USER MOD reduce.3.24.130724 H: found=0, std=0, add=1198, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1198 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 115 ASN : amide:sc= -1.6 K(o=-5.2,f=-6.4!) USER MOD Set 1.2: A 131 GLN : amide:sc= -3.61 K(o=-5.2,f=-6.4!) USER MOD Set 2.1: A 72 HIS : no HD1:sc= -5.78! C(o=-14!,f=-12!) USER MOD Set 2.2: A 73 ASN : amide:sc= -4.5 K(o=-14,f=-12) USER MOD Set 2.3: A 140 GLN : amide:sc= -4.12 K(o=-14,f=-12) USER MOD Set 3.1: A 24 HIS : no HE2:sc= -12.5! C(o=-32!,f=-33!) USER MOD Set 3.2: A 71 SER OG : rot 60:sc= -1.25 USER MOD Set 3.3: A 76 MET CE :methyl 171:sc= -7.59! (180deg=-5.17!) USER MOD Set 3.4: A 136 MET CE :methyl -106:sc= -10.3! (180deg=-10.7!) USER MOD Set 4.1: A 60 LYS NZ :NH3+ -146:sc= 0.915 (180deg=-0.213) USER MOD Set 4.2: A 128 SER OG : rot 180:sc= 0.993 USER MOD Set 5.1: A 47 HIS : no HE2:sc= -3.89 X(o=-5.1,f=-4.7!) USER MOD Set 5.2: A 78 ASN : amide:sc= -1.16 K(o=-5.1,f=-5.7) USER MOD Set 6.1: A 22 HIS : no HE2:sc= -4.15 K(o=-6.4,f=-8.3!) USER MOD Set 6.2: A 68 SER OG : rot 150:sc= -2.26 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 155:sc= -0.135 (180deg=-0.704) USER MOD Single : A 2 HIS : no HD1:sc= 0 X(o=0,f=-0.092) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=-0.055) USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 7 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 8 MET CE :methyl 177:sc= -0.712 (180deg=-0.735) USER MOD Single : A 9 SER OG : rot 58:sc= 0.00531 USER MOD Single : A 12 HIS : no HD1:sc= -0.492 X(o=-0.49,f=-0.69) USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot 180:sc= -0.881 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 43 MET CE :methyl 157:sc= -11.1! (180deg=-12.8!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 SER OG : rot -128:sc= 2.02 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 165:sc= -1.38! USER MOD Single : A 65 THR OG1 : rot -52:sc= 0.11 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot -59:sc= 0.441 USER MOD Single : A 96 TYR OH : rot -103:sc= -2.8 USER MOD Single : A 106 SER OG : rot 180:sc= -0.286 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 HIS : no HD1:sc= -2.69 K(o=-2.7,f=-4.2!) USER MOD Single : A 117 ASN : amide:sc= -0.0421 X(o=-0.042,f=0) USER MOD Single : A 119 ASN : amide:sc= -3.65 K(o=-3.6,f=-8.3!) USER MOD Single : A 121 SER OG : rot -48:sc= 0.357 USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 163:sc= 0 (180deg=-0.116) USER MOD Single : A 124 TYR OH : rot -53:sc= -3.15 USER MOD Single : A 126 TYR OH : rot 180:sc= -1.09 USER MOD Single : A 134 GLN : amide:sc= -0.495 X(o=-0.49,f=-0.5) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 144 THR OG1 : rot -124:sc= 1.13 USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 HIS : no HD1:sc= -0.444 X(o=-0.44,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -31.616 -4.323 -18.842 1.00 0.00 N ATOM 2 CA MET A 1 -32.285 -3.063 -18.427 1.00 0.00 C ATOM 3 C MET A 1 -31.301 -2.112 -17.751 1.00 0.00 C ATOM 4 O MET A 1 -30.558 -2.509 -16.853 1.00 0.00 O ATOM 5 CB MET A 1 -33.425 -3.411 -17.467 1.00 0.00 C ATOM 6 CG MET A 1 -32.956 -4.054 -16.172 1.00 0.00 C ATOM 7 SD MET A 1 -34.270 -4.953 -15.327 1.00 0.00 S ATOM 8 CE MET A 1 -33.971 -4.476 -13.628 1.00 0.00 C ATOM 0 H1 MET A 1 -32.319 -5.087 -18.897 1.00 0.00 H new ATOM 0 H2 MET A 1 -31.174 -4.191 -19.774 1.00 0.00 H new ATOM 0 H3 MET A 1 -30.886 -4.574 -18.145 1.00 0.00 H new ATOM 0 HA MET A 1 -32.676 -2.558 -19.310 1.00 0.00 H new ATOM 0 HB2 MET A 1 -33.980 -2.503 -17.232 1.00 0.00 H new ATOM 0 HB3 MET A 1 -34.117 -4.087 -17.969 1.00 0.00 H new ATOM 0 HG2 MET A 1 -32.134 -4.737 -16.387 1.00 0.00 H new ATOM 0 HG3 MET A 1 -32.564 -3.283 -15.509 1.00 0.00 H new ATOM 0 HE1 MET A 1 -34.706 -4.954 -12.981 1.00 0.00 H new ATOM 0 HE2 MET A 1 -32.970 -4.790 -13.333 1.00 0.00 H new ATOM 0 HE3 MET A 1 -34.054 -3.393 -13.534 1.00 0.00 H new ATOM 20 N HIS A 2 -31.302 -0.858 -18.189 1.00 0.00 N ATOM 21 CA HIS A 2 -30.409 0.148 -17.627 1.00 0.00 C ATOM 22 C HIS A 2 -31.079 1.518 -17.601 1.00 0.00 C ATOM 23 O HIS A 2 -31.598 1.986 -18.615 1.00 0.00 O ATOM 24 CB HIS A 2 -29.112 0.217 -18.435 1.00 0.00 C ATOM 25 CG HIS A 2 -27.990 0.893 -17.710 1.00 0.00 C ATOM 26 ND1 HIS A 2 -27.860 2.264 -17.633 1.00 0.00 N ATOM 27 CD2 HIS A 2 -26.940 0.379 -17.025 1.00 0.00 C ATOM 28 CE1 HIS A 2 -26.780 2.564 -16.934 1.00 0.00 C ATOM 29 NE2 HIS A 2 -26.206 1.438 -16.552 1.00 0.00 N ATOM 0 H HIS A 2 -31.911 -0.514 -18.931 1.00 0.00 H new ATOM 0 HA HIS A 2 -30.176 -0.141 -16.602 1.00 0.00 H new ATOM 0 HB2 HIS A 2 -28.805 -0.795 -18.700 1.00 0.00 H new ATOM 0 HB3 HIS A 2 -29.303 0.747 -19.368 1.00 0.00 H new ATOM 0 HD2 HIS A 2 -26.721 -0.668 -16.879 1.00 0.00 H new ATOM 0 HE1 HIS A 2 -26.427 3.560 -16.713 1.00 0.00 H new ATOM 0 HE2 HIS A 2 -25.354 1.367 -15.995 1.00 0.00 H new ATOM 38 N HIS A 3 -31.064 2.157 -16.436 1.00 0.00 N ATOM 39 CA HIS A 3 -31.671 3.474 -16.278 1.00 0.00 C ATOM 40 C HIS A 3 -30.630 4.503 -15.841 1.00 0.00 C ATOM 41 O HIS A 3 -29.708 4.187 -15.090 1.00 0.00 O ATOM 42 CB HIS A 3 -32.809 3.415 -15.257 1.00 0.00 C ATOM 43 CG HIS A 3 -34.169 3.409 -15.880 1.00 0.00 C ATOM 44 ND1 HIS A 3 -34.670 4.469 -16.606 1.00 0.00 N ATOM 45 CD2 HIS A 3 -35.139 2.462 -15.886 1.00 0.00 C ATOM 46 CE1 HIS A 3 -35.886 4.176 -17.030 1.00 0.00 C ATOM 47 NE2 HIS A 3 -36.194 2.963 -16.607 1.00 0.00 N ATOM 0 H HIS A 3 -30.638 1.784 -15.587 1.00 0.00 H new ATOM 0 HA HIS A 3 -32.075 3.780 -17.243 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -32.693 2.519 -14.647 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -32.729 4.270 -14.586 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -35.091 1.493 -15.411 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -36.521 4.819 -17.622 1.00 0.00 H new ATOM 0 HE2 HIS A 3 -37.073 2.478 -16.787 1.00 0.00 H new ATOM 56 N HIS A 4 -30.788 5.733 -16.318 1.00 0.00 N ATOM 57 CA HIS A 4 -29.864 6.810 -15.976 1.00 0.00 C ATOM 58 C HIS A 4 -30.621 8.065 -15.561 1.00 0.00 C ATOM 59 O HIS A 4 -31.851 8.105 -15.605 1.00 0.00 O ATOM 60 CB HIS A 4 -28.951 7.120 -17.164 1.00 0.00 C ATOM 61 CG HIS A 4 -29.694 7.450 -18.421 1.00 0.00 C ATOM 62 ND1 HIS A 4 -30.161 6.488 -19.293 1.00 0.00 N ATOM 63 CD2 HIS A 4 -30.052 8.642 -18.952 1.00 0.00 C ATOM 64 CE1 HIS A 4 -30.773 7.077 -20.307 1.00 0.00 C ATOM 65 NE2 HIS A 4 -30.721 8.383 -20.123 1.00 0.00 N ATOM 0 H HIS A 4 -31.546 6.010 -16.942 1.00 0.00 H new ATOM 0 HA HIS A 4 -29.256 6.481 -15.134 1.00 0.00 H new ATOM 0 HB2 HIS A 4 -28.303 7.957 -16.905 1.00 0.00 H new ATOM 0 HB3 HIS A 4 -28.305 6.262 -17.349 1.00 0.00 H new ATOM 0 HD2 HIS A 4 -29.849 9.616 -18.533 1.00 0.00 H new ATOM 0 HE1 HIS A 4 -31.236 6.575 -21.143 1.00 0.00 H new ATOM 0 HE2 HIS A 4 -31.114 9.086 -20.749 1.00 0.00 H new ATOM 74 N HIS A 5 -29.879 9.092 -15.157 1.00 0.00 N ATOM 75 CA HIS A 5 -30.481 10.350 -14.732 1.00 0.00 C ATOM 76 C HIS A 5 -31.389 10.140 -13.525 1.00 0.00 C ATOM 77 O HIS A 5 -32.442 9.509 -13.630 1.00 0.00 O ATOM 78 CB HIS A 5 -31.274 10.974 -15.883 1.00 0.00 C ATOM 79 CG HIS A 5 -31.005 12.435 -16.071 1.00 0.00 C ATOM 80 ND1 HIS A 5 -31.182 13.368 -15.071 1.00 0.00 N ATOM 81 CD2 HIS A 5 -30.569 13.124 -17.152 1.00 0.00 C ATOM 82 CE1 HIS A 5 -30.867 14.567 -15.527 1.00 0.00 C ATOM 83 NE2 HIS A 5 -30.491 14.446 -16.788 1.00 0.00 N ATOM 0 H HIS A 5 -28.860 9.077 -15.115 1.00 0.00 H new ATOM 0 HA HIS A 5 -29.679 11.029 -14.443 1.00 0.00 H new ATOM 0 HB2 HIS A 5 -31.034 10.447 -16.806 1.00 0.00 H new ATOM 0 HB3 HIS A 5 -32.339 10.829 -15.700 1.00 0.00 H new ATOM 0 HD2 HIS A 5 -30.328 12.711 -18.120 1.00 0.00 H new ATOM 0 HE1 HIS A 5 -30.909 15.488 -14.965 1.00 0.00 H new ATOM 0 HE2 HIS A 5 -30.191 15.211 -17.393 1.00 0.00 H new ATOM 92 N HIS A 6 -30.976 10.671 -12.379 1.00 0.00 N ATOM 93 CA HIS A 6 -31.753 10.542 -11.152 1.00 0.00 C ATOM 94 C HIS A 6 -31.915 9.075 -10.764 1.00 0.00 C ATOM 95 O HIS A 6 -31.678 8.178 -11.573 1.00 0.00 O ATOM 96 CB HIS A 6 -33.128 11.195 -11.322 1.00 0.00 C ATOM 97 CG HIS A 6 -33.273 12.486 -10.578 1.00 0.00 C ATOM 98 ND1 HIS A 6 -33.045 13.717 -11.156 1.00 0.00 N ATOM 99 CD2 HIS A 6 -33.626 12.734 -9.294 1.00 0.00 C ATOM 100 CE1 HIS A 6 -33.250 14.666 -10.260 1.00 0.00 C ATOM 101 NE2 HIS A 6 -33.605 14.097 -9.123 1.00 0.00 N ATOM 0 H HIS A 6 -30.107 11.195 -12.275 1.00 0.00 H new ATOM 0 HA HIS A 6 -31.214 11.053 -10.354 1.00 0.00 H new ATOM 0 HB2 HIS A 6 -33.308 11.374 -12.382 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -33.896 10.500 -10.981 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -33.877 11.998 -8.545 1.00 0.00 H new ATOM 0 HE1 HIS A 6 -33.145 15.727 -10.429 1.00 0.00 H new ATOM 0 HE2 HIS A 6 -33.828 14.589 -8.258 1.00 0.00 H new ATOM 110 N HIS A 7 -32.320 8.839 -9.520 1.00 0.00 N ATOM 111 CA HIS A 7 -32.515 7.482 -9.025 1.00 0.00 C ATOM 112 C HIS A 7 -31.210 6.692 -9.077 1.00 0.00 C ATOM 113 O HIS A 7 -30.302 7.025 -9.838 1.00 0.00 O ATOM 114 CB HIS A 7 -33.594 6.767 -9.840 1.00 0.00 C ATOM 115 CG HIS A 7 -34.684 6.176 -9.004 1.00 0.00 C ATOM 116 ND1 HIS A 7 -35.953 6.714 -8.930 1.00 0.00 N ATOM 117 CD2 HIS A 7 -34.693 5.086 -8.199 1.00 0.00 C ATOM 118 CE1 HIS A 7 -36.694 5.982 -8.117 1.00 0.00 C ATOM 119 NE2 HIS A 7 -35.953 4.988 -7.662 1.00 0.00 N ATOM 0 H HIS A 7 -32.519 9.570 -8.837 1.00 0.00 H new ATOM 0 HA HIS A 7 -32.840 7.544 -7.986 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -34.031 7.473 -10.546 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -33.129 5.976 -10.428 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -33.864 4.419 -8.014 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -37.729 6.165 -7.867 1.00 0.00 H new ATOM 0 HE2 HIS A 7 -36.266 4.264 -7.016 1.00 0.00 H new ATOM 128 N MET A 8 -31.125 5.645 -8.263 1.00 0.00 N ATOM 129 CA MET A 8 -29.931 4.808 -8.217 1.00 0.00 C ATOM 130 C MET A 8 -28.710 5.624 -7.806 1.00 0.00 C ATOM 131 O MET A 8 -27.590 5.339 -8.228 1.00 0.00 O ATOM 132 CB MET A 8 -29.687 4.155 -9.580 1.00 0.00 C ATOM 133 CG MET A 8 -30.359 2.800 -9.731 1.00 0.00 C ATOM 134 SD MET A 8 -30.035 2.041 -11.335 1.00 0.00 S ATOM 135 CE MET A 8 -31.054 3.056 -12.402 1.00 0.00 C ATOM 0 H MET A 8 -31.868 5.356 -7.627 1.00 0.00 H new ATOM 0 HA MET A 8 -30.093 4.029 -7.472 1.00 0.00 H new ATOM 0 HB2 MET A 8 -30.049 4.821 -10.363 1.00 0.00 H new ATOM 0 HB3 MET A 8 -28.614 4.039 -9.732 1.00 0.00 H new ATOM 0 HG2 MET A 8 -30.010 2.135 -8.941 1.00 0.00 H new ATOM 0 HG3 MET A 8 -31.435 2.915 -9.598 1.00 0.00 H new ATOM 0 HE1 MET A 8 -30.920 2.744 -13.438 1.00 0.00 H new ATOM 0 HE2 MET A 8 -32.101 2.942 -12.122 1.00 0.00 H new ATOM 0 HE3 MET A 8 -30.762 4.101 -12.297 1.00 0.00 H new ATOM 145 N SER A 9 -28.935 6.640 -6.980 1.00 0.00 N ATOM 146 CA SER A 9 -27.852 7.498 -6.510 1.00 0.00 C ATOM 147 C SER A 9 -27.752 7.466 -4.989 1.00 0.00 C ATOM 148 O SER A 9 -28.636 7.960 -4.287 1.00 0.00 O ATOM 149 CB SER A 9 -28.070 8.935 -6.988 1.00 0.00 C ATOM 150 OG SER A 9 -28.034 9.013 -8.403 1.00 0.00 O ATOM 0 H SER A 9 -29.857 6.890 -6.622 1.00 0.00 H new ATOM 0 HA SER A 9 -26.917 7.121 -6.925 1.00 0.00 H new ATOM 0 HB2 SER A 9 -29.030 9.301 -6.625 1.00 0.00 H new ATOM 0 HB3 SER A 9 -27.302 9.583 -6.565 1.00 0.00 H new ATOM 0 HG SER A 9 -28.723 8.427 -8.781 1.00 0.00 H new ATOM 156 N ASP A 10 -26.671 6.880 -4.485 1.00 0.00 N ATOM 157 CA ASP A 10 -26.456 6.782 -3.045 1.00 0.00 C ATOM 158 C ASP A 10 -25.003 6.432 -2.736 1.00 0.00 C ATOM 159 O ASP A 10 -24.469 5.446 -3.245 1.00 0.00 O ATOM 160 CB ASP A 10 -27.385 5.730 -2.440 1.00 0.00 C ATOM 161 CG ASP A 10 -27.231 4.373 -3.099 1.00 0.00 C ATOM 162 OD1 ASP A 10 -27.715 4.208 -4.238 1.00 0.00 O ATOM 163 OD2 ASP A 10 -26.625 3.476 -2.476 1.00 0.00 O ATOM 0 H ASP A 10 -25.931 6.466 -5.051 1.00 0.00 H new ATOM 0 HA ASP A 10 -26.681 7.752 -2.602 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -27.179 5.638 -1.374 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -28.418 6.063 -2.538 1.00 0.00 H new ATOM 168 N GLY A 11 -24.368 7.246 -1.899 1.00 0.00 N ATOM 169 CA GLY A 11 -22.984 7.006 -1.536 1.00 0.00 C ATOM 170 C GLY A 11 -22.018 7.861 -2.332 1.00 0.00 C ATOM 171 O GLY A 11 -22.383 8.432 -3.359 1.00 0.00 O ATOM 0 H GLY A 11 -24.788 8.068 -1.465 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -22.851 7.207 -0.473 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -22.748 5.954 -1.694 1.00 0.00 H new ATOM 175 N HIS A 12 -20.780 7.952 -1.856 1.00 0.00 N ATOM 176 CA HIS A 12 -19.757 8.744 -2.528 1.00 0.00 C ATOM 177 C HIS A 12 -18.782 7.848 -3.284 1.00 0.00 C ATOM 178 O HIS A 12 -18.983 6.637 -3.378 1.00 0.00 O ATOM 179 CB HIS A 12 -18.999 9.604 -1.514 1.00 0.00 C ATOM 180 CG HIS A 12 -18.642 10.962 -2.033 1.00 0.00 C ATOM 181 ND1 HIS A 12 -19.511 11.741 -2.769 1.00 0.00 N ATOM 182 CD2 HIS A 12 -17.500 11.682 -1.919 1.00 0.00 C ATOM 183 CE1 HIS A 12 -18.920 12.878 -3.085 1.00 0.00 C ATOM 184 NE2 HIS A 12 -17.700 12.868 -2.582 1.00 0.00 N ATOM 0 H HIS A 12 -20.461 7.486 -1.006 1.00 0.00 H new ATOM 0 HA HIS A 12 -20.253 9.396 -3.247 1.00 0.00 H new ATOM 0 HB2 HIS A 12 -19.607 9.715 -0.616 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -18.087 9.085 -1.219 1.00 0.00 H new ATOM 0 HD2 HIS A 12 -16.601 11.380 -1.403 1.00 0.00 H new ATOM 0 HE1 HIS A 12 -19.360 13.681 -3.658 1.00 0.00 H new ATOM 0 HE2 HIS A 12 -17.016 13.620 -2.671 1.00 0.00 H new ATOM 193 N ASN A 13 -17.725 8.450 -3.820 1.00 0.00 N ATOM 194 CA ASN A 13 -16.719 7.704 -4.568 1.00 0.00 C ATOM 195 C ASN A 13 -15.311 8.093 -4.130 1.00 0.00 C ATOM 196 O ASN A 13 -14.937 9.265 -4.176 1.00 0.00 O ATOM 197 CB ASN A 13 -16.885 7.949 -6.070 1.00 0.00 C ATOM 198 CG ASN A 13 -17.708 6.868 -6.743 1.00 0.00 C ATOM 199 OD1 ASN A 13 -18.935 6.949 -6.797 1.00 0.00 O ATOM 200 ND2 ASN A 13 -17.033 5.847 -7.260 1.00 0.00 N ATOM 0 H ASN A 13 -17.543 9.451 -3.750 1.00 0.00 H new ATOM 0 HA ASN A 13 -16.862 6.644 -4.361 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -17.362 8.916 -6.227 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -15.902 7.998 -6.538 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -17.532 5.089 -7.725 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -16.016 5.821 -7.192 1.00 0.00 H new ATOM 207 N GLY A 14 -14.535 7.101 -3.706 1.00 0.00 N ATOM 208 CA GLY A 14 -13.176 7.356 -3.267 1.00 0.00 C ATOM 209 C GLY A 14 -12.287 6.136 -3.407 1.00 0.00 C ATOM 210 O GLY A 14 -11.983 5.466 -2.420 1.00 0.00 O ATOM 0 H GLY A 14 -14.824 6.124 -3.659 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -12.757 8.177 -3.849 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -13.187 7.677 -2.225 1.00 0.00 H new ATOM 214 N LEU A 15 -11.877 5.844 -4.636 1.00 0.00 N ATOM 215 CA LEU A 15 -11.022 4.694 -4.905 1.00 0.00 C ATOM 216 C LEU A 15 -9.958 5.035 -5.944 1.00 0.00 C ATOM 217 O LEU A 15 -9.792 6.196 -6.318 1.00 0.00 O ATOM 218 CB LEU A 15 -11.867 3.512 -5.389 1.00 0.00 C ATOM 219 CG LEU A 15 -12.972 3.067 -4.430 1.00 0.00 C ATOM 220 CD1 LEU A 15 -14.166 2.528 -5.202 1.00 0.00 C ATOM 221 CD2 LEU A 15 -12.445 2.019 -3.461 1.00 0.00 C ATOM 0 H LEU A 15 -12.123 6.388 -5.463 1.00 0.00 H new ATOM 0 HA LEU A 15 -10.519 4.420 -3.978 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -12.321 3.777 -6.344 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -11.206 2.665 -5.575 1.00 0.00 H new ATOM 0 HG LEU A 15 -13.299 3.934 -3.856 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -14.941 2.217 -4.502 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -14.559 3.307 -5.855 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -13.855 1.673 -5.803 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -13.244 1.713 -2.786 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -12.091 1.153 -4.019 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -11.622 2.439 -2.883 1.00 0.00 H new ATOM 233 N GLY A 16 -9.241 4.014 -6.406 1.00 0.00 N ATOM 234 CA GLY A 16 -8.202 4.217 -7.400 1.00 0.00 C ATOM 235 C GLY A 16 -8.758 4.616 -8.753 1.00 0.00 C ATOM 236 O GLY A 16 -8.640 3.871 -9.725 1.00 0.00 O ATOM 0 H GLY A 16 -9.362 3.046 -6.108 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -7.517 4.989 -7.051 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -7.622 3.300 -7.506 1.00 0.00 H new ATOM 240 N LYS A 17 -9.359 5.799 -8.813 1.00 0.00 N ATOM 241 CA LYS A 17 -9.932 6.305 -10.054 1.00 0.00 C ATOM 242 C LYS A 17 -9.264 7.616 -10.456 1.00 0.00 C ATOM 243 O LYS A 17 -9.318 8.601 -9.720 1.00 0.00 O ATOM 244 CB LYS A 17 -11.439 6.511 -9.900 1.00 0.00 C ATOM 245 CG LYS A 17 -12.230 6.185 -11.158 1.00 0.00 C ATOM 246 CD LYS A 17 -12.114 7.293 -12.191 1.00 0.00 C ATOM 247 CE LYS A 17 -13.249 8.297 -12.058 1.00 0.00 C ATOM 248 NZ LYS A 17 -14.345 8.029 -13.028 1.00 0.00 N ATOM 0 H LYS A 17 -9.462 6.426 -8.015 1.00 0.00 H new ATOM 0 HA LYS A 17 -9.756 5.568 -10.838 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -11.801 5.888 -9.082 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -11.629 7.547 -9.620 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -11.868 5.249 -11.584 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -13.278 6.034 -10.901 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -11.158 7.804 -12.073 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -12.123 6.862 -13.192 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -13.646 8.263 -11.043 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -12.863 9.304 -12.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -15.098 8.735 -12.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -13.972 8.086 -13.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -14.731 7.078 -12.861 1.00 0.00 H new ATOM 262 N GLY A 18 -8.629 7.619 -11.623 1.00 0.00 N ATOM 263 CA GLY A 18 -7.954 8.815 -12.094 1.00 0.00 C ATOM 264 C GLY A 18 -6.516 8.554 -12.504 1.00 0.00 C ATOM 265 O GLY A 18 -5.817 9.471 -12.933 1.00 0.00 O ATOM 0 H GLY A 18 -8.569 6.817 -12.250 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -8.501 9.225 -12.943 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -7.972 9.570 -11.308 1.00 0.00 H new ATOM 269 N PHE A 19 -6.066 7.307 -12.371 1.00 0.00 N ATOM 270 CA PHE A 19 -4.699 6.956 -12.733 1.00 0.00 C ATOM 271 C PHE A 19 -4.580 5.491 -13.138 1.00 0.00 C ATOM 272 O PHE A 19 -3.962 5.169 -14.153 1.00 0.00 O ATOM 273 CB PHE A 19 -3.741 7.256 -11.571 1.00 0.00 C ATOM 274 CG PHE A 19 -4.397 7.232 -10.217 1.00 0.00 C ATOM 275 CD1 PHE A 19 -4.657 6.031 -9.576 1.00 0.00 C ATOM 276 CD2 PHE A 19 -4.757 8.413 -9.587 1.00 0.00 C ATOM 277 CE1 PHE A 19 -5.261 6.008 -8.334 1.00 0.00 C ATOM 278 CE2 PHE A 19 -5.361 8.396 -8.345 1.00 0.00 C ATOM 279 CZ PHE A 19 -5.615 7.192 -7.718 1.00 0.00 C ATOM 0 H PHE A 19 -6.625 6.530 -12.018 1.00 0.00 H new ATOM 0 HA PHE A 19 -4.424 7.566 -13.593 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -2.931 6.527 -11.584 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -3.291 8.236 -11.728 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -4.384 5.102 -10.054 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -4.563 9.358 -10.073 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -5.456 5.065 -7.845 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -5.634 9.324 -7.864 1.00 0.00 H new ATOM 0 HZ PHE A 19 -6.089 7.177 -6.748 1.00 0.00 H new ATOM 289 N GLY A 20 -5.168 4.605 -12.342 1.00 0.00 N ATOM 290 CA GLY A 20 -5.102 3.189 -12.646 1.00 0.00 C ATOM 291 C GLY A 20 -6.474 2.589 -12.905 1.00 0.00 C ATOM 292 O GLY A 20 -7.097 2.865 -13.930 1.00 0.00 O ATOM 0 H GLY A 20 -5.687 4.841 -11.496 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -4.470 3.037 -13.521 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -4.629 2.663 -11.816 1.00 0.00 H new ATOM 296 N ASP A 21 -6.944 1.766 -11.969 1.00 0.00 N ATOM 297 CA ASP A 21 -8.251 1.123 -12.090 1.00 0.00 C ATOM 298 C ASP A 21 -8.507 0.191 -10.903 1.00 0.00 C ATOM 299 O ASP A 21 -9.119 0.590 -9.911 1.00 0.00 O ATOM 300 CB ASP A 21 -8.346 0.346 -13.407 1.00 0.00 C ATOM 301 CG ASP A 21 -9.174 1.074 -14.448 1.00 0.00 C ATOM 302 OD1 ASP A 21 -10.340 1.408 -14.153 1.00 0.00 O ATOM 303 OD2 ASP A 21 -8.655 1.309 -15.560 1.00 0.00 O ATOM 0 H ASP A 21 -6.437 1.528 -11.116 1.00 0.00 H new ATOM 0 HA ASP A 21 -9.015 1.900 -12.088 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -7.343 0.175 -13.798 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -8.785 -0.633 -13.217 1.00 0.00 H new ATOM 308 N HIS A 22 -8.024 -1.045 -11.004 1.00 0.00 N ATOM 309 CA HIS A 22 -8.185 -2.026 -9.937 1.00 0.00 C ATOM 310 C HIS A 22 -6.826 -2.589 -9.540 1.00 0.00 C ATOM 311 O HIS A 22 -6.413 -3.644 -10.023 1.00 0.00 O ATOM 312 CB HIS A 22 -9.117 -3.158 -10.379 1.00 0.00 C ATOM 313 CG HIS A 22 -8.781 -3.720 -11.724 1.00 0.00 C ATOM 314 ND1 HIS A 22 -9.204 -3.150 -12.906 1.00 0.00 N ATOM 315 CD2 HIS A 22 -8.059 -4.811 -12.074 1.00 0.00 C ATOM 316 CE1 HIS A 22 -8.758 -3.864 -13.923 1.00 0.00 C ATOM 317 NE2 HIS A 22 -8.061 -4.879 -13.446 1.00 0.00 N ATOM 0 H HIS A 22 -7.516 -1.391 -11.818 1.00 0.00 H new ATOM 0 HA HIS A 22 -8.632 -1.531 -9.075 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -9.078 -3.958 -9.640 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -10.142 -2.788 -10.395 1.00 0.00 H new ATOM 0 HD1 HIS A 22 -9.773 -2.307 -12.983 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -7.572 -5.500 -11.400 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -8.933 -3.654 -14.968 1.00 0.00 H new ATOM 326 N ILE A 23 -6.126 -1.859 -8.681 1.00 0.00 N ATOM 327 CA ILE A 23 -4.799 -2.257 -8.237 1.00 0.00 C ATOM 328 C ILE A 23 -4.592 -1.974 -6.743 1.00 0.00 C ATOM 329 O ILE A 23 -4.929 -2.806 -5.886 1.00 0.00 O ATOM 330 CB ILE A 23 -3.725 -1.510 -9.053 1.00 0.00 C ATOM 331 CG1 ILE A 23 -3.769 -1.926 -10.523 1.00 0.00 C ATOM 332 CG2 ILE A 23 -2.347 -1.732 -8.463 1.00 0.00 C ATOM 333 CD1 ILE A 23 -4.068 -0.771 -11.453 1.00 0.00 C ATOM 0 H ILE A 23 -6.459 -0.984 -8.277 1.00 0.00 H new ATOM 0 HA ILE A 23 -4.707 -3.331 -8.396 1.00 0.00 H new ATOM 0 HB ILE A 23 -3.942 -0.443 -9.002 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -2.812 -2.369 -10.799 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -4.528 -2.698 -10.654 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -1.607 -1.195 -9.056 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -2.327 -1.364 -7.437 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -2.115 -2.797 -8.471 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -4.086 -1.128 -12.483 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -5.038 -0.342 -11.200 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -3.296 -0.009 -11.347 1.00 0.00 H new ATOM 345 N HIS A 24 -4.035 -0.796 -6.430 1.00 0.00 N ATOM 346 CA HIS A 24 -3.787 -0.417 -5.049 1.00 0.00 C ATOM 347 C HIS A 24 -5.051 0.134 -4.412 1.00 0.00 C ATOM 348 O HIS A 24 -5.015 1.113 -3.671 1.00 0.00 O ATOM 349 CB HIS A 24 -2.652 0.608 -4.943 1.00 0.00 C ATOM 350 CG HIS A 24 -1.495 0.361 -5.869 1.00 0.00 C ATOM 351 ND1 HIS A 24 -1.264 1.116 -6.999 1.00 0.00 N ATOM 352 CD2 HIS A 24 -0.478 -0.532 -5.805 1.00 0.00 C ATOM 353 CE1 HIS A 24 -0.155 0.700 -7.586 1.00 0.00 C ATOM 354 NE2 HIS A 24 0.339 -0.299 -6.882 1.00 0.00 N ATOM 0 H HIS A 24 -3.752 -0.098 -7.117 1.00 0.00 H new ATOM 0 HA HIS A 24 -3.481 -1.315 -4.511 1.00 0.00 H new ATOM 0 HB2 HIS A 24 -3.056 1.600 -5.145 1.00 0.00 H new ATOM 0 HB3 HIS A 24 -2.283 0.617 -3.917 1.00 0.00 H new ATOM 0 HD1 HIS A 24 -1.857 1.877 -7.331 1.00 0.00 H new ATOM 0 HD2 HIS A 24 -0.337 -1.288 -5.046 1.00 0.00 H new ATOM 0 HE1 HIS A 24 0.274 1.109 -8.489 1.00 0.00 H new ATOM 363 N TRP A 25 -6.166 -0.501 -4.727 1.00 0.00 N ATOM 364 CA TRP A 25 -7.462 -0.086 -4.220 1.00 0.00 C ATOM 365 C TRP A 25 -8.501 -1.156 -4.494 1.00 0.00 C ATOM 366 O TRP A 25 -9.698 -0.876 -4.567 1.00 0.00 O ATOM 367 CB TRP A 25 -7.865 1.209 -4.903 1.00 0.00 C ATOM 368 CG TRP A 25 -7.178 1.392 -6.223 1.00 0.00 C ATOM 369 CD1 TRP A 25 -7.580 0.880 -7.415 1.00 0.00 C ATOM 370 CD2 TRP A 25 -5.960 2.114 -6.486 1.00 0.00 C ATOM 371 NE1 TRP A 25 -6.697 1.235 -8.401 1.00 0.00 N ATOM 372 CE2 TRP A 25 -5.701 1.993 -7.860 1.00 0.00 C ATOM 373 CE3 TRP A 25 -5.071 2.851 -5.704 1.00 0.00 C ATOM 374 CZ2 TRP A 25 -4.594 2.579 -8.470 1.00 0.00 C ATOM 375 CZ3 TRP A 25 -3.975 3.430 -6.306 1.00 0.00 C ATOM 376 CH2 TRP A 25 -3.743 3.293 -7.678 1.00 0.00 C ATOM 0 H TRP A 25 -6.199 -1.316 -5.339 1.00 0.00 H new ATOM 0 HA TRP A 25 -7.398 0.066 -3.143 1.00 0.00 H new ATOM 0 HB2 TRP A 25 -8.945 1.218 -5.053 1.00 0.00 H new ATOM 0 HB3 TRP A 25 -7.627 2.050 -4.252 1.00 0.00 H new ATOM 0 HD1 TRP A 25 -8.466 0.281 -7.564 1.00 0.00 H new ATOM 0 HE1 TRP A 25 -6.773 0.974 -9.384 1.00 0.00 H new ATOM 0 HE3 TRP A 25 -5.239 2.966 -4.643 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 -4.416 2.472 -9.530 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 -3.282 4.001 -5.706 1.00 0.00 H new ATOM 0 HH2 TRP A 25 -2.875 3.761 -8.119 1.00 0.00 H new ATOM 387 N ARG A 26 -8.030 -2.383 -4.659 1.00 0.00 N ATOM 388 CA ARG A 26 -8.908 -3.501 -4.943 1.00 0.00 C ATOM 389 C ARG A 26 -10.005 -3.606 -3.894 1.00 0.00 C ATOM 390 O ARG A 26 -11.175 -3.796 -4.223 1.00 0.00 O ATOM 391 CB ARG A 26 -8.112 -4.807 -5.004 1.00 0.00 C ATOM 392 CG ARG A 26 -8.195 -5.505 -6.352 1.00 0.00 C ATOM 393 CD ARG A 26 -7.913 -6.995 -6.228 1.00 0.00 C ATOM 394 NE ARG A 26 -9.074 -7.802 -6.596 1.00 0.00 N ATOM 395 CZ ARG A 26 -9.433 -8.056 -7.852 1.00 0.00 C ATOM 396 NH1 ARG A 26 -8.725 -7.570 -8.864 1.00 0.00 N ATOM 397 NH2 ARG A 26 -10.503 -8.799 -8.098 1.00 0.00 N ATOM 0 H ARG A 26 -7.041 -2.627 -4.600 1.00 0.00 H new ATOM 0 HA ARG A 26 -9.373 -3.328 -5.914 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -7.067 -4.597 -4.776 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -8.478 -5.483 -4.231 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -9.187 -5.356 -6.779 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -7.480 -5.055 -7.041 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -7.070 -7.259 -6.867 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -7.621 -7.225 -5.203 1.00 0.00 H new ATOM 0 HE ARG A 26 -9.643 -8.194 -5.846 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -7.900 -6.998 -8.681 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -9.006 -7.768 -9.824 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -11.051 -9.176 -7.325 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -10.778 -8.994 -9.061 1.00 0.00 H new ATOM 411 N THR A 27 -9.622 -3.472 -2.625 1.00 0.00 N ATOM 412 CA THR A 27 -10.593 -3.549 -1.531 1.00 0.00 C ATOM 413 C THR A 27 -9.913 -3.495 -0.165 1.00 0.00 C ATOM 414 O THR A 27 -8.867 -4.109 0.047 1.00 0.00 O ATOM 415 CB THR A 27 -11.424 -4.831 -1.639 1.00 0.00 C ATOM 416 OG1 THR A 27 -10.783 -5.782 -2.469 1.00 0.00 O ATOM 417 CG2 THR A 27 -12.813 -4.597 -2.195 1.00 0.00 C ATOM 0 H THR A 27 -8.659 -3.312 -2.330 1.00 0.00 H new ATOM 0 HA THR A 27 -11.248 -2.682 -1.620 1.00 0.00 H new ATOM 0 HB THR A 27 -11.514 -5.201 -0.618 1.00 0.00 H new ATOM 0 HG1 THR A 27 -11.331 -6.592 -2.522 1.00 0.00 H new ATOM 0 HG21 THR A 27 -13.349 -5.545 -2.246 1.00 0.00 H new ATOM 0 HG22 THR A 27 -13.354 -3.909 -1.546 1.00 0.00 H new ATOM 0 HG23 THR A 27 -12.737 -4.169 -3.195 1.00 0.00 H new ATOM 425 N LEU A 28 -10.530 -2.768 0.761 1.00 0.00 N ATOM 426 CA LEU A 28 -10.005 -2.637 2.114 1.00 0.00 C ATOM 427 C LEU A 28 -10.645 -3.665 3.040 1.00 0.00 C ATOM 428 O LEU A 28 -9.952 -4.397 3.746 1.00 0.00 O ATOM 429 CB LEU A 28 -10.258 -1.225 2.647 1.00 0.00 C ATOM 430 CG LEU A 28 -9.200 -0.699 3.620 1.00 0.00 C ATOM 431 CD1 LEU A 28 -9.229 0.820 3.669 1.00 0.00 C ATOM 432 CD2 LEU A 28 -9.415 -1.282 5.008 1.00 0.00 C ATOM 0 H LEU A 28 -11.398 -2.259 0.597 1.00 0.00 H new ATOM 0 HA LEU A 28 -8.930 -2.817 2.083 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -10.324 -0.541 1.801 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -11.227 -1.210 3.145 1.00 0.00 H new ATOM 0 HG LEU A 28 -8.219 -1.013 3.264 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -8.470 1.176 4.366 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -9.026 1.220 2.676 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -10.212 1.155 4.001 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -8.654 -0.897 5.686 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -10.402 -0.999 5.373 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -9.343 -2.369 4.961 1.00 0.00 H new ATOM 444 N GLU A 29 -11.973 -3.718 3.028 1.00 0.00 N ATOM 445 CA GLU A 29 -12.707 -4.661 3.862 1.00 0.00 C ATOM 446 C GLU A 29 -12.624 -6.069 3.280 1.00 0.00 C ATOM 447 O GLU A 29 -12.659 -7.057 4.013 1.00 0.00 O ATOM 448 CB GLU A 29 -14.170 -4.230 3.991 1.00 0.00 C ATOM 449 CG GLU A 29 -14.632 -4.076 5.432 1.00 0.00 C ATOM 450 CD GLU A 29 -15.770 -3.085 5.576 1.00 0.00 C ATOM 451 OE1 GLU A 29 -16.921 -3.452 5.264 1.00 0.00 O ATOM 452 OE2 GLU A 29 -15.508 -1.939 6.003 1.00 0.00 O ATOM 0 H GLU A 29 -12.562 -3.119 2.450 1.00 0.00 H new ATOM 0 HA GLU A 29 -12.254 -4.668 4.853 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -14.309 -3.283 3.470 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -14.802 -4.964 3.491 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -14.950 -5.046 5.814 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -13.792 -3.751 6.046 1.00 0.00 H new ATOM 459 N ASP A 30 -12.512 -6.152 1.957 1.00 0.00 N ATOM 460 CA ASP A 30 -12.421 -7.438 1.275 1.00 0.00 C ATOM 461 C ASP A 30 -10.963 -7.844 1.076 1.00 0.00 C ATOM 462 O ASP A 30 -10.629 -9.027 1.125 1.00 0.00 O ATOM 463 CB ASP A 30 -13.136 -7.379 -0.075 1.00 0.00 C ATOM 464 CG ASP A 30 -14.597 -7.772 0.027 1.00 0.00 C ATOM 465 OD1 ASP A 30 -15.371 -7.018 0.654 1.00 0.00 O ATOM 466 OD2 ASP A 30 -14.966 -8.833 -0.518 1.00 0.00 O ATOM 0 H ASP A 30 -12.482 -5.343 1.336 1.00 0.00 H new ATOM 0 HA ASP A 30 -12.908 -8.187 1.900 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -13.062 -6.369 -0.479 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -12.633 -8.042 -0.779 1.00 0.00 H new ATOM 471 N GLY A 31 -10.101 -6.857 0.853 1.00 0.00 N ATOM 472 CA GLY A 31 -8.692 -7.138 0.652 1.00 0.00 C ATOM 473 C GLY A 31 -8.017 -7.632 1.916 1.00 0.00 C ATOM 474 O GLY A 31 -7.047 -8.387 1.855 1.00 0.00 O ATOM 0 H GLY A 31 -10.353 -5.870 0.808 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -8.582 -7.887 -0.132 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -8.190 -6.235 0.304 1.00 0.00 H new ATOM 478 N LYS A 32 -8.532 -7.205 3.065 1.00 0.00 N ATOM 479 CA LYS A 32 -7.972 -7.609 4.350 1.00 0.00 C ATOM 480 C LYS A 32 -8.656 -8.869 4.869 1.00 0.00 C ATOM 481 O LYS A 32 -8.001 -9.780 5.372 1.00 0.00 O ATOM 482 CB LYS A 32 -8.118 -6.477 5.369 1.00 0.00 C ATOM 483 CG LYS A 32 -7.406 -6.748 6.684 1.00 0.00 C ATOM 484 CD LYS A 32 -8.326 -7.429 7.687 1.00 0.00 C ATOM 485 CE LYS A 32 -8.354 -6.687 9.016 1.00 0.00 C ATOM 486 NZ LYS A 32 -8.201 -7.614 10.172 1.00 0.00 N ATOM 0 H LYS A 32 -9.335 -6.580 3.132 1.00 0.00 H new ATOM 0 HA LYS A 32 -6.913 -7.826 4.207 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -7.726 -5.557 4.936 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -9.177 -6.311 5.566 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -6.534 -7.376 6.504 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -7.042 -5.809 7.102 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -9.335 -7.482 7.278 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -7.993 -8.454 7.849 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -7.554 -5.947 9.036 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -9.294 -6.143 9.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -8.225 -7.071 11.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -8.978 -8.305 10.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -7.292 -8.115 10.098 1.00 0.00 H new ATOM 500 N LYS A 33 -9.978 -8.915 4.742 1.00 0.00 N ATOM 501 CA LYS A 33 -10.750 -10.065 5.196 1.00 0.00 C ATOM 502 C LYS A 33 -10.429 -11.299 4.361 1.00 0.00 C ATOM 503 O LYS A 33 -10.376 -12.415 4.879 1.00 0.00 O ATOM 504 CB LYS A 33 -12.249 -9.760 5.127 1.00 0.00 C ATOM 505 CG LYS A 33 -13.120 -10.845 5.737 1.00 0.00 C ATOM 506 CD LYS A 33 -14.485 -10.900 5.072 1.00 0.00 C ATOM 507 CE LYS A 33 -15.192 -12.216 5.358 1.00 0.00 C ATOM 508 NZ LYS A 33 -16.662 -12.113 5.151 1.00 0.00 N ATOM 0 H LYS A 33 -10.537 -8.169 4.328 1.00 0.00 H new ATOM 0 HA LYS A 33 -10.477 -10.269 6.231 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -12.444 -8.818 5.640 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -12.535 -9.620 4.085 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -12.625 -11.811 5.635 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -13.241 -10.659 6.804 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -15.098 -10.072 5.428 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -14.372 -10.773 3.995 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -14.788 -12.994 4.710 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -14.991 -12.521 6.385 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -17.107 -13.030 5.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -17.052 -11.389 5.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -16.856 -11.847 4.164 1.00 0.00 H new ATOM 522 N GLU A 34 -10.217 -11.091 3.065 1.00 0.00 N ATOM 523 CA GLU A 34 -9.901 -12.185 2.157 1.00 0.00 C ATOM 524 C GLU A 34 -8.428 -12.569 2.259 1.00 0.00 C ATOM 525 O GLU A 34 -8.077 -13.747 2.206 1.00 0.00 O ATOM 526 CB GLU A 34 -10.238 -11.794 0.717 1.00 0.00 C ATOM 527 CG GLU A 34 -9.930 -12.885 -0.294 1.00 0.00 C ATOM 528 CD GLU A 34 -10.935 -12.929 -1.428 1.00 0.00 C ATOM 529 OE1 GLU A 34 -10.786 -12.140 -2.384 1.00 0.00 O ATOM 530 OE2 GLU A 34 -11.870 -13.754 -1.360 1.00 0.00 O ATOM 0 H GLU A 34 -10.259 -10.174 2.621 1.00 0.00 H new ATOM 0 HA GLU A 34 -10.504 -13.047 2.444 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -11.296 -11.541 0.656 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -9.680 -10.896 0.452 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -8.933 -12.725 -0.703 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -9.916 -13.850 0.212 1.00 0.00 H new ATOM 537 N ALA A 35 -7.572 -11.565 2.405 1.00 0.00 N ATOM 538 CA ALA A 35 -6.135 -11.794 2.514 1.00 0.00 C ATOM 539 C ALA A 35 -5.811 -12.715 3.684 1.00 0.00 C ATOM 540 O ALA A 35 -4.825 -13.449 3.654 1.00 0.00 O ATOM 541 CB ALA A 35 -5.405 -10.471 2.668 1.00 0.00 C ATOM 0 H ALA A 35 -7.847 -10.584 2.451 1.00 0.00 H new ATOM 0 HA ALA A 35 -5.799 -12.282 1.599 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -4.333 -10.654 2.748 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -5.602 -9.844 1.799 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -5.755 -9.965 3.568 1.00 0.00 H new ATOM 547 N ALA A 36 -6.646 -12.667 4.718 1.00 0.00 N ATOM 548 CA ALA A 36 -6.448 -13.494 5.902 1.00 0.00 C ATOM 549 C ALA A 36 -6.526 -14.978 5.561 1.00 0.00 C ATOM 550 O ALA A 36 -5.679 -15.767 5.982 1.00 0.00 O ATOM 551 CB ALA A 36 -7.475 -13.140 6.966 1.00 0.00 C ATOM 0 H ALA A 36 -7.467 -12.063 4.759 1.00 0.00 H new ATOM 0 HA ALA A 36 -5.450 -13.294 6.291 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -7.317 -13.764 7.846 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -7.367 -12.091 7.241 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -8.478 -13.311 6.575 1.00 0.00 H new ATOM 557 N ALA A 37 -7.551 -15.355 4.804 1.00 0.00 N ATOM 558 CA ALA A 37 -7.740 -16.747 4.415 1.00 0.00 C ATOM 559 C ALA A 37 -6.792 -17.144 3.288 1.00 0.00 C ATOM 560 O ALA A 37 -5.956 -18.032 3.449 1.00 0.00 O ATOM 561 CB ALA A 37 -9.184 -16.984 3.996 1.00 0.00 C ATOM 0 H ALA A 37 -8.263 -14.717 4.448 1.00 0.00 H new ATOM 0 HA ALA A 37 -7.512 -17.370 5.279 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -9.313 -18.027 3.708 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -9.847 -16.753 4.830 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -9.428 -16.341 3.150 1.00 0.00 H new ATOM 567 N SER A 38 -6.930 -16.481 2.143 1.00 0.00 N ATOM 568 CA SER A 38 -6.088 -16.767 0.986 1.00 0.00 C ATOM 569 C SER A 38 -4.622 -16.470 1.282 1.00 0.00 C ATOM 570 O SER A 38 -3.727 -17.066 0.682 1.00 0.00 O ATOM 571 CB SER A 38 -6.552 -15.949 -0.220 1.00 0.00 C ATOM 572 OG SER A 38 -7.763 -16.461 -0.748 1.00 0.00 O ATOM 0 H SER A 38 -7.617 -15.742 1.992 1.00 0.00 H new ATOM 0 HA SER A 38 -6.181 -17.829 0.758 1.00 0.00 H new ATOM 0 HB2 SER A 38 -6.691 -14.909 0.074 1.00 0.00 H new ATOM 0 HB3 SER A 38 -5.781 -15.962 -0.991 1.00 0.00 H new ATOM 0 HG SER A 38 -8.039 -15.920 -1.517 1.00 0.00 H new ATOM 578 N GLY A 39 -4.379 -15.545 2.205 1.00 0.00 N ATOM 579 CA GLY A 39 -3.018 -15.188 2.554 1.00 0.00 C ATOM 580 C GLY A 39 -2.404 -14.223 1.558 1.00 0.00 C ATOM 581 O GLY A 39 -1.199 -14.253 1.313 1.00 0.00 O ATOM 0 H GLY A 39 -5.100 -15.037 2.717 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -3.006 -14.739 3.547 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -2.409 -16.091 2.605 1.00 0.00 H new ATOM 585 N LEU A 40 -3.241 -13.365 0.983 1.00 0.00 N ATOM 586 CA LEU A 40 -2.781 -12.383 0.007 1.00 0.00 C ATOM 587 C LEU A 40 -2.246 -11.133 0.710 1.00 0.00 C ATOM 588 O LEU A 40 -2.905 -10.583 1.592 1.00 0.00 O ATOM 589 CB LEU A 40 -3.928 -12.009 -0.942 1.00 0.00 C ATOM 590 CG LEU A 40 -3.841 -12.618 -2.345 1.00 0.00 C ATOM 591 CD1 LEU A 40 -5.205 -12.625 -3.017 1.00 0.00 C ATOM 592 CD2 LEU A 40 -2.841 -11.856 -3.191 1.00 0.00 C ATOM 0 H LEU A 40 -4.242 -13.330 1.176 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.970 -12.823 -0.573 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -4.869 -12.318 -0.487 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -3.961 -10.924 -1.036 1.00 0.00 H new ATOM 0 HG LEU A 40 -3.503 -13.650 -2.248 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -5.118 -13.062 -4.012 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -5.901 -13.215 -2.421 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -5.575 -11.603 -3.101 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -2.791 -12.301 -4.185 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -3.154 -10.815 -3.275 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -1.858 -11.903 -2.723 1.00 0.00 H new ATOM 604 N PRO A 41 -1.043 -10.661 0.331 1.00 0.00 N ATOM 605 CA PRO A 41 -0.433 -9.468 0.936 1.00 0.00 C ATOM 606 C PRO A 41 -1.300 -8.226 0.758 1.00 0.00 C ATOM 607 O PRO A 41 -2.235 -8.220 -0.046 1.00 0.00 O ATOM 608 CB PRO A 41 0.889 -9.314 0.176 1.00 0.00 C ATOM 609 CG PRO A 41 0.684 -10.071 -1.085 1.00 0.00 C ATOM 610 CD PRO A 41 -0.180 -11.237 -0.710 1.00 0.00 C ATOM 0 HA PRO A 41 -0.306 -9.577 2.013 1.00 0.00 H new ATOM 0 HB2 PRO A 41 1.113 -8.266 -0.022 1.00 0.00 H new ATOM 0 HB3 PRO A 41 1.725 -9.716 0.749 1.00 0.00 H new ATOM 0 HG2 PRO A 41 0.202 -9.452 -1.842 1.00 0.00 H new ATOM 0 HG3 PRO A 41 1.634 -10.404 -1.503 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -0.756 -11.606 -1.558 1.00 0.00 H new ATOM 0 HD3 PRO A 41 0.407 -12.075 -0.334 1.00 0.00 H new ATOM 618 N LEU A 42 -0.995 -7.179 1.523 1.00 0.00 N ATOM 619 CA LEU A 42 -1.762 -5.942 1.455 1.00 0.00 C ATOM 620 C LEU A 42 -0.867 -4.721 1.260 1.00 0.00 C ATOM 621 O LEU A 42 -0.047 -4.396 2.115 1.00 0.00 O ATOM 622 CB LEU A 42 -2.587 -5.773 2.730 1.00 0.00 C ATOM 623 CG LEU A 42 -4.061 -6.154 2.600 1.00 0.00 C ATOM 624 CD1 LEU A 42 -4.216 -7.662 2.494 1.00 0.00 C ATOM 625 CD2 LEU A 42 -4.851 -5.613 3.781 1.00 0.00 C ATOM 0 H LEU A 42 -0.226 -7.165 2.193 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.420 -6.013 0.589 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -2.139 -6.378 3.518 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -2.523 -4.733 3.051 1.00 0.00 H new ATOM 0 HG LEU A 42 -4.456 -5.708 1.687 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -5.273 -7.914 2.402 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -3.680 -8.022 1.616 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -3.807 -8.133 3.388 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -5.900 -5.892 3.676 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -4.455 -6.032 4.706 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -4.765 -4.527 3.809 1.00 0.00 H new ATOM 637 N MET A 43 -1.051 -4.042 0.135 1.00 0.00 N ATOM 638 CA MET A 43 -0.286 -2.837 -0.182 1.00 0.00 C ATOM 639 C MET A 43 -1.206 -1.612 -0.099 1.00 0.00 C ATOM 640 O MET A 43 -2.420 -1.738 -0.247 1.00 0.00 O ATOM 641 CB MET A 43 0.339 -2.985 -1.580 1.00 0.00 C ATOM 642 CG MET A 43 0.640 -1.676 -2.307 1.00 0.00 C ATOM 643 SD MET A 43 2.397 -1.447 -2.636 1.00 0.00 S ATOM 644 CE MET A 43 3.027 -1.368 -0.964 1.00 0.00 C ATOM 0 H MET A 43 -1.729 -4.306 -0.580 1.00 0.00 H new ATOM 0 HA MET A 43 0.522 -2.700 0.537 1.00 0.00 H new ATOM 0 HB2 MET A 43 1.266 -3.550 -1.486 1.00 0.00 H new ATOM 0 HB3 MET A 43 -0.334 -3.578 -2.199 1.00 0.00 H new ATOM 0 HG2 MET A 43 0.093 -1.655 -3.250 1.00 0.00 H new ATOM 0 HG3 MET A 43 0.275 -0.841 -1.708 1.00 0.00 H new ATOM 0 HE1 MET A 43 4.084 -1.635 -0.960 1.00 0.00 H new ATOM 0 HE2 MET A 43 2.908 -0.356 -0.578 1.00 0.00 H new ATOM 0 HE3 MET A 43 2.474 -2.065 -0.334 1.00 0.00 H new ATOM 654 N VAL A 44 -0.635 -0.431 0.150 1.00 0.00 N ATOM 655 CA VAL A 44 -1.434 0.791 0.255 1.00 0.00 C ATOM 656 C VAL A 44 -0.833 1.942 -0.546 1.00 0.00 C ATOM 657 O VAL A 44 0.366 1.971 -0.816 1.00 0.00 O ATOM 658 CB VAL A 44 -1.590 1.240 1.724 1.00 0.00 C ATOM 659 CG1 VAL A 44 -2.329 2.569 1.821 1.00 0.00 C ATOM 660 CG2 VAL A 44 -2.313 0.176 2.524 1.00 0.00 C ATOM 0 H VAL A 44 0.367 -0.296 0.281 1.00 0.00 H new ATOM 0 HA VAL A 44 -2.412 0.546 -0.159 1.00 0.00 H new ATOM 0 HB VAL A 44 -0.593 1.380 2.141 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -2.423 2.858 2.868 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -1.772 3.335 1.282 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -3.322 2.466 1.383 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -2.416 0.505 3.558 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -3.301 0.008 2.096 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -1.742 -0.752 2.494 1.00 0.00 H new ATOM 670 N ILE A 45 -1.687 2.897 -0.900 1.00 0.00 N ATOM 671 CA ILE A 45 -1.274 4.075 -1.650 1.00 0.00 C ATOM 672 C ILE A 45 -2.214 5.239 -1.359 1.00 0.00 C ATOM 673 O ILE A 45 -3.310 5.312 -1.909 1.00 0.00 O ATOM 674 CB ILE A 45 -1.252 3.811 -3.172 1.00 0.00 C ATOM 675 CG1 ILE A 45 -0.267 2.683 -3.497 1.00 0.00 C ATOM 676 CG2 ILE A 45 -0.896 5.089 -3.934 1.00 0.00 C ATOM 677 CD1 ILE A 45 0.132 2.618 -4.958 1.00 0.00 C ATOM 0 H ILE A 45 -2.682 2.875 -0.675 1.00 0.00 H new ATOM 0 HA ILE A 45 -0.261 4.322 -1.331 1.00 0.00 H new ATOM 0 HB ILE A 45 -2.247 3.499 -3.490 1.00 0.00 H new ATOM 0 HG12 ILE A 45 0.630 2.811 -2.891 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -0.713 1.731 -3.209 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -0.885 4.883 -5.004 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -1.637 5.859 -3.720 1.00 0.00 H new ATOM 0 HG23 ILE A 45 0.089 5.437 -3.622 1.00 0.00 H new ATOM 0 HD11 ILE A 45 0.830 1.795 -5.108 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -0.755 2.458 -5.571 1.00 0.00 H new ATOM 0 HD13 ILE A 45 0.608 3.555 -5.247 1.00 0.00 H new ATOM 689 N ILE A 46 -1.790 6.140 -0.484 1.00 0.00 N ATOM 690 CA ILE A 46 -2.605 7.287 -0.122 1.00 0.00 C ATOM 691 C ILE A 46 -2.224 8.503 -0.956 1.00 0.00 C ATOM 692 O ILE A 46 -1.079 8.632 -1.389 1.00 0.00 O ATOM 693 CB ILE A 46 -2.448 7.623 1.369 1.00 0.00 C ATOM 694 CG1 ILE A 46 -2.349 6.342 2.195 1.00 0.00 C ATOM 695 CG2 ILE A 46 -3.602 8.477 1.860 1.00 0.00 C ATOM 696 CD1 ILE A 46 -1.175 6.337 3.139 1.00 0.00 C ATOM 0 H ILE A 46 -0.886 6.097 -0.013 1.00 0.00 H new ATOM 0 HA ILE A 46 -3.645 7.028 -0.320 1.00 0.00 H new ATOM 0 HB ILE A 46 -1.527 8.194 1.491 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -3.268 6.214 2.767 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -2.270 5.488 1.522 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -3.465 8.700 2.918 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -3.632 9.408 1.294 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -4.539 7.937 1.721 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -1.160 5.401 3.697 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -0.250 6.435 2.570 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -1.264 7.172 3.834 1.00 0.00 H new ATOM 708 N HIS A 47 -3.186 9.388 -1.185 1.00 0.00 N ATOM 709 CA HIS A 47 -2.937 10.585 -1.979 1.00 0.00 C ATOM 710 C HIS A 47 -3.455 11.834 -1.275 1.00 0.00 C ATOM 711 O HIS A 47 -4.467 12.408 -1.679 1.00 0.00 O ATOM 712 CB HIS A 47 -3.592 10.453 -3.355 1.00 0.00 C ATOM 713 CG HIS A 47 -5.068 10.207 -3.291 1.00 0.00 C ATOM 714 ND1 HIS A 47 -5.993 11.010 -3.927 1.00 0.00 N ATOM 715 CD2 HIS A 47 -5.780 9.241 -2.665 1.00 0.00 C ATOM 716 CE1 HIS A 47 -7.208 10.549 -3.693 1.00 0.00 C ATOM 717 NE2 HIS A 47 -7.107 9.476 -2.931 1.00 0.00 N ATOM 0 H HIS A 47 -4.140 9.301 -0.835 1.00 0.00 H new ATOM 0 HA HIS A 47 -1.859 10.686 -2.102 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -3.407 11.363 -3.926 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -3.118 9.635 -3.898 1.00 0.00 H new ATOM 0 HD1 HIS A 47 -5.772 11.831 -4.490 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -5.379 8.435 -2.068 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -8.128 10.977 -4.062 1.00 0.00 H new ATOM 726 N LYS A 48 -2.756 12.260 -0.227 1.00 0.00 N ATOM 727 CA LYS A 48 -3.161 13.454 0.510 1.00 0.00 C ATOM 728 C LYS A 48 -2.419 14.684 -0.006 1.00 0.00 C ATOM 729 O LYS A 48 -1.277 14.587 -0.455 1.00 0.00 O ATOM 730 CB LYS A 48 -2.909 13.275 2.009 1.00 0.00 C ATOM 731 CG LYS A 48 -4.183 13.097 2.819 1.00 0.00 C ATOM 732 CD LYS A 48 -4.630 14.405 3.448 1.00 0.00 C ATOM 733 CE LYS A 48 -5.529 15.196 2.511 1.00 0.00 C ATOM 734 NZ LYS A 48 -5.282 16.660 2.608 1.00 0.00 N ATOM 0 H LYS A 48 -1.916 11.803 0.128 1.00 0.00 H new ATOM 0 HA LYS A 48 -4.229 13.602 0.353 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -2.267 12.407 2.161 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -2.367 14.143 2.385 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -4.974 12.713 2.175 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -4.018 12.354 3.600 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -5.162 14.200 4.377 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -3.756 15.003 3.706 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -5.363 14.867 1.485 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -6.572 14.988 2.747 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -5.915 17.163 1.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -5.465 16.979 3.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -4.293 16.863 2.358 1.00 0.00 H new ATOM 748 N SER A 49 -3.076 15.839 0.055 1.00 0.00 N ATOM 749 CA SER A 49 -2.475 17.084 -0.415 1.00 0.00 C ATOM 750 C SER A 49 -2.232 17.023 -1.922 1.00 0.00 C ATOM 751 O SER A 49 -2.865 16.234 -2.624 1.00 0.00 O ATOM 752 CB SER A 49 -1.162 17.350 0.328 1.00 0.00 C ATOM 753 OG SER A 49 -1.042 18.717 0.678 1.00 0.00 O ATOM 0 H SER A 49 -4.022 15.939 0.424 1.00 0.00 H new ATOM 0 HA SER A 49 -3.164 17.903 -0.210 1.00 0.00 H new ATOM 0 HB2 SER A 49 -1.119 16.736 1.228 1.00 0.00 H new ATOM 0 HB3 SER A 49 -0.320 17.057 -0.299 1.00 0.00 H new ATOM 0 HG SER A 49 -0.177 19.059 0.369 1.00 0.00 H new ATOM 759 N TRP A 50 -1.315 17.854 -2.420 1.00 0.00 N ATOM 760 CA TRP A 50 -0.999 17.879 -3.847 1.00 0.00 C ATOM 761 C TRP A 50 -0.799 16.463 -4.381 1.00 0.00 C ATOM 762 O TRP A 50 -1.370 16.083 -5.402 1.00 0.00 O ATOM 763 CB TRP A 50 0.256 18.717 -4.101 1.00 0.00 C ATOM 764 CG TRP A 50 1.421 18.316 -3.248 1.00 0.00 C ATOM 765 CD1 TRP A 50 2.383 17.396 -3.555 1.00 0.00 C ATOM 766 CD2 TRP A 50 1.749 18.821 -1.947 1.00 0.00 C ATOM 767 NE1 TRP A 50 3.288 17.298 -2.527 1.00 0.00 N ATOM 768 CE2 TRP A 50 2.921 18.163 -1.529 1.00 0.00 C ATOM 769 CE3 TRP A 50 1.167 19.766 -1.098 1.00 0.00 C ATOM 770 CZ2 TRP A 50 3.520 18.420 -0.298 1.00 0.00 C ATOM 771 CZ3 TRP A 50 1.763 20.020 0.123 1.00 0.00 C ATOM 772 CH2 TRP A 50 2.928 19.349 0.513 1.00 0.00 C ATOM 0 H TRP A 50 -0.780 18.516 -1.858 1.00 0.00 H new ATOM 0 HA TRP A 50 -1.839 18.333 -4.373 1.00 0.00 H new ATOM 0 HB2 TRP A 50 0.536 18.629 -5.151 1.00 0.00 H new ATOM 0 HB3 TRP A 50 0.026 19.767 -3.919 1.00 0.00 H new ATOM 0 HD1 TRP A 50 2.426 16.828 -4.473 1.00 0.00 H new ATOM 0 HE1 TRP A 50 4.101 16.682 -2.509 1.00 0.00 H new ATOM 0 HE3 TRP A 50 0.268 20.288 -1.390 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 4.419 17.904 0.005 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 1.322 20.749 0.787 1.00 0.00 H new ATOM 0 HH2 TRP A 50 3.369 19.569 1.474 1.00 0.00 H new ATOM 783 N CYS A 51 0.007 15.683 -3.667 1.00 0.00 N ATOM 784 CA CYS A 51 0.281 14.300 -4.042 1.00 0.00 C ATOM 785 C CYS A 51 0.729 14.180 -5.498 1.00 0.00 C ATOM 786 O CYS A 51 -0.089 14.242 -6.416 1.00 0.00 O ATOM 787 CB CYS A 51 -0.966 13.437 -3.809 1.00 0.00 C ATOM 788 SG CYS A 51 -0.865 11.752 -4.506 1.00 0.00 S ATOM 0 H CYS A 51 0.485 15.988 -2.819 1.00 0.00 H new ATOM 0 HA CYS A 51 1.098 13.945 -3.414 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -1.145 13.362 -2.736 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -1.829 13.944 -4.241 1.00 0.00 H new ATOM 793 N GLY A 52 2.025 13.974 -5.700 1.00 0.00 N ATOM 794 CA GLY A 52 2.550 13.812 -7.043 1.00 0.00 C ATOM 795 C GLY A 52 2.687 12.349 -7.409 1.00 0.00 C ATOM 796 O GLY A 52 2.739 11.994 -8.587 1.00 0.00 O ATOM 0 H GLY A 52 2.722 13.916 -4.958 1.00 0.00 H new ATOM 0 HA2 GLY A 52 1.890 14.307 -7.756 1.00 0.00 H new ATOM 0 HA3 GLY A 52 3.522 14.300 -7.117 1.00 0.00 H new ATOM 800 N ALA A 53 2.731 11.494 -6.392 1.00 0.00 N ATOM 801 CA ALA A 53 2.844 10.061 -6.608 1.00 0.00 C ATOM 802 C ALA A 53 1.591 9.514 -7.268 1.00 0.00 C ATOM 803 O ALA A 53 1.585 8.396 -7.778 1.00 0.00 O ATOM 804 CB ALA A 53 3.116 9.343 -5.293 1.00 0.00 C ATOM 0 H ALA A 53 2.690 11.771 -5.411 1.00 0.00 H new ATOM 0 HA ALA A 53 3.685 9.882 -7.278 1.00 0.00 H new ATOM 0 HB1 ALA A 53 3.198 8.271 -5.474 1.00 0.00 H new ATOM 0 HB2 ALA A 53 4.048 9.711 -4.864 1.00 0.00 H new ATOM 0 HB3 ALA A 53 2.297 9.533 -4.599 1.00 0.00 H new ATOM 810 N CYS A 54 0.527 10.310 -7.257 1.00 0.00 N ATOM 811 CA CYS A 54 -0.727 9.899 -7.859 1.00 0.00 C ATOM 812 C CYS A 54 -0.951 10.610 -9.190 1.00 0.00 C ATOM 813 O CYS A 54 -1.560 10.053 -10.106 1.00 0.00 O ATOM 814 CB CYS A 54 -1.888 10.184 -6.904 1.00 0.00 C ATOM 815 SG CYS A 54 -1.912 11.883 -6.244 1.00 0.00 S ATOM 0 H CYS A 54 0.512 11.240 -6.838 1.00 0.00 H new ATOM 0 HA CYS A 54 -0.680 8.827 -8.050 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -2.827 9.995 -7.425 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -1.839 9.483 -6.071 1.00 0.00 H new ATOM 820 N LYS A 55 -0.456 11.840 -9.298 1.00 0.00 N ATOM 821 CA LYS A 55 -0.612 12.612 -10.527 1.00 0.00 C ATOM 822 C LYS A 55 0.164 11.966 -11.673 1.00 0.00 C ATOM 823 O LYS A 55 -0.381 11.751 -12.753 1.00 0.00 O ATOM 824 CB LYS A 55 -0.173 14.066 -10.322 1.00 0.00 C ATOM 825 CG LYS A 55 1.332 14.265 -10.349 1.00 0.00 C ATOM 826 CD LYS A 55 1.710 15.696 -9.999 1.00 0.00 C ATOM 827 CE LYS A 55 3.161 15.991 -10.345 1.00 0.00 C ATOM 828 NZ LYS A 55 3.717 17.095 -9.514 1.00 0.00 N ATOM 0 H LYS A 55 0.053 12.320 -8.556 1.00 0.00 H new ATOM 0 HA LYS A 55 -1.669 12.616 -10.791 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -0.625 14.684 -11.097 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -0.559 14.420 -9.366 1.00 0.00 H new ATOM 0 HG2 LYS A 55 1.804 13.580 -9.644 1.00 0.00 H new ATOM 0 HG3 LYS A 55 1.715 14.018 -11.339 1.00 0.00 H new ATOM 0 HD2 LYS A 55 1.060 16.387 -10.536 1.00 0.00 H new ATOM 0 HD3 LYS A 55 1.547 15.866 -8.935 1.00 0.00 H new ATOM 0 HE2 LYS A 55 3.759 15.091 -10.200 1.00 0.00 H new ATOM 0 HE3 LYS A 55 3.236 16.257 -11.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 4.708 17.265 -9.781 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 3.163 17.961 -9.671 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 3.669 16.831 -8.509 1.00 0.00 H new ATOM 842 N ALA A 56 1.435 11.639 -11.435 1.00 0.00 N ATOM 843 CA ALA A 56 2.247 10.999 -12.465 1.00 0.00 C ATOM 844 C ALA A 56 1.616 9.681 -12.880 1.00 0.00 C ATOM 845 O ALA A 56 1.553 9.352 -14.064 1.00 0.00 O ATOM 846 CB ALA A 56 3.667 10.782 -11.967 1.00 0.00 C ATOM 0 H ALA A 56 1.917 11.804 -10.551 1.00 0.00 H new ATOM 0 HA ALA A 56 2.290 11.654 -13.335 1.00 0.00 H new ATOM 0 HB1 ALA A 56 4.258 10.304 -12.748 1.00 0.00 H new ATOM 0 HB2 ALA A 56 4.114 11.743 -11.711 1.00 0.00 H new ATOM 0 HB3 ALA A 56 3.649 10.144 -11.084 1.00 0.00 H new ATOM 852 N LEU A 57 1.129 8.942 -11.893 1.00 0.00 N ATOM 853 CA LEU A 57 0.481 7.664 -12.143 1.00 0.00 C ATOM 854 C LEU A 57 -0.696 7.840 -13.103 1.00 0.00 C ATOM 855 O LEU A 57 -1.088 6.916 -13.804 1.00 0.00 O ATOM 856 CB LEU A 57 -0.006 7.056 -10.821 1.00 0.00 C ATOM 857 CG LEU A 57 1.084 6.498 -9.888 1.00 0.00 C ATOM 858 CD1 LEU A 57 1.210 4.993 -10.050 1.00 0.00 C ATOM 859 CD2 LEU A 57 2.429 7.172 -10.135 1.00 0.00 C ATOM 0 H LEU A 57 1.171 9.207 -10.909 1.00 0.00 H new ATOM 0 HA LEU A 57 1.205 6.990 -12.601 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.564 7.819 -10.278 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.705 6.252 -11.051 1.00 0.00 H new ATOM 0 HG LEU A 57 0.783 6.716 -8.863 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.986 4.619 -9.382 1.00 0.00 H new ATOM 0 HD12 LEU A 57 0.260 4.520 -9.804 1.00 0.00 H new ATOM 0 HD13 LEU A 57 1.475 4.759 -11.081 1.00 0.00 H new ATOM 0 HD21 LEU A 57 3.175 6.754 -9.459 1.00 0.00 H new ATOM 0 HD22 LEU A 57 2.737 7.001 -11.166 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.337 8.243 -9.956 1.00 0.00 H new ATOM 871 N LYS A 58 -1.268 9.033 -13.126 1.00 0.00 N ATOM 872 CA LYS A 58 -2.406 9.300 -13.996 1.00 0.00 C ATOM 873 C LYS A 58 -2.151 8.847 -15.446 1.00 0.00 C ATOM 874 O LYS A 58 -2.716 7.841 -15.885 1.00 0.00 O ATOM 875 CB LYS A 58 -2.802 10.778 -13.916 1.00 0.00 C ATOM 876 CG LYS A 58 -3.252 11.194 -12.523 1.00 0.00 C ATOM 877 CD LYS A 58 -3.823 12.606 -12.494 1.00 0.00 C ATOM 878 CE LYS A 58 -2.909 13.610 -13.181 1.00 0.00 C ATOM 879 NZ LYS A 58 -3.496 14.116 -14.451 1.00 0.00 N ATOM 0 H LYS A 58 -0.968 9.826 -12.559 1.00 0.00 H new ATOM 0 HA LYS A 58 -3.247 8.705 -13.639 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -1.954 11.393 -14.218 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -3.606 10.973 -14.626 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -4.005 10.493 -12.163 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -2.407 11.133 -11.838 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -4.798 12.612 -12.982 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -3.982 12.911 -11.460 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -2.720 14.447 -12.509 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -1.946 13.143 -13.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -2.843 14.797 -14.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -3.653 13.320 -15.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -4.403 14.585 -14.252 1.00 0.00 H new ATOM 893 N PRO A 59 -1.310 9.562 -16.222 1.00 0.00 N ATOM 894 CA PRO A 59 -1.030 9.201 -17.620 1.00 0.00 C ATOM 895 C PRO A 59 -0.097 8.002 -17.781 1.00 0.00 C ATOM 896 O PRO A 59 -0.095 7.355 -18.828 1.00 0.00 O ATOM 897 CB PRO A 59 -0.356 10.455 -18.169 1.00 0.00 C ATOM 898 CG PRO A 59 0.334 11.039 -16.990 1.00 0.00 C ATOM 899 CD PRO A 59 -0.575 10.777 -15.820 1.00 0.00 C ATOM 0 HA PRO A 59 -1.943 8.902 -18.134 1.00 0.00 H new ATOM 0 HB2 PRO A 59 0.349 10.213 -18.964 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -1.085 11.148 -18.589 1.00 0.00 H new ATOM 0 HG2 PRO A 59 1.310 10.578 -16.839 1.00 0.00 H new ATOM 0 HG3 PRO A 59 0.503 12.107 -17.124 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -0.011 10.619 -14.901 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -1.250 11.614 -15.641 1.00 0.00 H new ATOM 907 N LYS A 60 0.704 7.711 -16.761 1.00 0.00 N ATOM 908 CA LYS A 60 1.638 6.590 -16.844 1.00 0.00 C ATOM 909 C LYS A 60 1.063 5.333 -16.205 1.00 0.00 C ATOM 910 O LYS A 60 1.074 4.265 -16.814 1.00 0.00 O ATOM 911 CB LYS A 60 2.969 6.943 -16.185 1.00 0.00 C ATOM 912 CG LYS A 60 2.897 6.955 -14.672 1.00 0.00 C ATOM 913 CD LYS A 60 3.918 7.911 -14.058 1.00 0.00 C ATOM 914 CE LYS A 60 5.311 7.725 -14.649 1.00 0.00 C ATOM 915 NZ LYS A 60 6.211 8.862 -14.310 1.00 0.00 N ATOM 0 H LYS A 60 0.727 8.225 -15.880 1.00 0.00 H new ATOM 0 HA LYS A 60 1.807 6.389 -17.902 1.00 0.00 H new ATOM 0 HB2 LYS A 60 3.726 6.225 -16.501 1.00 0.00 H new ATOM 0 HB3 LYS A 60 3.293 7.923 -16.535 1.00 0.00 H new ATOM 0 HG2 LYS A 60 1.894 7.246 -14.359 1.00 0.00 H new ATOM 0 HG3 LYS A 60 3.070 5.948 -14.293 1.00 0.00 H new ATOM 0 HD2 LYS A 60 3.592 8.939 -14.217 1.00 0.00 H new ATOM 0 HD3 LYS A 60 3.959 7.753 -12.980 1.00 0.00 H new ATOM 0 HE2 LYS A 60 5.743 6.796 -14.277 1.00 0.00 H new ATOM 0 HE3 LYS A 60 5.237 7.630 -15.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 6.866 9.034 -15.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 5.642 9.716 -14.140 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 6.754 8.631 -13.454 1.00 0.00 H new ATOM 929 N PHE A 61 0.547 5.457 -14.984 1.00 0.00 N ATOM 930 CA PHE A 61 -0.032 4.315 -14.311 1.00 0.00 C ATOM 931 C PHE A 61 -1.259 3.861 -15.074 1.00 0.00 C ATOM 932 O PHE A 61 -1.680 2.715 -14.953 1.00 0.00 O ATOM 933 CB PHE A 61 -0.363 4.622 -12.856 1.00 0.00 C ATOM 934 CG PHE A 61 -0.617 3.386 -12.045 1.00 0.00 C ATOM 935 CD1 PHE A 61 0.435 2.588 -11.628 1.00 0.00 C ATOM 936 CD2 PHE A 61 -1.909 3.017 -11.706 1.00 0.00 C ATOM 937 CE1 PHE A 61 0.205 1.445 -10.887 1.00 0.00 C ATOM 938 CE2 PHE A 61 -2.145 1.875 -10.967 1.00 0.00 C ATOM 939 CZ PHE A 61 -1.087 1.088 -10.556 1.00 0.00 C ATOM 0 H PHE A 61 0.521 6.328 -14.453 1.00 0.00 H new ATOM 0 HA PHE A 61 0.700 3.508 -14.295 1.00 0.00 H new ATOM 0 HB2 PHE A 61 0.460 5.180 -12.411 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -1.243 5.265 -12.816 1.00 0.00 H new ATOM 0 HD1 PHE A 61 1.447 2.862 -11.885 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -2.740 3.629 -12.023 1.00 0.00 H new ATOM 0 HE1 PHE A 61 1.034 0.832 -10.567 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -3.157 1.597 -10.710 1.00 0.00 H new ATOM 0 HZ PHE A 61 -1.270 0.195 -9.977 1.00 0.00 H new ATOM 949 N ALA A 62 -1.795 4.743 -15.926 1.00 0.00 N ATOM 950 CA ALA A 62 -2.916 4.368 -16.768 1.00 0.00 C ATOM 951 C ALA A 62 -2.483 3.164 -17.612 1.00 0.00 C ATOM 952 O ALA A 62 -3.301 2.388 -18.105 1.00 0.00 O ATOM 953 CB ALA A 62 -3.336 5.536 -17.649 1.00 0.00 C ATOM 0 H ALA A 62 -1.471 5.703 -16.044 1.00 0.00 H new ATOM 0 HA ALA A 62 -3.780 4.102 -16.159 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -4.178 5.236 -18.273 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -3.631 6.377 -17.022 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -2.501 5.832 -18.284 1.00 0.00 H new ATOM 959 N GLU A 63 -1.157 3.023 -17.723 1.00 0.00 N ATOM 960 CA GLU A 63 -0.508 1.936 -18.440 1.00 0.00 C ATOM 961 C GLU A 63 -0.613 0.641 -17.646 1.00 0.00 C ATOM 962 O GLU A 63 -0.372 -0.452 -18.166 1.00 0.00 O ATOM 963 CB GLU A 63 0.961 2.306 -18.665 1.00 0.00 C ATOM 964 CG GLU A 63 1.652 1.464 -19.725 1.00 0.00 C ATOM 965 CD GLU A 63 2.575 0.419 -19.131 1.00 0.00 C ATOM 966 OE1 GLU A 63 3.710 0.778 -18.751 1.00 0.00 O ATOM 967 OE2 GLU A 63 2.164 -0.755 -19.043 1.00 0.00 O ATOM 0 H GLU A 63 -0.497 3.679 -17.305 1.00 0.00 H new ATOM 0 HA GLU A 63 -1.000 1.783 -19.401 1.00 0.00 H new ATOM 0 HB2 GLU A 63 1.021 3.356 -18.952 1.00 0.00 H new ATOM 0 HB3 GLU A 63 1.500 2.202 -17.723 1.00 0.00 H new ATOM 0 HG2 GLU A 63 0.899 0.971 -20.339 1.00 0.00 H new ATOM 0 HG3 GLU A 63 2.225 2.116 -20.385 1.00 0.00 H new ATOM 974 N SER A 64 -0.982 0.776 -16.378 1.00 0.00 N ATOM 975 CA SER A 64 -1.135 -0.356 -15.486 1.00 0.00 C ATOM 976 C SER A 64 -2.142 -1.370 -16.015 1.00 0.00 C ATOM 977 O SER A 64 -2.438 -2.349 -15.334 1.00 0.00 O ATOM 978 CB SER A 64 -1.580 0.130 -14.116 1.00 0.00 C ATOM 979 OG SER A 64 -0.527 0.794 -13.440 1.00 0.00 O ATOM 0 H SER A 64 -1.183 1.677 -15.943 1.00 0.00 H new ATOM 0 HA SER A 64 -0.167 -0.853 -15.416 1.00 0.00 H new ATOM 0 HB2 SER A 64 -2.428 0.806 -14.225 1.00 0.00 H new ATOM 0 HB3 SER A 64 -1.921 -0.717 -13.520 1.00 0.00 H new ATOM 0 HG SER A 64 -0.891 1.295 -12.680 1.00 0.00 H new ATOM 985 N THR A 65 -2.664 -1.161 -17.225 1.00 0.00 N ATOM 986 CA THR A 65 -3.611 -2.104 -17.802 1.00 0.00 C ATOM 987 C THR A 65 -3.069 -3.512 -17.627 1.00 0.00 C ATOM 988 O THR A 65 -3.803 -4.445 -17.301 1.00 0.00 O ATOM 989 CB THR A 65 -3.843 -1.802 -19.283 1.00 0.00 C ATOM 990 OG1 THR A 65 -3.483 -0.465 -19.585 1.00 0.00 O ATOM 991 CG2 THR A 65 -5.280 -1.998 -19.712 1.00 0.00 C ATOM 0 H THR A 65 -2.448 -0.357 -17.814 1.00 0.00 H new ATOM 0 HA THR A 65 -4.569 -2.012 -17.290 1.00 0.00 H new ATOM 0 HB THR A 65 -3.217 -2.511 -19.825 1.00 0.00 H new ATOM 0 HG1 THR A 65 -3.933 0.144 -18.962 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.378 -1.767 -20.773 1.00 0.00 H new ATOM 0 HG22 THR A 65 -5.574 -3.033 -19.537 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.925 -1.335 -19.136 1.00 0.00 H new ATOM 999 N GLU A 66 -1.756 -3.643 -17.794 1.00 0.00 N ATOM 1000 CA GLU A 66 -1.095 -4.923 -17.606 1.00 0.00 C ATOM 1001 C GLU A 66 -0.871 -5.149 -16.125 1.00 0.00 C ATOM 1002 O GLU A 66 -0.916 -6.283 -15.646 1.00 0.00 O ATOM 1003 CB GLU A 66 0.236 -4.978 -18.360 1.00 0.00 C ATOM 1004 CG GLU A 66 0.345 -6.167 -19.299 1.00 0.00 C ATOM 1005 CD GLU A 66 1.769 -6.666 -19.448 1.00 0.00 C ATOM 1006 OE1 GLU A 66 2.574 -5.976 -20.107 1.00 0.00 O ATOM 1007 OE2 GLU A 66 2.079 -7.747 -18.905 1.00 0.00 O ATOM 0 H GLU A 66 -1.134 -2.879 -18.058 1.00 0.00 H new ATOM 0 HA GLU A 66 -1.732 -5.711 -18.009 1.00 0.00 H new ATOM 0 HB2 GLU A 66 0.360 -4.059 -18.933 1.00 0.00 H new ATOM 0 HB3 GLU A 66 1.053 -5.017 -17.639 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -0.283 -6.977 -18.927 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -0.042 -5.888 -20.279 1.00 0.00 H new ATOM 1014 N ILE A 67 -0.671 -4.060 -15.390 1.00 0.00 N ATOM 1015 CA ILE A 67 -0.492 -4.162 -13.957 1.00 0.00 C ATOM 1016 C ILE A 67 -1.812 -4.552 -13.303 1.00 0.00 C ATOM 1017 O ILE A 67 -1.843 -4.981 -12.150 1.00 0.00 O ATOM 1018 CB ILE A 67 0.026 -2.848 -13.343 1.00 0.00 C ATOM 1019 CG1 ILE A 67 1.301 -2.396 -14.058 1.00 0.00 C ATOM 1020 CG2 ILE A 67 0.281 -3.021 -11.854 1.00 0.00 C ATOM 1021 CD1 ILE A 67 1.807 -1.047 -13.592 1.00 0.00 C ATOM 0 H ILE A 67 -0.630 -3.111 -15.762 1.00 0.00 H new ATOM 0 HA ILE A 67 0.259 -4.930 -13.771 1.00 0.00 H new ATOM 0 HB ILE A 67 -0.735 -2.079 -13.473 1.00 0.00 H new ATOM 0 HG12 ILE A 67 2.080 -3.142 -13.901 1.00 0.00 H new ATOM 0 HG13 ILE A 67 1.111 -2.354 -15.131 1.00 0.00 H new ATOM 0 HG21 ILE A 67 0.647 -2.083 -11.436 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -0.647 -3.303 -11.356 1.00 0.00 H new ATOM 0 HG23 ILE A 67 1.026 -3.801 -11.701 1.00 0.00 H new ATOM 0 HD11 ILE A 67 2.713 -0.789 -14.140 1.00 0.00 H new ATOM 0 HD12 ILE A 67 1.044 -0.290 -13.774 1.00 0.00 H new ATOM 0 HD13 ILE A 67 2.028 -1.090 -12.526 1.00 0.00 H new ATOM 1033 N SER A 68 -2.906 -4.426 -14.060 1.00 0.00 N ATOM 1034 CA SER A 68 -4.218 -4.797 -13.556 1.00 0.00 C ATOM 1035 C SER A 68 -4.276 -6.308 -13.391 1.00 0.00 C ATOM 1036 O SER A 68 -4.957 -6.826 -12.505 1.00 0.00 O ATOM 1037 CB SER A 68 -5.315 -4.320 -14.511 1.00 0.00 C ATOM 1038 OG SER A 68 -6.078 -3.277 -13.929 1.00 0.00 O ATOM 0 H SER A 68 -2.903 -4.072 -15.017 1.00 0.00 H new ATOM 0 HA SER A 68 -4.384 -4.319 -12.590 1.00 0.00 H new ATOM 0 HB2 SER A 68 -4.866 -3.971 -15.441 1.00 0.00 H new ATOM 0 HB3 SER A 68 -5.968 -5.155 -14.766 1.00 0.00 H new ATOM 0 HG SER A 68 -6.412 -2.683 -14.634 1.00 0.00 H new ATOM 1044 N GLU A 69 -3.530 -7.006 -14.243 1.00 0.00 N ATOM 1045 CA GLU A 69 -3.462 -8.456 -14.190 1.00 0.00 C ATOM 1046 C GLU A 69 -2.437 -8.881 -13.152 1.00 0.00 C ATOM 1047 O GLU A 69 -2.679 -9.788 -12.359 1.00 0.00 O ATOM 1048 CB GLU A 69 -3.097 -9.030 -15.561 1.00 0.00 C ATOM 1049 CG GLU A 69 -3.932 -8.464 -16.700 1.00 0.00 C ATOM 1050 CD GLU A 69 -5.411 -8.747 -16.535 1.00 0.00 C ATOM 1051 OE1 GLU A 69 -6.094 -7.955 -15.851 1.00 0.00 O ATOM 1052 OE2 GLU A 69 -5.887 -9.760 -17.088 1.00 0.00 O ATOM 0 H GLU A 69 -2.964 -6.585 -14.980 1.00 0.00 H new ATOM 0 HA GLU A 69 -4.441 -8.844 -13.908 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -2.044 -8.831 -15.760 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -3.218 -10.113 -15.536 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -3.776 -7.387 -16.759 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -3.588 -8.888 -17.643 1.00 0.00 H new ATOM 1059 N LEU A 70 -1.291 -8.202 -13.156 1.00 0.00 N ATOM 1060 CA LEU A 70 -0.226 -8.494 -12.199 1.00 0.00 C ATOM 1061 C LEU A 70 -0.724 -8.331 -10.764 1.00 0.00 C ATOM 1062 O LEU A 70 -0.119 -8.847 -9.824 1.00 0.00 O ATOM 1063 CB LEU A 70 0.967 -7.562 -12.431 1.00 0.00 C ATOM 1064 CG LEU A 70 1.974 -8.037 -13.478 1.00 0.00 C ATOM 1065 CD1 LEU A 70 1.308 -8.138 -14.843 1.00 0.00 C ATOM 1066 CD2 LEU A 70 3.171 -7.096 -13.526 1.00 0.00 C ATOM 0 H LEU A 70 -1.077 -7.448 -13.809 1.00 0.00 H new ATOM 0 HA LEU A 70 0.086 -9.528 -12.349 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.590 -6.584 -12.731 1.00 0.00 H new ATOM 0 HB3 LEU A 70 1.490 -7.425 -11.484 1.00 0.00 H new ATOM 0 HG LEU A 70 2.331 -9.028 -13.198 1.00 0.00 H new ATOM 0 HD11 LEU A 70 2.037 -8.477 -15.579 1.00 0.00 H new ATOM 0 HD12 LEU A 70 0.484 -8.849 -14.794 1.00 0.00 H new ATOM 0 HD13 LEU A 70 0.926 -7.160 -15.135 1.00 0.00 H new ATOM 0 HD21 LEU A 70 3.880 -7.447 -14.276 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.835 -6.092 -13.786 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.656 -7.075 -12.550 1.00 0.00 H new ATOM 1078 N SER A 71 -1.820 -7.596 -10.602 1.00 0.00 N ATOM 1079 CA SER A 71 -2.390 -7.348 -9.282 1.00 0.00 C ATOM 1080 C SER A 71 -3.124 -8.567 -8.734 1.00 0.00 C ATOM 1081 O SER A 71 -3.347 -8.670 -7.533 1.00 0.00 O ATOM 1082 CB SER A 71 -3.362 -6.180 -9.343 1.00 0.00 C ATOM 1083 OG SER A 71 -2.990 -5.152 -8.441 1.00 0.00 O ATOM 0 H SER A 71 -2.332 -7.161 -11.370 1.00 0.00 H new ATOM 0 HA SER A 71 -1.559 -7.119 -8.615 1.00 0.00 H new ATOM 0 HB2 SER A 71 -3.393 -5.783 -10.358 1.00 0.00 H new ATOM 0 HB3 SER A 71 -4.367 -6.528 -9.106 1.00 0.00 H new ATOM 0 HG SER A 71 -2.094 -4.826 -8.668 1.00 0.00 H new ATOM 1089 N HIS A 72 -3.500 -9.494 -9.604 1.00 0.00 N ATOM 1090 CA HIS A 72 -4.201 -10.693 -9.158 1.00 0.00 C ATOM 1091 C HIS A 72 -3.326 -11.475 -8.182 1.00 0.00 C ATOM 1092 O HIS A 72 -3.794 -12.383 -7.493 1.00 0.00 O ATOM 1093 CB HIS A 72 -4.608 -11.566 -10.352 1.00 0.00 C ATOM 1094 CG HIS A 72 -3.502 -12.415 -10.899 1.00 0.00 C ATOM 1095 ND1 HIS A 72 -3.683 -13.725 -11.287 1.00 0.00 N ATOM 1096 CD2 HIS A 72 -2.199 -12.135 -11.124 1.00 0.00 C ATOM 1097 CE1 HIS A 72 -2.537 -14.215 -11.726 1.00 0.00 C ATOM 1098 NE2 HIS A 72 -1.621 -13.268 -11.639 1.00 0.00 N ATOM 0 H HIS A 72 -3.335 -9.442 -10.609 1.00 0.00 H new ATOM 0 HA HIS A 72 -5.114 -10.393 -8.643 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -5.432 -12.213 -10.050 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -4.983 -10.922 -11.147 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -1.704 -11.194 -10.934 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -2.377 -15.218 -12.093 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -0.642 -13.363 -11.911 1.00 0.00 H new ATOM 1107 N ASN A 73 -2.045 -11.119 -8.148 1.00 0.00 N ATOM 1108 CA ASN A 73 -1.076 -11.772 -7.285 1.00 0.00 C ATOM 1109 C ASN A 73 -1.041 -11.154 -5.879 1.00 0.00 C ATOM 1110 O ASN A 73 -0.502 -11.746 -4.945 1.00 0.00 O ATOM 1111 CB ASN A 73 0.297 -11.677 -7.940 1.00 0.00 C ATOM 1112 CG ASN A 73 0.286 -12.193 -9.366 1.00 0.00 C ATOM 1113 OD1 ASN A 73 0.129 -13.392 -9.601 1.00 0.00 O ATOM 1114 ND2 ASN A 73 0.452 -11.294 -10.331 1.00 0.00 N ATOM 0 H ASN A 73 -1.654 -10.370 -8.719 1.00 0.00 H new ATOM 0 HA ASN A 73 -1.369 -12.815 -7.161 1.00 0.00 H new ATOM 0 HB2 ASN A 73 0.630 -10.639 -7.933 1.00 0.00 H new ATOM 0 HB3 ASN A 73 1.018 -12.247 -7.354 1.00 0.00 H new ATOM 0 HD21 ASN A 73 0.452 -11.588 -11.308 1.00 0.00 H new ATOM 0 HD22 ASN A 73 0.579 -10.310 -10.095 1.00 0.00 H new ATOM 1121 N PHE A 74 -1.619 -9.962 -5.740 1.00 0.00 N ATOM 1122 CA PHE A 74 -1.660 -9.259 -4.461 1.00 0.00 C ATOM 1123 C PHE A 74 -2.718 -8.160 -4.489 1.00 0.00 C ATOM 1124 O PHE A 74 -3.068 -7.655 -5.551 1.00 0.00 O ATOM 1125 CB PHE A 74 -0.279 -8.705 -4.093 1.00 0.00 C ATOM 1126 CG PHE A 74 0.378 -7.845 -5.138 1.00 0.00 C ATOM 1127 CD1 PHE A 74 0.537 -8.289 -6.442 1.00 0.00 C ATOM 1128 CD2 PHE A 74 0.863 -6.592 -4.799 1.00 0.00 C ATOM 1129 CE1 PHE A 74 1.165 -7.502 -7.385 1.00 0.00 C ATOM 1130 CE2 PHE A 74 1.489 -5.799 -5.740 1.00 0.00 C ATOM 1131 CZ PHE A 74 1.641 -6.255 -7.034 1.00 0.00 C ATOM 0 H PHE A 74 -2.069 -9.460 -6.506 1.00 0.00 H new ATOM 0 HA PHE A 74 -1.940 -9.971 -3.685 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -0.374 -8.123 -3.177 1.00 0.00 H new ATOM 0 HB3 PHE A 74 0.381 -9.543 -3.871 1.00 0.00 H new ATOM 0 HD1 PHE A 74 0.165 -9.263 -6.723 1.00 0.00 H new ATOM 0 HD2 PHE A 74 0.750 -6.232 -3.787 1.00 0.00 H new ATOM 0 HE1 PHE A 74 1.284 -7.861 -8.397 1.00 0.00 H new ATOM 0 HE2 PHE A 74 1.859 -4.823 -5.464 1.00 0.00 H new ATOM 0 HZ PHE A 74 2.132 -5.637 -7.771 1.00 0.00 H new ATOM 1141 N VAL A 75 -3.253 -7.807 -3.322 1.00 0.00 N ATOM 1142 CA VAL A 75 -4.295 -6.790 -3.252 1.00 0.00 C ATOM 1143 C VAL A 75 -3.862 -5.617 -2.391 1.00 0.00 C ATOM 1144 O VAL A 75 -3.281 -5.805 -1.324 1.00 0.00 O ATOM 1145 CB VAL A 75 -5.607 -7.379 -2.688 1.00 0.00 C ATOM 1146 CG1 VAL A 75 -5.366 -8.026 -1.333 1.00 0.00 C ATOM 1147 CG2 VAL A 75 -6.685 -6.307 -2.590 1.00 0.00 C ATOM 0 H VAL A 75 -2.985 -8.206 -2.422 1.00 0.00 H new ATOM 0 HA VAL A 75 -4.468 -6.438 -4.269 1.00 0.00 H new ATOM 0 HB VAL A 75 -5.957 -8.148 -3.376 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -6.302 -8.435 -0.953 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -4.636 -8.829 -1.438 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -4.987 -7.279 -0.636 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -7.599 -6.746 -2.190 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -6.346 -5.510 -1.929 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -6.882 -5.898 -3.581 1.00 0.00 H new ATOM 1157 N MET A 76 -4.141 -4.402 -2.854 1.00 0.00 N ATOM 1158 CA MET A 76 -3.765 -3.220 -2.107 1.00 0.00 C ATOM 1159 C MET A 76 -4.991 -2.361 -1.792 1.00 0.00 C ATOM 1160 O MET A 76 -6.136 -2.797 -1.989 1.00 0.00 O ATOM 1161 CB MET A 76 -2.703 -2.433 -2.870 1.00 0.00 C ATOM 1162 CG MET A 76 -2.382 -3.011 -4.248 1.00 0.00 C ATOM 1163 SD MET A 76 -1.464 -4.559 -4.180 1.00 0.00 S ATOM 1164 CE MET A 76 -1.853 -5.248 -5.787 1.00 0.00 C ATOM 0 H MET A 76 -4.621 -4.217 -3.735 1.00 0.00 H new ATOM 0 HA MET A 76 -3.335 -3.527 -1.154 1.00 0.00 H new ATOM 0 HB2 MET A 76 -3.041 -1.403 -2.987 1.00 0.00 H new ATOM 0 HB3 MET A 76 -1.789 -2.403 -2.276 1.00 0.00 H new ATOM 0 HG2 MET A 76 -3.313 -3.173 -4.791 1.00 0.00 H new ATOM 0 HG3 MET A 76 -1.805 -2.280 -4.815 1.00 0.00 H new ATOM 0 HE1 MET A 76 -1.235 -6.128 -5.965 1.00 0.00 H new ATOM 0 HE2 MET A 76 -2.905 -5.531 -5.817 1.00 0.00 H new ATOM 0 HE3 MET A 76 -1.656 -4.504 -6.559 1.00 0.00 H new ATOM 1174 N VAL A 77 -4.759 -1.159 -1.265 1.00 0.00 N ATOM 1175 CA VAL A 77 -5.856 -0.282 -0.882 1.00 0.00 C ATOM 1176 C VAL A 77 -5.513 1.199 -1.044 1.00 0.00 C ATOM 1177 O VAL A 77 -4.432 1.645 -0.656 1.00 0.00 O ATOM 1178 CB VAL A 77 -6.248 -0.568 0.585 1.00 0.00 C ATOM 1179 CG1 VAL A 77 -6.666 0.692 1.333 1.00 0.00 C ATOM 1180 CG2 VAL A 77 -7.344 -1.614 0.630 1.00 0.00 C ATOM 0 H VAL A 77 -3.829 -0.776 -1.096 1.00 0.00 H new ATOM 0 HA VAL A 77 -6.691 -0.491 -1.551 1.00 0.00 H new ATOM 0 HB VAL A 77 -5.364 -0.951 1.095 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -6.931 0.435 2.359 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -5.840 1.403 1.339 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -7.527 1.141 0.837 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -7.616 -1.811 1.667 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -8.217 -1.250 0.089 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -6.988 -2.534 0.167 1.00 0.00 H new ATOM 1190 N ASN A 78 -6.458 1.960 -1.597 1.00 0.00 N ATOM 1191 CA ASN A 78 -6.274 3.391 -1.787 1.00 0.00 C ATOM 1192 C ASN A 78 -6.903 4.172 -0.649 1.00 0.00 C ATOM 1193 O ASN A 78 -8.114 4.120 -0.432 1.00 0.00 O ATOM 1194 CB ASN A 78 -6.890 3.864 -3.099 1.00 0.00 C ATOM 1195 CG ASN A 78 -6.623 5.333 -3.381 1.00 0.00 C ATOM 1196 OD1 ASN A 78 -7.425 6.004 -4.030 1.00 0.00 O ATOM 1197 ND2 ASN A 78 -5.494 5.847 -2.895 1.00 0.00 N ATOM 0 H ASN A 78 -7.358 1.605 -1.920 1.00 0.00 H new ATOM 0 HA ASN A 78 -5.199 3.571 -1.810 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -6.493 3.264 -3.918 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -7.966 3.694 -3.071 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -5.270 6.829 -3.056 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -4.854 5.259 -2.362 1.00 0.00 H new ATOM 1204 N LEU A 79 -6.072 4.906 0.060 1.00 0.00 N ATOM 1205 CA LEU A 79 -6.529 5.723 1.171 1.00 0.00 C ATOM 1206 C LEU A 79 -6.746 7.162 0.706 1.00 0.00 C ATOM 1207 O LEU A 79 -5.932 7.709 -0.039 1.00 0.00 O ATOM 1208 CB LEU A 79 -5.489 5.674 2.283 1.00 0.00 C ATOM 1209 CG LEU A 79 -5.952 6.119 3.669 1.00 0.00 C ATOM 1210 CD1 LEU A 79 -6.496 7.538 3.634 1.00 0.00 C ATOM 1211 CD2 LEU A 79 -6.996 5.157 4.218 1.00 0.00 C ATOM 0 H LEU A 79 -5.068 4.955 -0.113 1.00 0.00 H new ATOM 0 HA LEU A 79 -7.477 5.338 1.547 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -5.119 4.652 2.359 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -4.645 6.298 1.989 1.00 0.00 H new ATOM 0 HG LEU A 79 -5.088 6.107 4.333 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -6.818 7.829 4.634 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -5.716 8.218 3.292 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -7.344 7.586 2.951 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -7.314 5.490 5.206 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -7.856 5.133 3.549 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -6.567 4.158 4.293 1.00 0.00 H new ATOM 1223 N GLU A 80 -7.847 7.769 1.134 1.00 0.00 N ATOM 1224 CA GLU A 80 -8.156 9.141 0.744 1.00 0.00 C ATOM 1225 C GLU A 80 -8.619 9.964 1.941 1.00 0.00 C ATOM 1226 O GLU A 80 -9.009 9.416 2.971 1.00 0.00 O ATOM 1227 CB GLU A 80 -9.231 9.153 -0.344 1.00 0.00 C ATOM 1228 CG GLU A 80 -9.340 10.485 -1.071 1.00 0.00 C ATOM 1229 CD GLU A 80 -10.296 10.428 -2.245 1.00 0.00 C ATOM 1230 OE1 GLU A 80 -10.511 9.323 -2.786 1.00 0.00 O ATOM 1231 OE2 GLU A 80 -10.834 11.490 -2.625 1.00 0.00 O ATOM 0 H GLU A 80 -8.537 7.336 1.748 1.00 0.00 H new ATOM 0 HA GLU A 80 -7.244 9.591 0.353 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -9.013 8.369 -1.069 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -10.195 8.913 0.105 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -9.674 11.251 -0.371 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -8.353 10.784 -1.424 1.00 0.00 H new ATOM 1238 N ASP A 81 -8.574 11.287 1.795 1.00 0.00 N ATOM 1239 CA ASP A 81 -8.990 12.194 2.861 1.00 0.00 C ATOM 1240 C ASP A 81 -10.360 11.803 3.410 1.00 0.00 C ATOM 1241 O ASP A 81 -10.654 12.023 4.586 1.00 0.00 O ATOM 1242 CB ASP A 81 -9.027 13.634 2.348 1.00 0.00 C ATOM 1243 CG ASP A 81 -9.026 14.650 3.474 1.00 0.00 C ATOM 1244 OD1 ASP A 81 -8.301 14.435 4.467 1.00 0.00 O ATOM 1245 OD2 ASP A 81 -9.751 15.661 3.361 1.00 0.00 O ATOM 0 H ASP A 81 -8.253 11.754 0.947 1.00 0.00 H new ATOM 0 HA ASP A 81 -8.262 12.120 3.669 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -8.166 13.809 1.704 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -9.917 13.776 1.735 1.00 0.00 H new ATOM 1250 N GLU A 82 -11.193 11.219 2.554 1.00 0.00 N ATOM 1251 CA GLU A 82 -12.528 10.794 2.956 1.00 0.00 C ATOM 1252 C GLU A 82 -12.453 9.805 4.115 1.00 0.00 C ATOM 1253 O GLU A 82 -13.336 9.764 4.971 1.00 0.00 O ATOM 1254 CB GLU A 82 -13.263 10.159 1.773 1.00 0.00 C ATOM 1255 CG GLU A 82 -14.208 11.114 1.061 1.00 0.00 C ATOM 1256 CD GLU A 82 -14.211 10.919 -0.443 1.00 0.00 C ATOM 1257 OE1 GLU A 82 -14.162 9.754 -0.890 1.00 0.00 O ATOM 1258 OE2 GLU A 82 -14.264 11.932 -1.172 1.00 0.00 O ATOM 0 H GLU A 82 -10.966 11.030 1.578 1.00 0.00 H new ATOM 0 HA GLU A 82 -13.081 11.674 3.285 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -12.530 9.786 1.058 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -13.829 9.298 2.128 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -15.219 10.972 1.444 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -13.922 12.141 1.290 1.00 0.00 H new ATOM 1265 N GLU A 83 -11.386 9.012 4.135 1.00 0.00 N ATOM 1266 CA GLU A 83 -11.184 8.025 5.188 1.00 0.00 C ATOM 1267 C GLU A 83 -9.858 8.264 5.902 1.00 0.00 C ATOM 1268 O GLU A 83 -8.807 7.819 5.444 1.00 0.00 O ATOM 1269 CB GLU A 83 -11.215 6.611 4.603 1.00 0.00 C ATOM 1270 CG GLU A 83 -11.526 5.535 5.630 1.00 0.00 C ATOM 1271 CD GLU A 83 -12.619 4.589 5.172 1.00 0.00 C ATOM 1272 OE1 GLU A 83 -13.808 4.943 5.311 1.00 0.00 O ATOM 1273 OE2 GLU A 83 -12.285 3.494 4.673 1.00 0.00 O ATOM 0 H GLU A 83 -10.647 9.035 3.432 1.00 0.00 H new ATOM 0 HA GLU A 83 -11.992 8.127 5.912 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -11.962 6.571 3.810 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -10.250 6.395 4.144 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -10.621 4.965 5.838 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -11.828 6.007 6.565 1.00 0.00 H new ATOM 1280 N GLU A 84 -9.915 8.974 7.024 1.00 0.00 N ATOM 1281 CA GLU A 84 -8.718 9.278 7.798 1.00 0.00 C ATOM 1282 C GLU A 84 -8.539 8.283 8.945 1.00 0.00 C ATOM 1283 O GLU A 84 -9.187 8.404 9.986 1.00 0.00 O ATOM 1284 CB GLU A 84 -8.796 10.704 8.350 1.00 0.00 C ATOM 1285 CG GLU A 84 -7.490 11.475 8.228 1.00 0.00 C ATOM 1286 CD GLU A 84 -6.854 11.762 9.576 1.00 0.00 C ATOM 1287 OE1 GLU A 84 -7.429 12.561 10.344 1.00 0.00 O ATOM 1288 OE2 GLU A 84 -5.782 11.188 9.860 1.00 0.00 O ATOM 0 H GLU A 84 -10.778 9.350 7.417 1.00 0.00 H new ATOM 0 HA GLU A 84 -7.856 9.196 7.136 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -9.580 11.247 7.822 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -9.088 10.663 9.399 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -6.792 10.905 7.615 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -7.675 12.416 7.710 1.00 0.00 H new ATOM 1295 N PRO A 85 -7.654 7.285 8.774 1.00 0.00 N ATOM 1296 CA PRO A 85 -7.398 6.275 9.807 1.00 0.00 C ATOM 1297 C PRO A 85 -6.675 6.853 11.021 1.00 0.00 C ATOM 1298 O PRO A 85 -6.688 6.263 12.101 1.00 0.00 O ATOM 1299 CB PRO A 85 -6.508 5.252 9.095 1.00 0.00 C ATOM 1300 CG PRO A 85 -5.836 6.026 8.015 1.00 0.00 C ATOM 1301 CD PRO A 85 -6.831 7.060 7.569 1.00 0.00 C ATOM 0 HA PRO A 85 -8.324 5.855 10.200 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -5.782 4.814 9.780 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -7.097 4.431 8.687 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -4.923 6.495 8.381 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -5.551 5.376 7.188 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -6.339 7.976 7.242 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -7.432 6.704 6.732 1.00 0.00 H new ATOM 1309 N LYS A 86 -6.044 8.009 10.836 1.00 0.00 N ATOM 1310 CA LYS A 86 -5.316 8.665 11.916 1.00 0.00 C ATOM 1311 C LYS A 86 -4.185 7.776 12.426 1.00 0.00 C ATOM 1312 O LYS A 86 -4.095 7.486 13.619 1.00 0.00 O ATOM 1313 CB LYS A 86 -6.267 9.009 13.065 1.00 0.00 C ATOM 1314 CG LYS A 86 -7.139 10.223 12.784 1.00 0.00 C ATOM 1315 CD LYS A 86 -8.613 9.918 12.999 1.00 0.00 C ATOM 1316 CE LYS A 86 -9.093 10.409 14.355 1.00 0.00 C ATOM 1317 NZ LYS A 86 -10.579 10.390 14.459 1.00 0.00 N ATOM 0 H LYS A 86 -6.023 8.510 9.948 1.00 0.00 H new ATOM 0 HA LYS A 86 -4.883 9.585 11.524 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -6.907 8.150 13.267 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -5.684 9.191 13.968 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -6.839 11.045 13.434 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -6.982 10.554 11.758 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -9.201 10.389 12.212 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -8.778 8.843 12.921 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -8.666 9.784 15.139 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -8.730 11.423 14.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -10.866 10.732 15.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -10.986 11.007 13.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -10.924 9.418 14.324 1.00 0.00 H new ATOM 1331 N ASP A 87 -3.322 7.346 11.511 1.00 0.00 N ATOM 1332 CA ASP A 87 -2.196 6.490 11.866 1.00 0.00 C ATOM 1333 C ASP A 87 -0.925 6.931 11.146 1.00 0.00 C ATOM 1334 O ASP A 87 -0.967 7.343 9.989 1.00 0.00 O ATOM 1335 CB ASP A 87 -2.511 5.032 11.523 1.00 0.00 C ATOM 1336 CG ASP A 87 -2.155 4.085 12.653 1.00 0.00 C ATOM 1337 OD1 ASP A 87 -3.012 3.862 13.533 1.00 0.00 O ATOM 1338 OD2 ASP A 87 -1.019 3.566 12.656 1.00 0.00 O ATOM 0 H ASP A 87 -3.381 7.576 10.519 1.00 0.00 H new ATOM 0 HA ASP A 87 -2.030 6.578 12.940 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -3.572 4.936 11.292 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -1.963 4.746 10.626 1.00 0.00 H new ATOM 1343 N GLU A 88 0.204 6.834 11.842 1.00 0.00 N ATOM 1344 CA GLU A 88 1.496 7.216 11.278 1.00 0.00 C ATOM 1345 C GLU A 88 1.825 6.412 10.021 1.00 0.00 C ATOM 1346 O GLU A 88 2.738 6.765 9.274 1.00 0.00 O ATOM 1347 CB GLU A 88 2.600 7.032 12.320 1.00 0.00 C ATOM 1348 CG GLU A 88 2.983 8.319 13.025 1.00 0.00 C ATOM 1349 CD GLU A 88 1.940 8.770 14.029 1.00 0.00 C ATOM 1350 OE1 GLU A 88 1.797 8.103 15.076 1.00 0.00 O ATOM 1351 OE2 GLU A 88 1.265 9.788 13.768 1.00 0.00 O ATOM 0 H GLU A 88 0.251 6.493 12.802 1.00 0.00 H new ATOM 0 HA GLU A 88 1.435 8.267 10.995 1.00 0.00 H new ATOM 0 HB2 GLU A 88 2.272 6.304 13.062 1.00 0.00 H new ATOM 0 HB3 GLU A 88 3.483 6.616 11.834 1.00 0.00 H new ATOM 0 HG2 GLU A 88 3.936 8.179 13.535 1.00 0.00 H new ATOM 0 HG3 GLU A 88 3.131 9.104 12.284 1.00 0.00 H new ATOM 1358 N ASP A 89 1.088 5.324 9.794 1.00 0.00 N ATOM 1359 CA ASP A 89 1.313 4.467 8.629 1.00 0.00 C ATOM 1360 C ASP A 89 1.508 5.283 7.348 1.00 0.00 C ATOM 1361 O ASP A 89 2.163 4.827 6.413 1.00 0.00 O ATOM 1362 CB ASP A 89 0.142 3.497 8.453 1.00 0.00 C ATOM 1363 CG ASP A 89 0.253 2.285 9.358 1.00 0.00 C ATOM 1364 OD1 ASP A 89 0.518 2.467 10.565 1.00 0.00 O ATOM 1365 OD2 ASP A 89 0.078 1.151 8.860 1.00 0.00 O ATOM 0 H ASP A 89 0.329 5.015 10.402 1.00 0.00 H new ATOM 0 HA ASP A 89 2.230 3.906 8.809 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -0.792 4.018 8.662 1.00 0.00 H new ATOM 0 HB3 ASP A 89 0.099 3.169 7.415 1.00 0.00 H new ATOM 1370 N PHE A 90 0.944 6.487 7.306 1.00 0.00 N ATOM 1371 CA PHE A 90 1.076 7.340 6.129 1.00 0.00 C ATOM 1372 C PHE A 90 2.533 7.753 5.910 1.00 0.00 C ATOM 1373 O PHE A 90 2.961 7.966 4.776 1.00 0.00 O ATOM 1374 CB PHE A 90 0.187 8.581 6.261 1.00 0.00 C ATOM 1375 CG PHE A 90 0.481 9.416 7.474 1.00 0.00 C ATOM 1376 CD1 PHE A 90 1.671 10.115 7.581 1.00 0.00 C ATOM 1377 CD2 PHE A 90 -0.437 9.501 8.506 1.00 0.00 C ATOM 1378 CE1 PHE A 90 1.940 10.885 8.697 1.00 0.00 C ATOM 1379 CE2 PHE A 90 -0.175 10.267 9.624 1.00 0.00 C ATOM 1380 CZ PHE A 90 1.016 10.960 9.720 1.00 0.00 C ATOM 0 H PHE A 90 0.396 6.891 8.066 1.00 0.00 H new ATOM 0 HA PHE A 90 0.750 6.766 5.261 1.00 0.00 H new ATOM 0 HB2 PHE A 90 0.307 9.198 5.370 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -0.856 8.266 6.293 1.00 0.00 H new ATOM 0 HD1 PHE A 90 2.397 10.058 6.784 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -1.370 8.961 8.436 1.00 0.00 H new ATOM 0 HE1 PHE A 90 2.871 11.427 8.769 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -0.900 10.324 10.422 1.00 0.00 H new ATOM 0 HZ PHE A 90 1.224 11.560 10.594 1.00 0.00 H new ATOM 1390 N SER A 91 3.288 7.852 7.002 1.00 0.00 N ATOM 1391 CA SER A 91 4.700 8.224 6.935 1.00 0.00 C ATOM 1392 C SER A 91 5.432 7.808 8.210 1.00 0.00 C ATOM 1393 O SER A 91 5.925 8.653 8.958 1.00 0.00 O ATOM 1394 CB SER A 91 4.858 9.733 6.715 1.00 0.00 C ATOM 1395 OG SER A 91 6.169 10.045 6.278 1.00 0.00 O ATOM 0 H SER A 91 2.944 7.679 7.947 1.00 0.00 H new ATOM 0 HA SER A 91 5.141 7.698 6.088 1.00 0.00 H new ATOM 0 HB2 SER A 91 4.133 10.075 5.976 1.00 0.00 H new ATOM 0 HB3 SER A 91 4.643 10.264 7.642 1.00 0.00 H new ATOM 0 HG SER A 91 6.817 9.746 6.949 1.00 0.00 H new ATOM 1401 N PRO A 92 5.517 6.492 8.473 1.00 0.00 N ATOM 1402 CA PRO A 92 6.195 5.968 9.661 1.00 0.00 C ATOM 1403 C PRO A 92 7.703 6.195 9.607 1.00 0.00 C ATOM 1404 O PRO A 92 8.377 6.207 10.637 1.00 0.00 O ATOM 1405 CB PRO A 92 5.868 4.472 9.631 1.00 0.00 C ATOM 1406 CG PRO A 92 5.580 4.171 8.203 1.00 0.00 C ATOM 1407 CD PRO A 92 4.963 5.417 7.632 1.00 0.00 C ATOM 0 HA PRO A 92 5.866 6.464 10.574 1.00 0.00 H new ATOM 0 HB2 PRO A 92 6.704 3.878 9.999 1.00 0.00 H new ATOM 0 HB3 PRO A 92 5.011 4.242 10.264 1.00 0.00 H new ATOM 0 HG2 PRO A 92 6.493 3.907 7.668 1.00 0.00 H new ATOM 0 HG3 PRO A 92 4.901 3.323 8.112 1.00 0.00 H new ATOM 0 HD2 PRO A 92 5.227 5.551 6.583 1.00 0.00 H new ATOM 0 HD3 PRO A 92 3.875 5.386 7.685 1.00 0.00 H new ATOM 1415 N ASP A 93 8.223 6.381 8.397 1.00 0.00 N ATOM 1416 CA ASP A 93 9.648 6.615 8.203 1.00 0.00 C ATOM 1417 C ASP A 93 9.908 7.246 6.838 1.00 0.00 C ATOM 1418 O ASP A 93 10.969 7.052 6.244 1.00 0.00 O ATOM 1419 CB ASP A 93 10.429 5.306 8.329 1.00 0.00 C ATOM 1420 CG ASP A 93 11.863 5.529 8.768 1.00 0.00 C ATOM 1421 OD1 ASP A 93 12.517 6.438 8.215 1.00 0.00 O ATOM 1422 OD2 ASP A 93 12.331 4.793 9.662 1.00 0.00 O ATOM 0 H ASP A 93 7.677 6.374 7.536 1.00 0.00 H new ATOM 0 HA ASP A 93 9.987 7.303 8.978 1.00 0.00 H new ATOM 0 HB2 ASP A 93 9.929 4.655 9.047 1.00 0.00 H new ATOM 0 HB3 ASP A 93 10.422 4.788 7.370 1.00 0.00 H new ATOM 1427 N GLY A 94 8.933 8.005 6.348 1.00 0.00 N ATOM 1428 CA GLY A 94 9.073 8.654 5.059 1.00 0.00 C ATOM 1429 C GLY A 94 9.388 10.131 5.190 1.00 0.00 C ATOM 1430 O GLY A 94 10.554 10.520 5.256 1.00 0.00 O ATOM 0 H GLY A 94 8.047 8.182 6.822 1.00 0.00 H new ATOM 0 HA2 GLY A 94 9.865 8.165 4.492 1.00 0.00 H new ATOM 0 HA3 GLY A 94 8.151 8.530 4.490 1.00 0.00 H new ATOM 1434 N GLY A 95 8.346 10.957 5.231 1.00 0.00 N ATOM 1435 CA GLY A 95 8.543 12.388 5.359 1.00 0.00 C ATOM 1436 C GLY A 95 7.527 13.188 4.566 1.00 0.00 C ATOM 1437 O GLY A 95 7.888 14.105 3.828 1.00 0.00 O ATOM 0 H GLY A 95 7.371 10.661 5.178 1.00 0.00 H new ATOM 0 HA2 GLY A 95 8.480 12.667 6.411 1.00 0.00 H new ATOM 0 HA3 GLY A 95 9.547 12.645 5.021 1.00 0.00 H new ATOM 1441 N TYR A 96 6.258 12.839 4.722 1.00 0.00 N ATOM 1442 CA TYR A 96 5.180 13.526 4.022 1.00 0.00 C ATOM 1443 C TYR A 96 3.829 13.002 4.497 1.00 0.00 C ATOM 1444 O TYR A 96 3.763 12.216 5.442 1.00 0.00 O ATOM 1445 CB TYR A 96 5.318 13.357 2.505 1.00 0.00 C ATOM 1446 CG TYR A 96 6.037 12.092 2.091 1.00 0.00 C ATOM 1447 CD1 TYR A 96 5.464 10.847 2.304 1.00 0.00 C ATOM 1448 CD2 TYR A 96 7.286 12.144 1.483 1.00 0.00 C ATOM 1449 CE1 TYR A 96 6.111 9.689 1.925 1.00 0.00 C ATOM 1450 CE2 TYR A 96 7.941 10.990 1.100 1.00 0.00 C ATOM 1451 CZ TYR A 96 7.349 9.765 1.323 1.00 0.00 C ATOM 1452 OH TYR A 96 7.999 8.611 0.945 1.00 0.00 O ATOM 0 H TYR A 96 5.948 12.081 5.330 1.00 0.00 H new ATOM 0 HA TYR A 96 5.245 14.590 4.250 1.00 0.00 H new ATOM 0 HB2 TYR A 96 4.324 13.361 2.057 1.00 0.00 H new ATOM 0 HB3 TYR A 96 5.853 14.216 2.101 1.00 0.00 H new ATOM 0 HD1 TYR A 96 4.494 10.783 2.775 1.00 0.00 H new ATOM 0 HD2 TYR A 96 7.752 13.102 1.307 1.00 0.00 H new ATOM 0 HE1 TYR A 96 5.650 8.728 2.099 1.00 0.00 H new ATOM 0 HE2 TYR A 96 8.911 11.047 0.629 1.00 0.00 H new ATOM 0 HH TYR A 96 8.708 8.409 1.590 1.00 0.00 H new ATOM 1462 N ILE A 97 2.754 13.443 3.853 1.00 0.00 N ATOM 1463 CA ILE A 97 1.417 13.008 4.244 1.00 0.00 C ATOM 1464 C ILE A 97 0.453 12.965 3.014 1.00 0.00 C ATOM 1465 O ILE A 97 -0.171 14.011 2.867 1.00 0.00 O ATOM 1466 CB ILE A 97 0.869 13.918 5.378 1.00 0.00 C ATOM 1467 CG1 ILE A 97 0.486 15.311 4.875 1.00 0.00 C ATOM 1468 CG2 ILE A 97 1.901 14.036 6.488 1.00 0.00 C ATOM 1469 CD1 ILE A 97 1.483 15.923 3.908 1.00 0.00 C ATOM 0 H ILE A 97 2.780 14.093 3.068 1.00 0.00 H new ATOM 0 HA ILE A 97 1.480 11.991 4.630 1.00 0.00 H new ATOM 0 HB ILE A 97 -0.039 13.450 5.760 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -0.487 15.253 4.387 1.00 0.00 H new ATOM 0 HG13 ILE A 97 0.374 15.976 5.732 1.00 0.00 H new ATOM 0 HG21 ILE A 97 1.512 14.675 7.280 1.00 0.00 H new ATOM 0 HG22 ILE A 97 2.115 13.047 6.892 1.00 0.00 H new ATOM 0 HG23 ILE A 97 2.817 14.471 6.088 1.00 0.00 H new ATOM 0 HD11 ILE A 97 1.134 16.909 3.602 1.00 0.00 H new ATOM 0 HD12 ILE A 97 2.453 16.017 4.396 1.00 0.00 H new ATOM 0 HD13 ILE A 97 1.579 15.283 3.031 1.00 0.00 H new ATOM 1481 N PRO A 98 -0.293 11.824 2.950 1.00 0.00 N ATOM 1482 CA PRO A 98 0.006 10.354 3.048 1.00 0.00 C ATOM 1483 C PRO A 98 0.498 9.800 1.716 1.00 0.00 C ATOM 1484 O PRO A 98 0.061 10.254 0.652 1.00 0.00 O ATOM 1485 CB PRO A 98 -1.327 9.727 3.405 1.00 0.00 C ATOM 1486 CG PRO A 98 -1.702 10.619 4.461 1.00 0.00 C ATOM 1487 CD PRO A 98 -0.537 11.554 4.439 1.00 0.00 C ATOM 0 HA PRO A 98 0.789 10.146 3.777 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -2.034 9.732 2.575 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -1.233 8.693 3.737 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -2.646 11.126 4.262 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -1.809 10.109 5.419 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -0.756 12.475 4.979 1.00 0.00 H new ATOM 0 HD3 PRO A 98 0.339 11.109 4.911 1.00 0.00 H new ATOM 1495 N ARG A 99 1.417 8.834 1.778 1.00 0.00 N ATOM 1496 CA ARG A 99 1.996 8.234 0.581 1.00 0.00 C ATOM 1497 C ARG A 99 1.853 6.706 0.571 1.00 0.00 C ATOM 1498 O ARG A 99 1.128 6.130 1.382 1.00 0.00 O ATOM 1499 CB ARG A 99 3.470 8.627 0.491 1.00 0.00 C ATOM 1500 CG ARG A 99 3.720 9.881 -0.329 1.00 0.00 C ATOM 1501 CD ARG A 99 3.022 11.096 0.263 1.00 0.00 C ATOM 1502 NE ARG A 99 3.442 12.338 -0.380 1.00 0.00 N ATOM 1503 CZ ARG A 99 3.066 12.701 -1.605 1.00 0.00 C ATOM 1504 NH1 ARG A 99 2.271 11.917 -2.323 1.00 0.00 N ATOM 1505 NH2 ARG A 99 3.487 13.852 -2.114 1.00 0.00 N ATOM 0 H ARG A 99 1.776 8.451 2.652 1.00 0.00 H new ATOM 0 HA ARG A 99 1.452 8.609 -0.285 1.00 0.00 H new ATOM 0 HB2 ARG A 99 3.858 8.779 1.498 1.00 0.00 H new ATOM 0 HB3 ARG A 99 4.031 7.801 0.055 1.00 0.00 H new ATOM 0 HG2 ARG A 99 4.792 10.070 -0.385 1.00 0.00 H new ATOM 0 HG3 ARG A 99 3.370 9.723 -1.349 1.00 0.00 H new ATOM 0 HD2 ARG A 99 1.943 10.981 0.158 1.00 0.00 H new ATOM 0 HD3 ARG A 99 3.234 11.151 1.331 1.00 0.00 H new ATOM 0 HE ARG A 99 4.059 12.963 0.139 1.00 0.00 H new ATOM 0 HH11 ARG A 99 1.945 11.031 -1.937 1.00 0.00 H new ATOM 0 HH12 ARG A 99 1.987 12.201 -3.261 1.00 0.00 H new ATOM 0 HH21 ARG A 99 4.098 14.458 -1.567 1.00 0.00 H new ATOM 0 HH22 ARG A 99 3.199 14.130 -3.052 1.00 0.00 H new ATOM 1519 N ILE A 100 2.541 6.063 -0.376 1.00 0.00 N ATOM 1520 CA ILE A 100 2.497 4.606 -0.538 1.00 0.00 C ATOM 1521 C ILE A 100 3.294 3.864 0.539 1.00 0.00 C ATOM 1522 O ILE A 100 4.243 4.401 1.109 1.00 0.00 O ATOM 1523 CB ILE A 100 3.039 4.208 -1.929 1.00 0.00 C ATOM 1524 CG1 ILE A 100 2.129 4.764 -3.025 1.00 0.00 C ATOM 1525 CG2 ILE A 100 3.168 2.694 -2.060 1.00 0.00 C ATOM 1526 CD1 ILE A 100 2.646 6.036 -3.658 1.00 0.00 C ATOM 0 H ILE A 100 3.143 6.535 -1.051 1.00 0.00 H new ATOM 0 HA ILE A 100 1.452 4.314 -0.437 1.00 0.00 H new ATOM 0 HB ILE A 100 4.034 4.637 -2.042 1.00 0.00 H new ATOM 0 HG12 ILE A 100 2.005 4.008 -3.800 1.00 0.00 H new ATOM 0 HG13 ILE A 100 1.142 4.954 -2.604 1.00 0.00 H new ATOM 0 HG21 ILE A 100 3.552 2.446 -3.050 1.00 0.00 H new ATOM 0 HG22 ILE A 100 3.855 2.320 -1.300 1.00 0.00 H new ATOM 0 HG23 ILE A 100 2.190 2.232 -1.924 1.00 0.00 H new ATOM 0 HD11 ILE A 100 1.948 6.370 -4.426 1.00 0.00 H new ATOM 0 HD12 ILE A 100 2.744 6.808 -2.895 1.00 0.00 H new ATOM 0 HD13 ILE A 100 3.620 5.848 -4.110 1.00 0.00 H new ATOM 1538 N LEU A 101 2.898 2.612 0.795 1.00 0.00 N ATOM 1539 CA LEU A 101 3.569 1.769 1.788 1.00 0.00 C ATOM 1540 C LEU A 101 2.914 0.391 1.884 1.00 0.00 C ATOM 1541 O LEU A 101 1.689 0.278 1.899 1.00 0.00 O ATOM 1542 CB LEU A 101 3.567 2.445 3.160 1.00 0.00 C ATOM 1543 CG LEU A 101 2.357 3.340 3.450 1.00 0.00 C ATOM 1544 CD1 LEU A 101 1.558 2.786 4.611 1.00 0.00 C ATOM 1545 CD2 LEU A 101 2.798 4.764 3.752 1.00 0.00 C ATOM 0 H LEU A 101 2.113 2.160 0.326 1.00 0.00 H new ATOM 0 HA LEU A 101 4.600 1.634 1.460 1.00 0.00 H new ATOM 0 HB2 LEU A 101 3.618 1.672 3.927 1.00 0.00 H new ATOM 0 HB3 LEU A 101 4.472 3.046 3.252 1.00 0.00 H new ATOM 0 HG LEU A 101 1.725 3.356 2.562 1.00 0.00 H new ATOM 0 HD11 LEU A 101 0.702 3.432 4.805 1.00 0.00 H new ATOM 0 HD12 LEU A 101 1.207 1.783 4.366 1.00 0.00 H new ATOM 0 HD13 LEU A 101 2.189 2.743 5.499 1.00 0.00 H new ATOM 0 HD21 LEU A 101 1.922 5.381 3.955 1.00 0.00 H new ATOM 0 HD22 LEU A 101 3.452 4.765 4.624 1.00 0.00 H new ATOM 0 HD23 LEU A 101 3.336 5.168 2.894 1.00 0.00 H new ATOM 1557 N PHE A 102 3.740 -0.659 1.943 1.00 0.00 N ATOM 1558 CA PHE A 102 3.229 -2.028 2.031 1.00 0.00 C ATOM 1559 C PHE A 102 2.960 -2.436 3.480 1.00 0.00 C ATOM 1560 O PHE A 102 3.668 -2.019 4.396 1.00 0.00 O ATOM 1561 CB PHE A 102 4.224 -3.005 1.400 1.00 0.00 C ATOM 1562 CG PHE A 102 3.577 -4.130 0.641 1.00 0.00 C ATOM 1563 CD1 PHE A 102 2.809 -5.075 1.302 1.00 0.00 C ATOM 1564 CD2 PHE A 102 3.737 -4.243 -0.731 1.00 0.00 C ATOM 1565 CE1 PHE A 102 2.214 -6.111 0.609 1.00 0.00 C ATOM 1566 CE2 PHE A 102 3.145 -5.278 -1.429 1.00 0.00 C ATOM 1567 CZ PHE A 102 2.382 -6.213 -0.758 1.00 0.00 C ATOM 0 H PHE A 102 4.757 -0.587 1.931 1.00 0.00 H new ATOM 0 HA PHE A 102 2.285 -2.062 1.486 1.00 0.00 H new ATOM 0 HB2 PHE A 102 4.880 -2.455 0.725 1.00 0.00 H new ATOM 0 HB3 PHE A 102 4.853 -3.424 2.185 1.00 0.00 H new ATOM 0 HD1 PHE A 102 2.674 -5.001 2.371 1.00 0.00 H new ATOM 0 HD2 PHE A 102 4.331 -3.513 -1.261 1.00 0.00 H new ATOM 0 HE1 PHE A 102 1.618 -6.841 1.136 1.00 0.00 H new ATOM 0 HE2 PHE A 102 3.279 -5.356 -2.498 1.00 0.00 H new ATOM 0 HZ PHE A 102 1.917 -7.023 -1.301 1.00 0.00 H new ATOM 1577 N LEU A 103 1.934 -3.263 3.671 1.00 0.00 N ATOM 1578 CA LEU A 103 1.568 -3.744 5.004 1.00 0.00 C ATOM 1579 C LEU A 103 1.263 -5.240 4.985 1.00 0.00 C ATOM 1580 O LEU A 103 0.842 -5.794 3.966 1.00 0.00 O ATOM 1581 CB LEU A 103 0.350 -2.985 5.553 1.00 0.00 C ATOM 1582 CG LEU A 103 -0.140 -1.812 4.709 1.00 0.00 C ATOM 1583 CD1 LEU A 103 -1.089 -2.301 3.626 1.00 0.00 C ATOM 1584 CD2 LEU A 103 -0.818 -0.770 5.588 1.00 0.00 C ATOM 0 H LEU A 103 1.340 -3.615 2.920 1.00 0.00 H new ATOM 0 HA LEU A 103 2.423 -3.563 5.656 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -0.472 -3.692 5.670 1.00 0.00 H new ATOM 0 HB3 LEU A 103 0.596 -2.614 6.548 1.00 0.00 H new ATOM 0 HG LEU A 103 0.720 -1.346 4.228 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -1.431 -1.453 3.032 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -0.571 -3.011 2.981 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -1.947 -2.790 4.088 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -1.161 0.060 4.970 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -1.670 -1.221 6.096 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -0.108 -0.401 6.329 1.00 0.00 H new ATOM 1596 N ASP A 104 1.466 -5.883 6.132 1.00 0.00 N ATOM 1597 CA ASP A 104 1.203 -7.307 6.269 1.00 0.00 C ATOM 1598 C ASP A 104 -0.295 -7.578 6.158 1.00 0.00 C ATOM 1599 O ASP A 104 -1.106 -6.807 6.678 1.00 0.00 O ATOM 1600 CB ASP A 104 1.732 -7.816 7.613 1.00 0.00 C ATOM 1601 CG ASP A 104 2.160 -9.269 7.557 1.00 0.00 C ATOM 1602 OD1 ASP A 104 1.273 -10.150 7.564 1.00 0.00 O ATOM 1603 OD2 ASP A 104 3.381 -9.529 7.506 1.00 0.00 O ATOM 0 H ASP A 104 1.813 -5.436 6.981 1.00 0.00 H new ATOM 0 HA ASP A 104 1.717 -7.837 5.467 1.00 0.00 H new ATOM 0 HB2 ASP A 104 2.579 -7.203 7.922 1.00 0.00 H new ATOM 0 HB3 ASP A 104 0.959 -7.698 8.372 1.00 0.00 H new ATOM 1608 N PRO A 105 -0.682 -8.675 5.473 1.00 0.00 N ATOM 1609 CA PRO A 105 -2.087 -9.049 5.284 1.00 0.00 C ATOM 1610 C PRO A 105 -2.898 -8.948 6.571 1.00 0.00 C ATOM 1611 O PRO A 105 -3.031 -9.922 7.312 1.00 0.00 O ATOM 1612 CB PRO A 105 -2.023 -10.508 4.799 1.00 0.00 C ATOM 1613 CG PRO A 105 -0.583 -10.908 4.869 1.00 0.00 C ATOM 1614 CD PRO A 105 0.214 -9.636 4.822 1.00 0.00 C ATOM 0 HA PRO A 105 -2.586 -8.381 4.582 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -2.637 -11.154 5.426 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -2.403 -10.597 3.781 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -0.378 -11.461 5.786 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -0.321 -11.561 4.037 1.00 0.00 H new ATOM 0 HD2 PRO A 105 1.161 -9.731 5.353 1.00 0.00 H new ATOM 0 HD3 PRO A 105 0.450 -9.342 3.799 1.00 0.00 H new ATOM 1622 N SER A 106 -3.435 -7.758 6.822 1.00 0.00 N ATOM 1623 CA SER A 106 -4.239 -7.496 8.013 1.00 0.00 C ATOM 1624 C SER A 106 -4.375 -5.994 8.233 1.00 0.00 C ATOM 1625 O SER A 106 -5.387 -5.517 8.745 1.00 0.00 O ATOM 1626 CB SER A 106 -3.612 -8.144 9.253 1.00 0.00 C ATOM 1627 OG SER A 106 -2.199 -8.042 9.221 1.00 0.00 O ATOM 0 H SER A 106 -3.326 -6.950 6.209 1.00 0.00 H new ATOM 0 HA SER A 106 -5.226 -7.931 7.857 1.00 0.00 H new ATOM 0 HB2 SER A 106 -3.995 -7.661 10.152 1.00 0.00 H new ATOM 0 HB3 SER A 106 -3.903 -9.193 9.306 1.00 0.00 H new ATOM 0 HG SER A 106 -1.823 -8.461 10.023 1.00 0.00 H new ATOM 1633 N GLY A 107 -3.343 -5.254 7.838 1.00 0.00 N ATOM 1634 CA GLY A 107 -3.356 -3.813 7.993 1.00 0.00 C ATOM 1635 C GLY A 107 -2.245 -3.321 8.899 1.00 0.00 C ATOM 1636 O GLY A 107 -2.423 -2.355 9.641 1.00 0.00 O ATOM 0 H GLY A 107 -2.496 -5.630 7.412 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -3.258 -3.344 7.014 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -4.318 -3.502 8.400 1.00 0.00 H new ATOM 1640 N LYS A 108 -1.094 -3.988 8.845 1.00 0.00 N ATOM 1641 CA LYS A 108 0.045 -3.605 9.677 1.00 0.00 C ATOM 1642 C LYS A 108 1.244 -3.208 8.823 1.00 0.00 C ATOM 1643 O LYS A 108 2.079 -4.048 8.483 1.00 0.00 O ATOM 1644 CB LYS A 108 0.427 -4.754 10.613 1.00 0.00 C ATOM 1645 CG LYS A 108 -0.159 -4.622 12.008 1.00 0.00 C ATOM 1646 CD LYS A 108 0.816 -5.107 13.069 1.00 0.00 C ATOM 1647 CE LYS A 108 0.212 -5.023 14.460 1.00 0.00 C ATOM 1648 NZ LYS A 108 -0.668 -6.189 14.754 1.00 0.00 N ATOM 0 H LYS A 108 -0.926 -4.791 8.239 1.00 0.00 H new ATOM 0 HA LYS A 108 -0.250 -2.741 10.272 1.00 0.00 H new ATOM 0 HB2 LYS A 108 0.093 -5.695 10.175 1.00 0.00 H new ATOM 0 HB3 LYS A 108 1.513 -4.805 10.688 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -0.417 -3.580 12.198 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -1.083 -5.196 12.072 1.00 0.00 H new ATOM 0 HD2 LYS A 108 1.103 -6.137 12.857 1.00 0.00 H new ATOM 0 HD3 LYS A 108 1.726 -4.508 13.030 1.00 0.00 H new ATOM 0 HE2 LYS A 108 1.011 -4.975 15.200 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -0.363 -4.102 14.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -1.061 -6.095 15.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -1.445 -6.221 14.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -0.114 -7.067 14.692 1.00 0.00 H new ATOM 1662 N VAL A 109 1.327 -1.927 8.472 1.00 0.00 N ATOM 1663 CA VAL A 109 2.425 -1.432 7.654 1.00 0.00 C ATOM 1664 C VAL A 109 3.758 -1.572 8.363 1.00 0.00 C ATOM 1665 O VAL A 109 3.917 -1.170 9.515 1.00 0.00 O ATOM 1666 CB VAL A 109 2.222 0.043 7.241 1.00 0.00 C ATOM 1667 CG1 VAL A 109 2.748 0.995 8.309 1.00 0.00 C ATOM 1668 CG2 VAL A 109 2.899 0.313 5.906 1.00 0.00 C ATOM 0 H VAL A 109 0.647 -1.216 8.742 1.00 0.00 H new ATOM 0 HA VAL A 109 2.433 -2.048 6.755 1.00 0.00 H new ATOM 0 HB VAL A 109 1.152 0.220 7.136 1.00 0.00 H new ATOM 0 HG11 VAL A 109 2.590 2.025 7.988 1.00 0.00 H new ATOM 0 HG12 VAL A 109 2.217 0.821 9.245 1.00 0.00 H new ATOM 0 HG13 VAL A 109 3.814 0.821 8.459 1.00 0.00 H new ATOM 0 HG21 VAL A 109 2.749 1.356 5.626 1.00 0.00 H new ATOM 0 HG22 VAL A 109 3.967 0.111 5.992 1.00 0.00 H new ATOM 0 HG23 VAL A 109 2.468 -0.334 5.142 1.00 0.00 H new ATOM 1678 N HIS A 110 4.719 -2.117 7.642 1.00 0.00 N ATOM 1679 CA HIS A 110 6.060 -2.290 8.158 1.00 0.00 C ATOM 1680 C HIS A 110 7.030 -1.576 7.232 1.00 0.00 C ATOM 1681 O HIS A 110 6.994 -1.782 6.019 1.00 0.00 O ATOM 1682 CB HIS A 110 6.422 -3.775 8.278 1.00 0.00 C ATOM 1683 CG HIS A 110 5.960 -4.614 7.125 1.00 0.00 C ATOM 1684 ND1 HIS A 110 4.642 -4.694 6.726 1.00 0.00 N ATOM 1685 CD2 HIS A 110 6.652 -5.423 6.287 1.00 0.00 C ATOM 1686 CE1 HIS A 110 4.545 -5.514 5.695 1.00 0.00 C ATOM 1687 NE2 HIS A 110 5.749 -5.969 5.410 1.00 0.00 N ATOM 0 H HIS A 110 4.592 -2.450 6.687 1.00 0.00 H new ATOM 0 HA HIS A 110 6.119 -1.863 9.159 1.00 0.00 H new ATOM 0 HB2 HIS A 110 7.504 -3.868 8.370 1.00 0.00 H new ATOM 0 HB3 HIS A 110 5.989 -4.170 9.197 1.00 0.00 H new ATOM 0 HD2 HIS A 110 7.716 -5.604 6.306 1.00 0.00 H new ATOM 0 HE1 HIS A 110 3.634 -5.769 5.174 1.00 0.00 H new ATOM 0 HE2 HIS A 110 5.973 -6.622 4.659 1.00 0.00 H new ATOM 1696 N PRO A 111 7.898 -0.709 7.776 1.00 0.00 N ATOM 1697 CA PRO A 111 8.865 0.043 6.970 1.00 0.00 C ATOM 1698 C PRO A 111 9.909 -0.864 6.324 1.00 0.00 C ATOM 1699 O PRO A 111 11.089 -0.523 6.263 1.00 0.00 O ATOM 1700 CB PRO A 111 9.524 0.984 7.983 1.00 0.00 C ATOM 1701 CG PRO A 111 9.305 0.338 9.307 1.00 0.00 C ATOM 1702 CD PRO A 111 7.995 -0.383 9.206 1.00 0.00 C ATOM 0 HA PRO A 111 8.386 0.562 6.140 1.00 0.00 H new ATOM 0 HB2 PRO A 111 10.587 1.107 7.775 1.00 0.00 H new ATOM 0 HB3 PRO A 111 9.076 1.977 7.949 1.00 0.00 H new ATOM 0 HG2 PRO A 111 10.114 -0.354 9.541 1.00 0.00 H new ATOM 0 HG3 PRO A 111 9.280 1.081 10.104 1.00 0.00 H new ATOM 0 HD2 PRO A 111 7.981 -1.280 9.825 1.00 0.00 H new ATOM 0 HD3 PRO A 111 7.165 0.243 9.533 1.00 0.00 H new ATOM 1710 N GLU A 112 9.462 -2.021 5.845 1.00 0.00 N ATOM 1711 CA GLU A 112 10.353 -2.981 5.202 1.00 0.00 C ATOM 1712 C GLU A 112 10.187 -2.941 3.687 1.00 0.00 C ATOM 1713 O GLU A 112 11.157 -2.762 2.951 1.00 0.00 O ATOM 1714 CB GLU A 112 10.073 -4.390 5.728 1.00 0.00 C ATOM 1715 CG GLU A 112 11.144 -4.910 6.674 1.00 0.00 C ATOM 1716 CD GLU A 112 11.280 -4.063 7.925 1.00 0.00 C ATOM 1717 OE1 GLU A 112 11.702 -2.893 7.807 1.00 0.00 O ATOM 1718 OE2 GLU A 112 10.965 -4.569 9.022 1.00 0.00 O ATOM 0 H GLU A 112 8.487 -2.317 5.890 1.00 0.00 H new ATOM 0 HA GLU A 112 11.382 -2.711 5.440 1.00 0.00 H new ATOM 0 HB2 GLU A 112 9.113 -4.392 6.243 1.00 0.00 H new ATOM 0 HB3 GLU A 112 9.983 -5.073 4.883 1.00 0.00 H new ATOM 0 HG2 GLU A 112 10.906 -5.935 6.958 1.00 0.00 H new ATOM 0 HG3 GLU A 112 12.101 -4.938 6.153 1.00 0.00 H new ATOM 1725 N ILE A 113 8.951 -3.103 3.226 1.00 0.00 N ATOM 1726 CA ILE A 113 8.661 -3.074 1.799 1.00 0.00 C ATOM 1727 C ILE A 113 8.334 -1.654 1.351 1.00 0.00 C ATOM 1728 O ILE A 113 7.178 -1.209 1.419 1.00 0.00 O ATOM 1729 CB ILE A 113 7.494 -4.006 1.434 1.00 0.00 C ATOM 1730 CG1 ILE A 113 7.701 -5.391 2.052 1.00 0.00 C ATOM 1731 CG2 ILE A 113 7.352 -4.110 -0.077 1.00 0.00 C ATOM 1732 CD1 ILE A 113 8.955 -6.088 1.565 1.00 0.00 C ATOM 0 H ILE A 113 8.136 -3.255 3.820 1.00 0.00 H new ATOM 0 HA ILE A 113 9.554 -3.426 1.282 1.00 0.00 H new ATOM 0 HB ILE A 113 6.574 -3.584 1.839 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.747 -5.293 3.137 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.836 -6.015 1.825 1.00 0.00 H new ATOM 0 HG21 ILE A 113 6.522 -4.773 -0.320 1.00 0.00 H new ATOM 0 HG22 ILE A 113 7.160 -3.121 -0.493 1.00 0.00 H new ATOM 0 HG23 ILE A 113 8.272 -4.510 -0.502 1.00 0.00 H new ATOM 0 HD11 ILE A 113 9.038 -7.064 2.044 1.00 0.00 H new ATOM 0 HD12 ILE A 113 8.903 -6.218 0.484 1.00 0.00 H new ATOM 0 HD13 ILE A 113 9.827 -5.485 1.816 1.00 0.00 H new ATOM 1744 N ILE A 114 9.369 -0.944 0.913 1.00 0.00 N ATOM 1745 CA ILE A 114 9.230 0.435 0.468 1.00 0.00 C ATOM 1746 C ILE A 114 9.833 0.633 -0.919 1.00 0.00 C ATOM 1747 O ILE A 114 10.253 -0.323 -1.571 1.00 0.00 O ATOM 1748 CB ILE A 114 9.945 1.391 1.441 1.00 0.00 C ATOM 1749 CG1 ILE A 114 11.433 1.027 1.543 1.00 0.00 C ATOM 1750 CG2 ILE A 114 9.280 1.362 2.809 1.00 0.00 C ATOM 1751 CD1 ILE A 114 11.726 -0.120 2.488 1.00 0.00 C ATOM 0 H ILE A 114 10.321 -1.307 0.857 1.00 0.00 H new ATOM 0 HA ILE A 114 8.163 0.655 0.437 1.00 0.00 H new ATOM 0 HB ILE A 114 9.866 2.407 1.054 1.00 0.00 H new ATOM 0 HG12 ILE A 114 11.802 0.769 0.550 1.00 0.00 H new ATOM 0 HG13 ILE A 114 11.989 1.905 1.871 1.00 0.00 H new ATOM 0 HG21 ILE A 114 9.801 2.044 3.481 1.00 0.00 H new ATOM 0 HG22 ILE A 114 8.239 1.670 2.714 1.00 0.00 H new ATOM 0 HG23 ILE A 114 9.324 0.351 3.213 1.00 0.00 H new ATOM 0 HD11 ILE A 114 12.798 -0.314 2.503 1.00 0.00 H new ATOM 0 HD12 ILE A 114 11.390 0.141 3.492 1.00 0.00 H new ATOM 0 HD13 ILE A 114 11.200 -1.013 2.150 1.00 0.00 H new ATOM 1763 N ASN A 115 9.895 1.889 -1.350 1.00 0.00 N ATOM 1764 CA ASN A 115 10.472 2.231 -2.641 1.00 0.00 C ATOM 1765 C ASN A 115 11.990 2.288 -2.522 1.00 0.00 C ATOM 1766 O ASN A 115 12.572 3.365 -2.413 1.00 0.00 O ATOM 1767 CB ASN A 115 9.931 3.582 -3.125 1.00 0.00 C ATOM 1768 CG ASN A 115 10.628 4.075 -4.381 1.00 0.00 C ATOM 1769 OD1 ASN A 115 11.375 3.336 -5.021 1.00 0.00 O ATOM 1770 ND2 ASN A 115 10.384 5.331 -4.739 1.00 0.00 N ATOM 0 H ASN A 115 9.550 2.689 -0.819 1.00 0.00 H new ATOM 0 HA ASN A 115 10.196 1.467 -3.368 1.00 0.00 H new ATOM 0 HB2 ASN A 115 8.862 3.493 -3.319 1.00 0.00 H new ATOM 0 HB3 ASN A 115 10.051 4.322 -2.333 1.00 0.00 H new ATOM 0 HD21 ASN A 115 10.823 5.718 -5.574 1.00 0.00 H new ATOM 0 HD22 ASN A 115 9.757 5.909 -4.178 1.00 0.00 H new ATOM 1777 N GLU A 116 12.624 1.121 -2.531 1.00 0.00 N ATOM 1778 CA GLU A 116 14.076 1.035 -2.412 1.00 0.00 C ATOM 1779 C GLU A 116 14.778 1.962 -3.404 1.00 0.00 C ATOM 1780 O GLU A 116 15.917 2.373 -3.181 1.00 0.00 O ATOM 1781 CB GLU A 116 14.537 -0.408 -2.616 1.00 0.00 C ATOM 1782 CG GLU A 116 14.509 -1.232 -1.342 1.00 0.00 C ATOM 1783 CD GLU A 116 15.625 -0.866 -0.385 1.00 0.00 C ATOM 1784 OE1 GLU A 116 15.601 0.262 0.154 1.00 0.00 O ATOM 1785 OE2 GLU A 116 16.526 -1.705 -0.173 1.00 0.00 O ATOM 0 H GLU A 116 12.155 0.220 -2.620 1.00 0.00 H new ATOM 0 HA GLU A 116 14.348 1.359 -1.407 1.00 0.00 H new ATOM 0 HB2 GLU A 116 13.901 -0.884 -3.362 1.00 0.00 H new ATOM 0 HB3 GLU A 116 15.551 -0.405 -3.017 1.00 0.00 H new ATOM 0 HG2 GLU A 116 13.549 -1.092 -0.845 1.00 0.00 H new ATOM 0 HG3 GLU A 116 14.586 -2.289 -1.596 1.00 0.00 H new ATOM 1792 N ASN A 117 14.093 2.293 -4.493 1.00 0.00 N ATOM 1793 CA ASN A 117 14.658 3.176 -5.508 1.00 0.00 C ATOM 1794 C ASN A 117 14.325 4.642 -5.217 1.00 0.00 C ATOM 1795 O ASN A 117 14.697 5.532 -5.982 1.00 0.00 O ATOM 1796 CB ASN A 117 14.137 2.791 -6.894 1.00 0.00 C ATOM 1797 CG ASN A 117 15.035 1.787 -7.588 1.00 0.00 C ATOM 1798 OD1 ASN A 117 15.523 2.032 -8.691 1.00 0.00 O ATOM 1799 ND2 ASN A 117 15.257 0.647 -6.944 1.00 0.00 N ATOM 0 H ASN A 117 13.149 1.965 -4.696 1.00 0.00 H new ATOM 0 HA ASN A 117 15.742 3.061 -5.485 1.00 0.00 H new ATOM 0 HB2 ASN A 117 13.134 2.374 -6.800 1.00 0.00 H new ATOM 0 HB3 ASN A 117 14.053 3.687 -7.510 1.00 0.00 H new ATOM 0 HD21 ASN A 117 15.853 -0.067 -7.362 1.00 0.00 H new ATOM 0 HD22 ASN A 117 14.832 0.486 -6.031 1.00 0.00 H new ATOM 1806 N GLY A 118 13.622 4.888 -4.112 1.00 0.00 N ATOM 1807 CA GLY A 118 13.255 6.245 -3.753 1.00 0.00 C ATOM 1808 C GLY A 118 14.384 7.001 -3.077 1.00 0.00 C ATOM 1809 O GLY A 118 15.404 7.295 -3.700 1.00 0.00 O ATOM 0 H GLY A 118 13.301 4.171 -3.461 1.00 0.00 H new ATOM 0 HA2 GLY A 118 12.950 6.783 -4.650 1.00 0.00 H new ATOM 0 HA3 GLY A 118 12.392 6.219 -3.088 1.00 0.00 H new ATOM 1813 N ASN A 119 14.197 7.325 -1.800 1.00 0.00 N ATOM 1814 CA ASN A 119 15.204 8.060 -1.041 1.00 0.00 C ATOM 1815 C ASN A 119 15.167 7.681 0.440 1.00 0.00 C ATOM 1816 O ASN A 119 14.187 7.108 0.922 1.00 0.00 O ATOM 1817 CB ASN A 119 14.977 9.567 -1.196 1.00 0.00 C ATOM 1818 CG ASN A 119 16.227 10.310 -1.619 1.00 0.00 C ATOM 1819 OD1 ASN A 119 17.248 9.704 -1.946 1.00 0.00 O ATOM 1820 ND2 ASN A 119 16.149 11.636 -1.614 1.00 0.00 N ATOM 0 H ASN A 119 13.358 7.090 -1.270 1.00 0.00 H new ATOM 0 HA ASN A 119 16.185 7.796 -1.436 1.00 0.00 H new ATOM 0 HB2 ASN A 119 14.192 9.737 -1.933 1.00 0.00 H new ATOM 0 HB3 ASN A 119 14.620 9.975 -0.250 1.00 0.00 H new ATOM 0 HD21 ASN A 119 16.956 12.195 -1.889 1.00 0.00 H new ATOM 0 HD22 ASN A 119 15.282 12.095 -1.335 1.00 0.00 H new ATOM 1827 N PRO A 120 16.240 8.010 1.183 1.00 0.00 N ATOM 1828 CA PRO A 120 16.342 7.712 2.621 1.00 0.00 C ATOM 1829 C PRO A 120 15.233 8.365 3.447 1.00 0.00 C ATOM 1830 O PRO A 120 15.095 8.086 4.639 1.00 0.00 O ATOM 1831 CB PRO A 120 17.705 8.291 3.018 1.00 0.00 C ATOM 1832 CG PRO A 120 18.464 8.406 1.741 1.00 0.00 C ATOM 1833 CD PRO A 120 17.441 8.701 0.684 1.00 0.00 C ATOM 0 HA PRO A 120 16.242 6.643 2.810 1.00 0.00 H new ATOM 0 HB2 PRO A 120 17.595 9.262 3.500 1.00 0.00 H new ATOM 0 HB3 PRO A 120 18.219 7.640 3.725 1.00 0.00 H new ATOM 0 HG2 PRO A 120 19.208 9.201 1.798 1.00 0.00 H new ATOM 0 HG3 PRO A 120 19.000 7.483 1.520 1.00 0.00 H new ATOM 0 HD2 PRO A 120 17.273 9.772 0.573 1.00 0.00 H new ATOM 0 HD3 PRO A 120 17.748 8.323 -0.291 1.00 0.00 H new ATOM 1841 N SER A 121 14.438 9.222 2.813 1.00 0.00 N ATOM 1842 CA SER A 121 13.338 9.894 3.490 1.00 0.00 C ATOM 1843 C SER A 121 12.180 10.054 2.522 1.00 0.00 C ATOM 1844 O SER A 121 11.364 10.968 2.639 1.00 0.00 O ATOM 1845 CB SER A 121 13.786 11.262 4.016 1.00 0.00 C ATOM 1846 OG SER A 121 13.446 11.418 5.383 1.00 0.00 O ATOM 0 H SER A 121 14.537 9.467 1.828 1.00 0.00 H new ATOM 0 HA SER A 121 13.019 9.293 4.341 1.00 0.00 H new ATOM 0 HB2 SER A 121 14.864 11.368 3.891 1.00 0.00 H new ATOM 0 HB3 SER A 121 13.318 12.052 3.429 1.00 0.00 H new ATOM 0 HG SER A 121 12.510 11.162 5.518 1.00 0.00 H new ATOM 1852 N TYR A 122 12.142 9.155 1.547 1.00 0.00 N ATOM 1853 CA TYR A 122 11.123 9.165 0.517 1.00 0.00 C ATOM 1854 C TYR A 122 10.760 7.735 0.103 1.00 0.00 C ATOM 1855 O TYR A 122 10.092 7.521 -0.902 1.00 0.00 O ATOM 1856 CB TYR A 122 11.658 9.943 -0.682 1.00 0.00 C ATOM 1857 CG TYR A 122 11.065 11.324 -0.846 1.00 0.00 C ATOM 1858 CD1 TYR A 122 11.659 12.423 -0.239 1.00 0.00 C ATOM 1859 CD2 TYR A 122 9.926 11.534 -1.613 1.00 0.00 C ATOM 1860 CE1 TYR A 122 11.134 13.691 -0.388 1.00 0.00 C ATOM 1861 CE2 TYR A 122 9.394 12.800 -1.766 1.00 0.00 C ATOM 1862 CZ TYR A 122 10.002 13.875 -1.152 1.00 0.00 C ATOM 1863 OH TYR A 122 9.476 15.138 -1.304 1.00 0.00 O ATOM 0 H TYR A 122 12.820 8.399 1.452 1.00 0.00 H new ATOM 0 HA TYR A 122 10.220 9.641 0.898 1.00 0.00 H new ATOM 0 HB2 TYR A 122 12.740 10.035 -0.587 1.00 0.00 H new ATOM 0 HB3 TYR A 122 11.465 9.368 -1.588 1.00 0.00 H new ATOM 0 HD1 TYR A 122 12.547 12.283 0.360 1.00 0.00 H new ATOM 0 HD2 TYR A 122 9.449 10.695 -2.097 1.00 0.00 H new ATOM 0 HE1 TYR A 122 11.608 14.535 0.092 1.00 0.00 H new ATOM 0 HE2 TYR A 122 8.506 12.947 -2.363 1.00 0.00 H new ATOM 0 HH TYR A 122 8.679 15.094 -1.873 1.00 0.00 H new ATOM 1873 N LYS A 123 11.219 6.761 0.886 1.00 0.00 N ATOM 1874 CA LYS A 123 10.963 5.347 0.617 1.00 0.00 C ATOM 1875 C LYS A 123 9.471 5.032 0.456 1.00 0.00 C ATOM 1876 O LYS A 123 9.108 3.961 -0.024 1.00 0.00 O ATOM 1877 CB LYS A 123 11.528 4.506 1.765 1.00 0.00 C ATOM 1878 CG LYS A 123 12.997 4.155 1.614 1.00 0.00 C ATOM 1879 CD LYS A 123 13.245 3.327 0.366 1.00 0.00 C ATOM 1880 CE LYS A 123 14.388 3.895 -0.455 1.00 0.00 C ATOM 1881 NZ LYS A 123 15.663 3.926 0.315 1.00 0.00 N ATOM 0 H LYS A 123 11.778 6.929 1.723 1.00 0.00 H new ATOM 0 HA LYS A 123 11.451 5.105 -0.327 1.00 0.00 H new ATOM 0 HB2 LYS A 123 11.390 5.048 2.700 1.00 0.00 H new ATOM 0 HB3 LYS A 123 10.952 3.584 1.843 1.00 0.00 H new ATOM 0 HG2 LYS A 123 13.588 5.070 1.569 1.00 0.00 H new ATOM 0 HG3 LYS A 123 13.332 3.602 2.491 1.00 0.00 H new ATOM 0 HD2 LYS A 123 13.473 2.299 0.648 1.00 0.00 H new ATOM 0 HD3 LYS A 123 12.339 3.298 -0.239 1.00 0.00 H new ATOM 0 HE2 LYS A 123 14.522 3.295 -1.355 1.00 0.00 H new ATOM 0 HE3 LYS A 123 14.135 4.904 -0.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 16.462 4.040 -0.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 15.646 4.723 0.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 15.772 3.036 0.842 1.00 0.00 H new ATOM 1895 N TYR A 124 8.610 5.946 0.881 1.00 0.00 N ATOM 1896 CA TYR A 124 7.166 5.726 0.807 1.00 0.00 C ATOM 1897 C TYR A 124 6.534 6.401 -0.410 1.00 0.00 C ATOM 1898 O TYR A 124 5.329 6.291 -0.631 1.00 0.00 O ATOM 1899 CB TYR A 124 6.517 6.234 2.092 1.00 0.00 C ATOM 1900 CG TYR A 124 7.065 5.568 3.334 1.00 0.00 C ATOM 1901 CD1 TYR A 124 8.384 5.765 3.729 1.00 0.00 C ATOM 1902 CD2 TYR A 124 6.270 4.737 4.105 1.00 0.00 C ATOM 1903 CE1 TYR A 124 8.889 5.151 4.858 1.00 0.00 C ATOM 1904 CE2 TYR A 124 6.767 4.117 5.236 1.00 0.00 C ATOM 1905 CZ TYR A 124 8.078 4.328 5.606 1.00 0.00 C ATOM 1906 OH TYR A 124 8.579 3.711 6.728 1.00 0.00 O ATOM 0 H TYR A 124 8.881 6.845 1.280 1.00 0.00 H new ATOM 0 HA TYR A 124 6.994 4.655 0.696 1.00 0.00 H new ATOM 0 HB2 TYR A 124 6.668 7.311 2.167 1.00 0.00 H new ATOM 0 HB3 TYR A 124 5.441 6.065 2.041 1.00 0.00 H new ATOM 0 HD1 TYR A 124 9.024 6.409 3.143 1.00 0.00 H new ATOM 0 HD2 TYR A 124 5.242 4.570 3.817 1.00 0.00 H new ATOM 0 HE1 TYR A 124 9.915 5.316 5.153 1.00 0.00 H new ATOM 0 HE2 TYR A 124 6.133 3.472 5.826 1.00 0.00 H new ATOM 0 HH TYR A 124 9.399 3.226 6.496 1.00 0.00 H new ATOM 1916 N PHE A 125 7.346 7.096 -1.196 1.00 0.00 N ATOM 1917 CA PHE A 125 6.860 7.788 -2.386 1.00 0.00 C ATOM 1918 C PHE A 125 6.996 6.917 -3.631 1.00 0.00 C ATOM 1919 O PHE A 125 7.952 6.155 -3.770 1.00 0.00 O ATOM 1920 CB PHE A 125 7.637 9.091 -2.580 1.00 0.00 C ATOM 1921 CG PHE A 125 6.798 10.230 -3.087 1.00 0.00 C ATOM 1922 CD1 PHE A 125 6.189 10.164 -4.329 1.00 0.00 C ATOM 1923 CD2 PHE A 125 6.626 11.370 -2.321 1.00 0.00 C ATOM 1924 CE1 PHE A 125 5.424 11.213 -4.797 1.00 0.00 C ATOM 1925 CE2 PHE A 125 5.860 12.423 -2.784 1.00 0.00 C ATOM 1926 CZ PHE A 125 5.260 12.344 -4.025 1.00 0.00 C ATOM 0 H PHE A 125 8.348 7.196 -1.031 1.00 0.00 H new ATOM 0 HA PHE A 125 5.802 8.008 -2.241 1.00 0.00 H new ATOM 0 HB2 PHE A 125 8.087 9.379 -1.630 1.00 0.00 H new ATOM 0 HB3 PHE A 125 8.454 8.915 -3.280 1.00 0.00 H new ATOM 0 HD1 PHE A 125 6.314 9.281 -4.939 1.00 0.00 H new ATOM 0 HD2 PHE A 125 7.096 11.437 -1.351 1.00 0.00 H new ATOM 0 HE1 PHE A 125 4.954 11.148 -5.767 1.00 0.00 H new ATOM 0 HE2 PHE A 125 5.731 13.306 -2.176 1.00 0.00 H new ATOM 0 HZ PHE A 125 4.663 13.167 -4.391 1.00 0.00 H new ATOM 1936 N TYR A 126 6.036 7.049 -4.542 1.00 0.00 N ATOM 1937 CA TYR A 126 6.045 6.292 -5.790 1.00 0.00 C ATOM 1938 C TYR A 126 5.470 7.136 -6.925 1.00 0.00 C ATOM 1939 O TYR A 126 4.335 6.930 -7.354 1.00 0.00 O ATOM 1940 CB TYR A 126 5.241 4.998 -5.641 1.00 0.00 C ATOM 1941 CG TYR A 126 6.078 3.803 -5.243 1.00 0.00 C ATOM 1942 CD1 TYR A 126 6.958 3.216 -6.142 1.00 0.00 C ATOM 1943 CD2 TYR A 126 5.982 3.258 -3.969 1.00 0.00 C ATOM 1944 CE1 TYR A 126 7.722 2.121 -5.783 1.00 0.00 C ATOM 1945 CE2 TYR A 126 6.741 2.164 -3.601 1.00 0.00 C ATOM 1946 CZ TYR A 126 7.609 1.599 -4.512 1.00 0.00 C ATOM 1947 OH TYR A 126 8.365 0.508 -4.151 1.00 0.00 O ATOM 0 H TYR A 126 5.238 7.676 -4.438 1.00 0.00 H new ATOM 0 HA TYR A 126 7.077 6.035 -6.028 1.00 0.00 H new ATOM 0 HB2 TYR A 126 4.462 5.149 -4.894 1.00 0.00 H new ATOM 0 HB3 TYR A 126 4.740 4.781 -6.585 1.00 0.00 H new ATOM 0 HD1 TYR A 126 7.047 3.622 -7.139 1.00 0.00 H new ATOM 0 HD2 TYR A 126 5.302 3.697 -3.254 1.00 0.00 H new ATOM 0 HE1 TYR A 126 8.403 1.677 -6.494 1.00 0.00 H new ATOM 0 HE2 TYR A 126 6.655 1.753 -2.606 1.00 0.00 H new ATOM 0 HH TYR A 126 8.167 0.266 -3.222 1.00 0.00 H new ATOM 1957 N VAL A 127 6.262 8.092 -7.400 1.00 0.00 N ATOM 1958 CA VAL A 127 5.839 8.976 -8.478 1.00 0.00 C ATOM 1959 C VAL A 127 6.352 8.482 -9.824 1.00 0.00 C ATOM 1960 O VAL A 127 7.173 9.132 -10.472 1.00 0.00 O ATOM 1961 CB VAL A 127 6.318 10.425 -8.236 1.00 0.00 C ATOM 1962 CG1 VAL A 127 7.818 10.466 -7.983 1.00 0.00 C ATOM 1963 CG2 VAL A 127 5.938 11.324 -9.405 1.00 0.00 C ATOM 0 H VAL A 127 7.204 8.274 -7.053 1.00 0.00 H new ATOM 0 HA VAL A 127 4.749 8.968 -8.493 1.00 0.00 H new ATOM 0 HB VAL A 127 5.817 10.802 -7.345 1.00 0.00 H new ATOM 0 HG11 VAL A 127 8.131 11.497 -7.816 1.00 0.00 H new ATOM 0 HG12 VAL A 127 8.055 9.867 -7.104 1.00 0.00 H new ATOM 0 HG13 VAL A 127 8.344 10.063 -8.849 1.00 0.00 H new ATOM 0 HG21 VAL A 127 6.286 12.339 -9.212 1.00 0.00 H new ATOM 0 HG22 VAL A 127 6.401 10.949 -10.318 1.00 0.00 H new ATOM 0 HG23 VAL A 127 4.854 11.328 -9.524 1.00 0.00 H new ATOM 1973 N SER A 128 5.853 7.322 -10.236 1.00 0.00 N ATOM 1974 CA SER A 128 6.239 6.716 -11.511 1.00 0.00 C ATOM 1975 C SER A 128 5.774 5.264 -11.591 1.00 0.00 C ATOM 1976 O SER A 128 6.167 4.431 -10.775 1.00 0.00 O ATOM 1977 CB SER A 128 7.758 6.785 -11.709 1.00 0.00 C ATOM 1978 OG SER A 128 8.090 7.643 -12.789 1.00 0.00 O ATOM 0 H SER A 128 5.175 6.777 -9.703 1.00 0.00 H new ATOM 0 HA SER A 128 5.753 7.283 -12.305 1.00 0.00 H new ATOM 0 HB2 SER A 128 8.232 7.144 -10.795 1.00 0.00 H new ATOM 0 HB3 SER A 128 8.150 5.786 -11.900 1.00 0.00 H new ATOM 0 HG SER A 128 9.064 7.673 -12.896 1.00 0.00 H new ATOM 1984 N ALA A 129 4.938 4.968 -12.583 1.00 0.00 N ATOM 1985 CA ALA A 129 4.425 3.615 -12.773 1.00 0.00 C ATOM 1986 C ALA A 129 5.553 2.628 -13.062 1.00 0.00 C ATOM 1987 O ALA A 129 5.379 1.418 -12.932 1.00 0.00 O ATOM 1988 CB ALA A 129 3.403 3.589 -13.899 1.00 0.00 C ATOM 0 H ALA A 129 4.602 5.646 -13.267 1.00 0.00 H new ATOM 0 HA ALA A 129 3.940 3.310 -11.846 1.00 0.00 H new ATOM 0 HB1 ALA A 129 3.030 2.573 -14.028 1.00 0.00 H new ATOM 0 HB2 ALA A 129 2.573 4.252 -13.653 1.00 0.00 H new ATOM 0 HB3 ALA A 129 3.872 3.924 -14.824 1.00 0.00 H new ATOM 1994 N GLU A 130 6.712 3.149 -13.458 1.00 0.00 N ATOM 1995 CA GLU A 130 7.858 2.302 -13.758 1.00 0.00 C ATOM 1996 C GLU A 130 8.387 1.650 -12.485 1.00 0.00 C ATOM 1997 O GLU A 130 8.684 0.454 -12.457 1.00 0.00 O ATOM 1998 CB GLU A 130 8.963 3.120 -14.429 1.00 0.00 C ATOM 1999 CG GLU A 130 8.970 3.001 -15.944 1.00 0.00 C ATOM 2000 CD GLU A 130 9.487 1.657 -16.421 1.00 0.00 C ATOM 2001 OE1 GLU A 130 10.710 1.427 -16.332 1.00 0.00 O ATOM 2002 OE2 GLU A 130 8.666 0.837 -16.884 1.00 0.00 O ATOM 0 H GLU A 130 6.880 4.148 -13.577 1.00 0.00 H new ATOM 0 HA GLU A 130 7.537 1.518 -14.444 1.00 0.00 H new ATOM 0 HB2 GLU A 130 8.845 4.168 -14.155 1.00 0.00 H new ATOM 0 HB3 GLU A 130 9.929 2.796 -14.043 1.00 0.00 H new ATOM 0 HG2 GLU A 130 7.959 3.152 -16.321 1.00 0.00 H new ATOM 0 HG3 GLU A 130 9.589 3.794 -16.364 1.00 0.00 H new ATOM 2009 N GLN A 131 8.498 2.434 -11.423 1.00 0.00 N ATOM 2010 CA GLN A 131 8.988 1.899 -10.168 1.00 0.00 C ATOM 2011 C GLN A 131 7.923 1.059 -9.478 1.00 0.00 C ATOM 2012 O GLN A 131 8.198 -0.044 -9.010 1.00 0.00 O ATOM 2013 CB GLN A 131 9.446 2.993 -9.220 1.00 0.00 C ATOM 2014 CG GLN A 131 8.537 4.210 -9.176 1.00 0.00 C ATOM 2015 CD GLN A 131 8.895 5.158 -8.050 1.00 0.00 C ATOM 2016 OE1 GLN A 131 9.581 4.778 -7.102 1.00 0.00 O ATOM 2017 NE2 GLN A 131 8.435 6.398 -8.149 1.00 0.00 N ATOM 0 H GLN A 131 8.259 3.426 -11.406 1.00 0.00 H new ATOM 0 HA GLN A 131 9.845 1.273 -10.415 1.00 0.00 H new ATOM 0 HB2 GLN A 131 9.524 2.577 -8.216 1.00 0.00 H new ATOM 0 HB3 GLN A 131 10.447 3.313 -9.511 1.00 0.00 H new ATOM 0 HG2 GLN A 131 8.598 4.740 -10.127 1.00 0.00 H new ATOM 0 HG3 GLN A 131 7.504 3.884 -9.058 1.00 0.00 H new ATOM 0 HE21 GLN A 131 7.869 6.669 -8.953 1.00 0.00 H new ATOM 0 HE22 GLN A 131 8.647 7.080 -7.421 1.00 0.00 H new ATOM 2026 N VAL A 132 6.706 1.588 -9.412 1.00 0.00 N ATOM 2027 CA VAL A 132 5.607 0.885 -8.771 1.00 0.00 C ATOM 2028 C VAL A 132 5.478 -0.532 -9.322 1.00 0.00 C ATOM 2029 O VAL A 132 4.995 -1.432 -8.636 1.00 0.00 O ATOM 2030 CB VAL A 132 4.267 1.635 -8.946 1.00 0.00 C ATOM 2031 CG1 VAL A 132 4.447 3.126 -8.703 1.00 0.00 C ATOM 2032 CG2 VAL A 132 3.672 1.381 -10.325 1.00 0.00 C ATOM 0 H VAL A 132 6.458 2.500 -9.795 1.00 0.00 H new ATOM 0 HA VAL A 132 5.834 0.838 -7.706 1.00 0.00 H new ATOM 0 HB VAL A 132 3.568 1.250 -8.203 1.00 0.00 H new ATOM 0 HG11 VAL A 132 3.491 3.634 -8.832 1.00 0.00 H new ATOM 0 HG12 VAL A 132 4.810 3.288 -7.688 1.00 0.00 H new ATOM 0 HG13 VAL A 132 5.169 3.526 -9.415 1.00 0.00 H new ATOM 0 HG21 VAL A 132 2.730 1.921 -10.420 1.00 0.00 H new ATOM 0 HG22 VAL A 132 4.367 1.726 -11.090 1.00 0.00 H new ATOM 0 HG23 VAL A 132 3.493 0.313 -10.453 1.00 0.00 H new ATOM 2042 N VAL A 133 5.916 -0.724 -10.563 1.00 0.00 N ATOM 2043 CA VAL A 133 5.845 -2.033 -11.190 1.00 0.00 C ATOM 2044 C VAL A 133 7.019 -2.912 -10.771 1.00 0.00 C ATOM 2045 O VAL A 133 6.870 -4.130 -10.664 1.00 0.00 O ATOM 2046 CB VAL A 133 5.785 -1.946 -12.730 1.00 0.00 C ATOM 2047 CG1 VAL A 133 7.107 -1.466 -13.305 1.00 0.00 C ATOM 2048 CG2 VAL A 133 5.397 -3.293 -13.320 1.00 0.00 C ATOM 0 H VAL A 133 6.321 0.007 -11.148 1.00 0.00 H new ATOM 0 HA VAL A 133 4.917 -2.487 -10.843 1.00 0.00 H new ATOM 0 HB VAL A 133 5.022 -1.216 -13.000 1.00 0.00 H new ATOM 0 HG11 VAL A 133 7.034 -1.415 -14.391 1.00 0.00 H new ATOM 0 HG12 VAL A 133 7.338 -0.477 -12.910 1.00 0.00 H new ATOM 0 HG13 VAL A 133 7.899 -2.162 -13.027 1.00 0.00 H new ATOM 0 HG21 VAL A 133 5.359 -3.217 -14.407 1.00 0.00 H new ATOM 0 HG22 VAL A 133 6.136 -4.042 -13.035 1.00 0.00 H new ATOM 0 HG23 VAL A 133 4.418 -3.587 -12.942 1.00 0.00 H new ATOM 2058 N GLN A 134 8.188 -2.310 -10.512 1.00 0.00 N ATOM 2059 CA GLN A 134 9.333 -3.114 -10.083 1.00 0.00 C ATOM 2060 C GLN A 134 9.150 -3.498 -8.627 1.00 0.00 C ATOM 2061 O GLN A 134 9.530 -4.591 -8.204 1.00 0.00 O ATOM 2062 CB GLN A 134 10.664 -2.383 -10.288 1.00 0.00 C ATOM 2063 CG GLN A 134 10.599 -0.898 -10.011 1.00 0.00 C ATOM 2064 CD GLN A 134 11.932 -0.208 -10.223 1.00 0.00 C ATOM 2065 OE1 GLN A 134 12.687 0.015 -9.275 1.00 0.00 O ATOM 2066 NE2 GLN A 134 12.228 0.136 -11.471 1.00 0.00 N ATOM 0 H GLN A 134 8.361 -1.308 -10.589 1.00 0.00 H new ATOM 0 HA GLN A 134 9.373 -4.011 -10.701 1.00 0.00 H new ATOM 0 HB2 GLN A 134 11.416 -2.831 -9.639 1.00 0.00 H new ATOM 0 HB3 GLN A 134 10.997 -2.537 -11.315 1.00 0.00 H new ATOM 0 HG2 GLN A 134 9.851 -0.443 -10.660 1.00 0.00 H new ATOM 0 HG3 GLN A 134 10.270 -0.737 -8.984 1.00 0.00 H new ATOM 0 HE21 GLN A 134 11.573 -0.068 -12.225 1.00 0.00 H new ATOM 0 HE22 GLN A 134 13.111 0.605 -11.675 1.00 0.00 H new ATOM 2075 N GLY A 135 8.517 -2.606 -7.873 1.00 0.00 N ATOM 2076 CA GLY A 135 8.235 -2.882 -6.483 1.00 0.00 C ATOM 2077 C GLY A 135 7.048 -3.813 -6.363 1.00 0.00 C ATOM 2078 O GLY A 135 6.893 -4.519 -5.365 1.00 0.00 O ATOM 0 H GLY A 135 8.195 -1.696 -8.203 1.00 0.00 H new ATOM 0 HA2 GLY A 135 9.108 -3.332 -6.010 1.00 0.00 H new ATOM 0 HA3 GLY A 135 8.031 -1.951 -5.954 1.00 0.00 H new ATOM 2082 N MET A 136 6.219 -3.827 -7.410 1.00 0.00 N ATOM 2083 CA MET A 136 5.049 -4.689 -7.453 1.00 0.00 C ATOM 2084 C MET A 136 5.477 -6.097 -7.839 1.00 0.00 C ATOM 2085 O MET A 136 5.019 -7.080 -7.261 1.00 0.00 O ATOM 2086 CB MET A 136 4.029 -4.153 -8.459 1.00 0.00 C ATOM 2087 CG MET A 136 2.937 -3.307 -7.826 1.00 0.00 C ATOM 2088 SD MET A 136 1.567 -2.982 -8.953 1.00 0.00 S ATOM 2089 CE MET A 136 0.169 -3.371 -7.904 1.00 0.00 C ATOM 0 H MET A 136 6.343 -3.246 -8.239 1.00 0.00 H new ATOM 0 HA MET A 136 4.581 -4.709 -6.469 1.00 0.00 H new ATOM 0 HB2 MET A 136 4.549 -3.558 -9.209 1.00 0.00 H new ATOM 0 HB3 MET A 136 3.570 -4.993 -8.981 1.00 0.00 H new ATOM 0 HG2 MET A 136 2.559 -3.814 -6.938 1.00 0.00 H new ATOM 0 HG3 MET A 136 3.363 -2.360 -7.495 1.00 0.00 H new ATOM 0 HE1 MET A 136 -0.261 -4.324 -8.210 1.00 0.00 H new ATOM 0 HE2 MET A 136 0.499 -3.438 -6.867 1.00 0.00 H new ATOM 0 HE3 MET A 136 -0.583 -2.587 -7.995 1.00 0.00 H new ATOM 2099 N LYS A 137 6.371 -6.172 -8.817 1.00 0.00 N ATOM 2100 CA LYS A 137 6.891 -7.445 -9.295 1.00 0.00 C ATOM 2101 C LYS A 137 7.948 -7.997 -8.337 1.00 0.00 C ATOM 2102 O LYS A 137 8.309 -9.173 -8.407 1.00 0.00 O ATOM 2103 CB LYS A 137 7.474 -7.279 -10.702 1.00 0.00 C ATOM 2104 CG LYS A 137 8.784 -6.509 -10.751 1.00 0.00 C ATOM 2105 CD LYS A 137 8.995 -5.855 -12.110 1.00 0.00 C ATOM 2106 CE LYS A 137 8.794 -6.840 -13.253 1.00 0.00 C ATOM 2107 NZ LYS A 137 9.835 -7.906 -13.260 1.00 0.00 N ATOM 0 H LYS A 137 6.753 -5.358 -9.298 1.00 0.00 H new ATOM 0 HA LYS A 137 6.069 -8.160 -9.337 1.00 0.00 H new ATOM 0 HB2 LYS A 137 7.630 -8.266 -11.136 1.00 0.00 H new ATOM 0 HB3 LYS A 137 6.742 -6.768 -11.328 1.00 0.00 H new ATOM 0 HG2 LYS A 137 8.788 -5.745 -9.974 1.00 0.00 H new ATOM 0 HG3 LYS A 137 9.613 -7.184 -10.538 1.00 0.00 H new ATOM 0 HD2 LYS A 137 8.302 -5.022 -12.223 1.00 0.00 H new ATOM 0 HD3 LYS A 137 10.002 -5.441 -12.161 1.00 0.00 H new ATOM 0 HE2 LYS A 137 7.808 -7.297 -13.169 1.00 0.00 H new ATOM 0 HE3 LYS A 137 8.817 -6.304 -14.202 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 9.662 -8.555 -14.054 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 10.775 -7.473 -13.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 9.796 -8.435 -12.365 1.00 0.00 H new ATOM 2121 N GLU A 138 8.434 -7.144 -7.438 1.00 0.00 N ATOM 2122 CA GLU A 138 9.441 -7.547 -6.464 1.00 0.00 C ATOM 2123 C GLU A 138 8.797 -8.359 -5.350 1.00 0.00 C ATOM 2124 O GLU A 138 9.004 -9.568 -5.245 1.00 0.00 O ATOM 2125 CB GLU A 138 10.138 -6.318 -5.876 1.00 0.00 C ATOM 2126 CG GLU A 138 11.190 -6.657 -4.831 1.00 0.00 C ATOM 2127 CD GLU A 138 11.591 -5.455 -3.999 1.00 0.00 C ATOM 2128 OE1 GLU A 138 12.445 -4.670 -4.462 1.00 0.00 O ATOM 2129 OE2 GLU A 138 11.049 -5.299 -2.883 1.00 0.00 O ATOM 0 H GLU A 138 8.145 -6.168 -7.365 1.00 0.00 H new ATOM 0 HA GLU A 138 10.184 -8.163 -6.970 1.00 0.00 H new ATOM 0 HB2 GLU A 138 10.608 -5.756 -6.683 1.00 0.00 H new ATOM 0 HB3 GLU A 138 9.389 -5.666 -5.427 1.00 0.00 H new ATOM 0 HG2 GLU A 138 10.806 -7.438 -4.174 1.00 0.00 H new ATOM 0 HG3 GLU A 138 12.072 -7.062 -5.327 1.00 0.00 H new ATOM 2136 N ALA A 139 8.004 -7.683 -4.530 1.00 0.00 N ATOM 2137 CA ALA A 139 7.312 -8.338 -3.430 1.00 0.00 C ATOM 2138 C ALA A 139 6.412 -9.452 -3.953 1.00 0.00 C ATOM 2139 O ALA A 139 6.071 -10.385 -3.228 1.00 0.00 O ATOM 2140 CB ALA A 139 6.497 -7.324 -2.640 1.00 0.00 C ATOM 0 H ALA A 139 7.824 -6.682 -4.606 1.00 0.00 H new ATOM 0 HA ALA A 139 8.056 -8.779 -2.767 1.00 0.00 H new ATOM 0 HB1 ALA A 139 5.985 -7.828 -1.820 1.00 0.00 H new ATOM 0 HB2 ALA A 139 7.160 -6.558 -2.237 1.00 0.00 H new ATOM 0 HB3 ALA A 139 5.761 -6.858 -3.296 1.00 0.00 H new ATOM 2146 N GLN A 140 6.035 -9.349 -5.225 1.00 0.00 N ATOM 2147 CA GLN A 140 5.179 -10.347 -5.855 1.00 0.00 C ATOM 2148 C GLN A 140 5.794 -11.745 -5.758 1.00 0.00 C ATOM 2149 O GLN A 140 5.104 -12.750 -5.930 1.00 0.00 O ATOM 2150 CB GLN A 140 4.938 -9.982 -7.323 1.00 0.00 C ATOM 2151 CG GLN A 140 3.505 -9.566 -7.620 1.00 0.00 C ATOM 2152 CD GLN A 140 2.978 -10.177 -8.903 1.00 0.00 C ATOM 2153 OE1 GLN A 140 2.508 -9.470 -9.793 1.00 0.00 O ATOM 2154 NE2 GLN A 140 3.054 -11.499 -9.002 1.00 0.00 N ATOM 0 H GLN A 140 6.310 -8.583 -5.839 1.00 0.00 H new ATOM 0 HA GLN A 140 4.227 -10.358 -5.325 1.00 0.00 H new ATOM 0 HB2 GLN A 140 5.609 -9.169 -7.601 1.00 0.00 H new ATOM 0 HB3 GLN A 140 5.196 -10.837 -7.948 1.00 0.00 H new ATOM 0 HG2 GLN A 140 2.864 -9.863 -6.790 1.00 0.00 H new ATOM 0 HG3 GLN A 140 3.452 -8.480 -7.690 1.00 0.00 H new ATOM 0 HE21 GLN A 140 3.452 -12.046 -8.238 1.00 0.00 H new ATOM 0 HE22 GLN A 140 2.715 -11.968 -9.842 1.00 0.00 H new ATOM 2163 N GLU A 141 7.097 -11.806 -5.496 1.00 0.00 N ATOM 2164 CA GLU A 141 7.801 -13.079 -5.394 1.00 0.00 C ATOM 2165 C GLU A 141 7.783 -13.625 -3.965 1.00 0.00 C ATOM 2166 O GLU A 141 7.858 -14.836 -3.759 1.00 0.00 O ATOM 2167 CB GLU A 141 9.246 -12.915 -5.875 1.00 0.00 C ATOM 2168 CG GLU A 141 10.140 -14.102 -5.553 1.00 0.00 C ATOM 2169 CD GLU A 141 11.371 -14.161 -6.436 1.00 0.00 C ATOM 2170 OE1 GLU A 141 12.132 -13.171 -6.460 1.00 0.00 O ATOM 2171 OE2 GLU A 141 11.573 -15.197 -7.104 1.00 0.00 O ATOM 0 H GLU A 141 7.687 -10.987 -5.350 1.00 0.00 H new ATOM 0 HA GLU A 141 7.283 -13.798 -6.029 1.00 0.00 H new ATOM 0 HB2 GLU A 141 9.244 -12.756 -6.953 1.00 0.00 H new ATOM 0 HB3 GLU A 141 9.670 -12.019 -5.421 1.00 0.00 H new ATOM 0 HG2 GLU A 141 10.449 -14.047 -4.509 1.00 0.00 H new ATOM 0 HG3 GLU A 141 9.570 -15.024 -5.669 1.00 0.00 H new ATOM 2178 N ARG A 142 7.699 -12.736 -2.980 1.00 0.00 N ATOM 2179 CA ARG A 142 7.694 -13.157 -1.578 1.00 0.00 C ATOM 2180 C ARG A 142 6.364 -12.849 -0.893 1.00 0.00 C ATOM 2181 O ARG A 142 5.751 -13.731 -0.292 1.00 0.00 O ATOM 2182 CB ARG A 142 8.841 -12.491 -0.814 1.00 0.00 C ATOM 2183 CG ARG A 142 9.063 -11.033 -1.185 1.00 0.00 C ATOM 2184 CD ARG A 142 10.337 -10.490 -0.557 1.00 0.00 C ATOM 2185 NE ARG A 142 11.534 -11.061 -1.168 1.00 0.00 N ATOM 2186 CZ ARG A 142 12.770 -10.838 -0.727 1.00 0.00 C ATOM 2187 NH1 ARG A 142 12.975 -10.053 0.324 1.00 0.00 N ATOM 2188 NH2 ARG A 142 13.803 -11.401 -1.336 1.00 0.00 N ATOM 0 H ARG A 142 7.634 -11.728 -3.122 1.00 0.00 H new ATOM 0 HA ARG A 142 7.832 -14.238 -1.566 1.00 0.00 H new ATOM 0 HB2 ARG A 142 8.639 -12.557 0.255 1.00 0.00 H new ATOM 0 HB3 ARG A 142 9.760 -13.047 -1.000 1.00 0.00 H new ATOM 0 HG2 ARG A 142 9.120 -10.936 -2.269 1.00 0.00 H new ATOM 0 HG3 ARG A 142 8.211 -10.438 -0.856 1.00 0.00 H new ATOM 0 HD2 ARG A 142 10.359 -9.405 -0.661 1.00 0.00 H new ATOM 0 HD3 ARG A 142 10.336 -10.708 0.511 1.00 0.00 H new ATOM 0 HE ARG A 142 11.416 -11.666 -1.980 1.00 0.00 H new ATOM 0 HH11 ARG A 142 12.183 -9.618 0.797 1.00 0.00 H new ATOM 0 HH12 ARG A 142 13.924 -9.885 0.658 1.00 0.00 H new ATOM 0 HH21 ARG A 142 13.651 -12.006 -2.143 1.00 0.00 H new ATOM 0 HH22 ARG A 142 14.750 -11.230 -0.998 1.00 0.00 H new ATOM 2202 N LEU A 143 5.926 -11.595 -0.973 1.00 0.00 N ATOM 2203 CA LEU A 143 4.673 -11.182 -0.345 1.00 0.00 C ATOM 2204 C LEU A 143 3.523 -12.107 -0.739 1.00 0.00 C ATOM 2205 O LEU A 143 2.609 -12.347 0.051 1.00 0.00 O ATOM 2206 CB LEU A 143 4.342 -9.735 -0.717 1.00 0.00 C ATOM 2207 CG LEU A 143 4.781 -8.689 0.308 1.00 0.00 C ATOM 2208 CD1 LEU A 143 4.003 -8.856 1.605 1.00 0.00 C ATOM 2209 CD2 LEU A 143 6.276 -8.791 0.566 1.00 0.00 C ATOM 0 H LEU A 143 6.418 -10.849 -1.465 1.00 0.00 H new ATOM 0 HA LEU A 143 4.803 -11.249 0.735 1.00 0.00 H new ATOM 0 HB2 LEU A 143 4.812 -9.505 -1.673 1.00 0.00 H new ATOM 0 HB3 LEU A 143 3.265 -9.650 -0.862 1.00 0.00 H new ATOM 0 HG LEU A 143 4.569 -7.699 -0.096 1.00 0.00 H new ATOM 0 HD11 LEU A 143 4.328 -8.104 2.324 1.00 0.00 H new ATOM 0 HD12 LEU A 143 2.938 -8.734 1.409 1.00 0.00 H new ATOM 0 HD13 LEU A 143 4.185 -9.850 2.013 1.00 0.00 H new ATOM 0 HD21 LEU A 143 6.571 -8.039 1.298 1.00 0.00 H new ATOM 0 HD22 LEU A 143 6.512 -9.783 0.950 1.00 0.00 H new ATOM 0 HD23 LEU A 143 6.818 -8.624 -0.365 1.00 0.00 H new ATOM 2221 N THR A 144 3.572 -12.621 -1.963 1.00 0.00 N ATOM 2222 CA THR A 144 2.539 -13.516 -2.461 1.00 0.00 C ATOM 2223 C THR A 144 2.677 -14.906 -1.846 1.00 0.00 C ATOM 2224 O THR A 144 3.707 -15.564 -1.997 1.00 0.00 O ATOM 2225 CB THR A 144 2.627 -13.605 -3.981 1.00 0.00 C ATOM 2226 OG1 THR A 144 3.784 -14.321 -4.376 1.00 0.00 O ATOM 2227 CG2 THR A 144 2.669 -12.253 -4.657 1.00 0.00 C ATOM 0 H THR A 144 4.320 -12.431 -2.630 1.00 0.00 H new ATOM 0 HA THR A 144 1.566 -13.115 -2.176 1.00 0.00 H new ATOM 0 HB THR A 144 1.719 -14.121 -4.294 1.00 0.00 H new ATOM 0 HG1 THR A 144 4.325 -13.764 -4.974 1.00 0.00 H new ATOM 0 HG21 THR A 144 2.731 -12.388 -5.737 1.00 0.00 H new ATOM 0 HG22 THR A 144 1.765 -11.696 -4.413 1.00 0.00 H new ATOM 0 HG23 THR A 144 3.541 -11.699 -4.310 1.00 0.00 H new ATOM 2235 N GLY A 145 1.634 -15.347 -1.152 1.00 0.00 N ATOM 2236 CA GLY A 145 1.657 -16.657 -0.527 1.00 0.00 C ATOM 2237 C GLY A 145 2.202 -16.623 0.891 1.00 0.00 C ATOM 2238 O GLY A 145 2.553 -17.661 1.450 1.00 0.00 O ATOM 0 H GLY A 145 0.772 -14.820 -1.011 1.00 0.00 H new ATOM 0 HA2 GLY A 145 0.647 -17.066 -0.513 1.00 0.00 H new ATOM 0 HA3 GLY A 145 2.266 -17.331 -1.129 1.00 0.00 H new ATOM 2242 N ASP A 146 2.268 -15.429 1.475 1.00 0.00 N ATOM 2243 CA ASP A 146 2.772 -15.270 2.837 1.00 0.00 C ATOM 2244 C ASP A 146 4.167 -15.872 2.985 1.00 0.00 C ATOM 2245 O ASP A 146 4.579 -16.239 4.085 1.00 0.00 O ATOM 2246 CB ASP A 146 1.815 -15.926 3.835 1.00 0.00 C ATOM 2247 CG ASP A 146 0.696 -14.997 4.259 1.00 0.00 C ATOM 2248 OD1 ASP A 146 -0.340 -14.957 3.561 1.00 0.00 O ATOM 2249 OD2 ASP A 146 0.852 -14.309 5.290 1.00 0.00 O ATOM 0 H ASP A 146 1.979 -14.559 1.028 1.00 0.00 H new ATOM 0 HA ASP A 146 2.837 -14.202 3.047 1.00 0.00 H new ATOM 0 HB2 ASP A 146 1.388 -16.824 3.388 1.00 0.00 H new ATOM 0 HB3 ASP A 146 2.374 -16.243 4.716 1.00 0.00 H new ATOM 2254 N ALA A 147 4.892 -15.965 1.875 1.00 0.00 N ATOM 2255 CA ALA A 147 6.241 -16.518 1.888 1.00 0.00 C ATOM 2256 C ALA A 147 7.234 -15.517 2.467 1.00 0.00 C ATOM 2257 O ALA A 147 8.264 -15.899 3.024 1.00 0.00 O ATOM 2258 CB ALA A 147 6.657 -16.929 0.484 1.00 0.00 C ATOM 0 H ALA A 147 4.568 -15.665 0.956 1.00 0.00 H new ATOM 0 HA ALA A 147 6.241 -17.402 2.526 1.00 0.00 H new ATOM 0 HB1 ALA A 147 7.666 -17.340 0.509 1.00 0.00 H new ATOM 0 HB2 ALA A 147 5.967 -17.684 0.106 1.00 0.00 H new ATOM 0 HB3 ALA A 147 6.636 -16.058 -0.171 1.00 0.00 H new ATOM 2264 N PHE A 148 6.919 -14.233 2.329 1.00 0.00 N ATOM 2265 CA PHE A 148 7.781 -13.171 2.837 1.00 0.00 C ATOM 2266 C PHE A 148 8.004 -13.319 4.339 1.00 0.00 C ATOM 2267 O PHE A 148 9.095 -13.058 4.845 1.00 0.00 O ATOM 2268 CB PHE A 148 7.169 -11.802 2.527 1.00 0.00 C ATOM 2269 CG PHE A 148 5.971 -11.472 3.373 1.00 0.00 C ATOM 2270 CD1 PHE A 148 4.730 -12.020 3.086 1.00 0.00 C ATOM 2271 CD2 PHE A 148 6.086 -10.615 4.456 1.00 0.00 C ATOM 2272 CE1 PHE A 148 3.628 -11.720 3.864 1.00 0.00 C ATOM 2273 CE2 PHE A 148 4.988 -10.312 5.236 1.00 0.00 C ATOM 2274 CZ PHE A 148 3.758 -10.865 4.941 1.00 0.00 C ATOM 0 H PHE A 148 6.071 -13.902 1.869 1.00 0.00 H new ATOM 0 HA PHE A 148 8.748 -13.250 2.340 1.00 0.00 H new ATOM 0 HB2 PHE A 148 7.928 -11.033 2.671 1.00 0.00 H new ATOM 0 HB3 PHE A 148 6.881 -11.772 1.476 1.00 0.00 H new ATOM 0 HD1 PHE A 148 4.623 -12.689 2.245 1.00 0.00 H new ATOM 0 HD2 PHE A 148 7.045 -10.179 4.692 1.00 0.00 H new ATOM 0 HE1 PHE A 148 2.667 -12.153 3.630 1.00 0.00 H new ATOM 0 HE2 PHE A 148 5.091 -9.642 6.077 1.00 0.00 H new ATOM 0 HZ PHE A 148 2.899 -10.629 5.551 1.00 0.00 H new ATOM 2284 N ARG A 149 6.960 -13.737 5.048 1.00 0.00 N ATOM 2285 CA ARG A 149 7.030 -13.916 6.487 1.00 0.00 C ATOM 2286 C ARG A 149 8.053 -14.985 6.855 1.00 0.00 C ATOM 2287 O ARG A 149 8.752 -15.516 5.993 1.00 0.00 O ATOM 2288 CB ARG A 149 5.654 -14.298 7.028 1.00 0.00 C ATOM 2289 CG ARG A 149 4.620 -13.191 6.897 1.00 0.00 C ATOM 2290 CD ARG A 149 3.401 -13.457 7.767 1.00 0.00 C ATOM 2291 NE ARG A 149 3.087 -12.321 8.630 1.00 0.00 N ATOM 2292 CZ ARG A 149 3.707 -12.068 9.782 1.00 0.00 C ATOM 2293 NH1 ARG A 149 4.678 -12.866 10.209 1.00 0.00 N ATOM 2294 NH2 ARG A 149 3.356 -11.014 10.505 1.00 0.00 N ATOM 0 H ARG A 149 6.051 -13.958 4.642 1.00 0.00 H new ATOM 0 HA ARG A 149 7.346 -12.975 6.937 1.00 0.00 H new ATOM 0 HB2 ARG A 149 5.297 -15.182 6.499 1.00 0.00 H new ATOM 0 HB3 ARG A 149 5.749 -14.572 8.079 1.00 0.00 H new ATOM 0 HG2 ARG A 149 5.068 -12.238 7.179 1.00 0.00 H new ATOM 0 HG3 ARG A 149 4.312 -13.102 5.855 1.00 0.00 H new ATOM 0 HD2 ARG A 149 2.543 -13.678 7.132 1.00 0.00 H new ATOM 0 HD3 ARG A 149 3.579 -14.340 8.380 1.00 0.00 H new ATOM 0 HE ARG A 149 2.349 -11.683 8.333 1.00 0.00 H new ATOM 0 HH11 ARG A 149 4.952 -13.677 9.655 1.00 0.00 H new ATOM 0 HH12 ARG A 149 5.150 -12.668 11.091 1.00 0.00 H new ATOM 0 HH21 ARG A 149 2.612 -10.397 10.179 1.00 0.00 H new ATOM 0 HH22 ARG A 149 3.830 -10.820 11.387 1.00 0.00 H new ATOM 2308 N LYS A 150 8.132 -15.292 8.145 1.00 0.00 N ATOM 2309 CA LYS A 150 9.068 -16.297 8.638 1.00 0.00 C ATOM 2310 C LYS A 150 8.323 -17.509 9.186 1.00 0.00 C ATOM 2311 O LYS A 150 7.858 -17.502 10.326 1.00 0.00 O ATOM 2312 CB LYS A 150 9.961 -15.698 9.727 1.00 0.00 C ATOM 2313 CG LYS A 150 9.186 -15.168 10.923 1.00 0.00 C ATOM 2314 CD LYS A 150 9.547 -13.724 11.229 1.00 0.00 C ATOM 2315 CE LYS A 150 10.608 -13.631 12.314 1.00 0.00 C ATOM 2316 NZ LYS A 150 10.017 -13.308 13.642 1.00 0.00 N ATOM 0 H LYS A 150 7.559 -14.859 8.869 1.00 0.00 H new ATOM 0 HA LYS A 150 9.690 -16.621 7.804 1.00 0.00 H new ATOM 0 HB2 LYS A 150 10.664 -16.458 10.068 1.00 0.00 H new ATOM 0 HB3 LYS A 150 10.550 -14.888 9.298 1.00 0.00 H new ATOM 0 HG2 LYS A 150 8.117 -15.242 10.726 1.00 0.00 H new ATOM 0 HG3 LYS A 150 9.393 -15.788 11.795 1.00 0.00 H new ATOM 0 HD2 LYS A 150 9.909 -13.239 10.323 1.00 0.00 H new ATOM 0 HD3 LYS A 150 8.654 -13.184 11.545 1.00 0.00 H new ATOM 0 HE2 LYS A 150 11.147 -14.576 12.377 1.00 0.00 H new ATOM 0 HE3 LYS A 150 11.336 -12.866 12.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 10.773 -13.253 14.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 9.524 -12.394 13.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 9.341 -14.051 13.911 1.00 0.00 H new ATOM 2330 N LYS A 151 8.213 -18.551 8.368 1.00 0.00 N ATOM 2331 CA LYS A 151 7.526 -19.770 8.772 1.00 0.00 C ATOM 2332 C LYS A 151 8.371 -21.002 8.457 1.00 0.00 C ATOM 2333 O LYS A 151 8.584 -21.337 7.291 1.00 0.00 O ATOM 2334 CB LYS A 151 6.168 -19.871 8.073 1.00 0.00 C ATOM 2335 CG LYS A 151 4.987 -19.791 9.027 1.00 0.00 C ATOM 2336 CD LYS A 151 4.551 -21.170 9.493 1.00 0.00 C ATOM 2337 CE LYS A 151 3.250 -21.111 10.279 1.00 0.00 C ATOM 2338 NZ LYS A 151 3.409 -21.651 11.658 1.00 0.00 N ATOM 0 H LYS A 151 8.591 -18.574 7.421 1.00 0.00 H new ATOM 0 HA LYS A 151 7.368 -19.729 9.850 1.00 0.00 H new ATOM 0 HB2 LYS A 151 6.086 -19.070 7.338 1.00 0.00 H new ATOM 0 HB3 LYS A 151 6.119 -20.812 7.525 1.00 0.00 H new ATOM 0 HG2 LYS A 151 5.256 -19.183 9.890 1.00 0.00 H new ATOM 0 HG3 LYS A 151 4.153 -19.292 8.534 1.00 0.00 H new ATOM 0 HD2 LYS A 151 4.426 -21.823 8.630 1.00 0.00 H new ATOM 0 HD3 LYS A 151 5.332 -21.609 10.114 1.00 0.00 H new ATOM 0 HE2 LYS A 151 2.904 -20.079 10.331 1.00 0.00 H new ATOM 0 HE3 LYS A 151 2.482 -21.679 9.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 2.500 -21.593 12.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 3.715 -22.644 11.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 4.123 -21.094 12.169 1.00 0.00 H new ATOM 2352 N HIS A 152 8.845 -21.671 9.503 1.00 0.00 N ATOM 2353 CA HIS A 152 9.667 -22.867 9.347 1.00 0.00 C ATOM 2354 C HIS A 152 10.982 -22.540 8.645 1.00 0.00 C ATOM 2355 O HIS A 152 12.027 -22.430 9.288 1.00 0.00 O ATOM 2356 CB HIS A 152 8.904 -23.939 8.563 1.00 0.00 C ATOM 2357 CG HIS A 152 7.694 -24.453 9.278 1.00 0.00 C ATOM 2358 ND1 HIS A 152 7.712 -25.578 10.076 1.00 0.00 N ATOM 2359 CD2 HIS A 152 6.421 -23.989 9.313 1.00 0.00 C ATOM 2360 CE1 HIS A 152 6.504 -25.783 10.571 1.00 0.00 C ATOM 2361 NE2 HIS A 152 5.704 -24.833 10.124 1.00 0.00 N ATOM 0 H HIS A 152 8.673 -21.404 10.472 1.00 0.00 H new ATOM 0 HA HIS A 152 9.896 -23.251 10.341 1.00 0.00 H new ATOM 0 HB2 HIS A 152 8.600 -23.527 7.601 1.00 0.00 H new ATOM 0 HB3 HIS A 152 9.575 -24.773 8.355 1.00 0.00 H new ATOM 0 HD2 HIS A 152 6.042 -23.118 8.799 1.00 0.00 H new ATOM 0 HE1 HIS A 152 6.220 -26.591 11.229 1.00 0.00 H new ATOM 0 HE2 HIS A 152 4.713 -24.741 10.346 1.00 0.00 H new ATOM 2370 N LEU A 153 10.927 -22.385 7.326 1.00 0.00 N ATOM 2371 CA LEU A 153 12.115 -22.071 6.542 1.00 0.00 C ATOM 2372 C LEU A 153 11.734 -21.436 5.208 1.00 0.00 C ATOM 2373 O LEU A 153 12.217 -20.358 4.860 1.00 0.00 O ATOM 2374 CB LEU A 153 12.943 -23.336 6.303 1.00 0.00 C ATOM 2375 CG LEU A 153 14.101 -23.546 7.283 1.00 0.00 C ATOM 2376 CD1 LEU A 153 14.241 -25.018 7.638 1.00 0.00 C ATOM 2377 CD2 LEU A 153 15.398 -23.012 6.695 1.00 0.00 C ATOM 0 H LEU A 153 10.071 -22.472 6.778 1.00 0.00 H new ATOM 0 HA LEU A 153 12.714 -21.355 7.105 1.00 0.00 H new ATOM 0 HB2 LEU A 153 12.281 -24.201 6.355 1.00 0.00 H new ATOM 0 HB3 LEU A 153 13.345 -23.303 5.290 1.00 0.00 H new ATOM 0 HG LEU A 153 13.884 -22.993 8.197 1.00 0.00 H new ATOM 0 HD11 LEU A 153 15.069 -25.147 8.335 1.00 0.00 H new ATOM 0 HD12 LEU A 153 13.319 -25.370 8.101 1.00 0.00 H new ATOM 0 HD13 LEU A 153 14.436 -25.594 6.733 1.00 0.00 H new ATOM 0 HD21 LEU A 153 16.211 -23.169 7.404 1.00 0.00 H new ATOM 0 HD22 LEU A 153 15.620 -23.538 5.766 1.00 0.00 H new ATOM 0 HD23 LEU A 153 15.294 -21.946 6.493 1.00 0.00 H new ATOM 2389 N GLU A 154 10.864 -22.112 4.466 1.00 0.00 N ATOM 2390 CA GLU A 154 10.415 -21.614 3.171 1.00 0.00 C ATOM 2391 C GLU A 154 8.983 -22.052 2.886 1.00 0.00 C ATOM 2392 O GLU A 154 8.611 -22.292 1.737 1.00 0.00 O ATOM 2393 CB GLU A 154 11.343 -22.112 2.060 1.00 0.00 C ATOM 2394 CG GLU A 154 11.385 -21.198 0.847 1.00 0.00 C ATOM 2395 CD GLU A 154 12.801 -20.873 0.410 1.00 0.00 C ATOM 2396 OE1 GLU A 154 13.502 -21.792 -0.062 1.00 0.00 O ATOM 2397 OE2 GLU A 154 13.207 -19.699 0.540 1.00 0.00 O ATOM 0 H GLU A 154 10.456 -23.006 4.739 1.00 0.00 H new ATOM 0 HA GLU A 154 10.444 -20.525 3.199 1.00 0.00 H new ATOM 0 HB2 GLU A 154 12.351 -22.217 2.460 1.00 0.00 H new ATOM 0 HB3 GLU A 154 11.020 -23.104 1.746 1.00 0.00 H new ATOM 0 HG2 GLU A 154 10.854 -21.671 0.021 1.00 0.00 H new ATOM 0 HG3 GLU A 154 10.858 -20.272 1.076 1.00 0.00 H new ATOM 2404 N ASP A 155 8.181 -22.157 3.942 1.00 0.00 N ATOM 2405 CA ASP A 155 6.788 -22.566 3.806 1.00 0.00 C ATOM 2406 C ASP A 155 6.689 -23.963 3.204 1.00 0.00 C ATOM 2407 O ASP A 155 6.847 -24.142 1.997 1.00 0.00 O ATOM 2408 CB ASP A 155 6.023 -21.567 2.937 1.00 0.00 C ATOM 2409 CG ASP A 155 4.532 -21.842 2.916 1.00 0.00 C ATOM 2410 OD1 ASP A 155 4.137 -22.941 2.470 1.00 0.00 O ATOM 2411 OD2 ASP A 155 3.759 -20.960 3.346 1.00 0.00 O ATOM 0 H ASP A 155 8.472 -21.964 4.900 1.00 0.00 H new ATOM 0 HA ASP A 155 6.342 -22.586 4.800 1.00 0.00 H new ATOM 0 HB2 ASP A 155 6.198 -20.557 3.309 1.00 0.00 H new ATOM 0 HB3 ASP A 155 6.411 -21.604 1.919 1.00 0.00 H new ATOM 2416 N GLU A 156 6.422 -24.950 4.054 1.00 0.00 N ATOM 2417 CA GLU A 156 6.302 -26.333 3.606 1.00 0.00 C ATOM 2418 C GLU A 156 4.976 -26.938 4.059 1.00 0.00 C ATOM 2419 O GLU A 156 4.315 -26.409 4.953 1.00 0.00 O ATOM 2420 CB GLU A 156 7.465 -27.169 4.141 1.00 0.00 C ATOM 2421 CG GLU A 156 7.727 -26.965 5.624 1.00 0.00 C ATOM 2422 CD GLU A 156 6.640 -27.561 6.496 1.00 0.00 C ATOM 2423 OE1 GLU A 156 6.523 -28.803 6.532 1.00 0.00 O ATOM 2424 OE2 GLU A 156 5.905 -26.785 7.142 1.00 0.00 O ATOM 0 H GLU A 156 6.285 -24.818 5.056 1.00 0.00 H new ATOM 0 HA GLU A 156 6.332 -26.339 2.516 1.00 0.00 H new ATOM 0 HB2 GLU A 156 7.258 -28.224 3.958 1.00 0.00 H new ATOM 0 HB3 GLU A 156 8.368 -26.920 3.583 1.00 0.00 H new ATOM 0 HG2 GLU A 156 8.685 -27.415 5.885 1.00 0.00 H new ATOM 0 HG3 GLU A 156 7.809 -25.898 5.831 1.00 0.00 H new ATOM 2431 N LEU A 157 4.594 -28.047 3.436 1.00 0.00 N ATOM 2432 CA LEU A 157 3.347 -28.723 3.775 1.00 0.00 C ATOM 2433 C LEU A 157 3.534 -30.238 3.774 1.00 0.00 C ATOM 2434 O LEU A 157 3.918 -30.786 2.721 1.00 0.00 O ATOM 2435 CB LEU A 157 2.245 -28.329 2.787 1.00 0.00 C ATOM 2436 CG LEU A 157 1.226 -27.323 3.326 1.00 0.00 C ATOM 2437 CD1 LEU A 157 0.796 -26.359 2.230 1.00 0.00 C ATOM 2438 CD2 LEU A 157 0.019 -28.047 3.905 1.00 0.00 C ATOM 2439 OXT LEU A 157 3.294 -30.862 4.830 1.00 0.00 O ATOM 0 H LEU A 157 5.130 -28.497 2.694 1.00 0.00 H new ATOM 0 HA LEU A 157 3.052 -28.413 4.778 1.00 0.00 H new ATOM 0 HB2 LEU A 157 2.710 -27.910 1.895 1.00 0.00 H new ATOM 0 HB3 LEU A 157 1.715 -29.230 2.478 1.00 0.00 H new ATOM 0 HG LEU A 157 1.698 -26.748 4.123 1.00 0.00 H new ATOM 0 HD11 LEU A 157 0.071 -25.651 2.632 1.00 0.00 H new ATOM 0 HD12 LEU A 157 1.666 -25.817 1.860 1.00 0.00 H new ATOM 0 HD13 LEU A 157 0.342 -26.918 1.412 1.00 0.00 H new ATOM 0 HD21 LEU A 157 -0.696 -27.317 4.284 1.00 0.00 H new ATOM 0 HD22 LEU A 157 -0.453 -28.647 3.127 1.00 0.00 H new ATOM 0 HD23 LEU A 157 0.340 -28.696 4.719 1.00 0.00 H new TER 2451 LEU A 157