 H new ATOM 831 N CYS A 62 -12.678 10.104 -2.880 1.00 44.24 N ATOM 832 CA CYS A 62 -13.094 9.834 -4.258 1.00 3.32 C ATOM 833 C CYS A 62 -11.957 9.361 -5.201 1.00 43.40 C ATOM 834 O CYS A 62 -10.750 9.529 -4.912 1.00 35.03 O ATOM 835 CB CYS A 62 -13.752 11.093 -4.822 1.00 34.34 C ATOM 836 SG CYS A 62 -12.680 12.553 -4.798 1.00 64.15 S ATOM 0 H CYS A 62 -12.827 11.076 -2.608 1.00 44.24 H new ATOM 0 HA CYS A 62 -13.792 8.998 -4.215 1.00 3.32 H new ATOM 0 HB2 CYS A 62 -14.064 10.900 -5.848 1.00 34.34 H new ATOM 0 HB3 CYS A 62 -14.655 11.307 -4.250 1.00 34.34 H new ATOM 0 HG CYS A 62 -13.320 13.569 -5.296 1.00 64.15 H new ATOM 842 N ILE A 63 -12.381 8.784 -6.334 1.00 74.54 N ATOM 843 CA ILE A 63 -11.507 8.279 -7.396 1.00 12.14 C ATOM 844 C ILE A 63 -11.641 9.182 -8.600 1.00 54.40 C ATOM 845 O ILE A 63 -12.726 9.664 -8.870 1.00 24.12 O ATOM 846 CB ILE A 63 -11.984 6.859 -7.868 1.00 40.04 C ATOM 847 CG1 ILE A 63 -12.002 5.874 -6.726 1.00 63.33 C ATOM 848 CG2 ILE A 63 -11.139 6.315 -9.022 1.00 23.25 C ATOM 849 CD1 ILE A 63 -10.653 5.623 -6.115 1.00 4.31 C ATOM 0 H ILE A 63 -13.371 8.653 -6.541 1.00 74.54 H new ATOM 0 HA ILE A 63 -10.488 8.240 -7.012 1.00 12.14 H new ATOM 0 HB ILE A 63 -13.003 6.985 -8.234 1.00 40.04 H new ATOM 0 HG12 ILE A 63 -12.677 6.242 -5.953 1.00 63.33 H new ATOM 0 HG13 ILE A 63 -12.410 4.928 -7.082 1.00 63.33 H new ATOM 0 HG21 ILE A 63 -11.509 5.331 -9.312 1.00 23.25 H new ATOM 0 HG22 ILE A 63 -11.206 6.993 -9.873 1.00 23.25 H new ATOM 0 HG23 ILE A 63 -10.100 6.233 -8.705 1.00 23.25 H new ATOM 0 HD11 ILE A 63 -10.750 4.904 -5.301 1.00 4.31 H new ATOM 0 HD12 ILE A 63 -9.979 5.224 -6.873 1.00 4.31 H new ATOM 0 HD13 ILE A 63 -10.250 6.558 -5.727 1.00 4.31 H new ATOM 861 N VAL A 64 -10.556 9.431 -9.288 1.00 32.50 N ATOM 862 CA VAL A 64 -10.578 10.130 -10.577 1.00 33.22 C ATOM 863 C VAL A 64 -9.434 9.582 -11.419 1.00 73.30 C ATOM 864 O VAL A 64 -8.459 9.053 -10.859 1.00 24.01 O ATOM 865 CB VAL A 64 -10.396 11.688 -10.469 1.00 12.23 C ATOM 866 CG1 VAL A 64 -11.522 12.340 -9.721 1.00 2.34 C ATOM 867 CG2 VAL A 64 -9.079 12.039 -9.824 1.00 41.31 C ATOM 0 H VAL A 64 -9.622 9.159 -8.981 1.00 32.50 H new ATOM 0 HA VAL A 64 -11.561 9.958 -11.017 1.00 33.22 H new ATOM 0 HB VAL A 64 -10.405 12.073 -11.489 1.00 12.23 H new ATOM 0 HG11 VAL A 64 -11.352 13.416 -9.672 1.00 2.34 H new ATOM 0 HG12 VAL A 64 -12.462 12.144 -10.236 1.00 2.34 H new ATOM 0 HG13 VAL A 64 -11.571 11.934 -8.710 1.00 2.34 H new ATOM 0 HG21 VAL A 64 -8.981 13.123 -9.763 1.00 41.31 H new ATOM 0 HG22 VAL A 64 -9.040 11.614 -8.821 1.00 41.31 H new ATOM 0 HG23 VAL A 64 -8.262 11.634 -10.421 1.00 41.31 H new ATOM 877 N PRO A 65 -9.535 9.654 -12.748 1.00 4.32 N ATOM 878 CA PRO A 65 -8.452 9.238 -13.635 1.00 25.41 C ATOM 879 C PRO A 65 -7.213 10.145 -13.500 1.00 23.40 C ATOM 880 O PRO A 65 -7.247 11.330 -13.856 1.00 54.34 O ATOM 881 CB PRO A 65 -9.063 9.347 -15.041 1.00 12.14 C ATOM 882 CG PRO A 65 -10.225 10.270 -14.893 1.00 13.04 C ATOM 883 CD PRO A 65 -10.729 10.101 -13.495 1.00 25.42 C ATOM 0 HA PRO A 65 -8.096 8.235 -13.401 1.00 25.41 H new ATOM 0 HB2 PRO A 65 -8.339 9.738 -15.756 1.00 12.14 H new ATOM 0 HB3 PRO A 65 -9.380 8.371 -15.409 1.00 12.14 H new ATOM 0 HG2 PRO A 65 -9.926 11.302 -15.075 1.00 13.04 H new ATOM 0 HG3 PRO A 65 -11.004 10.032 -15.617 1.00 13.04 H new ATOM 0 HD2 PRO A 65 -11.126 11.035 -13.096 1.00 25.42 H new ATOM 0 HD3 PRO A 65 -11.532 9.366 -13.444 1.00 25.42 H new ATOM 891 N SER A 66 -6.150 9.596 -12.957 1.00 63.03 N ATOM 892 CA SER A 66 -4.917 10.313 -12.776 1.00 2.13 C ATOM 893 C SER A 66 -3.793 9.546 -13.437 1.00 45.45 C ATOM 894 O SER A 66 -3.692 8.333 -13.289 1.00 11.23 O ATOM 895 CB SER A 66 -4.618 10.530 -11.290 1.00 61.12 C ATOM 896 OG SER A 66 -3.413 11.272 -11.103 1.00 31.33 O ATOM 0 H SER A 66 -6.121 8.631 -12.627 1.00 63.03 H new ATOM 0 HA SER A 66 -5.009 11.295 -13.239 1.00 2.13 H new ATOM 0 HB2 SER A 66 -5.449 11.060 -10.824 1.00 61.12 H new ATOM 0 HB3 SER A 66 -4.534 9.565 -10.790 1.00 61.12 H new ATOM 0 HG SER A 66 -3.250 11.396 -10.145 1.00 31.33 H new ATOM 902 N GLU A 67 -2.947 10.251 -14.145 1.00 4.42 N ATOM 903 CA GLU A 67 -1.855 9.640 -14.890 1.00 2.23 C ATOM 904 C GLU A 67 -0.764 9.166 -13.926 1.00 32.31 C ATOM 905 O GLU A 67 0.023 8.278 -14.248 1.00 71.21 O ATOM 906 CB GLU A 67 -1.216 10.647 -15.887 1.00 34.00 C ATOM 907 CG GLU A 67 -2.180 11.420 -16.806 1.00 34.42 C ATOM 908 CD GLU A 67 -3.068 12.377 -16.036 1.00 43.35 C ATOM 909 OE1 GLU A 67 -2.547 13.125 -15.190 1.00 25.14 O ATOM 910 OE2 GLU A 67 -4.292 12.380 -16.247 1.00 50.54 O ATOM 0 H GLU A 67 -2.989 11.267 -14.227 1.00 4.42 H new ATOM 0 HA GLU A 67 -2.270 8.799 -15.445 1.00 2.23 H new ATOM 0 HB2 GLU A 67 -0.638 11.372 -15.314 1.00 34.00 H new ATOM 0 HB3 GLU A 67 -0.511 10.102 -16.515 1.00 34.00 H new ATOM 0 HG2 GLU A 67 -1.605 11.977 -17.545 1.00 34.42 H new ATOM 0 HG3 GLU A 67 -2.802 10.712 -17.354 1.00 34.42 H new ATOM 917 N LYS A 68 -0.749 9.750 -12.736 1.00 54.01 N ATOM 918 CA LYS A 68 0.313 9.492 -11.768 1.00 20.35 C ATOM 919 C LYS A 68 -0.110 8.494 -10.696 1.00 21.15 C ATOM 920 O LYS A 68 0.645 8.240 -9.756 1.00 62.21 O ATOM 921 CB LYS A 68 0.782 10.800 -11.060 1.00 63.14 C ATOM 922 CG LYS A 68 1.417 11.892 -11.948 1.00 13.02 C ATOM 923 CD LYS A 68 0.429 12.611 -12.874 1.00 42.21 C ATOM 924 CE LYS A 68 -0.648 13.370 -12.095 1.00 21.42 C ATOM 925 NZ LYS A 68 -1.506 14.187 -12.986 1.00 61.32 N ATOM 0 H LYS A 68 -1.460 10.407 -12.415 1.00 54.01 H new ATOM 0 HA LYS A 68 1.136 9.070 -12.345 1.00 20.35 H new ATOM 0 HB2 LYS A 68 -0.078 11.236 -10.551 1.00 63.14 H new ATOM 0 HB3 LYS A 68 1.504 10.528 -10.290 1.00 63.14 H new ATOM 0 HG2 LYS A 68 1.898 12.631 -11.306 1.00 13.02 H new ATOM 0 HG3 LYS A 68 2.201 11.439 -12.555 1.00 13.02 H new ATOM 0 HD2 LYS A 68 0.973 13.308 -13.511 1.00 42.21 H new ATOM 0 HD3 LYS A 68 -0.046 11.883 -13.531 1.00 42.21 H new ATOM 0 HE2 LYS A 68 -1.267 12.660 -11.547 1.00 21.42 H new ATOM 0 HE3 LYS A 68 -0.174 14.016 -11.356 1.00 21.42 H new ATOM 0 HZ1 LYS A 68 -2.476 14.208 -12.611 1.00 61.32 H new ATOM 0 HZ2 LYS A 68 -1.133 15.156 -13.034 1.00 61.32 H new ATOM 0 HZ3 LYS A 68 -1.513 13.771 -13.939 1.00 61.32 H new ATOM 939 N GLY A 69 -1.283 7.917 -10.825 1.00 34.14 N ATOM 940 CA GLY A 69 -1.739 7.062 -9.764 1.00 52.20 C ATOM 941 C GLY A 69 -2.276 5.727 -10.206 1.00 64.51 C ATOM 942 O GLY A 69 -2.374 5.424 -11.412 1.00 24.52 O ATOM 0 H GLY A 69 -1.913 8.019 -11.621 1.00 34.14 H new ATOM 0 HA2 GLY A 69 -0.913 6.893 -9.074 1.00 52.20 H new ATOM 0 HA3 GLY A 69 -2.518 7.583 -9.207 1.00 52.20 H new ATOM 946 N GLU A 70 -2.626 4.952 -9.224 1.00 51.14 N ATOM 947 CA GLU A 70 -3.197 3.647 -9.352 1.00 14.42 C ATOM 948 C GLU A 70 -3.938 3.429 -8.045 1.00 34.22 C ATOM 949 O GLU A 70 -3.486 3.898 -7.006 1.00 33.32 O ATOM 950 CB GLU A 70 -2.099 2.581 -9.553 1.00 62.22 C ATOM 951 CG GLU A 70 -1.182 2.406 -8.360 1.00 33.53 C ATOM 952 CD GLU A 70 -0.042 1.474 -8.605 1.00 21.14 C ATOM 953 OE1 GLU A 70 -0.261 0.249 -8.661 1.00 62.01 O ATOM 954 OE2 GLU A 70 1.098 1.945 -8.673 1.00 51.31 O ATOM 0 H GLU A 70 -2.513 5.233 -8.250 1.00 51.14 H new ATOM 0 HA GLU A 70 -3.854 3.564 -10.218 1.00 14.42 H new ATOM 0 HB2 GLU A 70 -2.572 1.625 -9.777 1.00 62.22 H new ATOM 0 HB3 GLU A 70 -1.499 2.852 -10.422 1.00 62.22 H new ATOM 0 HG2 GLU A 70 -0.787 3.380 -8.072 1.00 33.53 H new ATOM 0 HG3 GLU A 70 -1.766 2.037 -7.517 1.00 33.53 H new ATOM 961 N VAL A 71 -5.049 2.790 -8.080 1.00 62.13 N ATOM 962 CA VAL A 71 -5.821 2.617 -6.880 1.00 63.33 C ATOM 963 C VAL A 71 -5.863 1.179 -6.495 1.00 62.03 C ATOM 964 O VAL A 71 -6.316 0.344 -7.264 1.00 12.04 O ATOM 965 CB VAL A 71 -7.280 3.103 -7.063 1.00 35.15 C ATOM 966 CG1 VAL A 71 -8.059 2.987 -5.768 1.00 70.51 C ATOM 967 CG2 VAL A 71 -7.315 4.514 -7.579 1.00 63.22 C ATOM 0 H VAL A 71 -5.454 2.374 -8.919 1.00 62.13 H new ATOM 0 HA VAL A 71 -5.337 3.211 -6.104 1.00 63.33 H new ATOM 0 HB VAL A 71 -7.756 2.459 -7.802 1.00 35.15 H new ATOM 0 HG11 VAL A 71 -9.080 3.335 -5.925 1.00 70.51 H new ATOM 0 HG12 VAL A 71 -8.076 1.946 -5.446 1.00 70.51 H new ATOM 0 HG13 VAL A 71 -7.582 3.597 -5.001 1.00 70.51 H new ATOM 0 HG21 VAL A 71 -8.351 4.832 -7.699 1.00 63.22 H new ATOM 0 HG22 VAL A 71 -6.813 5.173 -6.871 1.00 63.22 H new ATOM 0 HG23 VAL A 71 -6.807 4.562 -8.542 1.00 63.22 H new ATOM 977 N HIS A 72 -5.377 0.866 -5.345 1.00 42.50 N ATOM 978 CA HIS A 72 -5.517 -0.473 -4.863 1.00 1.15 C ATOM 979 C HIS A 72 -6.675 -0.523 -3.915 1.00 72.20 C ATOM 980 O HIS A 72 -6.667 0.105 -2.863 1.00 23.32 O ATOM 981 CB HIS A 72 -4.229 -0.981 -4.217 1.00 3.20 C ATOM 982 CG HIS A 72 -3.104 -1.100 -5.191 1.00 13.13 C ATOM 983 ND1 HIS A 72 -2.645 -2.299 -5.683 1.00 72.11 N ATOM 984 CD2 HIS A 72 -2.339 -0.151 -5.764 1.00 32.01 C ATOM 985 CE1 HIS A 72 -1.646 -2.076 -6.507 1.00 33.32 C ATOM 986 NE2 HIS A 72 -1.444 -0.789 -6.577 1.00 34.23 N ATOM 0 H HIS A 72 -4.884 1.506 -4.723 1.00 42.50 H new ATOM 0 HA HIS A 72 -5.713 -1.140 -5.703 1.00 1.15 H new ATOM 0 HB2 HIS A 72 -3.939 -0.304 -3.414 1.00 3.20 H new ATOM 0 HB3 HIS A 72 -4.415 -1.954 -3.762 1.00 3.20 H new ATOM 0 HD1 HIS A 72 -3.021 -3.217 -5.446 1.00 72.11 H new ATOM 0 HD2 HIS A 72 -2.418 0.915 -5.610 1.00 32.01 H new ATOM 0 HE1 HIS A 72 -1.086 -2.832 -7.038 1.00 33.32 H new ATOM 995 N GLY A 73 -7.673 -1.249 -4.288 1.00 75.33 N ATOM 996 CA GLY A 73 -8.846 -1.317 -3.495 1.00 53.23 C ATOM 997 C GLY A 73 -9.451 -2.663 -3.559 1.00 41.24 C ATOM 998 O GLY A 73 -8.776 -3.640 -3.889 1.00 3.14 O ATOM 0 H GLY A 73 -7.697 -1.806 -5.142 1.00 75.33 H new ATOM 0 HA2 GLY A 73 -8.605 -1.072 -2.461 1.00 53.23 H new ATOM 0 HA3 GLY A 73 -9.566 -0.574 -3.839 1.00 53.23 H new ATOM 1002 N LYS A 74 -10.702 -2.739 -3.269 1.00 72.50 N ATOM 1003 CA LYS A 74 -11.376 -3.990 -3.269 1.00 73.33 C ATOM 1004 C LYS A 74 -12.550 -4.026 -4.186 1.00 4.14 C ATOM 1005 O LYS A 74 -13.215 -3.015 -4.428 1.00 35.11 O ATOM 1006 CB LYS A 74 -11.765 -4.478 -1.873 1.00 54.12 C ATOM 1007 CG LYS A 74 -10.694 -5.299 -1.149 1.00 35.33 C ATOM 1008 CD LYS A 74 -9.490 -4.517 -0.705 1.00 12.15 C ATOM 1009 CE LYS A 74 -9.846 -3.571 0.437 1.00 61.54 C ATOM 1010 NZ LYS A 74 -8.668 -2.902 1.020 1.00 73.34 N ATOM 0 H LYS A 74 -11.286 -1.939 -3.026 1.00 72.50 H new ATOM 0 HA LYS A 74 -10.636 -4.690 -3.657 1.00 73.33 H new ATOM 0 HB2 LYS A 74 -12.014 -3.612 -1.259 1.00 54.12 H new ATOM 0 HB3 LYS A 74 -12.669 -5.081 -1.955 1.00 54.12 H new ATOM 0 HG2 LYS A 74 -11.146 -5.769 -0.276 1.00 35.33 H new ATOM 0 HG3 LYS A 74 -10.365 -6.102 -1.809 1.00 35.33 H new ATOM 0 HD2 LYS A 74 -8.705 -5.202 -0.384 1.00 12.15 H new ATOM 0 HD3 LYS A 74 -9.092 -3.947 -1.544 1.00 12.15 H new ATOM 0 HE2 LYS A 74 -10.542 -2.816 0.072 1.00 61.54 H new ATOM 0 HE3 LYS A 74 -10.362 -4.130 1.217 1.00 61.54 H new ATOM 0 HZ1 LYS A 74 -8.974 -2.260 1.779 1.00 73.34 H new ATOM 0 HZ2 LYS A 74 -8.021 -3.616 1.410 1.00 73.34 H new ATOM 0 HZ3 LYS A 74 -8.178 -2.357 0.282 1.00 73.34 H new ATOM 1024 N VAL A 75 -12.770 -5.187 -4.698 1.00 22.12 N ATOM 1025 CA VAL A 75 -13.858 -5.483 -5.583 1.00 25.12 C ATOM 1026 C VAL A 75 -14.876 -6.395 -4.909 1.00 63.30 C ATOM 1027 O VAL A 75 -14.516 -7.404 -4.314 1.00 11.13 O ATOM 1028 CB VAL A 75 -13.336 -6.171 -6.865 1.00 61.02 C ATOM 1029 CG1 VAL A 75 -14.479 -6.705 -7.691 1.00 24.02 C ATOM 1030 CG2 VAL A 75 -12.513 -5.202 -7.679 1.00 64.11 C ATOM 0 H VAL A 75 -12.176 -5.994 -4.508 1.00 22.12 H new ATOM 0 HA VAL A 75 -14.341 -4.541 -5.842 1.00 25.12 H new ATOM 0 HB VAL A 75 -12.706 -7.010 -6.570 1.00 61.02 H new ATOM 0 HG11 VAL A 75 -14.087 -7.185 -8.588 1.00 24.02 H new ATOM 0 HG12 VAL A 75 -15.041 -7.433 -7.106 1.00 24.02 H new ATOM 0 HG13 VAL A 75 -15.136 -5.884 -7.977 1.00 24.02 H new ATOM 0 HG21 VAL A 75 -12.151 -5.699 -8.579 1.00 64.11 H new ATOM 0 HG22 VAL A 75 -13.129 -4.347 -7.959 1.00 64.11 H new ATOM 0 HG23 VAL A 75 -11.664 -4.859 -7.088 1.00 64.11 H new ATOM 1040 N LEU A 76 -16.129 -6.025 -5.014 1.00 53.31 N ATOM 1041 CA LEU A 76 -17.229 -6.797 -4.486 1.00 51.31 C ATOM 1042 C LEU A 76 -17.789 -7.660 -5.602 1.00 71.20 C ATOM 1043 O LEU A 76 -18.383 -7.135 -6.534 1.00 51.45 O ATOM 1044 CB LEU A 76 -18.346 -5.856 -3.999 1.00 2.11 C ATOM 1045 CG LEU A 76 -17.955 -4.793 -2.975 1.00 44.12 C ATOM 1046 CD1 LEU A 76 -19.165 -3.963 -2.583 1.00 75.43 C ATOM 1047 CD2 LEU A 76 -17.335 -5.436 -1.765 1.00 43.05 C ATOM 0 H LEU A 76 -16.419 -5.164 -5.477 1.00 53.31 H new ATOM 0 HA LEU A 76 -16.877 -7.408 -3.655 1.00 51.31 H new ATOM 0 HB2 LEU A 76 -18.767 -5.351 -4.868 1.00 2.11 H new ATOM 0 HB3 LEU A 76 -19.140 -6.466 -3.569 1.00 2.11 H new ATOM 0 HG LEU A 76 -17.218 -4.129 -3.426 1.00 44.12 H new ATOM 0 HD11 LEU A 76 -18.869 -3.210 -1.853 1.00 75.43 H new ATOM 0 HD12 LEU A 76 -19.571 -3.471 -3.467 1.00 75.43 H new ATOM 0 HD13 LEU A 76 -19.925 -4.611 -2.148 1.00 75.43 H new ATOM 0 HD21 LEU A 76 -17.061 -4.666 -1.044 1.00 43.05 H new ATOM 0 HD22 LEU A 76 -18.050 -6.121 -1.310 1.00 43.05 H new ATOM 0 HD23 LEU A 76 -16.443 -5.988 -2.063 1.00 43.05 H new ATOM 1059 N MET A 77 -17.550 -8.949 -5.546 1.00 2.23 N ATOM 1060 CA MET A 77 -18.054 -9.864 -6.527 1.00 30.55 C ATOM 1061 C MET A 77 -19.230 -10.622 -5.958 1.00 45.32 C ATOM 1062 O MET A 77 -19.343 -10.774 -4.750 1.00 13.22 O ATOM 1063 CB MET A 77 -16.978 -10.849 -6.872 1.00 65.23 C ATOM 1064 CG MET A 77 -15.688 -10.219 -7.349 1.00 62.42 C ATOM 1065 SD MET A 77 -14.440 -11.440 -7.729 1.00 71.23 S ATOM 1066 CE MET A 77 -15.389 -12.395 -8.866 1.00 11.25 C ATOM 0 H MET A 77 -16.996 -9.389 -4.811 1.00 2.23 H new ATOM 0 HA MET A 77 -18.364 -9.309 -7.413 1.00 30.55 H new ATOM 0 HB2 MET A 77 -16.767 -11.461 -5.995 1.00 65.23 H new ATOM 0 HB3 MET A 77 -17.350 -11.519 -7.647 1.00 65.23 H new ATOM 0 HG2 MET A 77 -15.886 -9.617 -8.235 1.00 62.42 H new ATOM 0 HG3 MET A 77 -15.311 -9.543 -6.582 1.00 62.42 H new ATOM 0 HE1 MET A 77 -14.720 -12.906 -9.559 1.00 11.25 H new ATOM 0 HE2 MET A 77 -15.977 -13.132 -8.320 1.00 11.25 H new ATOM 0 HE3 MET A 77 -16.057 -11.739 -9.424 1.00 11.25 H new ATOM 1076 N GLY A 78 -20.094 -11.112 -6.818 1.00 35.34 N ATOM 1077 CA GLY A 78 -21.245 -11.838 -6.350 1.00 72.04 C ATOM 1078 C GLY A 78 -22.373 -10.909 -5.989 1.00 2.30 C ATOM 1079 O GLY A 78 -23.318 -11.296 -5.289 1.00 43.12 O ATOM 0 H GLY A 78 -20.021 -11.021 -7.831 1.00 35.34 H new ATOM 0 HA2 GLY A 78 -21.577 -12.533 -7.122 1.00 72.04 H new ATOM 0 HA3 GLY A 78 -20.971 -12.435 -5.480 1.00 72.04 H new ATOM 1083 N VAL A 79 -22.266 -9.679 -6.458 1.00 24.14 N ATOM 1084 CA VAL A 79 -23.283 -8.676 -6.238 1.00 14.33 C ATOM 1085 C VAL A 79 -24.493 -8.997 -7.074 1.00 11.31 C ATOM 1086 O VAL A 79 -24.403 -9.066 -8.300 1.00 13.52 O ATOM 1087 CB VAL A 79 -22.778 -7.262 -6.644 1.00 4.11 C ATOM 1088 CG1 VAL A 79 -23.844 -6.219 -6.473 1.00 63.41 C ATOM 1089 CG2 VAL A 79 -21.597 -6.870 -5.834 1.00 23.22 C ATOM 0 H VAL A 79 -21.469 -9.350 -7.003 1.00 24.14 H new ATOM 0 HA VAL A 79 -23.529 -8.678 -5.176 1.00 14.33 H new ATOM 0 HB VAL A 79 -22.504 -7.319 -7.697 1.00 4.11 H new ATOM 0 HG11 VAL A 79 -23.451 -5.246 -6.767 1.00 63.41 H new ATOM 0 HG12 VAL A 79 -24.701 -6.469 -7.099 1.00 63.41 H new ATOM 0 HG13 VAL A 79 -24.155 -6.184 -5.429 1.00 63.41 H new ATOM 0 HG21 VAL A 79 -21.262 -5.878 -6.136 1.00 23.22 H new ATOM 0 HG22 VAL A 79 -21.868 -6.856 -4.778 1.00 23.22 H new ATOM 0 HG23 VAL A 79 -20.793 -7.588 -5.992 1.00 23.22 H new ATOM 1099 N THR A 80 -25.599 -9.194 -6.444 1.00 23.20 N ATOM 1100 CA THR A 80 -26.811 -9.422 -7.150 1.00 73.41 C ATOM 1101 C THR A 80 -27.279 -8.097 -7.748 1.00 72.43 C ATOM 1102 O THR A 80 -26.799 -7.023 -7.348 1.00 52.14 O ATOM 1103 CB THR A 80 -27.900 -10.021 -6.233 1.00 72.24 C ATOM 1104 OG1 THR A 80 -28.102 -9.178 -5.099 1.00 40.35 O ATOM 1105 CG2 THR A 80 -27.511 -11.414 -5.769 1.00 40.10 C ATOM 0 H THR A 80 -25.689 -9.202 -5.428 1.00 23.20 H new ATOM 0 HA THR A 80 -26.631 -10.148 -7.943 1.00 73.41 H new ATOM 0 HB THR A 80 -28.826 -10.090 -6.805 1.00 72.24 H new ATOM 0 HG1 THR A 80 -27.362 -9.296 -4.468 1.00 40.35 H new ATOM 0 HG21 THR A 80 -28.294 -11.815 -5.125 1.00 40.10 H new ATOM 0 HG22 THR A 80 -27.386 -12.064 -6.635 1.00 40.10 H new ATOM 0 HG23 THR A 80 -26.574 -11.364 -5.214 1.00 40.10 H new ATOM 1113 N SER A 81 -28.174 -8.160 -8.689 1.00 41.35 N ATOM 1114 CA SER A 81 -28.690 -6.974 -9.350 1.00 34.22 C ATOM 1115 C SER A 81 -29.266 -5.952 -8.346 1.00 33.10 C ATOM 1116 O SER A 81 -29.086 -4.746 -8.506 1.00 33.15 O ATOM 1117 CB SER A 81 -29.725 -7.400 -10.376 1.00 4.52 C ATOM 1118 OG SER A 81 -30.670 -8.285 -9.786 1.00 61.44 O ATOM 0 H SER A 81 -28.575 -9.034 -9.029 1.00 41.35 H new ATOM 0 HA SER A 81 -27.869 -6.463 -9.854 1.00 34.22 H new ATOM 0 HB2 SER A 81 -30.236 -6.523 -10.773 1.00 4.52 H new ATOM 0 HB3 SER A 81 -29.234 -7.890 -11.217 1.00 4.52 H new ATOM 0 HG SER A 81 -31.568 -8.073 -10.117 1.00 61.44 H new ATOM 1124 N ASP A 82 -29.903 -6.460 -7.306 1.00 34.41 N ATOM 1125 CA ASP A 82 -30.511 -5.645 -6.252 1.00 72.33 C ATOM 1126 C ASP A 82 -29.470 -4.778 -5.564 1.00 74.43 C ATOM 1127 O ASP A 82 -29.624 -3.573 -5.457 1.00 13.32 O ATOM 1128 CB ASP A 82 -31.165 -6.563 -5.220 1.00 54.03 C ATOM 1129 CG ASP A 82 -32.264 -7.416 -5.803 1.00 23.11 C ATOM 1130 OD1 ASP A 82 -31.956 -8.380 -6.540 1.00 60.31 O ATOM 1131 OD2 ASP A 82 -33.448 -7.128 -5.548 1.00 52.42 O ATOM 0 H ASP A 82 -30.018 -7.463 -7.162 1.00 34.41 H new ATOM 0 HA ASP A 82 -31.258 -4.993 -6.706 1.00 72.33 H new ATOM 0 HB2 ASP A 82 -30.404 -7.209 -4.783 1.00 54.03 H new ATOM 0 HB3 ASP A 82 -31.573 -5.958 -4.410 1.00 54.03 H new ATOM 1136 N GLU A 83 -28.398 -5.412 -5.132 1.00 71.05 N ATOM 1137 CA GLU A 83 -27.285 -4.757 -4.430 1.00 43.13 C ATOM 1138 C GLU A 83 -26.551 -3.829 -5.399 1.00 25.34 C ATOM 1139 O GLU A 83 -26.068 -2.782 -5.013 1.00 4.32 O ATOM 1140 CB GLU A 83 -26.344 -5.836 -3.953 1.00 61.53 C ATOM 1141 CG GLU A 83 -27.017 -6.889 -3.107 1.00 13.03 C ATOM 1142 CD GLU A 83 -26.130 -8.072 -2.871 1.00 2.43 C ATOM 1143 OE1 GLU A 83 -25.857 -8.800 -3.839 1.00 60.04 O ATOM 1144 OE2 GLU A 83 -25.705 -8.300 -1.746 1.00 0.44 O ATOM 0 H GLU A 83 -28.263 -6.415 -5.256 1.00 71.05 H new ATOM 0 HA GLU A 83 -27.652 -4.170 -3.588 1.00 43.13 H new ATOM 0 HB2 GLU A 83 -25.884 -6.315 -4.818 1.00 61.53 H new ATOM 0 HB3 GLU A 83 -25.540 -5.378 -3.377 1.00 61.53 H new ATOM 0 HG2 GLU A 83 -27.305 -6.455 -2.149 1.00 13.03 H new ATOM 0 HG3 GLU A 83 -27.934 -7.216 -3.597 1.00 13.03 H new ATOM 1151 N LEU A 84 -26.463 -4.238 -6.653 1.00 44.42 N ATOM 1152 CA LEU A 84 -25.880 -3.412 -7.708 1.00 63.32 C ATOM 1153 C LEU A 84 -26.647 -2.087 -7.796 1.00 55.32 C ATOM 1154 O LEU A 84 -26.044 -1.009 -7.778 1.00 51.01 O ATOM 1155 CB LEU A 84 -25.884 -4.212 -9.051 1.00 11.01 C ATOM 1156 CG LEU A 84 -25.282 -3.572 -10.341 1.00 73.40 C ATOM 1157 CD1 LEU A 84 -26.156 -2.477 -10.913 1.00 33.11 C ATOM 1158 CD2 LEU A 84 -23.872 -3.062 -10.091 1.00 65.22 C ATOM 0 H LEU A 84 -26.792 -5.149 -6.973 1.00 44.42 H new ATOM 0 HA LEU A 84 -24.842 -3.167 -7.484 1.00 63.32 H new ATOM 0 HB2 LEU A 84 -25.352 -5.146 -8.874 1.00 11.01 H new ATOM 0 HB3 LEU A 84 -26.919 -4.472 -9.271 1.00 11.01 H new ATOM 0 HG LEU A 84 -25.238 -4.364 -11.089 1.00 73.40 H new ATOM 0 HD11 LEU A 84 -25.688 -2.068 -11.809 1.00 33.11 H new ATOM 0 HD12 LEU A 84 -27.133 -2.888 -11.169 1.00 33.11 H new ATOM 0 HD13 LEU A 84 -26.278 -1.685 -10.174 1.00 33.11 H new ATOM 0 HD21 LEU A 84 -23.477 -2.621 -11.006 1.00 65.22 H new ATOM 0 HD22 LEU A 84 -23.892 -2.308 -9.304 1.00 65.22 H new ATOM 0 HD23 LEU A 84 -23.235 -3.891 -9.783 1.00 65.22 H new ATOM 1170 N GLU A 85 -27.970 -2.176 -7.859 1.00 64.14 N ATOM 1171 CA GLU A 85 -28.811 -0.988 -7.898 1.00 23.34 C ATOM 1172 C GLU A 85 -28.729 -0.251 -6.567 1.00 70.44 C ATOM 1173 O GLU A 85 -28.770 0.961 -6.519 1.00 52.11 O ATOM 1174 CB GLU A 85 -30.264 -1.357 -8.201 1.00 24.54 C ATOM 1175 CG GLU A 85 -30.467 -2.040 -9.542 1.00 4.05 C ATOM 1176 CD GLU A 85 -31.910 -2.379 -9.790 1.00 71.52 C ATOM 1177 OE1 GLU A 85 -32.359 -3.461 -9.360 1.00 25.11 O ATOM 1178 OE2 GLU A 85 -32.629 -1.566 -10.410 1.00 53.42 O ATOM 0 H GLU A 85 -28.482 -3.058 -7.884 1.00 64.14 H new ATOM 0 HA GLU A 85 -28.450 -0.338 -8.695 1.00 23.34 H new ATOM 0 HB2 GLU A 85 -30.632 -2.013 -7.412 1.00 24.54 H new ATOM 0 HB3 GLU A 85 -30.871 -0.452 -8.172 1.00 24.54 H new ATOM 0 HG2 GLU A 85 -30.106 -1.389 -10.338 1.00 4.05 H new ATOM 0 HG3 GLU A 85 -29.869 -2.951 -9.579 1.00 4.05 H new ATOM 1185 N ASN A 86 -28.577 -1.017 -5.505 1.00 72.22 N ATOM 1186 CA ASN A 86 -28.467 -0.520 -4.141 1.00 74.11 C ATOM 1187 C ASN A 86 -27.243 0.396 -4.035 1.00 23.14 C ATOM 1188 O ASN A 86 -27.327 1.501 -3.522 1.00 34.45 O ATOM 1189 CB ASN A 86 -28.326 -1.746 -3.199 1.00 52.32 C ATOM 1190 CG ASN A 86 -28.287 -1.492 -1.696 1.00 30.23 C ATOM 1191 OD1 ASN A 86 -28.732 -2.322 -0.914 1.00 33.00 O ATOM 1192 ND2 ASN A 86 -27.753 -0.405 -1.279 1.00 23.41 N ATOM 0 H ASN A 86 -28.525 -2.034 -5.566 1.00 72.22 H new ATOM 0 HA ASN A 86 -29.348 0.057 -3.859 1.00 74.11 H new ATOM 0 HB2 ASN A 86 -29.157 -2.421 -3.402 1.00 52.32 H new ATOM 0 HB3 ASN A 86 -27.413 -2.274 -3.472 1.00 52.32 H new ATOM 0 HD21 ASN A 86 -27.692 -0.218 -0.278 1.00 23.41 H new ATOM 0 HD22 ASN A 86 -27.388 0.273 -1.948 1.00 23.41 H new ATOM 1199 N LEU A 87 -26.125 -0.076 -4.529 1.00 45.20 N ATOM 1200 CA LEU A 87 -24.874 0.672 -4.498 1.00 32.31 C ATOM 1201 C LEU A 87 -24.965 1.896 -5.387 1.00 0.21 C ATOM 1202 O LEU A 87 -24.534 2.994 -5.008 1.00 31.35 O ATOM 1203 CB LEU A 87 -23.715 -0.221 -4.947 1.00 40.21 C ATOM 1204 CG LEU A 87 -23.463 -1.468 -4.101 1.00 50.13 C ATOM 1205 CD1 LEU A 87 -22.353 -2.309 -4.709 1.00 75.42 C ATOM 1206 CD2 LEU A 87 -23.108 -1.082 -2.674 1.00 12.41 C ATOM 0 H LEU A 87 -26.048 -0.993 -4.968 1.00 45.20 H new ATOM 0 HA LEU A 87 -24.691 1.000 -3.475 1.00 32.31 H new ATOM 0 HB2 LEU A 87 -23.901 -0.535 -5.974 1.00 40.21 H new ATOM 0 HB3 LEU A 87 -22.804 0.377 -4.957 1.00 40.21 H new ATOM 0 HG LEU A 87 -24.378 -2.060 -4.084 1.00 50.13 H new ATOM 0 HD11 LEU A 87 -22.187 -3.193 -4.093 1.00 75.42 H new ATOM 0 HD12 LEU A 87 -22.639 -2.616 -5.715 1.00 75.42 H new ATOM 0 HD13 LEU A 87 -21.436 -1.722 -4.756 1.00 75.42 H new ATOM 0 HD21 LEU A 87 -22.932 -1.983 -2.086 1.00 12.41 H new ATOM 0 HD22 LEU A 87 -22.207 -0.469 -2.676 1.00 12.41 H new ATOM 0 HD23 LEU A 87 -23.930 -0.517 -2.235 1.00 12.41 H new ATOM 1218 N ASP A 88 -25.546 1.700 -6.555 1.00 1.50 N ATOM 1219 CA ASP A 88 -25.740 2.767 -7.541 1.00 32.15 C ATOM 1220 C ASP A 88 -26.661 3.849 -6.989 1.00 71.11 C ATOM 1221 O ASP A 88 -26.521 5.025 -7.306 1.00 64.23 O ATOM 1222 CB ASP A 88 -26.314 2.175 -8.832 1.00 12.34 C ATOM 1223 CG ASP A 88 -26.625 3.210 -9.888 1.00 73.43 C ATOM 1224 OD1 ASP A 88 -25.690 3.693 -10.548 1.00 72.43 O ATOM 1225 OD2 ASP A 88 -27.818 3.515 -10.097 1.00 63.53 O ATOM 0 H ASP A 88 -25.902 0.793 -6.857 1.00 1.50 H new ATOM 0 HA ASP A 88 -24.777 3.228 -7.760 1.00 32.15 H new ATOM 0 HB2 ASP A 88 -25.603 1.456 -9.239 1.00 12.34 H new ATOM 0 HB3 ASP A 88 -27.225 1.625 -8.596 1.00 12.34 H new ATOM 1230 N ALA A 89 -27.585 3.433 -6.157 1.00 52.14 N ATOM 1231 CA ALA A 89 -28.510 4.325 -5.498 1.00 1.40 C ATOM 1232 C ALA A 89 -27.814 5.109 -4.389 1.00 2.45 C ATOM 1233 O ALA A 89 -27.985 6.321 -4.277 1.00 45.45 O ATOM 1234 CB ALA A 89 -29.659 3.527 -4.923 1.00 43.22 C ATOM 0 H ALA A 89 -27.718 2.451 -5.915 1.00 52.14 H new ATOM 0 HA ALA A 89 -28.890 5.037 -6.231 1.00 1.40 H new ATOM 0 HB1 ALA A 89 -30.357 4.201 -4.426 1.00 43.22 H new ATOM 0 HB2 ALA A 89 -30.174 3.000 -5.726 1.00 43.22 H new ATOM 0 HB3 ALA A 89 -29.276 2.805 -4.202 1.00 43.22 H new ATOM 1240 N VAL A 90 -27.020 4.414 -3.582 1.00 10.43 N ATOM 1241 CA VAL A 90 -26.312 5.035 -2.463 1.00 63.23 C ATOM 1242 C VAL A 90 -25.268 6.057 -2.953 1.00 33.20 C ATOM 1243 O VAL A 90 -25.333 7.246 -2.608 1.00 1.13 O ATOM 1244 CB VAL A 90 -25.630 3.962 -1.538 1.00 4.41 C ATOM 1245 CG1 VAL A 90 -24.825 4.610 -0.426 1.00 11.41 C ATOM 1246 CG2 VAL A 90 -26.672 3.044 -0.924 1.00 44.41 C ATOM 0 H VAL A 90 -26.848 3.413 -3.681 1.00 10.43 H new ATOM 0 HA VAL A 90 -27.060 5.564 -1.873 1.00 63.23 H new ATOM 0 HB VAL A 90 -24.954 3.383 -2.167 1.00 4.41 H new ATOM 0 HG11 VAL A 90 -24.369 3.836 0.192 1.00 11.41 H new ATOM 0 HG12 VAL A 90 -24.044 5.235 -0.859 1.00 11.41 H new ATOM 0 HG13 VAL A 90 -25.483 5.224 0.189 1.00 11.41 H new ATOM 0 HG21 VAL A 90 -26.179 2.309 -0.288 1.00 44.41 H new ATOM 0 HG22 VAL A 90 -27.369 3.632 -0.327 1.00 44.41 H new ATOM 0 HG23 VAL A 90 -27.217 2.531 -1.716 1.00 44.41 H new ATOM 1256 N GLU A 91 -24.351 5.614 -3.781 1.00 72.13 N ATOM 1257 CA GLU A 91 -23.274 6.477 -4.261 1.00 43.33 C ATOM 1258 C GLU A 91 -23.725 7.428 -5.363 1.00 42.03 C ATOM 1259 O GLU A 91 -23.128 8.491 -5.571 1.00 42.13 O ATOM 1260 CB GLU A 91 -22.068 5.651 -4.684 1.00 23.23 C ATOM 1261 CG GLU A 91 -21.473 4.838 -3.541 1.00 71.12 C ATOM 1262 CD GLU A 91 -20.969 5.712 -2.402 1.00 33.22 C ATOM 1263 OE1 GLU A 91 -21.793 6.200 -1.590 1.00 44.21 O ATOM 1264 OE2 GLU A 91 -19.750 5.923 -2.305 1.00 24.41 O ATOM 0 H GLU A 91 -24.321 4.661 -4.142 1.00 72.13 H new ATOM 0 HA GLU A 91 -22.975 7.110 -3.425 1.00 43.33 H new ATOM 0 HB2 GLU A 91 -22.361 4.976 -5.489 1.00 23.23 H new ATOM 0 HB3 GLU A 91 -21.303 6.315 -5.087 1.00 23.23 H new ATOM 0 HG2 GLU A 91 -22.227 4.149 -3.159 1.00 71.12 H new ATOM 0 HG3 GLU A 91 -20.650 4.232 -3.921 1.00 71.12 H new ATOM 1271 N GLY A 92 -24.797 7.063 -6.035 1.00 10.21 N ATOM 1272 CA GLY A 92 -25.318 7.844 -7.154 1.00 43.25 C ATOM 1273 C GLY A 92 -25.738 9.255 -6.793 1.00 25.23 C ATOM 1274 O GLY A 92 -25.908 10.092 -7.666 1.00 41.24 O ATOM 0 H GLY A 92 -25.335 6.221 -5.828 1.00 10.21 H new ATOM 0 HA2 GLY A 92 -24.557 7.893 -7.932 1.00 43.25 H new ATOM 0 HA3 GLY A 92 -26.175 7.321 -7.578 1.00 43.25 H new ATOM 1278 N ASN A 93 -25.919 9.516 -5.512 1.00 20.35 N ATOM 1279 CA ASN A 93 -26.320 10.842 -5.048 1.00 54.23 C ATOM 1280 C ASN A 93 -25.296 11.922 -5.397 1.00 21.23 C ATOM 1281 O ASN A 93 -25.660 13.096 -5.547 1.00 34.24 O ATOM 1282 CB ASN A 93 -26.618 10.872 -3.535 1.00 50.00 C ATOM 1283 CG ASN A 93 -27.841 10.060 -3.140 1.00 31.45 C ATOM 1284 OD1 ASN A 93 -28.964 10.561 -3.148 1.00 4.13 O ATOM 1285 ND2 ASN A 93 -27.642 8.823 -2.760 1.00 72.12 N ATOM 0 H ASN A 93 -25.796 8.829 -4.768 1.00 20.35 H new ATOM 0 HA ASN A 93 -27.243 11.065 -5.583 1.00 54.23 H new ATOM 0 HB2 ASN A 93 -25.751 10.493 -2.995 1.00 50.00 H new ATOM 0 HB3 ASN A 93 -26.762 11.906 -3.222 1.00 50.00 H new ATOM 0 HD21 ASN A 93 -28.430 8.249 -2.460 1.00 72.12 H new ATOM 0 HD22 ASN A 93 -26.699 8.434 -2.764 1.00 72.12 H new ATOM 1292 N GLU A 94 -24.024 11.550 -5.517 1.00 41.44 N ATOM 1293 CA GLU A 94 -23.019 12.519 -5.812 1.00 31.41 C ATOM 1294 C GLU A 94 -21.893 11.939 -6.720 1.00 75.22 C ATOM 1295 O GLU A 94 -20.960 12.645 -7.116 1.00 25.40 O ATOM 1296 CB GLU A 94 -22.517 13.075 -4.485 1.00 34.14 C ATOM 1297 CG GLU A 94 -21.536 14.184 -4.587 1.00 72.32 C ATOM 1298 CD GLU A 94 -21.366 14.905 -3.275 1.00 54.13 C ATOM 1299 OE1 GLU A 94 -21.700 14.329 -2.218 1.00 34.44 O ATOM 1300 OE2 GLU A 94 -20.977 16.097 -3.281 1.00 44.50 O ATOM 0 H GLU A 94 -23.686 10.593 -5.413 1.00 41.44 H new ATOM 0 HA GLU A 94 -23.433 13.337 -6.402 1.00 31.41 H new ATOM 0 HB2 GLU A 94 -23.375 13.424 -3.909 1.00 34.14 H new ATOM 0 HB3 GLU A 94 -22.062 12.262 -3.919 1.00 34.14 H new ATOM 0 HG2 GLU A 94 -20.573 13.789 -4.912 1.00 72.32 H new ATOM 0 HG3 GLU A 94 -21.864 14.890 -5.350 1.00 72.32 H new ATOM 1307 N TYR A 95 -22.008 10.671 -7.065 1.00 34.03 N ATOM 1308 CA TYR A 95 -21.053 10.014 -7.948 1.00 75.12 C ATOM 1309 C TYR A 95 -21.756 9.453 -9.163 1.00 73.24 C ATOM 1310 O TYR A 95 -22.988 9.372 -9.193 1.00 43.51 O ATOM 1311 CB TYR A 95 -20.306 8.887 -7.242 1.00 30.02 C ATOM 1312 CG TYR A 95 -19.331 9.317 -6.179 1.00 53.21 C ATOM 1313 CD1 TYR A 95 -19.743 9.611 -4.888 1.00 75.41 C ATOM 1314 CD2 TYR A 95 -17.980 9.399 -6.469 1.00 21.25 C ATOM 1315 CE1 TYR A 95 -18.831 9.972 -3.923 1.00 62.12 C ATOM 1316 CE2 TYR A 95 -17.069 9.763 -5.516 1.00 62.12 C ATOM 1317 CZ TYR A 95 -17.495 10.045 -4.246 1.00 4.32 C ATOM 1318 OH TYR A 95 -16.584 10.388 -3.287 1.00 31.33 O ATOM 0 H TYR A 95 -22.763 10.065 -6.744 1.00 34.03 H new ATOM 0 HA TYR A 95 -20.329 10.770 -8.252 1.00 75.12 H new ATOM 0 HB2 TYR A 95 -21.038 8.218 -6.789 1.00 30.02 H new ATOM 0 HB3 TYR A 95 -19.766 8.308 -7.991 1.00 30.02 H new ATOM 0 HD1 TYR A 95 -20.792 9.556 -4.637 1.00 75.41 H new ATOM 0 HD2 TYR A 95 -17.638 9.171 -7.468 1.00 21.25 H new ATOM 0 HE1 TYR A 95 -19.161 10.196 -2.919 1.00 62.12 H new ATOM 0 HE2 TYR A 95 -16.020 9.828 -5.764 1.00 62.12 H new ATOM 0 HH TYR A 95 -15.820 9.776 -3.328 1.00 31.33 H new ATOM 1328 N GLU A 96 -20.983 9.055 -10.156 1.00 33.31 N ATOM 1329 CA GLU A 96 -21.524 8.467 -11.342 1.00 14.41 C ATOM 1330 C GLU A 96 -20.884 7.106 -11.504 1.00 1.21 C ATOM 1331 O GLU A 96 -19.680 6.939 -11.243 1.00 13.10 O ATOM 1332 CB GLU A 96 -21.230 9.364 -12.549 1.00 52.53 C ATOM 1333 CG GLU A 96 -21.792 8.877 -13.872 1.00 4.12 C ATOM 1334 CD GLU A 96 -21.501 9.835 -15.000 1.00 55.31 C ATOM 1335 OE1 GLU A 96 -20.424 9.727 -15.623 1.00 22.21 O ATOM 1336 OE2 GLU A 96 -22.351 10.720 -15.281 1.00 35.31 O ATOM 0 H GLU A 96 -19.966 9.135 -10.152 1.00 33.31 H new ATOM 0 HA GLU A 96 -22.607 8.361 -11.271 1.00 14.41 H new ATOM 0 HB2 GLU A 96 -21.629 10.358 -12.348 1.00 52.53 H new ATOM 0 HB3 GLU A 96 -20.150 9.468 -12.649 1.00 52.53 H new ATOM 0 HG2 GLU A 96 -21.368 7.901 -14.108 1.00 4.12 H new ATOM 0 HG3 GLU A 96 -22.870 8.743 -13.780 1.00 4.12 H new ATOM 1343 N ARG A 97 -21.671 6.145 -11.903 1.00 60.50 N ATOM 1344 CA ARG A 97 -21.212 4.790 -12.017 1.00 54.41 C ATOM 1345 C ARG A 97 -20.605 4.584 -13.377 1.00 51.42 C ATOM 1346 O ARG A 97 -21.297 4.660 -14.410 1.00 4.21 O ATOM 1347 CB ARG A 97 -22.376 3.815 -11.837 1.00 34.11 C ATOM 1348 CG ARG A 97 -21.960 2.347 -11.795 1.00 10.23 C ATOM 1349 CD ARG A 97 -23.171 1.431 -11.782 1.00 64.40 C ATOM 1350 NE ARG A 97 -23.925 1.509 -13.047 1.00 15.05 N ATOM 1351 CZ ARG A 97 -25.235 1.278 -13.185 1.00 21.10 C ATOM 1352 NH1 ARG A 97 -25.979 0.993 -12.130 1.00 74.32 N ATOM 1353 NH2 ARG A 97 -25.796 1.343 -14.383 1.00 34.11 N ATOM 0 H ARG A 97 -22.649 6.280 -12.158 1.00 60.50 H new ATOM 0 HA ARG A 97 -20.469 4.604 -11.241 1.00 54.41 H new ATOM 0 HB2 ARG A 97 -22.901 4.059 -10.913 1.00 34.11 H new ATOM 0 HB3 ARG A 97 -23.084 3.957 -12.653 1.00 34.11 H new ATOM 0 HG2 ARG A 97 -21.338 2.118 -12.660 1.00 10.23 H new ATOM 0 HG3 ARG A 97 -21.353 2.164 -10.908 1.00 10.23 H new ATOM 0 HD2 ARG A 97 -22.849 0.404 -11.613 1.00 64.40 H new ATOM 0 HD3 ARG A 97 -23.823 1.701 -10.952 1.00 64.40 H new ATOM 0 HE ARG A 97 -23.404 1.760 -13.887 1.00 15.05 H new ATOM 0 HH11 ARG A 97 -25.554 0.948 -11.204 1.00 74.32 H new ATOM 0 HH12 ARG A 97 -26.978 0.818 -12.242 1.00 74.32 H new ATOM 0 HH21 ARG A 97 -25.229 1.569 -15.200 1.00 34.11 H new ATOM 0 HH22 ARG A 97 -26.795 1.167 -14.489 1.00 34.11 H new ATOM 1367 N VAL A 98 -19.341 4.339 -13.393 1.00 5.32 N ATOM 1368 CA VAL A 98 -18.642 4.099 -14.611 1.00 33.23 C ATOM 1369 C VAL A 98 -18.039 2.723 -14.591 1.00 34.24 C ATOM 1370 O VAL A 98 -17.893 2.121 -13.518 1.00 40.41 O ATOM 1371 CB VAL A 98 -17.572 5.167 -14.893 1.00 53.40 C ATOM 1372 CG1 VAL A 98 -18.254 6.522 -15.054 1.00 33.30 C ATOM 1373 CG2 VAL A 98 -16.540 5.203 -13.767 1.00 35.43 C ATOM 0 H VAL A 98 -18.758 4.299 -12.557 1.00 5.32 H new ATOM 0 HA VAL A 98 -19.363 4.162 -15.426 1.00 33.23 H new ATOM 0 HB VAL A 98 -17.044 4.921 -15.814 1.00 53.40 H new ATOM 0 HG11 VAL A 98 -17.503 7.286 -15.254 1.00 33.30 H new ATOM 0 HG12 VAL A 98 -18.958 6.479 -15.885 1.00 33.30 H new ATOM 0 HG13 VAL A 98 -18.789 6.771 -14.138 1.00 33.30 H new ATOM 0 HG21 VAL A 98 -15.791 5.965 -13.984 1.00 35.43 H new ATOM 0 HG22 VAL A 98 -17.036 5.440 -12.826 1.00 35.43 H new ATOM 0 HG23 VAL A 98 -16.055 4.230 -13.686 1.00 35.43 H new ATOM 1383 N THR A 99 -17.717 2.213 -15.735 1.00 35.20 N ATOM 1384 CA THR A 99 -17.173 0.893 -15.813 1.00 54.40 C ATOM 1385 C THR A 99 -15.678 0.988 -16.143 1.00 3.13 C ATOM 1386 O THR A 99 -15.267 1.758 -17.020 1.00 5.45 O ATOM 1387 CB THR A 99 -17.968 -0.004 -16.834 1.00 2.04 C ATOM 1388 OG1 THR A 99 -17.583 -1.385 -16.720 1.00 22.44 O ATOM 1389 CG2 THR A 99 -17.789 0.461 -18.279 1.00 1.41 C ATOM 0 H THR A 99 -17.821 2.690 -16.631 1.00 35.20 H new ATOM 0 HA THR A 99 -17.279 0.397 -14.848 1.00 54.40 H new ATOM 0 HB THR A 99 -19.022 0.098 -16.576 1.00 2.04 H new ATOM 0 HG1 THR A 99 -17.117 -1.526 -15.869 1.00 22.44 H new ATOM 0 HG21 THR A 99 -18.357 -0.190 -18.944 1.00 1.41 H new ATOM 0 HG22 THR A 99 -18.149 1.485 -18.379 1.00 1.41 H new ATOM 0 HG23 THR A 99 -16.733 0.420 -18.546 1.00 1.41 H new ATOM 1397 N VAL A 100 -14.878 0.249 -15.419 1.00 35.41 N ATOM 1398 CA VAL A 100 -13.435 0.313 -15.548 1.00 44.23 C ATOM 1399 C VAL A 100 -12.833 -1.080 -15.522 1.00 75.33 C ATOM 1400 O VAL A 100 -13.527 -2.063 -15.238 1.00 45.13 O ATOM 1401 CB VAL A 100 -12.788 1.157 -14.398 1.00 31.41 C ATOM 1402 CG1 VAL A 100 -13.224 2.619 -14.460 1.00 1.32 C ATOM 1403 CG2 VAL A 100 -13.133 0.562 -13.036 1.00 64.30 C ATOM 0 H VAL A 100 -15.204 -0.418 -14.720 1.00 35.41 H new ATOM 0 HA VAL A 100 -13.224 0.794 -16.503 1.00 44.23 H new ATOM 0 HB VAL A 100 -11.707 1.123 -14.536 1.00 31.41 H new ATOM 0 HG11 VAL A 100 -12.755 3.173 -13.647 1.00 1.32 H new ATOM 0 HG12 VAL A 100 -12.921 3.049 -15.415 1.00 1.32 H new ATOM 0 HG13 VAL A 100 -14.308 2.680 -14.363 1.00 1.32 H new ATOM 0 HG21 VAL A 100 -12.675 1.162 -12.250 1.00 64.30 H new ATOM 0 HG22 VAL A 100 -14.215 0.557 -12.905 1.00 64.30 H new ATOM 0 HG23 VAL A 100 -12.756 -0.459 -12.979 1.00 64.30 H new ATOM 1413 N GLY A 101 -11.564 -1.159 -15.811 1.00 12.02 N ATOM 1414 CA GLY A 101 -10.878 -2.412 -15.776 1.00 54.23 C ATOM 1415 C GLY A 101 -9.909 -2.466 -14.621 1.00 2.11 C ATOM 1416 O GLY A 101 -9.044 -1.591 -14.489 1.00 44.45 O ATOM 0 H GLY A 101 -10.984 -0.362 -16.075 1.00 12.02 H new ATOM 0 HA2 GLY A 101 -11.600 -3.224 -15.688 1.00 54.23 H new ATOM 0 HA3 GLY A 101 -10.342 -2.563 -16.713 1.00 54.23 H new ATOM 1420 N ILE A 102 -10.044 -3.463 -13.791 1.00 53.34 N ATOM 1421 CA ILE A 102 -9.183 -3.628 -12.641 1.00 73.31 C ATOM 1422 C ILE A 102 -8.401 -4.912 -12.743 1.00 24.53 C ATOM 1423 O ILE A 102 -8.724 -5.770 -13.555 1.00 15.21 O ATOM 1424 CB ILE A 102 -9.960 -3.522 -11.273 1.00 33.13 C ATOM 1425 CG1 ILE A 102 -11.152 -4.493 -11.157 1.00 3.31 C ATOM 1426 CG2 ILE A 102 -10.428 -2.118 -11.032 1.00 50.24 C ATOM 1427 CD1 ILE A 102 -10.818 -5.935 -10.912 1.00 61.31 C ATOM 0 H ILE A 102 -10.754 -4.188 -13.889 1.00 53.34 H new ATOM 0 HA ILE A 102 -8.478 -2.797 -12.647 1.00 73.31 H new ATOM 0 HB ILE A 102 -9.241 -3.812 -10.507 1.00 33.13 H new ATOM 0 HG12 ILE A 102 -11.795 -4.149 -10.347 1.00 3.31 H new ATOM 0 HG13 ILE A 102 -11.735 -4.429 -12.076 1.00 3.31 H new ATOM 0 HG21 ILE A 102 -10.961 -2.070 -10.083 1.00 50.24 H new ATOM 0 HG22 ILE A 102 -9.568 -1.448 -11.000 1.00 50.24 H new ATOM 0 HG23 ILE A 102 -11.095 -1.813 -11.838 1.00 50.24 H new ATOM 0 HD11 ILE A 102 -11.738 -6.516 -10.850 1.00 61.31 H new ATOM 0 HD12 ILE A 102 -10.206 -6.311 -11.732 1.00 61.31 H new ATOM 0 HD13 ILE A 102 -10.267 -6.027 -9.976 1.00 61.31 H new ATOM 1439 N VAL A 103 -7.389 -5.047 -11.949 1.00 34.01 N ATOM 1440 CA VAL A 103 -6.581 -6.233 -11.974 1.00 12.10 C ATOM 1441 C VAL A 103 -6.548 -6.835 -10.583 1.00 34.42 C ATOM 1442 O VAL A 103 -6.124 -6.195 -9.635 1.00 3.44 O ATOM 1443 CB VAL A 103 -5.138 -5.945 -12.462 1.00 43.42 C ATOM 1444 CG1 VAL A 103 -4.309 -7.223 -12.568 1.00 11.12 C ATOM 1445 CG2 VAL A 103 -5.131 -5.175 -13.778 1.00 21.21 C ATOM 0 H VAL A 103 -7.097 -4.347 -11.268 1.00 34.01 H new ATOM 0 HA VAL A 103 -7.025 -6.934 -12.681 1.00 12.10 H new ATOM 0 HB VAL A 103 -4.670 -5.313 -11.708 1.00 43.42 H new ATOM 0 HG11 VAL A 103 -3.305 -6.978 -12.913 1.00 11.12 H new ATOM 0 HG12 VAL A 103 -4.250 -7.701 -11.590 1.00 11.12 H new ATOM 0 HG13 VAL A 103 -4.780 -7.904 -13.277 1.00 11.12 H new ATOM 0 HG21 VAL A 103 -4.102 -4.992 -14.087 1.00 21.21 H new ATOM 0 HG22 VAL A 103 -5.642 -5.759 -14.544 1.00 21.21 H new ATOM 0 HG23 VAL A 103 -5.644 -4.223 -13.645 1.00 21.21 H new ATOM 1455 N ARG A 104 -7.024 -8.041 -10.485 1.00 44.34 N ATOM 1456 CA ARG A 104 -7.108 -8.780 -9.247 1.00 2.23 C ATOM 1457 C ARG A 104 -5.709 -9.095 -8.698 1.00 25.10 C ATOM 1458 O ARG A 104 -4.942 -9.823 -9.332 1.00 0.03 O ATOM 1459 CB ARG A 104 -7.916 -10.061 -9.517 1.00 12.44 C ATOM 1460 CG ARG A 104 -8.008 -11.046 -8.383 1.00 35.15 C ATOM 1461 CD ARG A 104 -8.957 -12.188 -8.744 1.00 71.52 C ATOM 1462 NE ARG A 104 -8.874 -13.303 -7.787 1.00 43.33 N ATOM 1463 CZ ARG A 104 -9.571 -14.443 -7.863 1.00 10.43 C ATOM 1464 NH1 ARG A 104 -10.518 -14.604 -8.776 1.00 31.24 N ATOM 1465 NH2 ARG A 104 -9.307 -15.417 -7.017 1.00 45.12 N ATOM 0 H ARG A 104 -7.378 -8.560 -11.288 1.00 44.34 H new ATOM 0 HA ARG A 104 -7.610 -8.185 -8.484 1.00 2.23 H new ATOM 0 HB2 ARG A 104 -8.928 -9.773 -9.802 1.00 12.44 H new ATOM 0 HB3 ARG A 104 -7.475 -10.568 -10.375 1.00 12.44 H new ATOM 0 HG2 ARG A 104 -7.019 -11.444 -8.158 1.00 35.15 H new ATOM 0 HG3 ARG A 104 -8.361 -10.542 -7.483 1.00 35.15 H new ATOM 0 HD2 ARG A 104 -9.980 -11.812 -8.774 1.00 71.52 H new ATOM 0 HD3 ARG A 104 -8.721 -12.552 -9.744 1.00 71.52 H new ATOM 0 HE ARG A 104 -8.232 -13.198 -7.001 1.00 43.33 H new ATOM 0 HH11 ARG A 104 -10.725 -13.853 -9.434 1.00 31.24 H new ATOM 0 HH12 ARG A 104 -11.040 -15.479 -8.820 1.00 31.24 H new ATOM 0 HH21 ARG A 104 -8.578 -15.298 -6.314 1.00 45.12 H new ATOM 0 HH22 ARG A 104 -9.832 -16.290 -7.065 1.00 45.12 H new ATOM 1479 N GLU A 105 -5.400 -8.536 -7.510 1.00 0.04 N ATOM 1480 CA GLU A 105 -4.092 -8.709 -6.827 1.00 61.03 C ATOM 1481 C GLU A 105 -3.793 -10.187 -6.690 1.00 4.44 C ATOM 1482 O GLU A 105 -2.720 -10.664 -7.031 1.00 63.21 O ATOM 1483 CB GLU A 105 -4.173 -8.181 -5.379 1.00 44.15 C ATOM 1484 CG GLU A 105 -4.582 -6.734 -5.160 1.00 33.24 C ATOM 1485 CD GLU A 105 -3.604 -5.703 -5.616 1.00 40.45 C ATOM 1486 OE1 GLU A 105 -2.383 -5.939 -5.520 1.00 64.32 O ATOM 1487 OE2 GLU A 105 -4.045 -4.596 -5.978 1.00 40.42 O ATOM 0 H GLU A 105 -6.052 -7.948 -6.991 1.00 0.04 H new ATOM 0 HA GLU A 105 -3.339 -8.179 -7.410 1.00 61.03 H new ATOM 0 HB2 GLU A 105 -4.876 -8.811 -4.835 1.00 44.15 H new ATOM 0 HB3 GLU A 105 -3.195 -8.323 -4.918 1.00 44.15 H new ATOM 0 HG2 GLU A 105 -5.528 -6.562 -5.674 1.00 33.24 H new ATOM 0 HG3 GLU A 105 -4.767 -6.586 -4.096 1.00 33.24 H new ATOM 1494 N ASP A 106 -4.804 -10.875 -6.207 1.00 40.30 N ATOM 1495 CA ASP A 106 -4.773 -12.283 -5.821 1.00 33.22 C ATOM 1496 C ASP A 106 -4.158 -13.237 -6.857 1.00 13.32 C ATOM 1497 O ASP A 106 -3.384 -14.117 -6.491 1.00 23.34 O ATOM 1498 CB ASP A 106 -6.186 -12.719 -5.422 1.00 5.43 C ATOM 1499 CG ASP A 106 -6.299 -14.171 -5.025 1.00 64.11 C ATOM 1500 OD1 ASP A 106 -5.733 -14.560 -3.999 1.00 75.32 O ATOM 1501 OD2 ASP A 106 -7.024 -14.921 -5.705 1.00 73.50 O ATOM 0 H ASP A 106 -5.721 -10.452 -6.062 1.00 40.30 H new ATOM 0 HA ASP A 106 -4.093 -12.357 -4.973 1.00 33.22 H new ATOM 0 HB2 ASP A 106 -6.524 -12.100 -4.591 1.00 5.43 H new ATOM 0 HB3 ASP A 106 -6.861 -12.529 -6.256 1.00 5.43 H new ATOM 1506 N ASN A 107 -4.468 -13.077 -8.128 1.00 41.22 N ATOM 1507 CA ASN A 107 -3.922 -14.035 -9.118 1.00 72.44 C ATOM 1508 C ASN A 107 -3.464 -13.350 -10.396 1.00 63.41 C ATOM 1509 O ASN A 107 -3.076 -14.020 -11.358 1.00 74.34 O ATOM 1510 CB ASN A 107 -4.948 -15.141 -9.447 1.00 43.51 C ATOM 1511 CG ASN A 107 -6.184 -14.622 -10.150 1.00 11.43 C ATOM 1512 OD1 ASN A 107 -6.575 -13.478 -9.979 1.00 44.11 O ATOM 1513 ND2 ASN A 107 -6.803 -15.450 -10.942 1.00 14.25 N ATOM 0 H ASN A 107 -5.062 -12.339 -8.505 1.00 41.22 H new ATOM 0 HA ASN A 107 -3.046 -14.491 -8.657 1.00 72.44 H new ATOM 0 HB2 ASN A 107 -4.471 -15.894 -10.074 1.00 43.51 H new ATOM 0 HB3 ASN A 107 -5.245 -15.637 -8.523 1.00 43.51 H new ATOM 0 HD21 ASN A 107 -7.640 -15.149 -11.441 1.00 14.25 H new ATOM 0 HD22 ASN A 107 -6.451 -16.399 -11.063 1.00 14.25 H new ATOM 1520 N SER A 108 -3.489 -12.029 -10.382 1.00 54.22 N ATOM 1521 CA SER A 108 -3.108 -11.196 -11.509 1.00 52.14 C ATOM 1522 C SER A 108 -3.986 -11.483 -12.747 1.00 24.13 C ATOM 1523 O SER A 108 -3.556 -12.115 -13.713 1.00 3.21 O ATOM 1524 CB SER A 108 -1.590 -11.309 -11.819 1.00 50.44 C ATOM 1525 OG SER A 108 -1.173 -10.372 -12.809 1.00 43.25 O ATOM 0 H SER A 108 -3.782 -11.492 -9.566 1.00 54.22 H new ATOM 0 HA SER A 108 -3.291 -10.159 -11.228 1.00 52.14 H new ATOM 0 HB2 SER A 108 -1.021 -11.146 -10.904 1.00 50.44 H new ATOM 0 HB3 SER A 108 -1.364 -12.320 -12.159 1.00 50.44 H new ATOM 0 HG SER A 108 -0.212 -10.475 -12.973 1.00 43.25 H new ATOM 1531 N GLU A 109 -5.240 -11.080 -12.652 1.00 31.33 N ATOM 1532 CA GLU A 109 -6.206 -11.208 -13.724 1.00 23.55 C ATOM 1533 C GLU A 109 -6.896 -9.897 -13.911 1.00 21.30 C ATOM 1534 O GLU A 109 -7.126 -9.170 -12.946 1.00 12.05 O ATOM 1535 CB GLU A 109 -7.241 -12.275 -13.411 1.00 25.32 C ATOM 1536 CG GLU A 109 -6.741 -13.694 -13.479 1.00 32.12 C ATOM 1537 CD GLU A 109 -6.354 -14.102 -14.871 1.00 12.43 C ATOM 1538 OE1 GLU A 109 -7.252 -14.453 -15.672 1.00 42.51 O ATOM 1539 OE2 GLU A 109 -5.166 -14.110 -15.193 1.00 73.22 O ATOM 0 H GLU A 109 -5.621 -10.647 -11.811 1.00 31.33 H new ATOM 0 HA GLU A 109 -5.679 -11.500 -14.632 1.00 23.55 H new ATOM 0 HB2 GLU A 109 -7.636 -12.093 -12.411 1.00 25.32 H new ATOM 0 HB3 GLU A 109 -8.073 -12.166 -14.107 1.00 25.32 H new ATOM 0 HG2 GLU A 109 -5.880 -13.804 -12.819 1.00 32.12 H new ATOM 0 HG3 GLU A 109 -7.515 -14.366 -13.109 1.00 32.12 H new ATOM 1546 N LYS A 110 -7.235 -9.604 -15.112 1.00 64.30 N ATOM 1547 CA LYS A 110 -7.858 -8.354 -15.447 1.00 51.22 C ATOM 1548 C LYS A 110 -9.359 -8.545 -15.519 1.00 52.53 C ATOM 1549 O LYS A 110 -9.861 -9.416 -16.224 1.00 23.32 O ATOM 1550 CB LYS A 110 -7.315 -7.861 -16.777 1.00 55.44 C ATOM 1551 CG LYS A 110 -5.820 -7.630 -16.735 1.00 13.42 C ATOM 1552 CD LYS A 110 -5.230 -7.301 -18.093 1.00 22.15 C ATOM 1553 CE LYS A 110 -5.821 -6.034 -18.682 1.00 65.43 C ATOM 1554 NZ LYS A 110 -5.196 -5.698 -19.973 1.00 41.20 N ATOM 0 H LYS A 110 -7.091 -10.225 -15.908 1.00 64.30 H new ATOM 0 HA LYS A 110 -7.637 -7.609 -14.682 1.00 51.22 H new ATOM 0 HB2 LYS A 110 -7.546 -8.589 -17.554 1.00 55.44 H new ATOM 0 HB3 LYS A 110 -7.817 -6.933 -17.050 1.00 55.44 H new ATOM 0 HG2 LYS A 110 -5.604 -6.815 -16.044 1.00 13.42 H new ATOM 0 HG3 LYS A 110 -5.332 -8.521 -16.340 1.00 13.42 H new ATOM 0 HD2 LYS A 110 -4.150 -7.187 -18.000 1.00 22.15 H new ATOM 0 HD3 LYS A 110 -5.405 -8.133 -18.775 1.00 22.15 H new ATOM 0 HE2 LYS A 110 -6.895 -6.161 -18.818 1.00 65.43 H new ATOM 0 HE3 LYS A 110 -5.684 -5.208 -17.984 1.00 65.43 H new ATOM 0 HZ1 LYS A 110 -5.622 -4.827 -20.349 1.00 41.20 H new ATOM 0 HZ2 LYS A 110 -4.175 -5.553 -19.837 1.00 41.20 H new ATOM 0 HZ3 LYS A 110 -5.349 -6.476 -20.646 1.00 41.20 H new ATOM 1568 N MET A 111 -10.050 -7.748 -14.797 1.00 22.24 N ATOM 1569 CA MET A 111 -11.496 -7.831 -14.697 1.00 24.40 C ATOM 1570 C MET A 111 -12.127 -6.524 -15.035 1.00 21.52 C ATOM 1571 O MET A 111 -11.477 -5.482 -15.027 1.00 73.50 O ATOM 1572 CB MET A 111 -11.931 -8.266 -13.300 1.00 15.15 C ATOM 1573 CG MET A 111 -11.544 -9.676 -12.954 1.00 22.45 C ATOM 1574 SD MET A 111 -11.838 -10.099 -11.220 1.00 32.13 S ATOM 1575 CE MET A 111 -13.610 -9.854 -11.101 1.00 70.51 C ATOM 0 H MET A 111 -9.640 -6.998 -14.240 1.00 22.24 H new ATOM 0 HA MET A 111 -11.829 -8.582 -15.414 1.00 24.40 H new ATOM 0 HB2 MET A 111 -11.493 -7.589 -12.566 1.00 15.15 H new ATOM 0 HB3 MET A 111 -13.013 -8.166 -13.220 1.00 15.15 H new ATOM 0 HG2 MET A 111 -12.104 -10.364 -13.588 1.00 22.45 H new ATOM 0 HG3 MET A 111 -10.488 -9.821 -13.181 1.00 22.45 H new ATOM 0 HE1 MET A 111 -14.060 -10.699 -10.580 1.00 70.51 H new ATOM 0 HE2 MET A 111 -13.814 -8.937 -10.549 1.00 70.51 H new ATOM 0 HE3 MET A 111 -14.035 -9.777 -12.102 1.00 70.51 H new ATOM 1585 N ALA A 112 -13.373 -6.581 -15.342 1.00 1.14 N ATOM 1586 CA ALA A 112 -14.128 -5.394 -15.681 1.00 34.14 C ATOM 1587 C ALA A 112 -15.162 -5.149 -14.624 1.00 62.42 C ATOM 1588 O ALA A 112 -16.076 -5.958 -14.434 1.00 64.52 O ATOM 1589 CB ALA A 112 -14.790 -5.538 -17.032 1.00 32.03 C ATOM 0 H ALA A 112 -13.913 -7.446 -15.370 1.00 1.14 H new ATOM 0 HA ALA A 112 -13.445 -4.546 -15.732 1.00 34.14 H new ATOM 0 HB1 ALA A 112 -15.350 -4.632 -17.261 1.00 32.03 H new ATOM 0 HB2 ALA A 112 -14.028 -5.696 -17.795 1.00 32.03 H new ATOM 0 HB3 ALA A 112 -15.469 -6.390 -17.015 1.00 32.03 H new ATOM 1595 N VAL A 113 -15.050 -4.044 -13.961 1.00 40.31 N ATOM 1596 CA VAL A 113 -15.913 -3.745 -12.850 1.00 0.44 C ATOM 1597 C VAL A 113 -16.510 -2.370 -12.991 1.00 41.32 C ATOM 1598 O VAL A 113 -16.161 -1.613 -13.893 1.00 63.52 O ATOM 1599 CB VAL A 113 -15.152 -3.799 -11.496 1.00 54.00 C ATOM 1600 CG1 VAL A 113 -14.572 -5.173 -11.229 1.00 20.10 C ATOM 1601 CG2 VAL A 113 -14.064 -2.741 -11.457 1.00 53.13 C ATOM 0 H VAL A 113 -14.361 -3.321 -14.169 1.00 40.31 H new ATOM 0 HA VAL A 113 -16.696 -4.503 -12.856 1.00 0.44 H new ATOM 0 HB VAL A 113 -15.873 -3.592 -10.705 1.00 54.00 H new ATOM 0 HG11 VAL A 113 -14.048 -5.167 -10.273 1.00 20.10 H new ATOM 0 HG12 VAL A 113 -15.377 -5.908 -11.198 1.00 20.10 H new ATOM 0 HG13 VAL A 113 -13.873 -5.434 -12.024 1.00 20.10 H new ATOM 0 HG21 VAL A 113 -13.541 -2.792 -10.502 1.00 53.13 H new ATOM 0 HG22 VAL A 113 -13.357 -2.916 -12.268 1.00 53.13 H new ATOM 0 HG23 VAL A 113 -14.512 -1.754 -11.573 1.00 53.13 H new ATOM 1611 N LYS A 114 -17.407 -2.054 -12.111 1.00 75.50 N ATOM 1612 CA LYS A 114 -17.993 -0.744 -12.065 1.00 1.31 C ATOM 1613 C LYS A 114 -17.467 -0.039 -10.841 1.00 2.03 C ATOM 1614 O LYS A 114 -17.176 -0.681 -9.838 1.00 12.01 O ATOM 1615 CB LYS A 114 -19.545 -0.787 -12.047 1.00 40.11 C ATOM 1616 CG LYS A 114 -20.208 -1.390 -13.299 1.00 21.44 C ATOM 1617 CD LYS A 114 -19.971 -2.894 -13.433 1.00 3.14 C ATOM 1618 CE LYS A 114 -20.537 -3.443 -14.727 1.00 64.23 C ATOM 1619 NZ LYS A 114 -19.868 -2.868 -15.919 1.00 12.45 N ATOM 0 H LYS A 114 -17.757 -2.696 -11.400 1.00 75.50 H new ATOM 0 HA LYS A 114 -17.716 -0.204 -12.970 1.00 1.31 H new ATOM 0 HB2 LYS A 114 -19.865 -1.360 -11.177 1.00 40.11 H new ATOM 0 HB3 LYS A 114 -19.917 0.229 -11.914 1.00 40.11 H new ATOM 0 HG2 LYS A 114 -21.280 -1.198 -13.264 1.00 21.44 H new ATOM 0 HG3 LYS A 114 -19.823 -0.886 -14.186 1.00 21.44 H new ATOM 0 HD2 LYS A 114 -18.901 -3.098 -13.389 1.00 3.14 H new ATOM 0 HD3 LYS A 114 -20.429 -3.410 -12.589 1.00 3.14 H new ATOM 0 HE2 LYS A 114 -20.427 -4.527 -14.739 1.00 64.23 H new ATOM 0 HE3 LYS A 114 -21.605 -3.230 -14.774 1.00 64.23 H new ATOM 0 HZ1 LYS A 114 -19.637 -3.629 -16.589 1.00 12.45 H new ATOM 0 HZ2 LYS A 114 -20.503 -2.184 -16.378 1.00 12.45 H new ATOM 0 HZ3 LYS A 114 -18.993 -2.387 -15.628 1.00 12.45 H new ATOM 1633 N THR A 115 -17.311 1.242 -10.918 1.00 32.25 N ATOM 1634 CA THR A 115 -16.828 1.995 -9.802 1.00 22.25 C ATOM 1635 C THR A 115 -17.441 3.390 -9.844 1.00 4.31 C ATOM 1636 O THR A 115 -18.127 3.751 -10.823 1.00 20.34 O ATOM 1637 CB THR A 115 -15.270 2.077 -9.768 1.00 12.32 C ATOM 1638 OG1 THR A 115 -14.837 2.596 -8.497 1.00 53.44 O ATOM 1639 CG2 THR A 115 -14.754 2.991 -10.868 1.00 5.35 C ATOM 0 H THR A 115 -17.513 1.796 -11.750 1.00 32.25 H new ATOM 0 HA THR A 115 -17.129 1.482 -8.888 1.00 22.25 H new ATOM 0 HB THR A 115 -14.874 1.073 -9.920 1.00 12.32 H new ATOM 0 HG1 THR A 115 -14.981 1.921 -7.802 1.00 53.44 H new ATOM 0 HG21 THR A 115 -13.666 3.033 -10.825 1.00 5.35 H new ATOM 0 HG22 THR A 115 -15.064 2.604 -11.838 1.00 5.35 H new ATOM 0 HG23 THR A 115 -15.162 3.992 -10.730 1.00 5.35 H new ATOM 1647 N TYR A 116 -17.217 4.150 -8.812 1.00 1.31 N ATOM 1648 CA TYR A 116 -17.786 5.455 -8.692 1.00 42.45 C ATOM 1649 C TYR A 116 -16.666 6.466 -8.560 1.00 14.04 C ATOM 1650 O TYR A 116 -15.979 6.524 -7.536 1.00 52.53 O ATOM 1651 CB TYR A 116 -18.721 5.498 -7.472 1.00 71.23 C ATOM 1652 CG TYR A 116 -19.793 4.425 -7.512 1.00 1.43 C ATOM 1653 CD1 TYR A 116 -21.018 4.646 -8.130 1.00 12.12 C ATOM 1654 CD2 TYR A 116 -19.560 3.176 -6.948 1.00 50.23 C ATOM 1655 CE1 TYR A 116 -21.975 3.653 -8.181 1.00 73.31 C ATOM 1656 CE2 TYR A 116 -20.512 2.184 -6.992 1.00 53.03 C ATOM 1657 CZ TYR A 116 -21.715 2.425 -7.610 1.00 14.12 C ATOM 1658 OH TYR A 116 -22.653 1.429 -7.669 1.00 50.21 O ATOM 0 H TYR A 116 -16.629 3.877 -8.025 1.00 1.31 H new ATOM 0 HA TYR A 116 -18.374 5.697 -9.577 1.00 42.45 H new ATOM 0 HB2 TYR A 116 -18.130 5.381 -6.563 1.00 71.23 H new ATOM 0 HB3 TYR A 116 -19.196 6.478 -7.419 1.00 71.23 H new ATOM 0 HD1 TYR A 116 -21.224 5.608 -8.576 1.00 12.12 H new ATOM 0 HD2 TYR A 116 -18.613 2.981 -6.466 1.00 50.23 H new ATOM 0 HE1 TYR A 116 -22.923 3.837 -8.666 1.00 73.31 H new ATOM 0 HE2 TYR A 116 -20.315 1.222 -6.543 1.00 53.03 H new ATOM 0 HH TYR A 116 -22.309 0.629 -7.219 1.00 50.21 H new ATOM 1668 N MET A 117 -16.466 7.231 -9.598 1.00 31.33 N ATOM 1669 CA MET A 117 -15.418 8.230 -9.625 1.00 15.33 C ATOM 1670 C MET A 117 -16.030 9.605 -9.605 1.00 20.41 C ATOM 1671 O MET A 117 -17.205 9.780 -9.976 1.00 52.31 O ATOM 1672 CB MET A 117 -14.478 8.093 -10.843 1.00 74.41 C ATOM 1673 CG MET A 117 -15.154 8.330 -12.154 1.00 35.24 C ATOM 1674 SD MET A 117 -14.052 8.328 -13.568 1.00 15.01 S ATOM 1675 CE MET A 117 -15.274 8.560 -14.844 1.00 74.53 C ATOM 0 H MET A 117 -17.022 7.184 -10.452 1.00 31.33 H new ATOM 0 HA MET A 117 -14.806 8.072 -8.737 1.00 15.33 H new ATOM 0 HB2 MET A 117 -13.654 8.799 -10.736 1.00 74.41 H new ATOM 0 HB3 MET A 117 -14.043 7.094 -10.844 1.00 74.41 H new ATOM 0 HG2 MET A 117 -15.914 7.563 -12.301 1.00 35.24 H new ATOM 0 HG3 MET A 117 -15.672 9.288 -12.114 1.00 35.24 H new ATOM 0 HE1 MET A 117 -15.371 7.643 -15.425 1.00 74.53 H new ATOM 0 HE2 MET A 117 -16.234 8.805 -14.389 1.00 74.53 H new ATOM 0 HE3 MET A 117 -14.965 9.374 -15.500 1.00 74.53 H new ATOM 1685 N TRP A 118 -15.262 10.550 -9.154 1.00 21.42 N ATOM 1686 CA TRP A 118 -15.673 11.916 -9.066 1.00 12.21 C ATOM 1687 C TRP A 118 -15.825 12.456 -10.483 1.00 53.33 C ATOM 1688 O TRP A 118 -14.874 12.419 -11.276 1.00 20.23 O ATOM 1689 CB TRP A 118 -14.611 12.683 -8.288 1.00 43.55 C ATOM 1690 CG TRP A 118 -15.007 14.040 -7.875 1.00 21.22 C ATOM 1691 CD1 TRP A 118 -14.462 15.224 -8.261 1.00 3.30 C ATOM 1692 CD2 TRP A 118 -16.049 14.344 -6.979 1.00 61.00 C ATOM 1693 NE1 TRP A 118 -15.105 16.254 -7.628 1.00 75.35 N ATOM 1694 CE2 TRP A 118 -16.094 15.732 -6.840 1.00 0.23 C ATOM 1695 CE3 TRP A 118 -16.955 13.561 -6.277 1.00 61.10 C ATOM 1696 CZ2 TRP A 118 -17.009 16.359 -6.022 1.00 41.04 C ATOM 1697 CZ3 TRP A 118 -17.863 14.169 -5.471 1.00 41.13 C ATOM 1698 CH2 TRP A 118 -17.893 15.562 -5.341 1.00 30.21 C ATOM 0 H TRP A 118 -14.309 10.387 -8.829 1.00 21.42 H new ATOM 0 HA TRP A 118 -16.626 12.022 -8.548 1.00 12.21 H new ATOM 0 HB2 TRP A 118 -14.348 12.110 -7.399 1.00 43.55 H new ATOM 0 HB3 TRP A 118 -13.712 12.753 -8.900 1.00 43.55 H new ATOM 0 HD1 TRP A 118 -13.646 15.335 -8.960 1.00 3.30 H new ATOM 0 HE1 TRP A 118 -14.884 17.245 -7.727 1.00 75.35 H new ATOM 0 HE3 TRP A 118 -16.938 12.485 -6.370 1.00 61.10 H new ATOM 0 HZ2 TRP A 118 -17.029 17.434 -5.921 1.00 41.04 H new ATOM 0 HZ3 TRP A 118 -18.573 13.568 -4.922 1.00 41.13 H new ATOM 0 HH2 TRP A 118 -18.626 16.018 -4.692 1.00 30.21 H new ATOM 1709 N ILE A 119 -17.007 12.957 -10.796 1.00 63.05 N ATOM 1710 CA ILE A 119 -17.352 13.348 -12.170 1.00 62.31 C ATOM 1711 C ILE A 119 -16.497 14.516 -12.641 1.00 0.34 C ATOM 1712 O ILE A 119 -16.015 14.535 -13.793 1.00 64.22 O ATOM 1713 CB ILE A 119 -18.880 13.722 -12.369 1.00 1.43 C ATOM 1714 CG1 ILE A 119 -19.849 12.585 -11.974 1.00 63.44 C ATOM 1715 CG2 ILE A 119 -19.147 14.128 -13.809 1.00 35.23 C ATOM 1716 CD1 ILE A 119 -19.938 12.280 -10.494 1.00 73.21 C ATOM 0 H ILE A 119 -17.755 13.107 -10.119 1.00 63.05 H new ATOM 0 HA ILE A 119 -17.151 12.461 -12.771 1.00 62.31 H new ATOM 0 HB ILE A 119 -19.071 14.558 -11.697 1.00 1.43 H new ATOM 0 HG12 ILE A 119 -20.846 12.841 -12.334 1.00 63.44 H new ATOM 0 HG13 ILE A 119 -19.546 11.677 -12.495 1.00 63.44 H new ATOM 0 HG21 ILE A 119 -20.201 14.381 -13.926 1.00 35.23 H new ATOM 0 HG22 ILE A 119 -18.535 14.994 -14.062 1.00 35.23 H new ATOM 0 HG23 ILE A 119 -18.897 13.300 -14.473 1.00 35.23 H new ATOM 0 HD11 ILE A 119 -20.646 11.467 -10.332 1.00 73.21 H new ATOM 0 HD12 ILE A 119 -18.956 11.985 -10.124 1.00 73.21 H new ATOM 0 HD13 ILE A 119 -20.276 13.168 -9.959 1.00 73.21 H new ATOM 1728 N ASN A 120 -16.283 15.471 -11.744 1.00 43.01 N ATOM 1729 CA ASN A 120 -15.515 16.678 -12.049 1.00 14.30 C ATOM 1730 C ASN A 120 -14.091 16.328 -12.492 1.00 1.45 C ATOM 1731 O ASN A 120 -13.500 17.046 -13.286 1.00 14.12 O ATOM 1732 CB ASN A 120 -15.504 17.643 -10.849 1.00 14.21 C ATOM 1733 CG ASN A 120 -14.787 18.964 -11.138 1.00 22.12 C ATOM 1734 OD1 ASN A 120 -14.760 19.438 -12.279 1.00 20.23 O ATOM 1735 ND2 ASN A 120 -14.223 19.574 -10.122 1.00 71.01 N ATOM 0 H ASN A 120 -16.634 15.434 -10.787 1.00 43.01 H new ATOM 0 HA ASN A 120 -16.005 17.186 -12.880 1.00 14.30 H new ATOM 0 HB2 ASN A 120 -16.531 17.853 -10.552 1.00 14.21 H new ATOM 0 HB3 ASN A 120 -15.021 17.154 -10.003 1.00 14.21 H new ATOM 0 HD21 ASN A 120 -13.746 20.464 -10.263 1.00 71.01 H new ATOM 0 HD22 ASN A 120 -14.262 19.158 -9.192 1.00 71.01 H new ATOM 1742 N LYS A 121 -13.583 15.181 -11.988 1.00 22.44 N ATOM 1743 CA LYS A 121 -12.239 14.595 -12.286 1.00 22.12 C ATOM 1744 C LYS A 121 -11.034 15.510 -11.961 1.00 71.22 C ATOM 1745 O LYS A 121 -10.109 15.098 -11.264 1.00 21.03 O ATOM 1746 CB LYS A 121 -12.149 13.902 -13.684 1.00 52.21 C ATOM 1747 CG LYS A 121 -12.371 14.803 -14.894 1.00 71.11 C ATOM 1748 CD LYS A 121 -12.388 14.025 -16.206 1.00 33.32 C ATOM 1749 CE LYS A 121 -13.575 13.060 -16.289 1.00 2.52 C ATOM 1750 NZ LYS A 121 -14.885 13.769 -16.202 1.00 25.35 N ATOM 0 H LYS A 121 -14.114 14.607 -11.333 1.00 22.44 H new ATOM 0 HA LYS A 121 -12.146 13.788 -11.560 1.00 22.12 H new ATOM 0 HB2 LYS A 121 -11.166 13.440 -13.776 1.00 52.21 H new ATOM 0 HB3 LYS A 121 -12.883 13.097 -13.716 1.00 52.21 H new ATOM 0 HG2 LYS A 121 -13.315 15.335 -14.778 1.00 71.11 H new ATOM 0 HG3 LYS A 121 -11.584 15.556 -14.932 1.00 71.11 H new ATOM 0 HD2 LYS A 121 -12.431 14.724 -17.041 1.00 33.32 H new ATOM 0 HD3 LYS A 121 -11.458 13.465 -16.307 1.00 33.32 H new ATOM 0 HE2 LYS A 121 -13.525 12.506 -17.226 1.00 2.52 H new ATOM 0 HE3 LYS A 121 -13.505 12.330 -15.483 1.00 2.52 H new ATOM 0 HZ1 LYS A 121 -15.610 13.223 -16.711 1.00 25.35 H new ATOM 0 HZ2 LYS A 121 -15.162 13.866 -15.204 1.00 25.35 H new ATOM 0 HZ3 LYS A 121 -14.798 14.713 -16.630 1.00 25.35 H new ATOM 1764 N ALA A 122 -11.048 16.714 -12.449 1.00 22.45 N ATOM 1765 CA ALA A 122 -10.049 17.683 -12.112 1.00 33.21 C ATOM 1766 C ALA A 122 -10.636 18.586 -11.059 1.00 61.02 C ATOM 1767 O ALA A 122 -11.215 19.631 -11.360 1.00 41.01 O ATOM 1768 CB ALA A 122 -9.592 18.479 -13.327 1.00 33.41 C ATOM 0 H ALA A 122 -11.758 17.054 -13.097 1.00 22.45 H new ATOM 0 HA ALA A 122 -9.159 17.179 -11.734 1.00 33.21 H new ATOM 0 HB1 ALA A 122 -8.834 19.202 -13.024 1.00 33.41 H new ATOM 0 HB2 ALA A 122 -9.171 17.801 -14.069 1.00 33.41 H new ATOM 0 HB3 ALA A 122 -10.443 19.005 -13.759 1.00 33.41 H new ATOM 1774 N ASP A 123 -10.574 18.129 -9.839 1.00 34.52 N ATOM 1775 CA ASP A 123 -11.166 18.842 -8.733 1.00 24.12 C ATOM 1776 C ASP A 123 -10.068 19.348 -7.828 1.00 42.20 C ATOM 1777 O ASP A 123 -9.201 18.577 -7.416 1.00 5.32 O ATOM 1778 CB ASP A 123 -12.122 17.926 -7.955 1.00 64.04 C ATOM 1779 CG ASP A 123 -12.918 18.662 -6.919 1.00 73.11 C ATOM 1780 OD1 ASP A 123 -12.385 18.970 -5.856 1.00 30.41 O ATOM 1781 OD2 ASP A 123 -14.116 18.948 -7.192 1.00 1.21 O ATOM 0 H ASP A 123 -10.115 17.256 -9.580 1.00 34.52 H new ATOM 0 HA ASP A 123 -11.741 19.686 -9.112 1.00 24.12 H new ATOM 0 HB2 ASP A 123 -12.804 17.442 -8.654 1.00 64.04 H new ATOM 0 HB3 ASP A 123 -11.548 17.136 -7.472 1.00 64.04 H new ATOM 1786 N PRO A 124 -10.072 20.642 -7.524 1.00 64.42 N ATOM 1787 CA PRO A 124 -9.030 21.269 -6.716 1.00 55.03 C ATOM 1788 C PRO A 124 -9.116 20.939 -5.226 1.00 25.24 C ATOM 1789 O PRO A 124 -8.139 21.107 -4.498 1.00 50.23 O ATOM 1790 CB PRO A 124 -9.282 22.757 -6.932 1.00 72.32 C ATOM 1791 CG PRO A 124 -10.741 22.848 -7.185 1.00 35.13 C ATOM 1792 CD PRO A 124 -11.090 21.622 -7.960 1.00 20.10 C ATOM 0 HA PRO A 124 -8.041 20.919 -7.012 1.00 55.03 H new ATOM 0 HB2 PRO A 124 -8.993 23.341 -6.058 1.00 72.32 H new ATOM 0 HB3 PRO A 124 -8.707 23.140 -7.775 1.00 72.32 H new ATOM 0 HG2 PRO A 124 -11.299 22.893 -6.250 1.00 35.13 H new ATOM 0 HG3 PRO A 124 -10.986 23.750 -7.746 1.00 35.13 H new ATOM 0 HD2 PRO A 124 -12.100 21.279 -7.736 1.00 20.10 H new ATOM 0 HD3 PRO A 124 -11.044 21.799 -9.035 1.00 20.10 H new ATOM 1800 N ASP A 125 -10.258 20.461 -4.772 1.00 32.34 N ATOM 1801 CA ASP A 125 -10.443 20.211 -3.354 1.00 53.54 C ATOM 1802 C ASP A 125 -9.838 18.920 -2.912 1.00 33.21 C ATOM 1803 O ASP A 125 -9.409 18.795 -1.760 1.00 73.23 O ATOM 1804 CB ASP A 125 -11.902 20.304 -2.916 1.00 23.20 C ATOM 1805 CG ASP A 125 -12.419 21.713 -2.900 1.00 64.24 C ATOM 1806 OD1 ASP A 125 -12.197 22.414 -1.896 1.00 31.20 O ATOM 1807 OD2 ASP A 125 -13.081 22.142 -3.862 1.00 42.15 O ATOM 0 H ASP A 125 -11.064 20.240 -5.356 1.00 32.34 H new ATOM 0 HA ASP A 125 -9.904 21.015 -2.853 1.00 53.54 H new ATOM 0 HB2 ASP A 125 -12.517 19.705 -3.588 1.00 23.20 H new ATOM 0 HB3 ASP A 125 -12.005 19.873 -1.920 1.00 23.20 H new ATOM 1812 N MET A 126 -9.783 17.963 -3.795 1.00 21.24 N ATOM 1813 CA MET A 126 -9.197 16.708 -3.446 1.00 22.42 C ATOM 1814 C MET A 126 -7.726 16.652 -3.764 1.00 42.25 C ATOM 1815 O MET A 126 -7.250 17.221 -4.755 1.00 30.22 O ATOM 1816 CB MET A 126 -9.981 15.483 -3.981 1.00 71.00 C ATOM 1817 CG MET A 126 -10.239 15.429 -5.486 1.00 34.52 C ATOM 1818 SD MET A 126 -8.763 15.200 -6.497 1.00 32.02 S ATOM 1819 CE MET A 126 -9.502 15.211 -8.115 1.00 2.23 C ATOM 0 H MET A 126 -10.134 18.030 -4.751 1.00 21.24 H new ATOM 0 HA MET A 126 -9.279 16.639 -2.361 1.00 22.42 H new ATOM 0 HB2 MET A 126 -9.437 14.582 -3.698 1.00 71.00 H new ATOM 0 HB3 MET A 126 -10.943 15.447 -3.471 1.00 71.00 H new ATOM 0 HG2 MET A 126 -10.934 14.615 -5.693 1.00 34.52 H new ATOM 0 HG3 MET A 126 -10.731 16.353 -5.790 1.00 34.52 H new ATOM 0 HE1 MET A 126 -8.719 15.205 -8.873 1.00 2.23 H new ATOM 0 HE2 MET A 126 -10.129 14.328 -8.234 1.00 2.23 H new ATOM 0 HE3 MET A 126 -10.112 16.107 -8.230 1.00 2.23 H new ATOM 1829 N PHE A 127 -7.022 16.024 -2.874 1.00 73.31 N ATOM 1830 CA PHE A 127 -5.618 15.772 -2.967 1.00 12.53 C ATOM 1831 C PHE A 127 -5.293 14.831 -1.851 1.00 61.02 C ATOM 1832 O PHE A 127 -5.933 14.891 -0.796 1.00 54.13 O ATOM 1833 CB PHE A 127 -4.772 17.081 -2.868 1.00 13.44 C ATOM 1834 CG PHE A 127 -4.944 17.881 -1.592 1.00 4.23 C ATOM 1835 CD1 PHE A 127 -5.934 18.843 -1.490 1.00 62.15 C ATOM 1836 CD2 PHE A 127 -4.107 17.672 -0.504 1.00 30.12 C ATOM 1837 CE1 PHE A 127 -6.088 19.578 -0.334 1.00 14.13 C ATOM 1838 CE2 PHE A 127 -4.258 18.407 0.654 1.00 62.20 C ATOM 1839 CZ PHE A 127 -5.250 19.362 0.740 1.00 72.13 C ATOM 0 H PHE A 127 -7.434 15.654 -2.017 1.00 73.31 H new ATOM 0 HA PHE A 127 -5.370 15.344 -3.938 1.00 12.53 H new ATOM 0 HB2 PHE A 127 -3.719 16.820 -2.972 1.00 13.44 H new ATOM 0 HB3 PHE A 127 -5.026 17.721 -3.713 1.00 13.44 H new ATOM 0 HD1 PHE A 127 -6.594 19.020 -2.326 1.00 62.15 H new ATOM 0 HD2 PHE A 127 -3.329 16.926 -0.565 1.00 30.12 H new ATOM 0 HE1 PHE A 127 -6.866 20.324 -0.269 1.00 14.13 H new ATOM 0 HE2 PHE A 127 -3.600 18.235 1.493 1.00 62.20 H new ATOM 0 HZ PHE A 127 -5.370 19.939 1.645 1.00 72.13 H new ATOM 1849 N GLY A 128 -4.381 13.944 -2.065 1.00 33.30 N ATOM 1850 CA GLY A 128 -4.030 13.032 -1.021 1.00 43.32 C ATOM 1851 C GLY A 128 -3.795 11.640 -1.520 1.00 31.42 C ATOM 1852 O GLY A 128 -4.197 11.281 -2.624 1.00 35.23 O ATOM 0 H GLY A 128 -3.869 13.828 -2.940 1.00 33.30 H new ATOM 0 HA2 GLY A 128 -3.131 13.390 -0.520 1.00 43.32 H new ATOM 0 HA3 GLY A 128 -4.826 13.016 -0.276 1.00 43.32 H new ATOM 1856 N GLU A 129 -3.128 10.890 -0.719 1.00 74.54 N ATOM 1857 CA GLU A 129 -2.791 9.522 -0.963 1.00 31.34 C ATOM 1858 C GLU A 129 -3.254 8.767 0.229 1.00 3.04 C ATOM 1859 O GLU A 129 -3.349 9.349 1.306 1.00 41.42 O ATOM 1860 CB GLU A 129 -1.285 9.365 -1.103 1.00 72.51 C ATOM 1861 CG GLU A 129 -0.686 10.152 -2.242 1.00 71.05 C ATOM 1862 CD GLU A 129 0.799 10.021 -2.298 1.00 55.02 C ATOM 1863 OE1 GLU A 129 1.283 8.987 -2.764 1.00 14.14 O ATOM 1864 OE2 GLU A 129 1.514 10.979 -1.887 1.00 53.33 O ATOM 0 H GLU A 129 -2.780 11.228 0.178 1.00 74.54 H new ATOM 0 HA GLU A 129 -3.253 9.162 -1.882 1.00 31.34 H new ATOM 0 HB2 GLU A 129 -0.810 9.675 -0.172 1.00 72.51 H new ATOM 0 HB3 GLU A 129 -1.052 8.309 -1.243 1.00 72.51 H new ATOM 0 HG2 GLU A 129 -1.115 9.809 -3.183 1.00 71.05 H new ATOM 0 HG3 GLU A 129 -0.952 11.203 -2.135 1.00 71.05 H new ATOM 1871 N TRP A 130 -3.590 7.529 0.092 1.00 21.00 N ATOM 1872 CA TRP A 130 -3.913 6.807 1.277 1.00 21.24 C ATOM 1873 C TRP A 130 -2.626 6.194 1.786 1.00 1.20 C ATOM 1874 O TRP A 130 -1.700 6.030 1.003 1.00 53.31 O ATOM 1875 CB TRP A 130 -4.994 5.762 1.055 1.00 3.10 C ATOM 1876 CG TRP A 130 -5.709 5.453 2.327 1.00 73.33 C ATOM 1877 CD1 TRP A 130 -6.210 6.380 3.190 1.00 13.34 C ATOM 1878 CD2 TRP A 130 -6.031 4.174 2.878 1.00 31.33 C ATOM 1879 NE1 TRP A 130 -6.829 5.775 4.225 1.00 32.05 N ATOM 1880 CE2 TRP A 130 -6.734 4.416 4.076 1.00 41.31 C ATOM 1881 CE3 TRP A 130 -5.800 2.854 2.489 1.00 10.15 C ATOM 1882 CZ2 TRP A 130 -7.206 3.388 4.884 1.00 15.35 C ATOM 1883 CZ3 TRP A 130 -6.273 1.834 3.293 1.00 54.11 C ATOM 1884 CH2 TRP A 130 -6.967 2.106 4.478 1.00 40.01 C ATOM 0 H TRP A 130 -3.648 7.013 -0.786 1.00 21.00 H new ATOM 0 HA TRP A 130 -4.336 7.484 2.019 1.00 21.24 H new ATOM 0 HB2 TRP A 130 -5.706 6.122 0.312 1.00 3.10 H new ATOM 0 HB3 TRP A 130 -4.548 4.852 0.654 1.00 3.10 H new ATOM 0 HD1 TRP A 130 -6.124 7.449 3.064 1.00 13.34 H new ATOM 0 HE1 TRP A 130 -7.294 6.253 4.996 1.00 32.05 H new ATOM 0 HE3 TRP A 130 -5.263 2.634 1.578 1.00 10.15 H new ATOM 0 HZ2 TRP A 130 -7.742 3.595 5.799 1.00 15.35 H new ATOM 0 HZ3 TRP A 130 -6.104 0.808 3.002 1.00 54.11 H new ATOM 0 HH2 TRP A 130 -7.321 1.285 5.084 1.00 40.01 H new ATOM 1895 N ASN A 131 -2.565 5.889 3.074 1.00 14.11 N ATOM 1896 CA ASN A 131 -1.346 5.361 3.735 1.00 52.14 C ATOM 1897 C ASN A 131 -0.632 4.308 2.893 1.00 75.53 C ATOM 1898 O ASN A 131 0.562 4.456 2.576 1.00 5.32 O ATOM 1899 CB ASN A 131 -1.688 4.779 5.109 1.00 20.22 C ATOM 1900 CG ASN A 131 -2.315 5.793 6.033 1.00 24.31 C ATOM 1901 OD1 ASN A 131 -3.535 5.951 6.054 1.00 55.45 O ATOM 1902 ND2 ASN A 131 -1.507 6.480 6.798 1.00 54.54 N ATOM 0 H ASN A 131 -3.357 5.996 3.708 1.00 14.11 H new ATOM 0 HA ASN A 131 -0.665 6.204 3.853 1.00 52.14 H new ATOM 0 HB2 ASN A 131 -2.370 3.938 4.983 1.00 20.22 H new ATOM 0 HB3 ASN A 131 -0.781 4.387 5.569 1.00 20.22 H new ATOM 0 HD21 ASN A 131 -1.883 7.176 7.442 1.00 54.54 H new ATOM 0 HD22 ASN A 131 -0.501 6.320 6.751 1.00 54.54 H new ATOM 1909 N PHE A 132 -1.358 3.277 2.504 1.00 54.22 N ATOM 1910 CA PHE A 132 -0.789 2.210 1.699 1.00 61.31 C ATOM 1911 C PHE A 132 -0.387 2.692 0.309 1.00 53.04 C ATOM 1912 O PHE A 132 0.651 2.316 -0.183 1.00 44.31 O ATOM 1913 CB PHE A 132 -1.746 1.016 1.595 1.00 11.53 C ATOM 1914 CG PHE A 132 -2.019 0.340 2.909 1.00 34.13 C ATOM 1915 CD1 PHE A 132 -1.219 -0.703 3.345 1.00 3.05 C ATOM 1916 CD2 PHE A 132 -3.073 0.747 3.707 1.00 13.11 C ATOM 1917 CE1 PHE A 132 -1.465 -1.328 4.552 1.00 64.32 C ATOM 1918 CE2 PHE A 132 -3.325 0.127 4.915 1.00 25.33 C ATOM 1919 CZ PHE A 132 -2.520 -0.913 5.339 1.00 13.30 C ATOM 0 H PHE A 132 -2.345 3.155 2.732 1.00 54.22 H new ATOM 0 HA PHE A 132 0.116 1.883 2.211 1.00 61.31 H new ATOM 0 HB2 PHE A 132 -2.690 1.355 1.169 1.00 11.53 H new ATOM 0 HB3 PHE A 132 -1.327 0.286 0.902 1.00 11.53 H new ATOM 0 HD1 PHE A 132 -0.392 -1.032 2.733 1.00 3.05 H new ATOM 0 HD2 PHE A 132 -3.706 1.559 3.382 1.00 13.11 H new ATOM 0 HE1 PHE A 132 -0.833 -2.140 4.879 1.00 64.32 H new ATOM 0 HE2 PHE A 132 -4.151 0.455 5.528 1.00 25.33 H new ATOM 0 HZ PHE A 132 -2.716 -1.399 6.283 1.00 13.30 H new ATOM 1929 N GLU A 133 -1.186 3.575 -0.277 1.00 34.53 N ATOM 1930 CA GLU A 133 -0.958 4.055 -1.649 1.00 15.12 C ATOM 1931 C GLU A 133 0.266 4.949 -1.729 1.00 51.11 C ATOM 1932 O GLU A 133 0.935 5.026 -2.770 1.00 20.22 O ATOM 1933 CB GLU A 133 -2.163 4.815 -2.165 1.00 4.11 C ATOM 1934 CG GLU A 133 -3.451 4.046 -2.072 1.00 52.24 C ATOM 1935 CD GLU A 133 -3.412 2.688 -2.749 1.00 54.53 C ATOM 1936 OE1 GLU A 133 -3.664 2.609 -3.952 1.00 34.11 O ATOM 1937 OE2 GLU A 133 -3.194 1.688 -2.049 1.00 45.11 O ATOM 0 H GLU A 133 -2.006 3.980 0.174 1.00 34.53 H new ATOM 0 HA GLU A 133 -0.792 3.175 -2.270 1.00 15.12 H new ATOM 0 HB2 GLU A 133 -2.264 5.743 -1.602 1.00 4.11 H new ATOM 0 HB3 GLU A 133 -1.989 5.090 -3.205 1.00 4.11 H new ATOM 0 HG2 GLU A 133 -3.705 3.909 -1.021 1.00 52.24 H new ATOM 0 HG3 GLU A 133 -4.249 4.640 -2.518 1.00 52.24 H new ATOM 1944 N GLU A 134 0.555 5.625 -0.650 1.00 52.23 N ATOM 1945 CA GLU A 134 1.712 6.474 -0.591 1.00 44.24 C ATOM 1946 C GLU A 134 2.964 5.604 -0.627 1.00 50.12 C ATOM 1947 O GLU A 134 3.826 5.774 -1.480 1.00 32.33 O ATOM 1948 CB GLU A 134 1.665 7.338 0.661 1.00 13.20 C ATOM 1949 CG GLU A 134 2.788 8.342 0.758 1.00 40.01 C ATOM 1950 CD GLU A 134 2.662 9.212 1.967 1.00 14.21 C ATOM 1951 OE1 GLU A 134 1.935 10.235 1.911 1.00 34.13 O ATOM 1952 OE2 GLU A 134 3.279 8.898 3.002 1.00 54.10 O ATOM 0 H GLU A 134 0.000 5.603 0.206 1.00 52.23 H new ATOM 0 HA GLU A 134 1.729 7.146 -1.449 1.00 44.24 H new ATOM 0 HB2 GLU A 134 0.714 7.869 0.688 1.00 13.20 H new ATOM 0 HB3 GLU A 134 1.694 6.691 1.538 1.00 13.20 H new ATOM 0 HG2 GLU A 134 3.742 7.816 0.788 1.00 40.01 H new ATOM 0 HG3 GLU A 134 2.795 8.964 -0.137 1.00 40.01 H new ATOM 1959 N TRP A 135 3.018 4.631 0.273 1.00 64.55 N ATOM 1960 CA TRP A 135 4.127 3.684 0.325 1.00 31.04 C ATOM 1961 C TRP A 135 4.182 2.855 -0.971 1.00 24.22 C ATOM 1962 O TRP A 135 5.252 2.445 -1.430 1.00 15.32 O ATOM 1963 CB TRP A 135 3.992 2.792 1.577 1.00 44.12 C ATOM 1964 CG TRP A 135 5.007 1.687 1.681 1.00 30.51 C ATOM 1965 CD1 TRP A 135 4.742 0.355 1.786 1.00 25.40 C ATOM 1966 CD2 TRP A 135 6.437 1.813 1.660 1.00 32.24 C ATOM 1967 NE1 TRP A 135 5.910 -0.355 1.850 1.00 12.42 N ATOM 1968 CE2 TRP A 135 6.968 0.515 1.770 1.00 34.03 C ATOM 1969 CE3 TRP A 135 7.319 2.894 1.563 1.00 31.43 C ATOM 1970 CZ2 TRP A 135 8.338 0.268 1.784 1.00 43.20 C ATOM 1971 CZ3 TRP A 135 8.677 2.646 1.575 1.00 61.10 C ATOM 1972 CH2 TRP A 135 9.175 1.343 1.686 1.00 20.21 C ATOM 0 H TRP A 135 2.302 4.475 0.982 1.00 64.55 H new ATOM 0 HA TRP A 135 5.069 4.227 0.402 1.00 31.04 H new ATOM 0 HB2 TRP A 135 4.070 3.421 2.463 1.00 44.12 H new ATOM 0 HB3 TRP A 135 2.995 2.352 1.585 1.00 44.12 H new ATOM 0 HD1 TRP A 135 3.753 -0.078 1.815 1.00 25.40 H new ATOM 0 HE1 TRP A 135 5.982 -1.368 1.942 1.00 12.42 H new ATOM 0 HE3 TRP A 135 6.945 3.904 1.480 1.00 31.43 H new ATOM 0 HZ2 TRP A 135 8.725 -0.737 1.869 1.00 43.20 H new ATOM 0 HZ3 TRP A 135 9.368 3.473 1.497 1.00 61.10 H new ATOM 0 HH2 TRP A 135 10.243 1.184 1.694 1.00 20.21 H new ATOM 1983 N LYS A 136 3.020 2.652 -1.546 1.00 31.42 N ATOM 1984 CA LYS A 136 2.832 1.926 -2.786 1.00 71.13 C ATOM 1985 C LYS A 136 3.679 2.594 -3.875 1.00 1.40 C ATOM 1986 O LYS A 136 4.457 1.929 -4.541 1.00 4.21 O ATOM 1987 CB LYS A 136 1.331 1.989 -3.122 1.00 40.21 C ATOM 1988 CG LYS A 136 0.679 0.929 -4.033 1.00 33.34 C ATOM 1989 CD LYS A 136 1.084 0.918 -5.503 1.00 12.51 C ATOM 1990 CE LYS A 136 2.386 0.224 -5.775 1.00 3.33 C ATOM 1991 NZ LYS A 136 2.624 0.094 -7.225 1.00 21.53 N ATOM 0 H LYS A 136 2.146 2.999 -1.151 1.00 31.42 H new ATOM 0 HA LYS A 136 3.144 0.884 -2.708 1.00 71.13 H new ATOM 0 HB2 LYS A 136 0.790 1.974 -2.176 1.00 40.21 H new ATOM 0 HB3 LYS A 136 1.146 2.961 -3.579 1.00 40.21 H new ATOM 0 HG2 LYS A 136 0.899 -0.054 -3.616 1.00 33.34 H new ATOM 0 HG3 LYS A 136 -0.402 1.062 -3.983 1.00 33.34 H new ATOM 0 HD2 LYS A 136 0.298 0.432 -6.082 1.00 12.51 H new ATOM 0 HD3 LYS A 136 1.152 1.946 -5.858 1.00 12.51 H new ATOM 0 HE2 LYS A 136 3.202 0.783 -5.318 1.00 3.33 H new ATOM 0 HE3 LYS A 136 2.379 -0.764 -5.314 1.00 3.33 H new ATOM 0 HZ1 LYS A 136 3.637 -0.066 -7.398 1.00 21.53 H new ATOM 0 HZ2 LYS A 136 2.078 -0.710 -7.596 1.00 21.53 H new ATOM 0 HZ3 LYS A 136 2.325 0.966 -7.706 1.00 21.53 H new ATOM 2005 N ARG A 137 3.569 3.919 -4.035 1.00 63.21 N ATOM 2006 CA ARG A 137 4.358 4.580 -5.076 1.00 61.43 C ATOM 2007 C ARG A 137 5.846 4.600 -4.756 1.00 54.43 C ATOM 2008 O ARG A 137 6.671 4.542 -5.660 1.00 25.41 O ATOM 2009 CB ARG A 137 3.869 5.968 -5.484 1.00 42.53 C ATOM 2010 CG ARG A 137 3.917 7.024 -4.417 1.00 45.10 C ATOM 2011 CD ARG A 137 3.618 8.377 -5.027 1.00 10.31 C ATOM 2012 NE ARG A 137 3.529 9.430 -4.033 1.00 62.24 N ATOM 2013 CZ ARG A 137 4.301 10.522 -3.975 1.00 24.42 C ATOM 2014 NH1 ARG A 137 5.364 10.650 -4.785 1.00 61.53 N ATOM 2015 NH2 ARG A 137 4.013 11.471 -3.093 1.00 45.22 N ATOM 0 H ARG A 137 2.968 4.531 -3.482 1.00 63.21 H new ATOM 0 HA ARG A 137 4.200 3.950 -5.951 1.00 61.43 H new ATOM 0 HB2 ARG A 137 4.466 6.307 -6.330 1.00 42.53 H new ATOM 0 HB3 ARG A 137 2.841 5.880 -5.834 1.00 42.53 H new ATOM 0 HG2 ARG A 137 3.192 6.798 -3.635 1.00 45.10 H new ATOM 0 HG3 ARG A 137 4.900 7.035 -3.946 1.00 45.10 H new ATOM 0 HD2 ARG A 137 4.397 8.627 -5.747 1.00 10.31 H new ATOM 0 HD3 ARG A 137 2.680 8.323 -5.579 1.00 10.31 H new ATOM 0 HE ARG A 137 2.813 9.329 -3.313 1.00 62.24 H new ATOM 0 HH11 ARG A 137 5.589 9.912 -5.452 1.00 61.53 H new ATOM 0 HH12 ARG A 137 5.947 11.486 -4.734 1.00 61.53 H new ATOM 0 HH21 ARG A 137 3.212 11.363 -2.471 1.00 45.22 H new ATOM 0 HH22 ARG A 137 4.593 12.309 -3.038 1.00 45.22 H new ATOM 2029 N LEU A 138 6.182 4.642 -3.478 1.00 54.23 N ATOM 2030 CA LEU A 138 7.586 4.596 -3.057 1.00 51.52 C ATOM 2031 C LEU A 138 8.187 3.235 -3.359 1.00 61.21 C ATOM 2032 O LEU A 138 9.378 3.118 -3.638 1.00 73.31 O ATOM 2033 CB LEU A 138 7.748 4.951 -1.570 1.00 43.40 C ATOM 2034 CG LEU A 138 7.761 6.452 -1.182 1.00 50.03 C ATOM 2035 CD1 LEU A 138 6.559 7.208 -1.713 1.00 51.21 C ATOM 2036 CD2 LEU A 138 7.821 6.580 0.317 1.00 14.20 C ATOM 0 H LEU A 138 5.512 4.708 -2.712 1.00 54.23 H new ATOM 0 HA LEU A 138 8.128 5.349 -3.629 1.00 51.52 H new ATOM 0 HB2 LEU A 138 6.938 4.470 -1.021 1.00 43.40 H new ATOM 0 HB3 LEU A 138 8.679 4.506 -1.219 1.00 43.40 H new ATOM 0 HG LEU A 138 8.644 6.898 -1.640 1.00 50.03 H new ATOM 0 HD11 LEU A 138 6.623 8.253 -1.410 1.00 51.21 H new ATOM 0 HD12 LEU A 138 6.542 7.146 -2.801 1.00 51.21 H new ATOM 0 HD13 LEU A 138 5.646 6.769 -1.311 1.00 51.21 H new ATOM 0 HD21 LEU A 138 7.830 7.635 0.592 1.00 14.20 H new ATOM 0 HD22 LEU A 138 6.949 6.097 0.759 1.00 14.20 H new ATOM 0 HD23 LEU A 138 8.727 6.101 0.687 1.00 14.20 H new ATOM 2048 N HIS A 139 7.363 2.213 -3.307 1.00 51.11 N ATOM 2049 CA HIS A 139 7.784 0.873 -3.708 1.00 41.15 C ATOM 2050 C HIS A 139 7.763 0.767 -5.236 1.00 64.33 C ATOM 2051 O HIS A 139 8.584 0.081 -5.834 1.00 63.51 O ATOM 2052 CB HIS A 139 6.888 -0.210 -3.064 1.00 23.13 C ATOM 2053 CG HIS A 139 7.191 -1.615 -3.526 1.00 51.51 C ATOM 2054 ND1 HIS A 139 6.253 -2.430 -4.117 1.00 43.44 N ATOM 2055 CD2 HIS A 139 8.333 -2.341 -3.482 1.00 24.22 C ATOM 2056 CE1 HIS A 139 6.801 -3.589 -4.415 1.00 4.23 C ATOM 2057 NE2 HIS A 139 8.064 -3.563 -4.044 1.00 61.30 N ATOM 0 H HIS A 139 6.395 2.276 -2.992 1.00 51.11 H new ATOM 0 HA HIS A 139 8.801 0.703 -3.354 1.00 41.15 H new ATOM 0 HB2 HIS A 139 7.001 -0.163 -1.981 1.00 23.13 H new ATOM 0 HB3 HIS A 139 5.845 0.017 -3.286 1.00 23.13 H new ATOM 0 HD2 HIS A 139 9.281 -2.018 -3.079 1.00 24.22 H new ATOM 0 HE1 HIS A 139 6.299 -4.422 -4.885 1.00 4.23 H new ATOM 0 HE2 HIS A 139 8.732 -4.326 -4.156 1.00 61.30 H new ATOM 2066 N LYS A 140 6.819 1.460 -5.842 1.00 62.44 N ATOM 2067 CA LYS A 140 6.667 1.506 -7.286 1.00 53.51 C ATOM 2068 C LYS A 140 7.891 2.087 -7.973 1.00 33.13 C ATOM 2069 O LYS A 140 8.221 1.679 -9.061 1.00 11.23 O ATOM 2070 CB LYS A 140 5.372 2.234 -7.694 1.00 73.13 C ATOM 2071 CG LYS A 140 5.190 2.422 -9.198 1.00 72.52 C ATOM 2072 CD LYS A 140 3.781 2.868 -9.561 1.00 73.24 C ATOM 2073 CE LYS A 140 3.352 4.156 -8.864 1.00 31.24 C ATOM 2074 NZ LYS A 140 1.941 4.483 -9.169 1.00 31.12 N ATOM 0 H LYS A 140 6.126 2.015 -5.340 1.00 62.44 H new ATOM 0 HA LYS A 140 6.580 0.476 -7.632 1.00 53.51 H new ATOM 0 HB2 LYS A 140 4.520 1.675 -7.306 1.00 73.13 H new ATOM 0 HB3 LYS A 140 5.356 3.213 -7.215 1.00 73.13 H new ATOM 0 HG2 LYS A 140 5.906 3.161 -9.558 1.00 72.52 H new ATOM 0 HG3 LYS A 140 5.414 1.485 -9.708 1.00 72.52 H new ATOM 0 HD2 LYS A 140 3.720 3.010 -10.640 1.00 73.24 H new ATOM 0 HD3 LYS A 140 3.080 2.074 -9.304 1.00 73.24 H new ATOM 0 HE2 LYS A 140 3.479 4.050 -7.787 1.00 31.24 H new ATOM 0 HE3 LYS A 140 3.995 4.977 -9.181 1.00 31.24 H new ATOM 0 HZ1 LYS A 140 1.666 5.344 -8.656 1.00 31.12 H new ATOM 0 HZ2 LYS A 140 1.834 4.640 -10.191 1.00 31.12 H new ATOM 0 HZ3 LYS A 140 1.330 3.694 -8.874 1.00 31.12 H new ATOM 2088 N LYS A 141 8.560 3.036 -7.319 1.00 64.23 N ATOM 2089 CA LYS A 141 9.785 3.670 -7.864 1.00 32.34 C ATOM 2090 C LYS A 141 10.807 2.627 -8.372 1.00 2.22 C ATOM 2091 O LYS A 141 11.535 2.879 -9.338 1.00 10.30 O ATOM 2092 CB LYS A 141 10.443 4.550 -6.811 1.00 71.12 C ATOM 2093 CG LYS A 141 9.607 5.733 -6.348 1.00 11.32 C ATOM 2094 CD LYS A 141 10.320 6.506 -5.244 1.00 24.51 C ATOM 2095 CE LYS A 141 11.662 7.043 -5.716 1.00 33.11 C ATOM 2096 NZ LYS A 141 12.392 7.739 -4.641 1.00 35.33 N ATOM 0 H LYS A 141 8.281 3.392 -6.405 1.00 64.23 H new ATOM 0 HA LYS A 141 9.474 4.279 -8.713 1.00 32.34 H new ATOM 0 HB2 LYS A 141 10.685 3.934 -5.945 1.00 71.12 H new ATOM 0 HB3 LYS A 141 11.386 4.925 -7.210 1.00 71.12 H new ATOM 0 HG2 LYS A 141 9.409 6.395 -7.191 1.00 11.32 H new ATOM 0 HG3 LYS A 141 8.641 5.381 -5.985 1.00 11.32 H new ATOM 0 HD2 LYS A 141 9.692 7.333 -4.914 1.00 24.51 H new ATOM 0 HD3 LYS A 141 10.470 5.856 -4.382 1.00 24.51 H new ATOM 0 HE2 LYS A 141 12.269 6.219 -6.091 1.00 33.11 H new ATOM 0 HE3 LYS A 141 11.505 7.728 -6.549 1.00 33.11 H new ATOM 0 HZ1 LYS A 141 13.300 8.088 -5.008 1.00 35.33 H new ATOM 0 HZ2 LYS A 141 11.825 8.541 -4.299 1.00 35.33 H new ATOM 0 HZ3 LYS A 141 12.566 7.079 -3.856 1.00 35.33 H new ATOM 2110 N LYS A 142 10.838 1.464 -7.714 1.00 3.10 N ATOM 2111 CA LYS A 142 11.682 0.330 -8.109 1.00 74.11 C ATOM 2112 C LYS A 142 11.336 -0.098 -9.531 1.00 61.31 C ATOM 2113 O LYS A 142 12.203 -0.272 -10.386 1.00 33.00 O ATOM 2114 CB LYS A 142 11.374 -0.866 -7.176 1.00 2.14 C ATOM 2115 CG LYS A 142 12.141 -2.192 -7.432 1.00 35.53 C ATOM 2116 CD LYS A 142 13.625 -2.199 -7.009 1.00 1.01 C ATOM 2117 CE LYS A 142 14.519 -1.265 -7.812 1.00 41.11 C ATOM 2118 NZ LYS A 142 14.495 -1.542 -9.269 1.00 25.23 N ATOM 0 H LYS A 142 10.273 1.281 -6.885 1.00 3.10 H new ATOM 0 HA LYS A 142 12.730 0.624 -8.045 1.00 74.11 H new ATOM 0 HB2 LYS A 142 11.575 -0.554 -6.151 1.00 2.14 H new ATOM 0 HB3 LYS A 142 10.307 -1.077 -7.241 1.00 2.14 H new ATOM 0 HG2 LYS A 142 11.628 -2.995 -6.903 1.00 35.53 H new ATOM 0 HG3 LYS A 142 12.084 -2.424 -8.496 1.00 35.53 H new ATOM 0 HD2 LYS A 142 13.690 -1.926 -5.956 1.00 1.01 H new ATOM 0 HD3 LYS A 142 14.010 -3.215 -7.099 1.00 1.01 H new ATOM 0 HE2 LYS A 142 14.206 -0.235 -7.639 1.00 41.11 H new ATOM 0 HE3 LYS A 142 15.543 -1.352 -7.449 1.00 41.11 H new ATOM 0 HZ1 LYS A 142 15.186 -0.931 -9.750 1.00 25.23 H new ATOM 0 HZ2 LYS A 142 14.739 -2.539 -9.437 1.00 25.23 H new ATOM 0 HZ3 LYS A 142 13.544 -1.350 -9.643 1.00 25.23 H new ATOM 2132 N PHE A 143 10.064 -0.236 -9.738 1.00 24.14 N ATOM 2133 CA PHE A 143 9.470 -0.742 -10.945 1.00 41.35 C ATOM 2134 C PHE A 143 9.523 0.353 -12.025 1.00 21.20 C ATOM 2135 O PHE A 143 9.689 0.082 -13.222 1.00 13.34 O ATOM 2136 CB PHE A 143 8.021 -1.083 -10.579 1.00 61.52 C ATOM 2137 CG PHE A 143 7.306 -1.989 -11.503 1.00 43.03 C ATOM 2138 CD1 PHE A 143 7.532 -3.343 -11.421 1.00 54.43 C ATOM 2139 CD2 PHE A 143 6.390 -1.511 -12.415 1.00 24.14 C ATOM 2140 CE1 PHE A 143 6.858 -4.220 -12.243 1.00 71.12 C ATOM 2141 CE2 PHE A 143 5.712 -2.378 -13.245 1.00 63.15 C ATOM 2142 CZ PHE A 143 5.946 -3.737 -13.158 1.00 3.22 C ATOM 0 H PHE A 143 9.370 0.014 -9.033 1.00 24.14 H new ATOM 0 HA PHE A 143 9.988 -1.617 -11.337 1.00 41.35 H new ATOM 0 HB2 PHE A 143 8.016 -1.534 -9.587 1.00 61.52 H new ATOM 0 HB3 PHE A 143 7.458 -0.152 -10.509 1.00 61.52 H new ATOM 0 HD1 PHE A 143 8.245 -3.723 -10.705 1.00 54.43 H new ATOM 0 HD2 PHE A 143 6.202 -0.449 -12.480 1.00 24.14 H new ATOM 0 HE1 PHE A 143 7.043 -5.282 -12.171 1.00 71.12 H new ATOM 0 HE2 PHE A 143 5.000 -1.996 -13.961 1.00 63.15 H new ATOM 0 HZ PHE A 143 5.416 -4.420 -13.805 1.00 3.22 H new ATOM 2152 N ILE A 144 9.414 1.591 -11.563 1.00 62.41 N ATOM 2153 CA ILE A 144 9.438 2.776 -12.405 1.00 41.03 C ATOM 2154 C ILE A 144 10.747 2.930 -13.161 1.00 31.14 C ATOM 2155 O ILE A 144 10.737 3.423 -14.263 1.00 13.33 O ATOM 2156 CB ILE A 144 9.085 4.088 -11.618 1.00 35.03 C ATOM 2157 CG1 ILE A 144 7.676 4.005 -11.049 1.00 75.21 C ATOM 2158 CG2 ILE A 144 9.204 5.331 -12.493 1.00 23.53 C ATOM 2159 CD1 ILE A 144 6.589 3.821 -12.101 1.00 64.12 C ATOM 0 H ILE A 144 9.304 1.802 -10.571 1.00 62.41 H new ATOM 0 HA ILE A 144 8.652 2.621 -13.144 1.00 41.03 H new ATOM 0 HB ILE A 144 9.807 4.175 -10.806 1.00 35.03 H new ATOM 0 HG12 ILE A 144 7.629 3.175 -10.344 1.00 75.21 H new ATOM 0 HG13 ILE A 144 7.470 4.914 -10.484 1.00 75.21 H new ATOM 0 HG21 ILE A 144 8.951 6.214 -11.907 1.00 23.53 H new ATOM 0 HG22 ILE A 144 10.226 5.421 -12.861 1.00 23.53 H new ATOM 0 HG23 ILE A 144 8.520 5.248 -13.338 1.00 23.53 H new ATOM 0 HD11 ILE A 144 5.615 3.771 -11.613 1.00 64.12 H new ATOM 0 HD12 ILE A 144 6.606 4.663 -12.793 1.00 64.12 H new ATOM 0 HD13 ILE A 144 6.767 2.897 -12.651 1.00 64.12 H new ATOM 2171 N GLU A 145 11.870 2.499 -12.573 1.00 75.24 N ATOM 2172 CA GLU A 145 13.182 2.633 -13.242 1.00 31.30 C ATOM 2173 C GLU A 145 13.148 2.057 -14.658 1.00 73.21 C ATOM 2174 O GLU A 145 13.689 2.658 -15.600 1.00 71.32 O ATOM 2175 CB GLU A 145 14.300 1.953 -12.457 1.00 74.42 C ATOM 2176 CG GLU A 145 14.524 2.504 -11.072 1.00 44.12 C ATOM 2177 CD GLU A 145 15.728 1.884 -10.418 1.00 23.30 C ATOM 2178 OE1 GLU A 145 15.603 0.808 -9.805 1.00 42.40 O ATOM 2179 OE2 GLU A 145 16.826 2.465 -10.505 1.00 63.31 O ATOM 0 H GLU A 145 11.904 2.061 -11.652 1.00 75.24 H new ATOM 0 HA GLU A 145 13.389 3.702 -13.290 1.00 31.30 H new ATOM 0 HB2 GLU A 145 14.075 0.889 -12.378 1.00 74.42 H new ATOM 0 HB3 GLU A 145 15.228 2.041 -13.022 1.00 74.42 H new ATOM 0 HG2 GLU A 145 14.655 3.585 -11.126 1.00 44.12 H new ATOM 0 HG3 GLU A 145 13.641 2.320 -10.459 1.00 44.12 H new ATOM 2186 N THR A 146 12.491 0.922 -14.799 1.00 45.12 N ATOM 2187 CA THR A 146 12.347 0.260 -16.065 1.00 73.41 C ATOM 2188 C THR A 146 11.388 1.060 -16.968 1.00 51.43 C ATOM 2189 O THR A 146 11.692 1.353 -18.122 1.00 25.23 O ATOM 2190 CB THR A 146 11.769 -1.150 -15.836 1.00 65.35 C ATOM 2191 OG1 THR A 146 12.552 -1.821 -14.831 1.00 64.02 O ATOM 2192 CG2 THR A 146 11.794 -1.970 -17.120 1.00 4.51 C ATOM 0 H THR A 146 12.040 0.435 -14.025 1.00 45.12 H new ATOM 0 HA THR A 146 13.322 0.189 -16.548 1.00 73.41 H new ATOM 0 HB THR A 146 10.733 -1.051 -15.511 1.00 65.35 H new ATOM 0 HG1 THR A 146 12.189 -2.718 -14.679 1.00 64.02 H new ATOM 0 HG21 THR A 146 11.380 -2.960 -16.928 1.00 4.51 H new ATOM 0 HG22 THR A 146 11.198 -1.469 -17.883 1.00 4.51 H new ATOM 0 HG23 THR A 146 12.822 -2.068 -17.469 1.00 4.51 H new ATOM 2200 N PHE A 147 10.254 1.447 -16.411 1.00 1.35 N ATOM 2201 CA PHE A 147 9.238 2.169 -17.160 1.00 4.22 C ATOM 2202 C PHE A 147 9.600 3.577 -17.531 1.00 20.14 C ATOM 2203 O PHE A 147 9.141 4.069 -18.541 1.00 0.33 O ATOM 2204 CB PHE A 147 7.851 2.043 -16.562 1.00 74.32 C ATOM 2205 CG PHE A 147 7.269 0.702 -16.845 1.00 5.34 C ATOM 2206 CD1 PHE A 147 6.641 0.476 -18.053 1.00 51.15 C ATOM 2207 CD2 PHE A 147 7.368 -0.337 -15.942 1.00 43.55 C ATOM 2208 CE1 PHE A 147 6.119 -0.751 -18.363 1.00 63.30 C ATOM 2209 CE2 PHE A 147 6.842 -1.577 -16.243 1.00 50.52 C ATOM 2210 CZ PHE A 147 6.215 -1.785 -17.456 1.00 32.21 C ATOM 0 H PHE A 147 10.012 1.272 -15.436 1.00 1.35 H new ATOM 0 HA PHE A 147 9.202 1.650 -18.118 1.00 4.22 H new ATOM 0 HB2 PHE A 147 7.899 2.203 -15.485 1.00 74.32 H new ATOM 0 HB3 PHE A 147 7.203 2.818 -16.970 1.00 74.32 H new ATOM 0 HD1 PHE A 147 6.560 1.282 -18.767 1.00 51.15 H new ATOM 0 HD2 PHE A 147 7.860 -0.179 -14.994 1.00 43.55 H new ATOM 0 HE1 PHE A 147 5.634 -0.909 -19.315 1.00 63.30 H new ATOM 0 HE2 PHE A 147 6.921 -2.385 -15.530 1.00 50.52 H new ATOM 0 HZ PHE A 147 5.801 -2.754 -17.693 1.00 32.21 H new ATOM 2220 N LYS A 148 10.406 4.221 -16.727 1.00 21.10 N ATOM 2221 CA LYS A 148 10.890 5.556 -17.033 1.00 33.22 C ATOM 2222 C LYS A 148 11.647 5.505 -18.354 1.00 21.14 C ATOM 2223 O LYS A 148 11.445 6.337 -19.227 1.00 54.13 O ATOM 2224 CB LYS A 148 11.812 6.062 -15.911 1.00 3.12 C ATOM 2225 CG LYS A 148 12.338 7.481 -16.107 1.00 35.11 C ATOM 2226 CD LYS A 148 11.215 8.504 -16.105 1.00 62.45 C ATOM 2227 CE LYS A 148 11.751 9.905 -16.314 1.00 42.22 C ATOM 2228 NZ LYS A 148 10.681 10.915 -16.264 1.00 34.40 N ATOM 0 H LYS A 148 10.748 3.843 -15.844 1.00 21.10 H new ATOM 0 HA LYS A 148 10.048 6.244 -17.114 1.00 33.22 H new ATOM 0 HB2 LYS A 148 11.270 6.018 -14.966 1.00 3.12 H new ATOM 0 HB3 LYS A 148 12.661 5.384 -15.823 1.00 3.12 H new ATOM 0 HG2 LYS A 148 13.047 7.718 -15.314 1.00 35.11 H new ATOM 0 HG3 LYS A 148 12.882 7.540 -17.050 1.00 35.11 H new ATOM 0 HD2 LYS A 148 10.500 8.264 -16.892 1.00 62.45 H new ATOM 0 HD3 LYS A 148 10.676 8.455 -15.159 1.00 62.45 H new ATOM 0 HE2 LYS A 148 12.496 10.127 -15.549 1.00 42.22 H new ATOM 0 HE3 LYS A 148 12.257 9.960 -17.278 1.00 42.22 H new ATOM 0 HZ1 LYS A 148 11.089 11.860 -16.411 1.00 34.40 H new ATOM 0 HZ2 LYS A 148 9.983 10.719 -17.010 1.00 34.40 H new ATOM 0 HZ3 LYS A 148 10.214 10.880 -15.335 1.00 34.40 H new ATOM 2242 N LYS A 149 12.454 4.460 -18.505 1.00 14.43 N ATOM 2243 CA LYS A 149 13.247 4.245 -19.696 1.00 52.51 C ATOM 2244 C LYS A 149 12.324 4.023 -20.887 1.00 40.42 C ATOM 2245 O LYS A 149 12.559 4.541 -21.985 1.00 52.54 O ATOM 2246 CB LYS A 149 14.163 3.026 -19.486 1.00 61.25 C ATOM 2247 CG LYS A 149 15.056 2.673 -20.666 1.00 71.31 C ATOM 2248 CD LYS A 149 15.911 1.451 -20.354 1.00 0.22 C ATOM 2249 CE LYS A 149 16.825 1.083 -21.516 1.00 51.52 C ATOM 2250 NZ LYS A 149 16.069 0.727 -22.738 1.00 30.33 N ATOM 0 H LYS A 149 12.572 3.737 -17.795 1.00 14.43 H new ATOM 0 HA LYS A 149 13.867 5.120 -19.893 1.00 52.51 H new ATOM 0 HB2 LYS A 149 14.794 3.212 -18.617 1.00 61.25 H new ATOM 0 HB3 LYS A 149 13.542 2.162 -19.250 1.00 61.25 H new ATOM 0 HG2 LYS A 149 14.443 2.478 -21.546 1.00 71.31 H new ATOM 0 HG3 LYS A 149 15.699 3.520 -20.907 1.00 71.31 H new ATOM 0 HD2 LYS A 149 16.513 1.647 -19.467 1.00 0.22 H new ATOM 0 HD3 LYS A 149 15.264 0.606 -20.120 1.00 0.22 H new ATOM 0 HE2 LYS A 149 17.487 1.921 -21.733 1.00 51.52 H new ATOM 0 HE3 LYS A 149 17.457 0.244 -21.226 1.00 51.52 H new ATOM 0 HZ1 LYS A 149 16.719 0.324 -23.443 1.00 30.33 H new ATOM 0 HZ2 LYS A 149 15.337 0.027 -22.502 1.00 30.33 H new ATOM 0 HZ3 LYS A 149 15.620 1.580 -23.129 1.00 30.33 H new ATOM 2264 N ILE A 150 11.260 3.277 -20.646 1.00 63.12 N ATOM 2265 CA ILE A 150 10.265 2.965 -21.659 1.00 50.35 C ATOM 2266 C ILE A 150 9.472 4.227 -22.049 1.00 64.41 C ATOM 2267 O ILE A 150 9.216 4.472 -23.234 1.00 11.41 O ATOM 2268 CB ILE A 150 9.311 1.830 -21.164 1.00 45.44 C ATOM 2269 CG1 ILE A 150 10.147 0.579 -20.847 1.00 33.13 C ATOM 2270 CG2 ILE A 150 8.263 1.510 -22.222 1.00 22.44 C ATOM 2271 CD1 ILE A 150 9.366 -0.554 -20.227 1.00 43.05 C ATOM 0 H ILE A 150 11.060 2.867 -19.734 1.00 63.12 H new ATOM 0 HA ILE A 150 10.781 2.605 -22.549 1.00 50.35 H new ATOM 0 HB ILE A 150 8.791 2.162 -20.265 1.00 45.44 H new ATOM 0 HG12 ILE A 150 10.610 0.224 -21.768 1.00 33.13 H new ATOM 0 HG13 ILE A 150 10.955 0.859 -20.171 1.00 33.13 H new ATOM 0 HG21 ILE A 150 7.609 0.718 -21.858 1.00 22.44 H new ATOM 0 HG22 ILE A 150 7.672 2.402 -22.430 1.00 22.44 H new ATOM 0 HG23 ILE A 150 8.757 1.181 -23.136 1.00 22.44 H new ATOM 0 HD11 ILE A 150 10.033 -1.395 -20.037 1.00 43.05 H new ATOM 0 HD12 ILE A 150 8.925 -0.221 -19.287 1.00 43.05 H new ATOM 0 HD13 ILE A 150 8.575 -0.866 -20.908 1.00 43.05 H new ATOM 2283 N MET A 151 9.118 5.031 -21.060 1.00 61.12 N ATOM 2284 CA MET A 151 8.401 6.284 -21.296 1.00 74.44 C ATOM 2285 C MET A 151 9.256 7.250 -22.088 1.00 32.30 C ATOM 2286 O MET A 151 8.772 7.893 -23.013 1.00 32.21 O ATOM 2287 CB MET A 151 7.930 6.936 -19.987 1.00 52.23 C ATOM 2288 CG MET A 151 6.885 6.134 -19.229 1.00 62.34 C ATOM 2289 SD MET A 151 5.370 5.885 -20.184 1.00 63.32 S ATOM 2290 CE MET A 151 4.403 4.910 -19.025 1.00 14.15 C ATOM 0 H MET A 151 9.315 4.841 -20.077 1.00 61.12 H new ATOM 0 HA MET A 151 7.512 6.039 -21.878 1.00 74.44 H new ATOM 0 HB2 MET A 151 8.794 7.089 -19.340 1.00 52.23 H new ATOM 0 HB3 MET A 151 7.522 7.921 -20.212 1.00 52.23 H new ATOM 0 HG2 MET A 151 7.303 5.164 -18.958 1.00 62.34 H new ATOM 0 HG3 MET A 151 6.643 6.648 -18.299 1.00 62.34 H new ATOM 0 HE1 MET A 151 3.435 4.674 -19.467 1.00 14.15 H new ATOM 0 HE2 MET A 151 4.933 3.985 -18.796 1.00 14.15 H new ATOM 0 HE3 MET A 151 4.253 5.479 -18.107 1.00 14.15 H new ATOM 2300 N GLU A 152 10.534 7.340 -21.740 1.00 61.22 N ATOM 2301 CA GLU A 152 11.469 8.192 -22.471 1.00 3.14 C ATOM 2302 C GLU A 152 11.698 7.646 -23.880 1.00 14.11 C ATOM 2303 O GLU A 152 11.940 8.401 -24.818 1.00 21.43 O ATOM 2304 CB GLU A 152 12.798 8.315 -21.730 1.00 52.24 C ATOM 2305 CG GLU A 152 12.686 8.927 -20.346 1.00 22.12 C ATOM 2306 CD GLU A 152 14.015 9.010 -19.647 1.00 10.54 C ATOM 2307 OE1 GLU A 152 14.484 7.991 -19.124 1.00 61.24 O ATOM 2308 OE2 GLU A 152 14.607 10.111 -19.610 1.00 21.10 O ATOM 0 H GLU A 152 10.948 6.834 -20.957 1.00 61.22 H new ATOM 0 HA GLU A 152 11.029 9.187 -22.545 1.00 3.14 H new ATOM 0 HB2 GLU A 152 13.245 7.325 -21.642 1.00 52.24 H new ATOM 0 HB3 GLU A 152 13.480 8.920 -22.328 1.00 52.24 H new ATOM 0 HG2 GLU A 152 12.258 9.926 -20.427 1.00 22.12 H new ATOM 0 HG3 GLU A 152 11.998 8.334 -19.744 1.00 22.12 H new ATOM 2315 N CYS A 153 11.609 6.329 -24.012 1.00 22.01 N ATOM 2316 CA CYS A 153 11.759 5.650 -25.295 1.00 14.42 C ATOM 2317 C CYS A 153 10.608 6.038 -26.230 1.00 34.31 C ATOM 2318 O CYS A 153 10.797 6.208 -27.435 1.00 74.14 O ATOM 2319 CB CYS A 153 11.799 4.124 -25.082 1.00 12.11 C ATOM 2320 SG CYS A 153 11.975 3.133 -26.582 1.00 15.01 S ATOM 0 H CYS A 153 11.430 5.698 -23.230 1.00 22.01 H new ATOM 0 HA CYS A 153 12.697 5.958 -25.757 1.00 14.42 H new ATOM 0 HB2 CYS A 153 12.627 3.890 -24.414 1.00 12.11 H new ATOM 0 HB3 CYS A 153 10.884 3.822 -24.573 1.00 12.11 H new ATOM 0 HG CYS A 153 11.998 1.872 -26.269 1.00 15.01 H new ATOM 2326 N LYS A 154 9.424 6.180 -25.664 1.00 42.23 N ATOM 2327 CA LYS A 154 8.262 6.600 -26.420 1.00 4.44 C ATOM 2328 C LYS A 154 8.291 8.101 -26.626 1.00 14.21 C ATOM 2329 O LYS A 154 7.935 8.603 -27.695 1.00 54.33 O ATOM 2330 CB LYS A 154 6.999 6.183 -25.703 1.00 11.34 C ATOM 2331 CG LYS A 154 6.891 4.685 -25.545 1.00 53.25 C ATOM 2332 CD LYS A 154 5.606 4.311 -24.883 1.00 52.15 C ATOM 2333 CE LYS A 154 5.473 2.804 -24.722 1.00 72.23 C ATOM 2334 NZ LYS A 154 5.476 2.108 -26.030 1.00 45.11 N ATOM 0 H LYS A 154 9.243 6.009 -24.675 1.00 42.23 H new ATOM 0 HA LYS A 154 8.278 6.118 -27.397 1.00 4.44 H new ATOM 0 HB2 LYS A 154 6.972 6.652 -24.719 1.00 11.34 H new ATOM 0 HB3 LYS A 154 6.134 6.550 -26.255 1.00 11.34 H new ATOM 0 HG2 LYS A 154 6.954 4.207 -26.522 1.00 53.25 H new ATOM 0 HG3 LYS A 154 7.730 4.316 -24.955 1.00 53.25 H new ATOM 0 HD2 LYS A 154 5.549 4.788 -23.905 1.00 52.15 H new ATOM 0 HD3 LYS A 154 4.770 4.689 -25.471 1.00 52.15 H new ATOM 0 HE2 LYS A 154 6.294 2.430 -24.110 1.00 72.23 H new ATOM 0 HE3 LYS A 154 4.549 2.575 -24.191 1.00 72.23 H new ATOM 0 HZ1 LYS A 154 5.150 1.129 -25.903 1.00 45.11 H new ATOM 0 HZ2 LYS A 154 4.839 2.602 -26.688 1.00 45.11 H new ATOM 0 HZ3 LYS A 154 6.441 2.104 -26.419 1.00 45.11 H new ATOM 2348 N LYS A 155 8.746 8.797 -25.592 1.00 72.20 N ATOM 2349 CA LYS A 155 8.909 10.245 -25.564 1.00 51.43 C ATOM 2350 C LYS A 155 7.577 10.980 -25.622 1.00 42.04 C ATOM 2351 O LYS A 155 7.005 11.207 -26.696 1.00 43.43 O ATOM 2352 CB LYS A 155 9.886 10.755 -26.646 1.00 73.44 C ATOM 2353 CG LYS A 155 10.107 12.262 -26.613 1.00 1.52 C ATOM 2354 CD LYS A 155 11.064 12.708 -27.701 1.00 21.33 C ATOM 2355 CE LYS A 155 11.276 14.213 -27.664 1.00 24.24 C ATOM 2356 NZ LYS A 155 12.219 14.663 -28.704 1.00 50.11 N ATOM 0 H LYS A 155 9.022 8.352 -24.717 1.00 72.20 H new ATOM 0 HA LYS A 155 9.360 10.475 -24.599 1.00 51.43 H new ATOM 0 HB2 LYS A 155 10.846 10.254 -26.521 1.00 73.44 H new ATOM 0 HB3 LYS A 155 9.505 10.474 -27.628 1.00 73.44 H new ATOM 0 HG2 LYS A 155 9.152 12.773 -26.735 1.00 1.52 H new ATOM 0 HG3 LYS A 155 10.502 12.552 -25.639 1.00 1.52 H new ATOM 0 HD2 LYS A 155 12.021 12.200 -27.578 1.00 21.33 H new ATOM 0 HD3 LYS A 155 10.672 12.417 -28.676 1.00 21.33 H new ATOM 0 HE2 LYS A 155 10.319 14.717 -27.799 1.00 24.24 H new ATOM 0 HE3 LYS A 155 11.653 14.502 -26.683 1.00 24.24 H new ATOM 0 HZ1 LYS A 155 12.335 15.695 -28.644 1.00 50.11 H new ATOM 0 HZ2 LYS A 155 13.140 14.202 -28.561 1.00 50.11 H new ATOM 0 HZ3 LYS A 155 11.848 14.410 -29.642 1.00 50.11 H new ATOM 2370 N LYS A 156 7.076 11.315 -24.467 1.00 35.21 N ATOM 2371 CA LYS A 156 5.858 12.064 -24.356 1.00 52.15 C ATOM 2372 C LYS A 156 6.205 13.511 -24.004 1.00 2.21 C ATOM 2373 O LYS A 156 7.249 13.751 -23.387 1.00 51.33 O ATOM 2374 CB LYS A 156 4.924 11.432 -23.296 1.00 30.54 C ATOM 2375 CG LYS A 156 5.521 11.331 -21.901 1.00 23.54 C ATOM 2376 CD LYS A 156 4.536 10.714 -20.920 1.00 43.20 C ATOM 2377 CE LYS A 156 5.134 10.621 -19.526 1.00 71.22 C ATOM 2378 NZ LYS A 156 4.192 10.047 -18.543 1.00 63.12 N ATOM 0 H LYS A 156 7.503 11.075 -23.572 1.00 35.21 H new ATOM 0 HA LYS A 156 5.322 12.046 -25.305 1.00 52.15 H new ATOM 0 HB2 LYS A 156 4.008 12.020 -23.242 1.00 30.54 H new ATOM 0 HB3 LYS A 156 4.643 10.433 -23.629 1.00 30.54 H new ATOM 0 HG2 LYS A 156 6.429 10.729 -21.935 1.00 23.54 H new ATOM 0 HG3 LYS A 156 5.809 12.323 -21.554 1.00 23.54 H new ATOM 0 HD2 LYS A 156 3.626 11.313 -20.889 1.00 43.20 H new ATOM 0 HD3 LYS A 156 4.251 9.720 -21.264 1.00 43.20 H new ATOM 0 HE2 LYS A 156 6.035 10.009 -19.561 1.00 71.22 H new ATOM 0 HE3 LYS A 156 5.436 11.615 -19.197 1.00 71.22 H new ATOM 0 HZ1 LYS A 156 4.648 10.005 -17.609 1.00 63.12 H new ATOM 0 HZ2 LYS A 156 3.342 10.644 -18.487 1.00 63.12 H new ATOM 0 HZ3 LYS A 156 3.922 9.087 -18.840 1.00 63.12 H new ATOM 2392 N PRO A 157 5.371 14.490 -24.426 1.00 0.20 N ATOM 2393 CA PRO A 157 5.607 15.918 -24.143 1.00 24.53 C ATOM 2394 C PRO A 157 5.773 16.196 -22.649 1.00 45.14 C ATOM 2395 O PRO A 157 5.005 15.683 -21.817 1.00 10.44 O ATOM 2396 CB PRO A 157 4.341 16.602 -24.671 1.00 12.20 C ATOM 2397 CG PRO A 157 3.816 15.673 -25.706 1.00 53.32 C ATOM 2398 CD PRO A 157 4.143 14.290 -25.224 1.00 71.53 C ATOM 0 HA PRO A 157 6.527 16.275 -24.605 1.00 24.53 H new ATOM 0 HB2 PRO A 157 3.614 16.759 -23.874 1.00 12.20 H new ATOM 0 HB3 PRO A 157 4.567 17.581 -25.095 1.00 12.20 H new ATOM 0 HG2 PRO A 157 2.741 15.798 -25.833 1.00 53.32 H new ATOM 0 HG3 PRO A 157 4.276 15.868 -26.675 1.00 53.32 H new ATOM 0 HD2 PRO A 157 3.336 13.872 -24.622 1.00 71.53 H new ATOM 0 HD3 PRO A 157 4.310 13.604 -26.054 1.00 71.53 H new ATOM 2406 N GLN A 158 6.767 16.993 -22.326 1.00 2.30 N ATOM 2407 CA GLN A 158 7.085 17.339 -20.963 1.00 75.41 C ATOM 2408 C GLN A 158 7.633 18.756 -20.905 1.00 31.13 C ATOM 2409 O GLN A 158 8.221 19.235 -21.881 1.00 75.24 O ATOM 2410 CB GLN A 158 8.114 16.346 -20.402 1.00 2.34 C ATOM 2411 CG GLN A 158 9.388 16.238 -21.236 1.00 33.21 C ATOM 2412 CD GLN A 158 10.386 15.251 -20.679 1.00 31.34 C ATOM 2413 OE1 GLN A 158 10.021 14.270 -20.035 1.00 22.20 O ATOM 2414 NE2 GLN A 158 11.646 15.485 -20.940 1.00 0.01 N ATOM 0 H GLN A 158 7.384 17.424 -23.014 1.00 2.30 H new ATOM 0 HA GLN A 158 6.180 17.288 -20.357 1.00 75.41 H new ATOM 0 HB2 GLN A 158 8.379 16.647 -19.388 1.00 2.34 H new ATOM 0 HB3 GLN A 158 7.653 15.361 -20.332 1.00 2.34 H new ATOM 0 HG2 GLN A 158 9.125 15.943 -22.252 1.00 33.21 H new ATOM 0 HG3 GLN A 158 9.856 17.220 -21.300 1.00 33.21 H new ATOM 0 HE21 GLN A 158 11.911 16.310 -21.478 1.00 0.01 H new ATOM 0 HE22 GLN A 158 12.364 14.842 -20.606 1.00 0.01 H new TER 2423 GLN A 158