USER MOD reduce.3.24.130724 H: found=0, std=0, add=945, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 939 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 108 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 112 THR OG1 : rot 83:sc= 1.2 USER MOD Set 2.1: A 89 ASN : amide:sc= -0.0257 K(o=1.2,f=0.53) USER MOD Set 2.2: A 100 SER OG : rot 85:sc= 1.26 USER MOD Set 3.1: A 76 ASN : amide:sc= -2.32! C(o=-5.1!,f=-6.6!) USER MOD Set 3.2: A 78 GLN : amide:sc= -2.73 K(o=-5.1,f=-6.4!) USER MOD Set 4.1: A 22 TYR OH : rot 150:sc= 1.22 USER MOD Set 4.2: A 72 LYS NZ :NH3+ 175:sc= 1.24 (180deg=0.484!) USER MOD Set 4.3: A 73 GLN : amide:sc= 0.0939 K(o=2.6,f=-3.9!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 173:sc= 0.96 (180deg=0.912) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= -0.454 USER MOD Single : A 8 GLN : amide:sc= -0.355 K(o=-0.35,f=-4.7!) USER MOD Single : A 12 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 16 ASN :FLIP amide:sc= -1.36! C(o=-2.1!,f=-1.4!) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 HIS : no HD1:sc= -0.255 X(o=-0.26,f=-0.033) USER MOD Single : A 29 TYR OH : rot 124:sc= 0.0711 USER MOD Single : A 32 HIS : no HD1:sc= -0.19 X(o=-0.19,f=-0.45) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot -37:sc= 0.0413 USER MOD Single : A 44 HIS : no HD1:sc= -3.17! C(o=-3.2!,f=-5!) USER MOD Single : A 47 CYS SG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 58 MET CE :methyl -142:sc= -1.68 (180deg=-5.71!) USER MOD Single : A 59 THR OG1 : rot 180:sc= -0.712 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot -165:sc= -4.2! USER MOD Single : A 71 ASN : amide:sc= -5.83! C(o=-5.8!,f=-9.9!) USER MOD Single : A 77 LYS NZ :NH3+ -165:sc= 1.18 (180deg=1.11) USER MOD Single : A 83 SER OG : rot 180:sc= 0.348 USER MOD Single : A 86 SER OG : rot 75:sc= -0.176! USER MOD Single : A 95 ASN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 103 ASN : amide:sc= -5.32! C(o=-5.3!,f=-5.9!) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 SER OG : rot -91:sc= 0.27 USER MOD Single : A 123 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 8.101 -8.031 -4.250 1.00 0.00 N ATOM 2 CA MET A 1 9.512 -7.699 -4.090 1.00 0.00 C ATOM 3 C MET A 1 9.975 -7.967 -2.662 1.00 0.00 C ATOM 4 O MET A 1 9.419 -7.424 -1.708 1.00 0.00 O ATOM 5 CB MET A 1 9.757 -6.233 -4.451 1.00 0.00 C ATOM 6 CG MET A 1 10.032 -6.009 -5.929 1.00 0.00 C ATOM 7 SD MET A 1 8.856 -6.867 -6.993 1.00 0.00 S ATOM 8 CE MET A 1 7.641 -5.579 -7.262 1.00 0.00 C ATOM 0 H1 MET A 1 7.778 -7.731 -5.192 1.00 0.00 H new ATOM 0 H2 MET A 1 7.973 -9.058 -4.151 1.00 0.00 H new ATOM 0 H3 MET A 1 7.544 -7.541 -3.521 1.00 0.00 H new ATOM 0 HA MET A 1 10.087 -8.333 -4.765 1.00 0.00 H new ATOM 0 HB2 MET A 1 8.887 -5.645 -4.159 1.00 0.00 H new ATOM 0 HB3 MET A 1 10.602 -5.861 -3.872 1.00 0.00 H new ATOM 0 HG2 MET A 1 9.997 -4.941 -6.143 1.00 0.00 H new ATOM 0 HG3 MET A 1 11.041 -6.348 -6.162 1.00 0.00 H new ATOM 0 HE1 MET A 1 6.846 -5.957 -7.904 1.00 0.00 H new ATOM 0 HE2 MET A 1 7.219 -5.271 -6.305 1.00 0.00 H new ATOM 0 HE3 MET A 1 8.118 -4.723 -7.740 1.00 0.00 H new ATOM 18 N GLU A 2 10.995 -8.808 -2.523 1.00 0.00 N ATOM 19 CA GLU A 2 11.531 -9.149 -1.210 1.00 0.00 C ATOM 20 C GLU A 2 12.595 -10.236 -1.322 1.00 0.00 C ATOM 21 O GLU A 2 12.574 -11.048 -2.247 1.00 0.00 O ATOM 22 CB GLU A 2 10.407 -9.613 -0.281 1.00 0.00 C ATOM 23 CG GLU A 2 9.385 -10.508 -0.962 1.00 0.00 C ATOM 24 CD GLU A 2 9.868 -11.937 -1.112 1.00 0.00 C ATOM 25 OE1 GLU A 2 10.917 -12.273 -0.523 1.00 0.00 O ATOM 26 OE2 GLU A 2 9.199 -12.720 -1.818 1.00 0.00 O ATOM 0 H GLU A 2 11.467 -9.266 -3.303 1.00 0.00 H new ATOM 0 HA GLU A 2 11.993 -8.255 -0.791 1.00 0.00 H new ATOM 0 HB2 GLU A 2 10.842 -10.149 0.562 1.00 0.00 H new ATOM 0 HB3 GLU A 2 9.898 -8.739 0.125 1.00 0.00 H new ATOM 0 HG2 GLU A 2 8.460 -10.500 -0.386 1.00 0.00 H new ATOM 0 HG3 GLU A 2 9.151 -10.102 -1.946 1.00 0.00 H new ATOM 33 N SER A 3 13.526 -10.244 -0.372 1.00 0.00 N ATOM 34 CA SER A 3 14.602 -11.228 -0.366 1.00 0.00 C ATOM 35 C SER A 3 14.582 -12.047 0.922 1.00 0.00 C ATOM 36 O SER A 3 14.044 -11.610 1.939 1.00 0.00 O ATOM 37 CB SER A 3 15.957 -10.535 -0.522 1.00 0.00 C ATOM 38 OG SER A 3 16.918 -11.414 -1.079 1.00 0.00 O ATOM 0 H SER A 3 13.556 -9.581 0.402 1.00 0.00 H new ATOM 0 HA SER A 3 14.448 -11.903 -1.208 1.00 0.00 H new ATOM 0 HB2 SER A 3 15.849 -9.658 -1.160 1.00 0.00 H new ATOM 0 HB3 SER A 3 16.302 -10.182 0.450 1.00 0.00 H new ATOM 0 HG SER A 3 17.775 -10.947 -1.170 1.00 0.00 H new ATOM 44 N SER A 4 15.173 -13.236 0.869 1.00 0.00 N ATOM 45 CA SER A 4 15.220 -14.118 2.029 1.00 0.00 C ATOM 46 C SER A 4 16.567 -14.829 2.116 1.00 0.00 C ATOM 47 O SER A 4 17.528 -14.451 1.444 1.00 0.00 O ATOM 48 CB SER A 4 14.091 -15.148 1.960 1.00 0.00 C ATOM 49 OG SER A 4 13.379 -15.208 3.184 1.00 0.00 O ATOM 0 H SER A 4 15.626 -13.611 0.035 1.00 0.00 H new ATOM 0 HA SER A 4 15.091 -13.508 2.923 1.00 0.00 H new ATOM 0 HB2 SER A 4 13.408 -14.890 1.151 1.00 0.00 H new ATOM 0 HB3 SER A 4 14.504 -16.130 1.727 1.00 0.00 H new ATOM 0 HG SER A 4 12.662 -15.872 3.113 1.00 0.00 H new ATOM 55 N THR A 5 16.631 -15.864 2.949 1.00 0.00 N ATOM 56 CA THR A 5 17.859 -16.628 3.126 1.00 0.00 C ATOM 57 C THR A 5 17.576 -18.126 3.151 1.00 0.00 C ATOM 58 O THR A 5 16.438 -18.549 3.354 1.00 0.00 O ATOM 59 CB THR A 5 18.584 -16.233 4.427 1.00 0.00 C ATOM 60 OG1 THR A 5 19.494 -17.268 4.814 1.00 0.00 O ATOM 61 CG2 THR A 5 17.586 -15.982 5.548 1.00 0.00 C ATOM 0 H THR A 5 15.846 -16.192 3.512 1.00 0.00 H new ATOM 0 HA THR A 5 18.501 -16.396 2.276 1.00 0.00 H new ATOM 0 HB THR A 5 19.138 -15.313 4.243 1.00 0.00 H new ATOM 0 HG1 THR A 5 19.952 -17.009 5.641 1.00 0.00 H new ATOM 0 HG21 THR A 5 18.121 -15.705 6.456 1.00 0.00 H new ATOM 0 HG22 THR A 5 16.913 -15.173 5.262 1.00 0.00 H new ATOM 0 HG23 THR A 5 17.008 -16.888 5.730 1.00 0.00 H new ATOM 69 N ASP A 6 18.618 -18.923 2.943 1.00 0.00 N ATOM 70 CA ASP A 6 18.481 -20.375 2.943 1.00 0.00 C ATOM 71 C ASP A 6 19.660 -21.032 3.654 1.00 0.00 C ATOM 72 O ASP A 6 20.660 -20.380 3.952 1.00 0.00 O ATOM 73 CB ASP A 6 18.378 -20.899 1.509 1.00 0.00 C ATOM 74 CG ASP A 6 19.311 -20.174 0.560 1.00 0.00 C ATOM 75 OD1 ASP A 6 18.915 -19.113 0.033 1.00 0.00 O ATOM 76 OD2 ASP A 6 20.438 -20.667 0.343 1.00 0.00 O ATOM 0 H ASP A 6 19.566 -18.589 2.772 1.00 0.00 H new ATOM 0 HA ASP A 6 17.568 -20.629 3.481 1.00 0.00 H new ATOM 0 HB2 ASP A 6 18.608 -21.964 1.497 1.00 0.00 H new ATOM 0 HB3 ASP A 6 17.352 -20.791 1.158 1.00 0.00 H new ATOM 81 N GLY A 7 19.535 -22.328 3.924 1.00 0.00 N ATOM 82 CA GLY A 7 20.596 -23.051 4.600 1.00 0.00 C ATOM 83 C GLY A 7 20.073 -23.964 5.691 1.00 0.00 C ATOM 84 O GLY A 7 19.974 -23.562 6.850 1.00 0.00 O ATOM 0 H GLY A 7 18.718 -22.890 3.686 1.00 0.00 H new ATOM 0 HA2 GLY A 7 21.150 -23.642 3.871 1.00 0.00 H new ATOM 0 HA3 GLY A 7 21.298 -22.338 5.033 1.00 0.00 H new ATOM 88 N GLN A 8 19.735 -25.194 5.319 1.00 0.00 N ATOM 89 CA GLN A 8 19.216 -26.165 6.276 1.00 0.00 C ATOM 90 C GLN A 8 19.053 -27.535 5.626 1.00 0.00 C ATOM 91 O GLN A 8 18.889 -27.642 4.411 1.00 0.00 O ATOM 92 CB GLN A 8 17.875 -25.691 6.839 1.00 0.00 C ATOM 93 CG GLN A 8 17.397 -26.500 8.034 1.00 0.00 C ATOM 94 CD GLN A 8 18.377 -26.467 9.190 1.00 0.00 C ATOM 95 OE1 GLN A 8 19.380 -27.181 9.190 1.00 0.00 O ATOM 96 NE2 GLN A 8 18.091 -25.635 10.185 1.00 0.00 N ATOM 0 H GLN A 8 19.811 -25.542 4.363 1.00 0.00 H new ATOM 0 HA GLN A 8 19.933 -26.253 7.092 1.00 0.00 H new ATOM 0 HB2 GLN A 8 17.962 -24.644 7.131 1.00 0.00 H new ATOM 0 HB3 GLN A 8 17.122 -25.741 6.052 1.00 0.00 H new ATOM 0 HG2 GLN A 8 16.434 -26.114 8.368 1.00 0.00 H new ATOM 0 HG3 GLN A 8 17.237 -27.534 7.728 1.00 0.00 H new ATOM 0 HE21 GLN A 8 17.249 -25.061 10.144 1.00 0.00 H new ATOM 0 HE22 GLN A 8 18.714 -25.570 10.990 1.00 0.00 H new ATOM 105 N VAL A 9 19.099 -28.582 6.444 1.00 0.00 N ATOM 106 CA VAL A 9 18.955 -29.946 5.950 1.00 0.00 C ATOM 107 C VAL A 9 17.557 -30.184 5.392 1.00 0.00 C ATOM 108 O VAL A 9 16.578 -30.224 6.137 1.00 0.00 O ATOM 109 CB VAL A 9 19.236 -30.977 7.059 1.00 0.00 C ATOM 110 CG1 VAL A 9 18.327 -30.737 8.254 1.00 0.00 C ATOM 111 CG2 VAL A 9 19.067 -32.392 6.525 1.00 0.00 C ATOM 0 H VAL A 9 19.235 -28.511 7.452 1.00 0.00 H new ATOM 0 HA VAL A 9 19.687 -30.073 5.153 1.00 0.00 H new ATOM 0 HB VAL A 9 20.268 -30.858 7.389 1.00 0.00 H new ATOM 0 HG11 VAL A 9 18.540 -31.475 9.027 1.00 0.00 H new ATOM 0 HG12 VAL A 9 18.502 -29.736 8.649 1.00 0.00 H new ATOM 0 HG13 VAL A 9 17.286 -30.827 7.943 1.00 0.00 H new ATOM 0 HG21 VAL A 9 19.269 -33.108 7.322 1.00 0.00 H new ATOM 0 HG22 VAL A 9 18.046 -32.526 6.167 1.00 0.00 H new ATOM 0 HG23 VAL A 9 19.764 -32.557 5.704 1.00 0.00 H new ATOM 121 N VAL A 10 17.470 -30.342 4.075 1.00 0.00 N ATOM 122 CA VAL A 10 16.191 -30.578 3.416 1.00 0.00 C ATOM 123 C VAL A 10 16.391 -31.027 1.972 1.00 0.00 C ATOM 124 O VAL A 10 17.447 -30.824 1.374 1.00 0.00 O ATOM 125 CB VAL A 10 15.310 -29.315 3.431 1.00 0.00 C ATOM 126 CG1 VAL A 10 14.247 -29.418 4.515 1.00 0.00 C ATOM 127 CG2 VAL A 10 16.165 -28.072 3.628 1.00 0.00 C ATOM 0 H VAL A 10 18.270 -30.311 3.443 1.00 0.00 H new ATOM 0 HA VAL A 10 15.689 -31.369 3.974 1.00 0.00 H new ATOM 0 HB VAL A 10 14.806 -29.233 2.468 1.00 0.00 H new ATOM 0 HG11 VAL A 10 13.634 -28.517 4.510 1.00 0.00 H new ATOM 0 HG12 VAL A 10 13.616 -30.286 4.325 1.00 0.00 H new ATOM 0 HG13 VAL A 10 14.728 -29.525 5.487 1.00 0.00 H new ATOM 0 HG21 VAL A 10 15.526 -27.189 3.636 1.00 0.00 H new ATOM 0 HG22 VAL A 10 16.698 -28.143 4.576 1.00 0.00 H new ATOM 0 HG23 VAL A 10 16.884 -27.992 2.813 1.00 0.00 H new ATOM 137 N PRO A 11 15.353 -31.653 1.398 1.00 0.00 N ATOM 138 CA PRO A 11 15.389 -32.143 0.017 1.00 0.00 C ATOM 139 C PRO A 11 15.395 -31.008 -1.001 1.00 0.00 C ATOM 140 O PRO A 11 14.433 -30.247 -1.100 1.00 0.00 O ATOM 141 CB PRO A 11 14.102 -32.962 -0.103 1.00 0.00 C ATOM 142 CG PRO A 11 13.186 -32.380 0.917 1.00 0.00 C ATOM 143 CD PRO A 11 14.063 -31.929 2.053 1.00 0.00 C ATOM 0 HA PRO A 11 16.294 -32.714 -0.189 1.00 0.00 H new ATOM 0 HB2 PRO A 11 13.678 -32.888 -1.104 1.00 0.00 H new ATOM 0 HB3 PRO A 11 14.286 -34.019 0.088 1.00 0.00 H new ATOM 0 HG2 PRO A 11 12.622 -31.544 0.503 1.00 0.00 H new ATOM 0 HG3 PRO A 11 12.459 -33.118 1.255 1.00 0.00 H new ATOM 0 HD2 PRO A 11 13.662 -31.041 2.542 1.00 0.00 H new ATOM 0 HD3 PRO A 11 14.157 -32.699 2.818 1.00 0.00 H new ATOM 151 N GLN A 12 16.484 -30.900 -1.755 1.00 0.00 N ATOM 152 CA GLN A 12 16.613 -29.857 -2.766 1.00 0.00 C ATOM 153 C GLN A 12 15.732 -30.157 -3.974 1.00 0.00 C ATOM 154 O GLN A 12 15.158 -29.250 -4.575 1.00 0.00 O ATOM 155 CB GLN A 12 18.072 -29.721 -3.205 1.00 0.00 C ATOM 156 CG GLN A 12 18.240 -29.045 -4.556 1.00 0.00 C ATOM 157 CD GLN A 12 19.690 -28.753 -4.886 1.00 0.00 C ATOM 158 OE1 GLN A 12 20.602 -29.335 -4.299 1.00 0.00 O ATOM 159 NE2 GLN A 12 19.912 -27.846 -5.831 1.00 0.00 N ATOM 0 H GLN A 12 17.290 -31.522 -1.685 1.00 0.00 H new ATOM 0 HA GLN A 12 16.284 -28.916 -2.325 1.00 0.00 H new ATOM 0 HB2 GLN A 12 18.618 -29.151 -2.453 1.00 0.00 H new ATOM 0 HB3 GLN A 12 18.525 -30.712 -3.245 1.00 0.00 H new ATOM 0 HG2 GLN A 12 17.816 -29.682 -5.332 1.00 0.00 H new ATOM 0 HG3 GLN A 12 17.675 -28.113 -4.565 1.00 0.00 H new ATOM 0 HE21 GLN A 12 19.126 -27.387 -6.292 1.00 0.00 H new ATOM 0 HE22 GLN A 12 20.868 -27.608 -6.095 1.00 0.00 H new ATOM 168 N GLU A 13 15.631 -31.436 -4.323 1.00 0.00 N ATOM 169 CA GLU A 13 14.820 -31.855 -5.461 1.00 0.00 C ATOM 170 C GLU A 13 13.335 -31.819 -5.113 1.00 0.00 C ATOM 171 O GLU A 13 12.479 -31.801 -5.997 1.00 0.00 O ATOM 172 CB GLU A 13 15.217 -33.263 -5.907 1.00 0.00 C ATOM 173 CG GLU A 13 14.728 -34.358 -4.975 1.00 0.00 C ATOM 174 CD GLU A 13 15.534 -34.437 -3.693 1.00 0.00 C ATOM 175 OE1 GLU A 13 16.708 -34.011 -3.703 1.00 0.00 O ATOM 176 OE2 GLU A 13 14.991 -34.924 -2.680 1.00 0.00 O ATOM 0 H GLU A 13 16.100 -32.199 -3.835 1.00 0.00 H new ATOM 0 HA GLU A 13 15.000 -31.158 -6.280 1.00 0.00 H new ATOM 0 HB2 GLU A 13 14.820 -33.444 -6.906 1.00 0.00 H new ATOM 0 HB3 GLU A 13 16.303 -33.319 -5.981 1.00 0.00 H new ATOM 0 HG2 GLU A 13 13.681 -34.181 -4.731 1.00 0.00 H new ATOM 0 HG3 GLU A 13 14.777 -35.317 -5.490 1.00 0.00 H new ATOM 183 N VAL A 14 13.036 -31.811 -3.817 1.00 0.00 N ATOM 184 CA VAL A 14 11.655 -31.778 -3.351 1.00 0.00 C ATOM 185 C VAL A 14 10.866 -30.677 -4.051 1.00 0.00 C ATOM 186 O VAL A 14 9.656 -30.797 -4.251 1.00 0.00 O ATOM 187 CB VAL A 14 11.582 -31.558 -1.829 1.00 0.00 C ATOM 188 CG1 VAL A 14 10.667 -30.388 -1.501 1.00 0.00 C ATOM 189 CG2 VAL A 14 11.112 -32.825 -1.130 1.00 0.00 C ATOM 0 H VAL A 14 13.732 -31.827 -3.072 1.00 0.00 H new ATOM 0 HA VAL A 14 11.216 -32.746 -3.592 1.00 0.00 H new ATOM 0 HB VAL A 14 12.582 -31.319 -1.466 1.00 0.00 H new ATOM 0 HG11 VAL A 14 10.628 -30.248 -0.421 1.00 0.00 H new ATOM 0 HG12 VAL A 14 11.052 -29.483 -1.971 1.00 0.00 H new ATOM 0 HG13 VAL A 14 9.665 -30.594 -1.876 1.00 0.00 H new ATOM 0 HG21 VAL A 14 11.066 -32.652 -0.055 1.00 0.00 H new ATOM 0 HG22 VAL A 14 10.122 -33.097 -1.496 1.00 0.00 H new ATOM 0 HG23 VAL A 14 11.811 -33.636 -1.337 1.00 0.00 H new ATOM 199 N LEU A 15 11.557 -29.605 -4.422 1.00 0.00 N ATOM 200 CA LEU A 15 10.921 -28.482 -5.101 1.00 0.00 C ATOM 201 C LEU A 15 10.111 -28.959 -6.302 1.00 0.00 C ATOM 202 O LEU A 15 9.067 -28.394 -6.624 1.00 0.00 O ATOM 203 CB LEU A 15 11.975 -27.469 -5.551 1.00 0.00 C ATOM 204 CG LEU A 15 12.488 -26.511 -4.476 1.00 0.00 C ATOM 205 CD1 LEU A 15 11.530 -25.343 -4.301 1.00 0.00 C ATOM 206 CD2 LEU A 15 12.684 -27.245 -3.157 1.00 0.00 C ATOM 0 H LEU A 15 12.558 -29.490 -4.264 1.00 0.00 H new ATOM 0 HA LEU A 15 10.242 -28.001 -4.397 1.00 0.00 H new ATOM 0 HB2 LEU A 15 12.826 -28.016 -5.957 1.00 0.00 H new ATOM 0 HB3 LEU A 15 11.557 -26.878 -6.366 1.00 0.00 H new ATOM 0 HG LEU A 15 13.453 -26.118 -4.797 1.00 0.00 H new ATOM 0 HD11 LEU A 15 11.912 -24.672 -3.532 1.00 0.00 H new ATOM 0 HD12 LEU A 15 11.440 -24.802 -5.243 1.00 0.00 H new ATOM 0 HD13 LEU A 15 10.551 -25.717 -4.003 1.00 0.00 H new ATOM 0 HD21 LEU A 15 13.050 -26.548 -2.403 1.00 0.00 H new ATOM 0 HD22 LEU A 15 11.733 -27.667 -2.831 1.00 0.00 H new ATOM 0 HD23 LEU A 15 13.410 -28.047 -3.291 1.00 0.00 H new ATOM 218 N ASN A 16 10.600 -30.005 -6.961 1.00 0.00 N ATOM 219 CA ASN A 16 9.922 -30.560 -8.126 1.00 0.00 C ATOM 220 C ASN A 16 9.627 -29.471 -9.154 1.00 0.00 C ATOM 221 O ASN A 16 10.451 -29.183 -10.023 1.00 0.00 O ATOM 222 CB ASN A 16 8.620 -31.246 -7.706 1.00 0.00 C ATOM 223 CG ASN A 16 7.670 -31.447 -8.871 1.00 0.00 C ATOM 224 OD1 ASN A 16 6.459 -30.918 -8.745 1.00 0.00 O flip ATOM 225 ND2 ASN A 16 8.022 -32.072 -9.872 1.00 0.00 N flip ATOM 0 H ASN A 16 11.464 -30.485 -6.707 1.00 0.00 H new ATOM 0 HA ASN A 16 10.583 -31.297 -8.583 1.00 0.00 H new ATOM 0 HB2 ASN A 16 8.850 -32.212 -7.258 1.00 0.00 H new ATOM 0 HB3 ASN A 16 8.128 -30.648 -6.939 1.00 0.00 H new ATOM 0 HD21 ASN A 16 8.963 -32.461 -9.925 1.00 0.00 H new ATOM 0 HD22 ASN A 16 7.372 -32.200 -10.648 1.00 0.00 H new ATOM 232 N LEU A 17 8.447 -28.869 -9.048 1.00 0.00 N ATOM 233 CA LEU A 17 8.043 -27.811 -9.967 1.00 0.00 C ATOM 234 C LEU A 17 8.801 -26.520 -9.678 1.00 0.00 C ATOM 235 O LEU A 17 9.314 -26.305 -8.579 1.00 0.00 O ATOM 236 CB LEU A 17 6.537 -27.567 -9.864 1.00 0.00 C ATOM 237 CG LEU A 17 6.108 -26.369 -9.015 1.00 0.00 C ATOM 238 CD1 LEU A 17 5.832 -25.162 -9.898 1.00 0.00 C ATOM 239 CD2 LEU A 17 4.881 -26.716 -8.184 1.00 0.00 C ATOM 0 H LEU A 17 7.754 -29.096 -8.335 1.00 0.00 H new ATOM 0 HA LEU A 17 8.284 -28.132 -10.980 1.00 0.00 H new ATOM 0 HB2 LEU A 17 6.141 -27.434 -10.871 1.00 0.00 H new ATOM 0 HB3 LEU A 17 6.071 -28.463 -9.454 1.00 0.00 H new ATOM 0 HG LEU A 17 6.923 -26.118 -8.336 1.00 0.00 H new ATOM 0 HD11 LEU A 17 5.528 -24.319 -9.277 1.00 0.00 H new ATOM 0 HD12 LEU A 17 6.735 -24.900 -10.449 1.00 0.00 H new ATOM 0 HD13 LEU A 17 5.034 -25.401 -10.602 1.00 0.00 H new ATOM 0 HD21 LEU A 17 4.590 -25.852 -7.586 1.00 0.00 H new ATOM 0 HD22 LEU A 17 4.060 -26.993 -8.845 1.00 0.00 H new ATOM 0 HD23 LEU A 17 5.113 -27.552 -7.524 1.00 0.00 H new ATOM 251 N PRO A 18 8.871 -25.636 -10.685 1.00 0.00 N ATOM 252 CA PRO A 18 9.561 -24.349 -10.561 1.00 0.00 C ATOM 253 C PRO A 18 8.828 -23.384 -9.636 1.00 0.00 C ATOM 254 O PRO A 18 8.268 -22.382 -10.085 1.00 0.00 O ATOM 255 CB PRO A 18 9.571 -23.813 -11.995 1.00 0.00 C ATOM 256 CG PRO A 18 8.404 -24.466 -12.651 1.00 0.00 C ATOM 257 CD PRO A 18 8.282 -25.826 -12.021 1.00 0.00 C ATOM 0 HA PRO A 18 10.554 -24.459 -10.125 1.00 0.00 H new ATOM 0 HB2 PRO A 18 9.479 -22.727 -12.012 1.00 0.00 H new ATOM 0 HB3 PRO A 18 10.502 -24.062 -12.504 1.00 0.00 H new ATOM 0 HG2 PRO A 18 7.495 -23.883 -12.500 1.00 0.00 H new ATOM 0 HG3 PRO A 18 8.556 -24.547 -13.727 1.00 0.00 H new ATOM 0 HD2 PRO A 18 7.243 -26.149 -11.960 1.00 0.00 H new ATOM 0 HD3 PRO A 18 8.818 -26.583 -12.593 1.00 0.00 H new ATOM 265 N LEU A 19 8.834 -23.691 -8.344 1.00 0.00 N ATOM 266 CA LEU A 19 8.169 -22.850 -7.355 1.00 0.00 C ATOM 267 C LEU A 19 8.539 -21.383 -7.550 1.00 0.00 C ATOM 268 O LEU A 19 7.672 -20.509 -7.549 1.00 0.00 O ATOM 269 CB LEU A 19 8.544 -23.298 -5.941 1.00 0.00 C ATOM 270 CG LEU A 19 7.664 -24.387 -5.327 1.00 0.00 C ATOM 271 CD1 LEU A 19 8.246 -24.861 -4.004 1.00 0.00 C ATOM 272 CD2 LEU A 19 6.243 -23.879 -5.134 1.00 0.00 C ATOM 0 H LEU A 19 9.292 -24.516 -7.957 1.00 0.00 H new ATOM 0 HA LEU A 19 7.093 -22.955 -7.490 1.00 0.00 H new ATOM 0 HB2 LEU A 19 9.573 -23.656 -5.956 1.00 0.00 H new ATOM 0 HB3 LEU A 19 8.519 -22.427 -5.287 1.00 0.00 H new ATOM 0 HG LEU A 19 7.636 -25.234 -6.013 1.00 0.00 H new ATOM 0 HD11 LEU A 19 7.606 -25.636 -3.582 1.00 0.00 H new ATOM 0 HD12 LEU A 19 9.245 -25.265 -4.170 1.00 0.00 H new ATOM 0 HD13 LEU A 19 8.305 -24.022 -3.311 1.00 0.00 H new ATOM 0 HD21 LEU A 19 5.631 -24.668 -4.696 1.00 0.00 H new ATOM 0 HD22 LEU A 19 6.253 -23.015 -4.469 1.00 0.00 H new ATOM 0 HD23 LEU A 19 5.826 -23.590 -6.099 1.00 0.00 H new ATOM 284 N GLU A 20 9.831 -21.121 -7.720 1.00 0.00 N ATOM 285 CA GLU A 20 10.315 -19.760 -7.919 1.00 0.00 C ATOM 286 C GLU A 20 9.628 -19.107 -9.115 1.00 0.00 C ATOM 287 O GLU A 20 9.233 -17.942 -9.060 1.00 0.00 O ATOM 288 CB GLU A 20 11.831 -19.758 -8.124 1.00 0.00 C ATOM 289 CG GLU A 20 12.546 -18.648 -7.372 1.00 0.00 C ATOM 290 CD GLU A 20 13.411 -17.793 -8.278 1.00 0.00 C ATOM 291 OE1 GLU A 20 14.316 -18.350 -8.933 1.00 0.00 O ATOM 292 OE2 GLU A 20 13.181 -16.566 -8.332 1.00 0.00 O ATOM 0 H GLU A 20 10.561 -21.833 -7.724 1.00 0.00 H new ATOM 0 HA GLU A 20 10.076 -19.183 -7.025 1.00 0.00 H new ATOM 0 HB2 GLU A 20 12.233 -20.719 -7.805 1.00 0.00 H new ATOM 0 HB3 GLU A 20 12.045 -19.661 -9.188 1.00 0.00 H new ATOM 0 HG2 GLU A 20 11.809 -18.016 -6.877 1.00 0.00 H new ATOM 0 HG3 GLU A 20 13.167 -19.085 -6.590 1.00 0.00 H new ATOM 299 N LYS A 21 9.488 -19.867 -10.196 1.00 0.00 N ATOM 300 CA LYS A 21 8.849 -19.365 -11.407 1.00 0.00 C ATOM 301 C LYS A 21 7.367 -19.092 -11.166 1.00 0.00 C ATOM 302 O LYS A 21 6.796 -18.165 -11.740 1.00 0.00 O ATOM 303 CB LYS A 21 9.014 -20.370 -12.549 1.00 0.00 C ATOM 304 CG LYS A 21 8.946 -19.739 -13.929 1.00 0.00 C ATOM 305 CD LYS A 21 10.234 -19.955 -14.705 1.00 0.00 C ATOM 306 CE LYS A 21 11.240 -18.846 -14.436 1.00 0.00 C ATOM 307 NZ LYS A 21 12.561 -19.386 -14.011 1.00 0.00 N ATOM 0 H LYS A 21 9.809 -20.833 -10.258 1.00 0.00 H new ATOM 0 HA LYS A 21 9.333 -18.428 -11.683 1.00 0.00 H new ATOM 0 HB2 LYS A 21 9.971 -20.879 -12.438 1.00 0.00 H new ATOM 0 HB3 LYS A 21 8.237 -21.130 -12.468 1.00 0.00 H new ATOM 0 HG2 LYS A 21 8.110 -20.165 -14.484 1.00 0.00 H new ATOM 0 HG3 LYS A 21 8.753 -18.671 -13.832 1.00 0.00 H new ATOM 0 HD2 LYS A 21 10.669 -20.916 -14.430 1.00 0.00 H new ATOM 0 HD3 LYS A 21 10.014 -19.998 -15.772 1.00 0.00 H new ATOM 0 HE2 LYS A 21 11.366 -18.244 -15.336 1.00 0.00 H new ATOM 0 HE3 LYS A 21 10.852 -18.184 -13.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 13.218 -18.599 -13.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 12.445 -19.939 -13.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 12.943 -19.998 -14.760 1.00 0.00 H new ATOM 321 N TYR A 22 6.752 -19.904 -10.314 1.00 0.00 N ATOM 322 CA TYR A 22 5.336 -19.750 -9.998 1.00 0.00 C ATOM 323 C TYR A 22 5.084 -18.445 -9.250 1.00 0.00 C ATOM 324 O TYR A 22 4.175 -17.686 -9.590 1.00 0.00 O ATOM 325 CB TYR A 22 4.847 -20.933 -9.162 1.00 0.00 C ATOM 326 CG TYR A 22 3.814 -20.555 -8.124 1.00 0.00 C ATOM 327 CD1 TYR A 22 4.190 -19.951 -6.931 1.00 0.00 C ATOM 328 CD2 TYR A 22 2.464 -20.804 -8.336 1.00 0.00 C ATOM 329 CE1 TYR A 22 3.250 -19.604 -5.979 1.00 0.00 C ATOM 330 CE2 TYR A 22 1.517 -20.460 -7.391 1.00 0.00 C ATOM 331 CZ TYR A 22 1.915 -19.860 -6.214 1.00 0.00 C ATOM 332 OH TYR A 22 0.975 -19.517 -5.270 1.00 0.00 O ATOM 0 H TYR A 22 7.211 -20.675 -9.830 1.00 0.00 H new ATOM 0 HA TYR A 22 4.781 -19.723 -10.936 1.00 0.00 H new ATOM 0 HB2 TYR A 22 4.424 -21.686 -9.826 1.00 0.00 H new ATOM 0 HB3 TYR A 22 5.700 -21.392 -8.663 1.00 0.00 H new ATOM 0 HD1 TYR A 22 5.234 -19.749 -6.744 1.00 0.00 H new ATOM 0 HD2 TYR A 22 2.149 -21.275 -9.256 1.00 0.00 H new ATOM 0 HE1 TYR A 22 3.559 -19.135 -5.056 1.00 0.00 H new ATOM 0 HE2 TYR A 22 0.471 -20.660 -7.572 1.00 0.00 H new ATOM 0 HH TYR A 22 0.127 -19.306 -5.714 1.00 0.00 H new ATOM 342 N HIS A 23 5.896 -18.189 -8.228 1.00 0.00 N ATOM 343 CA HIS A 23 5.762 -16.975 -7.431 1.00 0.00 C ATOM 344 C HIS A 23 6.122 -15.742 -8.255 1.00 0.00 C ATOM 345 O HIS A 23 5.598 -14.654 -8.019 1.00 0.00 O ATOM 346 CB HIS A 23 6.655 -17.053 -6.192 1.00 0.00 C ATOM 347 CG HIS A 23 6.148 -16.246 -5.037 1.00 0.00 C ATOM 348 ND1 HIS A 23 6.962 -15.794 -4.020 1.00 0.00 N ATOM 349 CD2 HIS A 23 4.902 -15.808 -4.742 1.00 0.00 C ATOM 350 CE1 HIS A 23 6.238 -15.115 -3.148 1.00 0.00 C ATOM 351 NE2 HIS A 23 4.984 -15.108 -3.564 1.00 0.00 N ATOM 0 H HIS A 23 6.653 -18.806 -7.933 1.00 0.00 H new ATOM 0 HA HIS A 23 4.722 -16.889 -7.116 1.00 0.00 H new ATOM 0 HB2 HIS A 23 6.746 -18.095 -5.885 1.00 0.00 H new ATOM 0 HB3 HIS A 23 7.656 -16.709 -6.453 1.00 0.00 H new ATOM 0 HD2 HIS A 23 4.009 -15.978 -5.325 1.00 0.00 H new ATOM 0 HE1 HIS A 23 6.608 -14.646 -2.248 1.00 0.00 H new ATOM 0 HE2 HIS A 23 4.204 -14.656 -3.087 1.00 0.00 H new ATOM 359 N GLU A 24 7.018 -15.922 -9.220 1.00 0.00 N ATOM 360 CA GLU A 24 7.448 -14.823 -10.076 1.00 0.00 C ATOM 361 C GLU A 24 6.322 -14.388 -11.010 1.00 0.00 C ATOM 362 O GLU A 24 5.988 -13.206 -11.088 1.00 0.00 O ATOM 363 CB GLU A 24 8.674 -15.233 -10.895 1.00 0.00 C ATOM 364 CG GLU A 24 9.994 -14.950 -10.197 1.00 0.00 C ATOM 365 CD GLU A 24 10.919 -14.085 -11.030 1.00 0.00 C ATOM 366 OE1 GLU A 24 11.602 -14.634 -11.921 1.00 0.00 O ATOM 367 OE2 GLU A 24 10.962 -12.860 -10.792 1.00 0.00 O ATOM 0 H GLU A 24 7.460 -16.817 -9.428 1.00 0.00 H new ATOM 0 HA GLU A 24 7.713 -13.981 -9.436 1.00 0.00 H new ATOM 0 HB2 GLU A 24 8.612 -16.298 -11.118 1.00 0.00 H new ATOM 0 HB3 GLU A 24 8.656 -14.706 -11.849 1.00 0.00 H new ATOM 0 HG2 GLU A 24 9.799 -14.456 -9.245 1.00 0.00 H new ATOM 0 HG3 GLU A 24 10.491 -15.893 -9.970 1.00 0.00 H new ATOM 374 N GLU A 25 5.741 -15.353 -11.716 1.00 0.00 N ATOM 375 CA GLU A 25 4.653 -15.070 -12.645 1.00 0.00 C ATOM 376 C GLU A 25 3.417 -14.572 -11.901 1.00 0.00 C ATOM 377 O GLU A 25 2.876 -13.513 -12.215 1.00 0.00 O ATOM 378 CB GLU A 25 4.306 -16.321 -13.455 1.00 0.00 C ATOM 379 CG GLU A 25 5.260 -16.585 -14.608 1.00 0.00 C ATOM 380 CD GLU A 25 5.565 -15.335 -15.410 1.00 0.00 C ATOM 381 OE1 GLU A 25 4.665 -14.479 -15.539 1.00 0.00 O ATOM 382 OE2 GLU A 25 6.704 -15.212 -15.908 1.00 0.00 O ATOM 0 H GLU A 25 6.005 -16.337 -11.662 1.00 0.00 H new ATOM 0 HA GLU A 25 4.985 -14.286 -13.326 1.00 0.00 H new ATOM 0 HB2 GLU A 25 4.305 -17.185 -12.790 1.00 0.00 H new ATOM 0 HB3 GLU A 25 3.294 -16.220 -13.848 1.00 0.00 H new ATOM 0 HG2 GLU A 25 6.190 -16.998 -14.218 1.00 0.00 H new ATOM 0 HG3 GLU A 25 4.828 -17.339 -15.267 1.00 0.00 H new ATOM 389 N ALA A 26 2.977 -15.346 -10.914 1.00 0.00 N ATOM 390 CA ALA A 26 1.807 -14.984 -10.124 1.00 0.00 C ATOM 391 C ALA A 26 1.987 -13.619 -9.469 1.00 0.00 C ATOM 392 O ALA A 26 1.032 -12.854 -9.333 1.00 0.00 O ATOM 393 CB ALA A 26 1.533 -16.046 -9.070 1.00 0.00 C ATOM 0 H ALA A 26 3.413 -16.227 -10.643 1.00 0.00 H new ATOM 0 HA ALA A 26 0.950 -14.925 -10.795 1.00 0.00 H new ATOM 0 HB1 ALA A 26 0.656 -15.763 -8.487 1.00 0.00 H new ATOM 0 HB2 ALA A 26 1.351 -17.004 -9.557 1.00 0.00 H new ATOM 0 HB3 ALA A 26 2.395 -16.134 -8.409 1.00 0.00 H new ATOM 399 N ASP A 27 3.217 -13.320 -9.065 1.00 0.00 N ATOM 400 CA ASP A 27 3.522 -12.046 -8.424 1.00 0.00 C ATOM 401 C ASP A 27 3.380 -10.893 -9.413 1.00 0.00 C ATOM 402 O ASP A 27 2.785 -9.862 -9.098 1.00 0.00 O ATOM 403 CB ASP A 27 4.938 -12.068 -7.847 1.00 0.00 C ATOM 404 CG ASP A 27 5.366 -10.716 -7.311 1.00 0.00 C ATOM 405 OD1 ASP A 27 5.282 -9.724 -8.066 1.00 0.00 O ATOM 406 OD2 ASP A 27 5.784 -10.649 -6.136 1.00 0.00 O ATOM 0 H ASP A 27 4.018 -13.942 -9.170 1.00 0.00 H new ATOM 0 HA ASP A 27 2.810 -11.895 -7.613 1.00 0.00 H new ATOM 0 HB2 ASP A 27 4.989 -12.806 -7.046 1.00 0.00 H new ATOM 0 HB3 ASP A 27 5.637 -12.387 -8.620 1.00 0.00 H new ATOM 411 N ASP A 28 3.931 -11.074 -10.608 1.00 0.00 N ATOM 412 CA ASP A 28 3.865 -10.048 -11.643 1.00 0.00 C ATOM 413 C ASP A 28 2.456 -9.945 -12.218 1.00 0.00 C ATOM 414 O ASP A 28 2.020 -8.870 -12.629 1.00 0.00 O ATOM 415 CB ASP A 28 4.864 -10.356 -12.760 1.00 0.00 C ATOM 416 CG ASP A 28 5.371 -9.103 -13.445 1.00 0.00 C ATOM 417 OD1 ASP A 28 5.280 -8.016 -12.837 1.00 0.00 O ATOM 418 OD2 ASP A 28 5.859 -9.208 -14.590 1.00 0.00 O ATOM 0 H ASP A 28 4.428 -11.921 -10.884 1.00 0.00 H new ATOM 0 HA ASP A 28 4.123 -9.091 -11.189 1.00 0.00 H new ATOM 0 HB2 ASP A 28 5.708 -10.907 -12.346 1.00 0.00 H new ATOM 0 HB3 ASP A 28 4.391 -11.004 -13.498 1.00 0.00 H new ATOM 423 N TYR A 29 1.750 -11.070 -12.244 1.00 0.00 N ATOM 424 CA TYR A 29 0.391 -11.107 -12.772 1.00 0.00 C ATOM 425 C TYR A 29 -0.562 -10.317 -11.880 1.00 0.00 C ATOM 426 O TYR A 29 -1.289 -9.441 -12.350 1.00 0.00 O ATOM 427 CB TYR A 29 -0.090 -12.554 -12.897 1.00 0.00 C ATOM 428 CG TYR A 29 -0.054 -13.084 -14.312 1.00 0.00 C ATOM 429 CD1 TYR A 29 -1.102 -12.843 -15.192 1.00 0.00 C ATOM 430 CD2 TYR A 29 1.028 -13.827 -14.769 1.00 0.00 C ATOM 431 CE1 TYR A 29 -1.074 -13.326 -16.486 1.00 0.00 C ATOM 432 CE2 TYR A 29 1.065 -14.313 -16.062 1.00 0.00 C ATOM 433 CZ TYR A 29 0.012 -14.060 -16.916 1.00 0.00 C ATOM 434 OH TYR A 29 0.045 -14.543 -18.204 1.00 0.00 O ATOM 0 H TYR A 29 2.096 -11.968 -11.906 1.00 0.00 H new ATOM 0 HA TYR A 29 0.399 -10.647 -13.760 1.00 0.00 H new ATOM 0 HB2 TYR A 29 0.529 -13.190 -12.264 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -1.110 -12.623 -12.518 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -1.953 -12.268 -14.859 1.00 0.00 H new ATOM 0 HD2 TYR A 29 1.854 -14.028 -14.102 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -1.897 -13.130 -17.157 1.00 0.00 H new ATOM 0 HE2 TYR A 29 1.914 -14.888 -16.402 1.00 0.00 H new ATOM 0 HH TYR A 29 0.859 -14.229 -18.650 1.00 0.00 H new ATOM 444 N LEU A 30 -0.552 -10.633 -10.590 1.00 0.00 N ATOM 445 CA LEU A 30 -1.414 -9.953 -9.629 1.00 0.00 C ATOM 446 C LEU A 30 -1.012 -8.490 -9.476 1.00 0.00 C ATOM 447 O LEU A 30 -1.864 -7.610 -9.355 1.00 0.00 O ATOM 448 CB LEU A 30 -1.352 -10.656 -8.272 1.00 0.00 C ATOM 449 CG LEU A 30 -1.754 -12.131 -8.260 1.00 0.00 C ATOM 450 CD1 LEU A 30 -2.594 -12.446 -7.033 1.00 0.00 C ATOM 451 CD2 LEU A 30 -2.509 -12.488 -9.532 1.00 0.00 C ATOM 0 H LEU A 30 0.043 -11.356 -10.185 1.00 0.00 H new ATOM 0 HA LEU A 30 -2.436 -9.992 -10.005 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -0.335 -10.575 -7.890 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -1.998 -10.119 -7.577 1.00 0.00 H new ATOM 0 HG LEU A 30 -0.847 -12.734 -8.218 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -2.870 -13.500 -7.042 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -2.019 -12.230 -6.133 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -3.496 -11.834 -7.043 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -2.787 -13.542 -9.506 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -3.409 -11.877 -9.605 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -1.873 -12.302 -10.397 1.00 0.00 H new ATOM 463 N ASP A 31 0.292 -8.237 -9.486 1.00 0.00 N ATOM 464 CA ASP A 31 0.809 -6.879 -9.351 1.00 0.00 C ATOM 465 C ASP A 31 0.303 -5.991 -10.484 1.00 0.00 C ATOM 466 O ASP A 31 -0.242 -4.913 -10.245 1.00 0.00 O ATOM 467 CB ASP A 31 2.338 -6.891 -9.340 1.00 0.00 C ATOM 468 CG ASP A 31 2.907 -6.854 -7.936 1.00 0.00 C ATOM 469 OD1 ASP A 31 2.112 -6.801 -6.974 1.00 0.00 O ATOM 470 OD2 ASP A 31 4.148 -6.879 -7.798 1.00 0.00 O ATOM 0 H ASP A 31 1.011 -8.954 -9.586 1.00 0.00 H new ATOM 0 HA ASP A 31 0.450 -6.472 -8.406 1.00 0.00 H new ATOM 0 HB2 ASP A 31 2.695 -7.786 -9.850 1.00 0.00 H new ATOM 0 HB3 ASP A 31 2.709 -6.034 -9.902 1.00 0.00 H new ATOM 475 N HIS A 32 0.487 -6.451 -11.717 1.00 0.00 N ATOM 476 CA HIS A 32 0.050 -5.698 -12.887 1.00 0.00 C ATOM 477 C HIS A 32 -1.473 -5.630 -12.952 1.00 0.00 C ATOM 478 O HIS A 32 -2.039 -4.713 -13.548 1.00 0.00 O ATOM 479 CB HIS A 32 0.598 -6.335 -14.165 1.00 0.00 C ATOM 480 CG HIS A 32 1.894 -5.741 -14.622 1.00 0.00 C ATOM 481 ND1 HIS A 32 2.172 -4.392 -14.546 1.00 0.00 N ATOM 482 CD2 HIS A 32 2.992 -6.319 -15.163 1.00 0.00 C ATOM 483 CE1 HIS A 32 3.384 -4.167 -15.021 1.00 0.00 C ATOM 484 NE2 HIS A 32 3.903 -5.320 -15.402 1.00 0.00 N ATOM 0 H HIS A 32 0.936 -7.341 -11.932 1.00 0.00 H new ATOM 0 HA HIS A 32 0.439 -4.683 -12.800 1.00 0.00 H new ATOM 0 HB2 HIS A 32 0.736 -7.403 -13.998 1.00 0.00 H new ATOM 0 HB3 HIS A 32 -0.141 -6.229 -14.959 1.00 0.00 H new ATOM 0 HD2 HIS A 32 3.126 -7.371 -15.368 1.00 0.00 H new ATOM 0 HE1 HIS A 32 3.868 -3.204 -15.087 1.00 0.00 H new ATOM 0 HE2 HIS A 32 4.830 -5.448 -15.808 1.00 0.00 H new ATOM 492 N LEU A 33 -2.130 -6.606 -12.335 1.00 0.00 N ATOM 493 CA LEU A 33 -3.588 -6.657 -12.323 1.00 0.00 C ATOM 494 C LEU A 33 -4.166 -5.516 -11.492 1.00 0.00 C ATOM 495 O LEU A 33 -5.000 -4.746 -11.970 1.00 0.00 O ATOM 496 CB LEU A 33 -4.066 -8.000 -11.768 1.00 0.00 C ATOM 497 CG LEU A 33 -4.777 -8.922 -12.760 1.00 0.00 C ATOM 498 CD1 LEU A 33 -6.232 -8.510 -12.922 1.00 0.00 C ATOM 499 CD2 LEU A 33 -4.064 -8.909 -14.104 1.00 0.00 C ATOM 0 H LEU A 33 -1.677 -7.372 -11.837 1.00 0.00 H new ATOM 0 HA LEU A 33 -3.939 -6.549 -13.349 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -3.204 -8.531 -11.363 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -4.741 -7.806 -10.935 1.00 0.00 H new ATOM 0 HG LEU A 33 -4.750 -9.938 -12.367 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -6.722 -9.177 -13.631 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -6.737 -8.571 -11.958 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -6.281 -7.486 -13.293 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -4.583 -9.570 -14.798 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -4.060 -7.895 -14.504 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -3.038 -9.252 -13.975 1.00 0.00 H new ATOM 511 N LEU A 34 -3.717 -5.412 -10.246 1.00 0.00 N ATOM 512 CA LEU A 34 -4.188 -4.363 -9.348 1.00 0.00 C ATOM 513 C LEU A 34 -3.672 -2.997 -9.789 1.00 0.00 C ATOM 514 O LEU A 34 -4.291 -1.970 -9.512 1.00 0.00 O ATOM 515 CB LEU A 34 -3.739 -4.652 -7.915 1.00 0.00 C ATOM 516 CG LEU A 34 -2.260 -4.992 -7.730 1.00 0.00 C ATOM 517 CD1 LEU A 34 -1.482 -3.766 -7.278 1.00 0.00 C ATOM 518 CD2 LEU A 34 -2.094 -6.129 -6.732 1.00 0.00 C ATOM 0 H LEU A 34 -3.028 -6.041 -9.835 1.00 0.00 H new ATOM 0 HA LEU A 34 -5.277 -4.349 -9.385 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -3.971 -3.782 -7.301 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -4.333 -5.481 -7.530 1.00 0.00 H new ATOM 0 HG LEU A 34 -1.860 -5.317 -8.690 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -0.431 -4.028 -7.152 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -1.573 -2.981 -8.028 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -1.884 -3.410 -6.329 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -1.035 -6.357 -6.613 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -2.511 -5.832 -5.770 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -2.617 -7.013 -7.097 1.00 0.00 H new ATOM 530 N ASP A 35 -2.537 -2.994 -10.478 1.00 0.00 N ATOM 531 CA ASP A 35 -1.939 -1.754 -10.961 1.00 0.00 C ATOM 532 C ASP A 35 -2.781 -1.143 -12.077 1.00 0.00 C ATOM 533 O ASP A 35 -3.018 0.065 -12.099 1.00 0.00 O ATOM 534 CB ASP A 35 -0.516 -2.010 -11.461 1.00 0.00 C ATOM 535 CG ASP A 35 0.283 -0.730 -11.610 1.00 0.00 C ATOM 536 OD1 ASP A 35 0.062 -0.004 -12.601 1.00 0.00 O ATOM 537 OD2 ASP A 35 1.130 -0.455 -10.734 1.00 0.00 O ATOM 0 H ASP A 35 -2.012 -3.836 -10.715 1.00 0.00 H new ATOM 0 HA ASP A 35 -1.903 -1.049 -10.130 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -0.004 -2.676 -10.766 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -0.558 -2.523 -12.422 1.00 0.00 H new ATOM 542 N SER A 36 -3.231 -1.986 -13.001 1.00 0.00 N ATOM 543 CA SER A 36 -4.042 -1.529 -14.123 1.00 0.00 C ATOM 544 C SER A 36 -5.455 -1.178 -13.665 1.00 0.00 C ATOM 545 O SER A 36 -6.011 -0.152 -14.056 1.00 0.00 O ATOM 546 CB SER A 36 -4.099 -2.603 -15.211 1.00 0.00 C ATOM 547 OG SER A 36 -4.148 -2.020 -16.501 1.00 0.00 O ATOM 0 H SER A 36 -3.047 -2.989 -12.995 1.00 0.00 H new ATOM 0 HA SER A 36 -3.577 -0.632 -14.532 1.00 0.00 H new ATOM 0 HB2 SER A 36 -3.225 -3.250 -15.134 1.00 0.00 H new ATOM 0 HB3 SER A 36 -4.976 -3.232 -15.059 1.00 0.00 H new ATOM 0 HG SER A 36 -4.182 -2.727 -17.179 1.00 0.00 H new ATOM 553 N LEU A 37 -6.030 -2.039 -12.832 1.00 0.00 N ATOM 554 CA LEU A 37 -7.378 -1.822 -12.319 1.00 0.00 C ATOM 555 C LEU A 37 -7.423 -0.602 -11.404 1.00 0.00 C ATOM 556 O LEU A 37 -8.386 0.163 -11.422 1.00 0.00 O ATOM 557 CB LEU A 37 -7.862 -3.060 -11.561 1.00 0.00 C ATOM 558 CG LEU A 37 -8.521 -4.150 -12.407 1.00 0.00 C ATOM 559 CD1 LEU A 37 -9.489 -3.536 -13.407 1.00 0.00 C ATOM 560 CD2 LEU A 37 -7.467 -4.981 -13.122 1.00 0.00 C ATOM 0 H LEU A 37 -5.584 -2.893 -12.498 1.00 0.00 H new ATOM 0 HA LEU A 37 -8.038 -1.641 -13.167 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -7.011 -3.498 -11.039 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -8.573 -2.740 -10.799 1.00 0.00 H new ATOM 0 HG LEU A 37 -9.084 -4.808 -11.744 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -9.949 -4.326 -14.001 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -10.264 -2.986 -12.873 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -8.949 -2.855 -14.065 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -7.955 -5.752 -13.719 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -6.876 -4.337 -13.773 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -6.814 -5.451 -12.387 1.00 0.00 H new ATOM 572 N GLU A 38 -6.373 -0.427 -10.607 1.00 0.00 N ATOM 573 CA GLU A 38 -6.293 0.701 -9.687 1.00 0.00 C ATOM 574 C GLU A 38 -6.142 2.015 -10.449 1.00 0.00 C ATOM 575 O GLU A 38 -6.725 3.031 -10.074 1.00 0.00 O ATOM 576 CB GLU A 38 -5.118 0.520 -8.724 1.00 0.00 C ATOM 577 CG GLU A 38 -5.372 -0.519 -7.644 1.00 0.00 C ATOM 578 CD GLU A 38 -5.857 0.096 -6.345 1.00 0.00 C ATOM 579 OE1 GLU A 38 -6.271 1.274 -6.364 1.00 0.00 O ATOM 580 OE2 GLU A 38 -5.822 -0.602 -5.310 1.00 0.00 O ATOM 0 H GLU A 38 -5.567 -1.052 -10.580 1.00 0.00 H new ATOM 0 HA GLU A 38 -7.220 0.737 -9.115 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -4.234 0.232 -9.293 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -4.896 1.477 -8.251 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -6.112 -1.235 -8.001 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -4.454 -1.076 -7.457 1.00 0.00 H new ATOM 587 N GLU A 39 -5.355 1.984 -11.520 1.00 0.00 N ATOM 588 CA GLU A 39 -5.126 3.173 -12.333 1.00 0.00 C ATOM 589 C GLU A 39 -6.384 3.549 -13.111 1.00 0.00 C ATOM 590 O GLU A 39 -6.617 4.722 -13.406 1.00 0.00 O ATOM 591 CB GLU A 39 -3.965 2.939 -13.301 1.00 0.00 C ATOM 592 CG GLU A 39 -3.131 4.182 -13.562 1.00 0.00 C ATOM 593 CD GLU A 39 -2.639 4.265 -14.994 1.00 0.00 C ATOM 594 OE1 GLU A 39 -3.484 4.395 -15.904 1.00 0.00 O ATOM 595 OE2 GLU A 39 -1.410 4.200 -15.205 1.00 0.00 O ATOM 0 H GLU A 39 -4.866 1.150 -11.845 1.00 0.00 H new ATOM 0 HA GLU A 39 -4.872 3.996 -11.665 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -3.321 2.157 -12.900 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -4.361 2.572 -14.248 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -3.724 5.067 -13.334 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -2.275 4.189 -12.887 1.00 0.00 H new ATOM 602 N LEU A 40 -7.190 2.547 -13.441 1.00 0.00 N ATOM 603 CA LEU A 40 -8.424 2.771 -14.186 1.00 0.00 C ATOM 604 C LEU A 40 -9.508 3.352 -13.283 1.00 0.00 C ATOM 605 O LEU A 40 -10.223 4.276 -13.670 1.00 0.00 O ATOM 606 CB LEU A 40 -8.912 1.463 -14.810 1.00 0.00 C ATOM 607 CG LEU A 40 -8.283 1.083 -16.151 1.00 0.00 C ATOM 608 CD1 LEU A 40 -8.866 -0.225 -16.663 1.00 0.00 C ATOM 609 CD2 LEU A 40 -8.486 2.195 -17.170 1.00 0.00 C ATOM 0 H LEU A 40 -7.012 1.571 -13.205 1.00 0.00 H new ATOM 0 HA LEU A 40 -8.214 3.488 -14.979 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -8.726 0.655 -14.102 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -9.992 1.528 -14.943 1.00 0.00 H new ATOM 0 HG LEU A 40 -7.212 0.946 -16.002 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -8.406 -0.479 -17.618 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -8.668 -1.018 -15.942 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -9.942 -0.116 -16.796 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -8.032 1.907 -18.118 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -9.553 2.365 -17.315 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -8.019 3.111 -16.807 1.00 0.00 H new ATOM 621 N SER A 41 -9.621 2.806 -12.077 1.00 0.00 N ATOM 622 CA SER A 41 -10.618 3.268 -11.118 1.00 0.00 C ATOM 623 C SER A 41 -10.224 4.622 -10.536 1.00 0.00 C ATOM 624 O SER A 41 -11.073 5.375 -10.060 1.00 0.00 O ATOM 625 CB SER A 41 -10.787 2.246 -9.993 1.00 0.00 C ATOM 626 OG SER A 41 -9.733 2.345 -9.051 1.00 0.00 O ATOM 0 H SER A 41 -9.034 2.043 -11.740 1.00 0.00 H new ATOM 0 HA SER A 41 -11.567 3.379 -11.643 1.00 0.00 H new ATOM 0 HB2 SER A 41 -11.742 2.406 -9.493 1.00 0.00 H new ATOM 0 HB3 SER A 41 -10.811 1.240 -10.412 1.00 0.00 H new ATOM 0 HG SER A 41 -8.894 2.538 -9.518 1.00 0.00 H new ATOM 632 N GLU A 42 -8.930 4.923 -10.577 1.00 0.00 N ATOM 633 CA GLU A 42 -8.423 6.186 -10.052 1.00 0.00 C ATOM 634 C GLU A 42 -8.340 7.239 -11.154 1.00 0.00 C ATOM 635 O GLU A 42 -8.739 8.387 -10.960 1.00 0.00 O ATOM 636 CB GLU A 42 -7.044 5.984 -9.421 1.00 0.00 C ATOM 637 CG GLU A 42 -6.357 7.282 -9.030 1.00 0.00 C ATOM 638 CD GLU A 42 -4.964 7.405 -9.615 1.00 0.00 C ATOM 639 OE1 GLU A 42 -4.299 6.361 -9.786 1.00 0.00 O ATOM 640 OE2 GLU A 42 -4.538 8.543 -9.902 1.00 0.00 O ATOM 0 H GLU A 42 -8.214 4.310 -10.968 1.00 0.00 H new ATOM 0 HA GLU A 42 -9.117 6.537 -9.288 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -7.147 5.357 -8.536 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -6.409 5.443 -10.122 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -6.963 8.124 -9.364 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -6.297 7.344 -7.943 1.00 0.00 H new ATOM 647 N ALA A 43 -7.820 6.839 -12.309 1.00 0.00 N ATOM 648 CA ALA A 43 -7.686 7.746 -13.442 1.00 0.00 C ATOM 649 C ALA A 43 -9.046 8.065 -14.053 1.00 0.00 C ATOM 650 O ALA A 43 -9.323 9.209 -14.415 1.00 0.00 O ATOM 651 CB ALA A 43 -6.761 7.148 -14.491 1.00 0.00 C ATOM 0 H ALA A 43 -7.484 5.892 -12.485 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.252 8.678 -13.080 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -6.670 7.836 -15.331 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -5.777 6.978 -14.054 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -7.172 6.201 -14.841 1.00 0.00 H new ATOM 657 N HIS A 44 -9.892 7.046 -14.167 1.00 0.00 N ATOM 658 CA HIS A 44 -11.225 7.218 -14.735 1.00 0.00 C ATOM 659 C HIS A 44 -11.749 5.901 -15.299 1.00 0.00 C ATOM 660 O HIS A 44 -11.584 5.594 -16.480 1.00 0.00 O ATOM 661 CB HIS A 44 -11.200 8.283 -15.833 1.00 0.00 C ATOM 662 CG HIS A 44 -12.242 8.078 -16.889 1.00 0.00 C ATOM 663 ND1 HIS A 44 -13.438 7.434 -16.652 1.00 0.00 N ATOM 664 CD2 HIS A 44 -12.263 8.438 -18.194 1.00 0.00 C ATOM 665 CE1 HIS A 44 -14.149 7.405 -17.765 1.00 0.00 C ATOM 666 NE2 HIS A 44 -13.458 8.008 -18.716 1.00 0.00 N ATOM 0 H HIS A 44 -9.678 6.093 -13.874 1.00 0.00 H new ATOM 0 HA HIS A 44 -11.894 7.543 -13.938 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -11.342 9.264 -15.380 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -10.216 8.288 -16.301 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -11.485 8.965 -18.726 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -15.128 6.964 -17.878 1.00 0.00 H new ATOM 0 HE2 HIS A 44 -13.763 8.134 -19.681 1.00 0.00 H new ATOM 674 N PRO A 45 -12.396 5.104 -14.436 1.00 0.00 N ATOM 675 CA PRO A 45 -12.958 3.807 -14.826 1.00 0.00 C ATOM 676 C PRO A 45 -14.163 3.950 -15.749 1.00 0.00 C ATOM 677 O PRO A 45 -14.018 4.004 -16.970 1.00 0.00 O ATOM 678 CB PRO A 45 -13.377 3.187 -13.491 1.00 0.00 C ATOM 679 CG PRO A 45 -13.612 4.350 -12.590 1.00 0.00 C ATOM 680 CD PRO A 45 -12.630 5.407 -13.015 1.00 0.00 C ATOM 0 HA PRO A 45 -12.243 3.205 -15.386 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -14.278 2.583 -13.601 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -12.600 2.532 -13.097 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -14.637 4.711 -12.678 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -13.460 4.073 -11.547 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -13.035 6.410 -12.879 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -11.708 5.355 -12.436 1.00 0.00 H new ATOM 688 N ASP A 46 -15.351 4.012 -15.158 1.00 0.00 N ATOM 689 CA ASP A 46 -16.581 4.151 -15.928 1.00 0.00 C ATOM 690 C ASP A 46 -17.776 4.380 -15.006 1.00 0.00 C ATOM 691 O ASP A 46 -18.725 5.077 -15.366 1.00 0.00 O ATOM 692 CB ASP A 46 -16.815 2.907 -16.786 1.00 0.00 C ATOM 693 CG ASP A 46 -17.279 3.250 -18.188 1.00 0.00 C ATOM 694 OD1 ASP A 46 -18.287 3.974 -18.318 1.00 0.00 O ATOM 695 OD2 ASP A 46 -16.633 2.793 -19.155 1.00 0.00 O ATOM 0 H ASP A 46 -15.488 3.968 -14.148 1.00 0.00 H new ATOM 0 HA ASP A 46 -16.476 5.018 -16.580 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -15.892 2.330 -16.843 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -17.559 2.272 -16.305 1.00 0.00 H new ATOM 700 N CYS A 47 -17.721 3.788 -13.818 1.00 0.00 N ATOM 701 CA CYS A 47 -18.800 3.926 -12.846 1.00 0.00 C ATOM 702 C CYS A 47 -18.245 4.007 -11.427 1.00 0.00 C ATOM 703 O CYS A 47 -17.969 5.094 -10.919 1.00 0.00 O ATOM 704 CB CYS A 47 -19.771 2.750 -12.960 1.00 0.00 C ATOM 705 SG CYS A 47 -21.239 3.100 -13.957 1.00 0.00 S ATOM 0 H CYS A 47 -16.942 3.209 -13.505 1.00 0.00 H new ATOM 0 HA CYS A 47 -19.335 4.851 -13.062 1.00 0.00 H new ATOM 0 HB2 CYS A 47 -19.245 1.899 -13.393 1.00 0.00 H new ATOM 0 HB3 CYS A 47 -20.086 2.454 -11.959 1.00 0.00 H new ATOM 0 HG CYS A 47 -21.998 2.045 -13.997 1.00 0.00 H new ATOM 711 N ILE A 48 -18.087 2.850 -10.793 1.00 0.00 N ATOM 712 CA ILE A 48 -17.566 2.791 -9.432 1.00 0.00 C ATOM 713 C ILE A 48 -17.000 1.410 -9.121 1.00 0.00 C ATOM 714 O ILE A 48 -17.434 0.728 -8.191 1.00 0.00 O ATOM 715 CB ILE A 48 -18.655 3.132 -8.398 1.00 0.00 C ATOM 716 CG1 ILE A 48 -19.795 3.907 -9.061 1.00 0.00 C ATOM 717 CG2 ILE A 48 -18.061 3.934 -7.249 1.00 0.00 C ATOM 718 CD1 ILE A 48 -21.017 4.054 -8.183 1.00 0.00 C ATOM 0 H ILE A 48 -18.312 1.942 -11.199 1.00 0.00 H new ATOM 0 HA ILE A 48 -16.769 3.532 -9.366 1.00 0.00 H new ATOM 0 HB ILE A 48 -19.058 2.202 -7.997 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -19.436 4.898 -9.339 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -20.079 3.401 -9.983 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -18.843 4.168 -6.526 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -17.280 3.349 -6.763 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -17.634 4.860 -7.634 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -21.784 4.614 -8.718 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -21.401 3.067 -7.926 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -20.748 4.587 -7.271 1.00 0.00 H new ATOM 730 N PRO A 49 -16.005 0.985 -9.914 1.00 0.00 N ATOM 731 CA PRO A 49 -15.355 -0.317 -9.741 1.00 0.00 C ATOM 732 C PRO A 49 -14.504 -0.377 -8.477 1.00 0.00 C ATOM 733 O PRO A 49 -13.555 0.390 -8.319 1.00 0.00 O ATOM 734 CB PRO A 49 -14.473 -0.442 -10.986 1.00 0.00 C ATOM 735 CG PRO A 49 -14.204 0.963 -11.402 1.00 0.00 C ATOM 736 CD PRO A 49 -15.437 1.745 -11.041 1.00 0.00 C ATOM 0 HA PRO A 49 -16.081 -1.123 -9.633 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -13.547 -0.973 -10.764 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -14.979 -0.999 -11.775 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -13.327 1.360 -10.891 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -14.004 1.022 -12.472 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -15.194 2.768 -10.754 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -16.134 1.805 -11.877 1.00 0.00 H new ATOM 744 N ASP A 50 -14.850 -1.294 -7.579 1.00 0.00 N ATOM 745 CA ASP A 50 -14.117 -1.455 -6.329 1.00 0.00 C ATOM 746 C ASP A 50 -12.878 -2.322 -6.534 1.00 0.00 C ATOM 747 O ASP A 50 -12.935 -3.357 -7.197 1.00 0.00 O ATOM 748 CB ASP A 50 -15.018 -2.074 -5.260 1.00 0.00 C ATOM 749 CG ASP A 50 -15.246 -1.145 -4.085 1.00 0.00 C ATOM 750 OD1 ASP A 50 -14.367 -1.082 -3.199 1.00 0.00 O ATOM 751 OD2 ASP A 50 -16.301 -0.479 -4.051 1.00 0.00 O ATOM 0 H ASP A 50 -15.634 -1.937 -7.694 1.00 0.00 H new ATOM 0 HA ASP A 50 -13.797 -0.468 -5.994 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -15.978 -2.334 -5.705 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -14.570 -3.002 -4.904 1.00 0.00 H new ATOM 756 N VAL A 51 -11.759 -1.892 -5.959 1.00 0.00 N ATOM 757 CA VAL A 51 -10.507 -2.629 -6.078 1.00 0.00 C ATOM 758 C VAL A 51 -10.088 -3.220 -4.737 1.00 0.00 C ATOM 759 O VAL A 51 -10.193 -2.566 -3.700 1.00 0.00 O ATOM 760 CB VAL A 51 -9.374 -1.729 -6.606 1.00 0.00 C ATOM 761 CG1 VAL A 51 -9.834 -0.957 -7.834 1.00 0.00 C ATOM 762 CG2 VAL A 51 -8.896 -0.780 -5.518 1.00 0.00 C ATOM 0 H VAL A 51 -11.694 -1.037 -5.406 1.00 0.00 H new ATOM 0 HA VAL A 51 -10.681 -3.436 -6.789 1.00 0.00 H new ATOM 0 HB VAL A 51 -8.536 -2.363 -6.897 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -9.021 -0.327 -8.193 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -10.123 -1.658 -8.617 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -10.688 -0.333 -7.572 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -8.096 -0.152 -5.909 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -9.725 -0.151 -5.194 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -8.524 -1.356 -4.670 1.00 0.00 H new ATOM 772 N GLU A 52 -9.612 -4.461 -4.766 1.00 0.00 N ATOM 773 CA GLU A 52 -9.177 -5.140 -3.552 1.00 0.00 C ATOM 774 C GLU A 52 -8.010 -6.080 -3.842 1.00 0.00 C ATOM 775 O GLU A 52 -8.075 -6.906 -4.754 1.00 0.00 O ATOM 776 CB GLU A 52 -10.337 -5.925 -2.936 1.00 0.00 C ATOM 777 CG GLU A 52 -11.690 -5.580 -3.535 1.00 0.00 C ATOM 778 CD GLU A 52 -12.829 -6.335 -2.876 1.00 0.00 C ATOM 779 OE1 GLU A 52 -12.550 -7.288 -2.119 1.00 0.00 O ATOM 780 OE2 GLU A 52 -13.999 -5.971 -3.118 1.00 0.00 O ATOM 0 H GLU A 52 -9.518 -5.016 -5.617 1.00 0.00 H new ATOM 0 HA GLU A 52 -8.843 -4.382 -2.843 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -10.153 -6.991 -3.066 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -10.365 -5.735 -1.863 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -11.864 -4.509 -3.437 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -11.679 -5.805 -4.602 1.00 0.00 H new ATOM 787 N LEU A 53 -6.944 -5.948 -3.061 1.00 0.00 N ATOM 788 CA LEU A 53 -5.761 -6.785 -3.233 1.00 0.00 C ATOM 789 C LEU A 53 -5.324 -7.390 -1.903 1.00 0.00 C ATOM 790 O LEU A 53 -4.884 -6.678 -1.000 1.00 0.00 O ATOM 791 CB LEU A 53 -4.617 -5.967 -3.835 1.00 0.00 C ATOM 792 CG LEU A 53 -3.207 -6.507 -3.595 1.00 0.00 C ATOM 793 CD1 LEU A 53 -2.687 -6.058 -2.238 1.00 0.00 C ATOM 794 CD2 LEU A 53 -3.193 -8.025 -3.698 1.00 0.00 C ATOM 0 H LEU A 53 -6.874 -5.270 -2.302 1.00 0.00 H new ATOM 0 HA LEU A 53 -6.016 -7.597 -3.914 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -4.777 -5.892 -4.911 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -4.670 -4.955 -3.433 1.00 0.00 H new ATOM 0 HG LEU A 53 -2.548 -6.104 -4.365 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -1.682 -6.452 -2.085 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -2.659 -4.969 -2.201 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -3.346 -6.431 -1.454 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -2.181 -8.392 -3.524 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -3.865 -8.447 -2.951 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -3.522 -8.325 -4.693 1.00 0.00 H new ATOM 806 N SER A 54 -5.445 -8.709 -1.791 1.00 0.00 N ATOM 807 CA SER A 54 -5.064 -9.410 -0.571 1.00 0.00 C ATOM 808 C SER A 54 -3.925 -10.390 -0.840 1.00 0.00 C ATOM 809 O SER A 54 -4.103 -11.390 -1.536 1.00 0.00 O ATOM 810 CB SER A 54 -6.266 -10.156 0.011 1.00 0.00 C ATOM 811 OG SER A 54 -5.895 -10.910 1.152 1.00 0.00 O ATOM 0 H SER A 54 -5.804 -9.313 -2.530 1.00 0.00 H new ATOM 0 HA SER A 54 -4.720 -8.669 0.151 1.00 0.00 H new ATOM 0 HB2 SER A 54 -7.045 -9.443 0.280 1.00 0.00 H new ATOM 0 HB3 SER A 54 -6.688 -10.818 -0.745 1.00 0.00 H new ATOM 0 HG SER A 54 -6.681 -11.376 1.506 1.00 0.00 H new ATOM 817 N HIS A 55 -2.755 -10.094 -0.284 1.00 0.00 N ATOM 818 CA HIS A 55 -1.586 -10.948 -0.463 1.00 0.00 C ATOM 819 C HIS A 55 -2.002 -12.365 -0.843 1.00 0.00 C ATOM 820 O HIS A 55 -2.232 -13.209 0.022 1.00 0.00 O ATOM 821 CB HIS A 55 -0.747 -10.975 0.815 1.00 0.00 C ATOM 822 CG HIS A 55 0.047 -9.725 1.038 1.00 0.00 C ATOM 823 ND1 HIS A 55 -0.179 -8.868 2.094 1.00 0.00 N ATOM 824 CD2 HIS A 55 1.071 -9.190 0.334 1.00 0.00 C ATOM 825 CE1 HIS A 55 0.671 -7.859 2.029 1.00 0.00 C ATOM 826 NE2 HIS A 55 1.441 -8.031 0.970 1.00 0.00 N ATOM 0 H HIS A 55 -2.591 -9.270 0.294 1.00 0.00 H new ATOM 0 HA HIS A 55 -0.986 -10.535 -1.274 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -1.406 -11.134 1.669 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -0.066 -11.825 0.775 1.00 0.00 H new ATOM 0 HD2 HIS A 55 1.515 -9.599 -0.562 1.00 0.00 H new ATOM 0 HE1 HIS A 55 0.727 -7.034 2.724 1.00 0.00 H new ATOM 0 HE2 HIS A 55 2.189 -7.405 0.673 1.00 0.00 H new ATOM 834 N GLY A 56 -2.096 -12.620 -2.145 1.00 0.00 N ATOM 835 CA GLY A 56 -2.485 -13.937 -2.617 1.00 0.00 C ATOM 836 C GLY A 56 -3.834 -13.929 -3.308 1.00 0.00 C ATOM 837 O GLY A 56 -4.373 -14.984 -3.645 1.00 0.00 O ATOM 0 H GLY A 56 -1.910 -11.939 -2.881 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -1.729 -14.310 -3.307 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -2.516 -14.627 -1.774 1.00 0.00 H new ATOM 841 N VAL A 57 -4.383 -12.737 -3.519 1.00 0.00 N ATOM 842 CA VAL A 57 -5.678 -12.596 -4.174 1.00 0.00 C ATOM 843 C VAL A 57 -5.847 -11.201 -4.763 1.00 0.00 C ATOM 844 O VAL A 57 -5.333 -10.222 -4.224 1.00 0.00 O ATOM 845 CB VAL A 57 -6.835 -12.872 -3.195 1.00 0.00 C ATOM 846 CG1 VAL A 57 -8.161 -12.929 -3.937 1.00 0.00 C ATOM 847 CG2 VAL A 57 -6.587 -14.163 -2.428 1.00 0.00 C ATOM 0 H VAL A 57 -3.951 -11.854 -3.246 1.00 0.00 H new ATOM 0 HA VAL A 57 -5.708 -13.332 -4.977 1.00 0.00 H new ATOM 0 HB VAL A 57 -6.884 -12.053 -2.477 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -8.966 -13.125 -3.229 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -8.340 -11.976 -4.436 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -8.129 -13.727 -4.679 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -7.414 -14.343 -1.741 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -6.511 -14.994 -3.129 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -5.658 -14.078 -1.864 1.00 0.00 H new ATOM 857 N MET A 58 -6.573 -11.117 -5.874 1.00 0.00 N ATOM 858 CA MET A 58 -6.811 -9.840 -6.536 1.00 0.00 C ATOM 859 C MET A 58 -8.301 -9.627 -6.785 1.00 0.00 C ATOM 860 O MET A 58 -8.814 -9.948 -7.857 1.00 0.00 O ATOM 861 CB MET A 58 -6.047 -9.777 -7.860 1.00 0.00 C ATOM 862 CG MET A 58 -5.792 -8.360 -8.347 1.00 0.00 C ATOM 863 SD MET A 58 -6.908 -7.157 -7.600 1.00 0.00 S ATOM 864 CE MET A 58 -7.110 -5.997 -8.950 1.00 0.00 C ATOM 0 H MET A 58 -7.006 -11.918 -6.334 1.00 0.00 H new ATOM 0 HA MET A 58 -6.453 -9.047 -5.880 1.00 0.00 H new ATOM 0 HB2 MET A 58 -5.092 -10.290 -7.744 1.00 0.00 H new ATOM 0 HB3 MET A 58 -6.609 -10.318 -8.621 1.00 0.00 H new ATOM 0 HG2 MET A 58 -4.762 -8.083 -8.122 1.00 0.00 H new ATOM 0 HG3 MET A 58 -5.902 -8.327 -9.431 1.00 0.00 H new ATOM 0 HE1 MET A 58 -7.147 -4.982 -8.555 1.00 0.00 H new ATOM 0 HE2 MET A 58 -6.269 -6.089 -9.637 1.00 0.00 H new ATOM 0 HE3 MET A 58 -8.037 -6.214 -9.480 1.00 0.00 H new ATOM 874 N THR A 59 -8.992 -9.084 -5.787 1.00 0.00 N ATOM 875 CA THR A 59 -10.423 -8.830 -5.898 1.00 0.00 C ATOM 876 C THR A 59 -10.693 -7.492 -6.578 1.00 0.00 C ATOM 877 O THR A 59 -9.972 -6.517 -6.361 1.00 0.00 O ATOM 878 CB THR A 59 -11.103 -8.837 -4.516 1.00 0.00 C ATOM 879 OG1 THR A 59 -10.154 -9.193 -3.504 1.00 0.00 O ATOM 880 CG2 THR A 59 -12.269 -9.814 -4.491 1.00 0.00 C ATOM 0 H THR A 59 -8.583 -8.812 -4.893 1.00 0.00 H new ATOM 0 HA THR A 59 -10.841 -9.633 -6.505 1.00 0.00 H new ATOM 0 HB THR A 59 -11.485 -7.835 -4.319 1.00 0.00 H new ATOM 0 HG1 THR A 59 -10.594 -9.193 -2.628 1.00 0.00 H new ATOM 0 HG21 THR A 59 -12.733 -9.801 -3.505 1.00 0.00 H new ATOM 0 HG22 THR A 59 -13.004 -9.523 -5.242 1.00 0.00 H new ATOM 0 HG23 THR A 59 -11.907 -10.819 -4.708 1.00 0.00 H new ATOM 888 N LEU A 60 -11.735 -7.452 -7.400 1.00 0.00 N ATOM 889 CA LEU A 60 -12.101 -6.233 -8.112 1.00 0.00 C ATOM 890 C LEU A 60 -13.598 -6.201 -8.405 1.00 0.00 C ATOM 891 O LEU A 60 -14.079 -6.895 -9.300 1.00 0.00 O ATOM 892 CB LEU A 60 -11.312 -6.125 -9.418 1.00 0.00 C ATOM 893 CG LEU A 60 -11.754 -5.021 -10.380 1.00 0.00 C ATOM 894 CD1 LEU A 60 -10.954 -3.750 -10.138 1.00 0.00 C ATOM 895 CD2 LEU A 60 -11.606 -5.481 -11.823 1.00 0.00 C ATOM 0 H LEU A 60 -12.342 -8.250 -7.590 1.00 0.00 H new ATOM 0 HA LEU A 60 -11.856 -5.383 -7.475 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -10.262 -5.967 -9.173 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -11.377 -7.080 -9.939 1.00 0.00 H new ATOM 0 HG LEU A 60 -12.806 -4.804 -10.195 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -11.282 -2.976 -10.832 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -11.111 -3.410 -9.114 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -9.894 -3.952 -10.295 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -11.925 -4.683 -12.494 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -10.563 -5.727 -12.021 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -12.224 -6.363 -11.989 1.00 0.00 H new ATOM 907 N GLU A 61 -14.328 -5.391 -7.645 1.00 0.00 N ATOM 908 CA GLU A 61 -15.770 -5.269 -7.824 1.00 0.00 C ATOM 909 C GLU A 61 -16.096 -4.328 -8.980 1.00 0.00 C ATOM 910 O GLU A 61 -15.442 -3.301 -9.162 1.00 0.00 O ATOM 911 CB GLU A 61 -16.425 -4.762 -6.538 1.00 0.00 C ATOM 912 CG GLU A 61 -17.548 -3.767 -6.779 1.00 0.00 C ATOM 913 CD GLU A 61 -18.162 -3.257 -5.489 1.00 0.00 C ATOM 914 OE1 GLU A 61 -18.506 -4.090 -4.625 1.00 0.00 O ATOM 915 OE2 GLU A 61 -18.298 -2.024 -5.345 1.00 0.00 O ATOM 0 H GLU A 61 -13.945 -4.810 -6.900 1.00 0.00 H new ATOM 0 HA GLU A 61 -16.167 -6.257 -8.059 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -16.818 -5.612 -5.980 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -15.664 -4.294 -5.913 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -17.164 -2.923 -7.353 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -18.322 -4.238 -7.384 1.00 0.00 H new ATOM 922 N ILE A 62 -17.112 -4.686 -9.758 1.00 0.00 N ATOM 923 CA ILE A 62 -17.525 -3.874 -10.896 1.00 0.00 C ATOM 924 C ILE A 62 -19.043 -3.732 -10.947 1.00 0.00 C ATOM 925 O ILE A 62 -19.754 -4.587 -11.476 1.00 0.00 O ATOM 926 CB ILE A 62 -17.032 -4.475 -12.226 1.00 0.00 C ATOM 927 CG1 ILE A 62 -15.546 -4.825 -12.132 1.00 0.00 C ATOM 928 CG2 ILE A 62 -17.283 -3.505 -13.370 1.00 0.00 C ATOM 929 CD1 ILE A 62 -14.644 -3.613 -12.050 1.00 0.00 C ATOM 0 H ILE A 62 -17.664 -5.533 -9.621 1.00 0.00 H new ATOM 0 HA ILE A 62 -17.074 -2.891 -10.762 1.00 0.00 H new ATOM 0 HB ILE A 62 -17.589 -5.391 -12.424 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -15.383 -5.449 -11.254 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -15.265 -5.419 -13.002 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -16.929 -3.944 -14.303 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -18.351 -3.301 -13.447 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -16.749 -2.574 -13.181 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -13.605 -3.936 -11.986 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -14.778 -2.999 -12.940 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -14.898 -3.030 -11.165 1.00 0.00 H new ATOM 941 N PRO A 63 -19.552 -2.625 -10.386 1.00 0.00 N ATOM 942 CA PRO A 63 -20.990 -2.343 -10.357 1.00 0.00 C ATOM 943 C PRO A 63 -21.545 -2.016 -11.739 1.00 0.00 C ATOM 944 O PRO A 63 -21.999 -0.900 -11.988 1.00 0.00 O ATOM 945 CB PRO A 63 -21.094 -1.124 -9.438 1.00 0.00 C ATOM 946 CG PRO A 63 -19.764 -0.459 -9.538 1.00 0.00 C ATOM 947 CD PRO A 63 -18.764 -1.564 -9.738 1.00 0.00 C ATOM 0 HA PRO A 63 -21.567 -3.203 -10.015 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -21.895 -0.456 -9.755 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -21.313 -1.419 -8.412 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -19.741 0.244 -10.371 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -19.543 0.109 -8.635 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -17.931 -1.243 -10.364 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -18.341 -1.899 -8.791 1.00 0.00 H new ATOM 955 N ALA A 64 -21.506 -2.998 -12.635 1.00 0.00 N ATOM 956 CA ALA A 64 -22.007 -2.815 -13.991 1.00 0.00 C ATOM 957 C ALA A 64 -22.057 -4.142 -14.741 1.00 0.00 C ATOM 958 O ALA A 64 -22.994 -4.404 -15.496 1.00 0.00 O ATOM 959 CB ALA A 64 -21.143 -1.814 -14.743 1.00 0.00 C ATOM 0 H ALA A 64 -21.132 -3.928 -12.445 1.00 0.00 H new ATOM 0 HA ALA A 64 -23.023 -2.425 -13.927 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -21.529 -1.687 -15.754 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -21.162 -0.855 -14.225 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -20.118 -2.181 -14.790 1.00 0.00 H new ATOM 965 N PHE A 65 -21.044 -4.974 -14.530 1.00 0.00 N ATOM 966 CA PHE A 65 -20.971 -6.274 -15.188 1.00 0.00 C ATOM 967 C PHE A 65 -20.815 -7.394 -14.164 1.00 0.00 C ATOM 968 O PHE A 65 -21.043 -8.564 -14.468 1.00 0.00 O ATOM 969 CB PHE A 65 -19.804 -6.305 -16.176 1.00 0.00 C ATOM 970 CG PHE A 65 -19.067 -5.000 -16.275 1.00 0.00 C ATOM 971 CD1 PHE A 65 -19.746 -3.826 -16.560 1.00 0.00 C ATOM 972 CD2 PHE A 65 -17.696 -4.947 -16.081 1.00 0.00 C ATOM 973 CE1 PHE A 65 -19.070 -2.624 -16.651 1.00 0.00 C ATOM 974 CE2 PHE A 65 -17.015 -3.747 -16.171 1.00 0.00 C ATOM 975 CZ PHE A 65 -17.703 -2.584 -16.456 1.00 0.00 C ATOM 0 H PHE A 65 -20.261 -4.772 -13.908 1.00 0.00 H new ATOM 0 HA PHE A 65 -21.902 -6.430 -15.732 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -19.105 -7.086 -15.876 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -20.181 -6.576 -17.162 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -20.815 -3.851 -16.713 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -17.153 -5.853 -15.857 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -19.610 -1.716 -16.875 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -15.946 -3.719 -16.019 1.00 0.00 H new ATOM 0 HZ PHE A 65 -17.174 -1.645 -16.526 1.00 0.00 H new ATOM 985 N GLY A 66 -20.424 -7.026 -12.947 1.00 0.00 N ATOM 986 CA GLY A 66 -20.243 -8.010 -11.896 1.00 0.00 C ATOM 987 C GLY A 66 -19.001 -7.751 -11.067 1.00 0.00 C ATOM 988 O GLY A 66 -18.590 -6.603 -10.892 1.00 0.00 O ATOM 0 H GLY A 66 -20.229 -6.064 -12.671 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -21.117 -8.007 -11.245 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -20.179 -9.004 -12.340 1.00 0.00 H new ATOM 992 N THR A 67 -18.402 -8.820 -10.552 1.00 0.00 N ATOM 993 CA THR A 67 -17.201 -8.703 -9.733 1.00 0.00 C ATOM 994 C THR A 67 -16.093 -9.614 -10.249 1.00 0.00 C ATOM 995 O THR A 67 -16.261 -10.831 -10.322 1.00 0.00 O ATOM 996 CB THR A 67 -17.490 -9.048 -8.260 1.00 0.00 C ATOM 997 OG1 THR A 67 -18.659 -8.351 -7.814 1.00 0.00 O ATOM 998 CG2 THR A 67 -16.307 -8.681 -7.377 1.00 0.00 C ATOM 0 H THR A 67 -18.729 -9.777 -10.687 1.00 0.00 H new ATOM 0 HA THR A 67 -16.874 -7.665 -9.798 1.00 0.00 H new ATOM 0 HB THR A 67 -17.658 -10.122 -8.187 1.00 0.00 H new ATOM 0 HG1 THR A 67 -18.837 -8.577 -6.877 1.00 0.00 H new ATOM 0 HG21 THR A 67 -16.534 -8.934 -6.341 1.00 0.00 H new ATOM 0 HG22 THR A 67 -15.426 -9.235 -7.701 1.00 0.00 H new ATOM 0 HG23 THR A 67 -16.113 -7.611 -7.455 1.00 0.00 H new ATOM 1006 N TYR A 68 -14.961 -9.017 -10.605 1.00 0.00 N ATOM 1007 CA TYR A 68 -13.826 -9.775 -11.116 1.00 0.00 C ATOM 1008 C TYR A 68 -12.853 -10.123 -9.993 1.00 0.00 C ATOM 1009 O TYR A 68 -12.482 -9.267 -9.190 1.00 0.00 O ATOM 1010 CB TYR A 68 -13.102 -8.980 -12.204 1.00 0.00 C ATOM 1011 CG TYR A 68 -13.520 -9.355 -13.607 1.00 0.00 C ATOM 1012 CD1 TYR A 68 -13.355 -10.652 -14.079 1.00 0.00 C ATOM 1013 CD2 TYR A 68 -14.081 -8.414 -14.462 1.00 0.00 C ATOM 1014 CE1 TYR A 68 -13.735 -10.999 -15.362 1.00 0.00 C ATOM 1015 CE2 TYR A 68 -14.465 -8.752 -15.745 1.00 0.00 C ATOM 1016 CZ TYR A 68 -14.290 -10.046 -16.190 1.00 0.00 C ATOM 1017 OH TYR A 68 -14.671 -10.388 -17.467 1.00 0.00 O ATOM 0 H TYR A 68 -14.805 -8.011 -10.549 1.00 0.00 H new ATOM 0 HA TYR A 68 -14.205 -10.703 -11.545 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -13.288 -7.917 -12.050 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -12.028 -9.134 -12.101 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -12.923 -11.401 -13.432 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -14.219 -7.400 -14.117 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -13.598 -12.011 -15.714 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -14.900 -8.008 -16.396 1.00 0.00 H new ATOM 0 HH TYR A 68 -14.817 -9.575 -17.994 1.00 0.00 H new ATOM 1027 N VAL A 69 -12.443 -11.387 -9.944 1.00 0.00 N ATOM 1028 CA VAL A 69 -11.513 -11.849 -8.921 1.00 0.00 C ATOM 1029 C VAL A 69 -10.415 -12.715 -9.528 1.00 0.00 C ATOM 1030 O VAL A 69 -10.678 -13.555 -10.390 1.00 0.00 O ATOM 1031 CB VAL A 69 -12.237 -12.653 -7.825 1.00 0.00 C ATOM 1032 CG1 VAL A 69 -11.471 -12.578 -6.513 1.00 0.00 C ATOM 1033 CG2 VAL A 69 -13.662 -12.148 -7.649 1.00 0.00 C ATOM 0 H VAL A 69 -12.740 -12.109 -10.601 1.00 0.00 H new ATOM 0 HA VAL A 69 -11.067 -10.960 -8.475 1.00 0.00 H new ATOM 0 HB VAL A 69 -12.280 -13.698 -8.133 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -11.998 -13.152 -5.751 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -10.471 -12.990 -6.651 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -11.394 -11.538 -6.196 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -14.160 -12.727 -6.871 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -13.643 -11.096 -7.363 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -14.206 -12.259 -8.587 1.00 0.00 H new ATOM 1043 N ILE A 70 -9.184 -12.505 -9.074 1.00 0.00 N ATOM 1044 CA ILE A 70 -8.046 -13.268 -9.572 1.00 0.00 C ATOM 1045 C ILE A 70 -7.038 -13.540 -8.460 1.00 0.00 C ATOM 1046 O ILE A 70 -6.368 -12.627 -7.979 1.00 0.00 O ATOM 1047 CB ILE A 70 -7.337 -12.533 -10.724 1.00 0.00 C ATOM 1048 CG1 ILE A 70 -8.284 -11.521 -11.372 1.00 0.00 C ATOM 1049 CG2 ILE A 70 -6.831 -13.530 -11.756 1.00 0.00 C ATOM 1050 CD1 ILE A 70 -7.753 -10.938 -12.664 1.00 0.00 C ATOM 0 H ILE A 70 -8.949 -11.813 -8.362 1.00 0.00 H new ATOM 0 HA ILE A 70 -8.438 -14.215 -9.943 1.00 0.00 H new ATOM 0 HB ILE A 70 -6.481 -11.993 -10.319 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -9.241 -12.005 -11.567 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -8.474 -10.711 -10.668 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -6.332 -12.995 -12.564 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -6.126 -14.215 -11.285 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -7.672 -14.095 -12.159 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -8.476 -10.229 -13.067 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -6.810 -10.425 -12.472 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -7.590 -11.739 -13.385 1.00 0.00 H new ATOM 1062 N ASN A 71 -6.935 -14.802 -8.058 1.00 0.00 N ATOM 1063 CA ASN A 71 -6.007 -15.195 -7.004 1.00 0.00 C ATOM 1064 C ASN A 71 -5.002 -16.222 -7.518 1.00 0.00 C ATOM 1065 O ASN A 71 -5.220 -16.857 -8.550 1.00 0.00 O ATOM 1066 CB ASN A 71 -6.772 -15.768 -5.809 1.00 0.00 C ATOM 1067 CG ASN A 71 -7.203 -17.205 -6.034 1.00 0.00 C ATOM 1068 OD1 ASN A 71 -6.400 -18.052 -6.425 1.00 0.00 O ATOM 1069 ND2 ASN A 71 -8.477 -17.486 -5.787 1.00 0.00 N ATOM 0 H ASN A 71 -7.483 -15.570 -8.446 1.00 0.00 H new ATOM 0 HA ASN A 71 -5.461 -14.307 -6.686 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -6.144 -15.715 -4.920 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -7.651 -15.154 -5.616 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -8.825 -18.436 -5.920 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -9.108 -16.752 -5.464 1.00 0.00 H new ATOM 1076 N LYS A 72 -3.902 -16.381 -6.791 1.00 0.00 N ATOM 1077 CA LYS A 72 -2.863 -17.331 -7.171 1.00 0.00 C ATOM 1078 C LYS A 72 -2.151 -17.880 -5.939 1.00 0.00 C ATOM 1079 O LYS A 72 -0.925 -17.989 -5.917 1.00 0.00 O ATOM 1080 CB LYS A 72 -1.850 -16.665 -8.104 1.00 0.00 C ATOM 1081 CG LYS A 72 -1.318 -15.343 -7.580 1.00 0.00 C ATOM 1082 CD LYS A 72 -0.097 -15.543 -6.697 1.00 0.00 C ATOM 1083 CE LYS A 72 -0.465 -15.507 -5.222 1.00 0.00 C ATOM 1084 NZ LYS A 72 0.361 -16.452 -4.421 1.00 0.00 N ATOM 0 H LYS A 72 -3.706 -15.864 -5.934 1.00 0.00 H new ATOM 0 HA LYS A 72 -3.338 -18.161 -7.694 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -1.014 -17.346 -8.264 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -2.317 -16.500 -9.075 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -1.060 -14.696 -8.418 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -2.098 -14.835 -7.014 1.00 0.00 H new ATOM 0 HD2 LYS A 72 0.372 -16.498 -6.933 1.00 0.00 H new ATOM 0 HD3 LYS A 72 0.638 -14.766 -6.909 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -0.333 -14.495 -4.839 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -1.519 -15.757 -5.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 0.139 -16.337 -3.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 0.152 -17.428 -4.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 1.369 -16.252 -4.579 1.00 0.00 H new ATOM 1098 N GLN A 73 -2.927 -18.224 -4.916 1.00 0.00 N ATOM 1099 CA GLN A 73 -2.369 -18.762 -3.681 1.00 0.00 C ATOM 1100 C GLN A 73 -3.134 -20.003 -3.233 1.00 0.00 C ATOM 1101 O GLN A 73 -3.460 -20.170 -2.057 1.00 0.00 O ATOM 1102 CB GLN A 73 -2.400 -17.703 -2.578 1.00 0.00 C ATOM 1103 CG GLN A 73 -1.372 -17.934 -1.483 1.00 0.00 C ATOM 1104 CD GLN A 73 -0.935 -16.647 -0.812 1.00 0.00 C ATOM 1105 OE1 GLN A 73 -0.188 -15.855 -1.388 1.00 0.00 O ATOM 1106 NE2 GLN A 73 -1.398 -16.431 0.414 1.00 0.00 N ATOM 0 H GLN A 73 -3.944 -18.140 -4.918 1.00 0.00 H new ATOM 0 HA GLN A 73 -1.334 -19.045 -3.873 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -2.231 -16.722 -3.023 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -3.395 -17.683 -2.133 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -1.790 -18.606 -0.734 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -0.500 -18.432 -1.907 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -2.015 -17.114 0.854 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -1.137 -15.582 0.916 1.00 0.00 H new ATOM 1115 N PRO A 74 -3.429 -20.895 -4.190 1.00 0.00 N ATOM 1116 CA PRO A 74 -4.160 -22.136 -3.917 1.00 0.00 C ATOM 1117 C PRO A 74 -3.333 -23.130 -3.109 1.00 0.00 C ATOM 1118 O PRO A 74 -2.132 -22.953 -2.904 1.00 0.00 O ATOM 1119 CB PRO A 74 -4.449 -22.692 -5.314 1.00 0.00 C ATOM 1120 CG PRO A 74 -3.378 -22.120 -6.178 1.00 0.00 C ATOM 1121 CD PRO A 74 -3.071 -20.761 -5.612 1.00 0.00 C ATOM 0 HA PRO A 74 -5.055 -21.959 -3.320 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -4.423 -23.782 -5.320 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -5.439 -22.395 -5.661 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -2.492 -22.754 -6.172 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -3.710 -22.046 -7.213 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -2.020 -20.501 -5.739 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -3.654 -19.981 -6.101 1.00 0.00 H new ATOM 1129 N PRO A 75 -3.988 -24.202 -2.639 1.00 0.00 N ATOM 1130 CA PRO A 75 -3.332 -25.246 -1.846 1.00 0.00 C ATOM 1131 C PRO A 75 -2.362 -26.080 -2.676 1.00 0.00 C ATOM 1132 O PRO A 75 -1.767 -27.035 -2.179 1.00 0.00 O ATOM 1133 CB PRO A 75 -4.499 -26.109 -1.360 1.00 0.00 C ATOM 1134 CG PRO A 75 -5.574 -25.896 -2.370 1.00 0.00 C ATOM 1135 CD PRO A 75 -5.420 -24.477 -2.846 1.00 0.00 C ATOM 0 HA PRO A 75 -2.729 -24.827 -1.040 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -4.216 -27.160 -1.299 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -4.826 -25.809 -0.365 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -5.476 -26.598 -3.198 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -6.559 -26.056 -1.931 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -5.702 -24.372 -3.894 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -6.047 -23.792 -2.276 1.00 0.00 H new ATOM 1143 N ASN A 76 -2.208 -25.713 -3.944 1.00 0.00 N ATOM 1144 CA ASN A 76 -1.310 -26.429 -4.843 1.00 0.00 C ATOM 1145 C ASN A 76 -0.460 -25.454 -5.653 1.00 0.00 C ATOM 1146 O ASN A 76 0.634 -25.071 -5.236 1.00 0.00 O ATOM 1147 CB ASN A 76 -2.110 -27.330 -5.786 1.00 0.00 C ATOM 1148 CG ASN A 76 -1.342 -27.673 -7.048 1.00 0.00 C ATOM 1149 OD1 ASN A 76 -1.722 -27.272 -8.148 1.00 0.00 O ATOM 1150 ND2 ASN A 76 -0.254 -28.420 -6.894 1.00 0.00 N ATOM 0 H ASN A 76 -2.693 -24.924 -4.372 1.00 0.00 H new ATOM 0 HA ASN A 76 -0.646 -27.046 -4.237 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -2.377 -28.250 -5.266 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -3.042 -26.833 -6.055 1.00 0.00 H new ATOM 0 HD21 ASN A 76 0.303 -28.683 -7.707 1.00 0.00 H new ATOM 0 HD22 ASN A 76 0.024 -28.730 -5.963 1.00 0.00 H new ATOM 1157 N LYS A 77 -0.971 -25.054 -6.813 1.00 0.00 N ATOM 1158 CA LYS A 77 -0.262 -24.122 -7.681 1.00 0.00 C ATOM 1159 C LYS A 77 -1.076 -23.820 -8.935 1.00 0.00 C ATOM 1160 O LYS A 77 -0.929 -24.490 -9.957 1.00 0.00 O ATOM 1161 CB LYS A 77 1.102 -24.695 -8.072 1.00 0.00 C ATOM 1162 CG LYS A 77 1.782 -23.933 -9.197 1.00 0.00 C ATOM 1163 CD LYS A 77 2.211 -24.863 -10.320 1.00 0.00 C ATOM 1164 CE LYS A 77 1.172 -24.913 -11.430 1.00 0.00 C ATOM 1165 NZ LYS A 77 1.787 -25.219 -12.751 1.00 0.00 N ATOM 0 H LYS A 77 -1.874 -25.361 -7.173 1.00 0.00 H new ATOM 0 HA LYS A 77 -0.115 -23.192 -7.131 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.752 -24.692 -7.197 1.00 0.00 H new ATOM 0 HB3 LYS A 77 0.977 -25.735 -8.373 1.00 0.00 H new ATOM 0 HG2 LYS A 77 1.102 -23.177 -9.589 1.00 0.00 H new ATOM 0 HG3 LYS A 77 2.653 -23.406 -8.807 1.00 0.00 H new ATOM 0 HD2 LYS A 77 3.165 -24.527 -10.728 1.00 0.00 H new ATOM 0 HD3 LYS A 77 2.369 -25.866 -9.923 1.00 0.00 H new ATOM 0 HE2 LYS A 77 0.424 -25.670 -11.194 1.00 0.00 H new ATOM 0 HE3 LYS A 77 0.652 -23.957 -11.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 1.110 -24.998 -13.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 2.646 -24.645 -12.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 2.036 -26.228 -12.793 1.00 0.00 H new ATOM 1179 N GLN A 78 -1.933 -22.808 -8.849 1.00 0.00 N ATOM 1180 CA GLN A 78 -2.769 -22.418 -9.978 1.00 0.00 C ATOM 1181 C GLN A 78 -3.358 -21.027 -9.765 1.00 0.00 C ATOM 1182 O GLN A 78 -3.220 -20.442 -8.690 1.00 0.00 O ATOM 1183 CB GLN A 78 -3.894 -23.434 -10.182 1.00 0.00 C ATOM 1184 CG GLN A 78 -3.502 -24.607 -11.066 1.00 0.00 C ATOM 1185 CD GLN A 78 -3.230 -25.870 -10.274 1.00 0.00 C ATOM 1186 OE1 GLN A 78 -3.717 -26.031 -9.155 1.00 0.00 O ATOM 1187 NE2 GLN A 78 -2.448 -26.775 -10.852 1.00 0.00 N ATOM 0 H GLN A 78 -2.067 -22.244 -8.010 1.00 0.00 H new ATOM 0 HA GLN A 78 -2.143 -22.395 -10.870 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -4.211 -23.812 -9.210 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -4.753 -22.929 -10.623 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -4.299 -24.798 -11.784 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -2.613 -24.344 -11.639 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -2.066 -26.600 -11.781 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -2.230 -27.645 -10.366 1.00 0.00 H new ATOM 1196 N ILE A 79 -4.013 -20.503 -10.795 1.00 0.00 N ATOM 1197 CA ILE A 79 -4.622 -19.181 -10.719 1.00 0.00 C ATOM 1198 C ILE A 79 -6.141 -19.268 -10.829 1.00 0.00 C ATOM 1199 O ILE A 79 -6.675 -19.738 -11.834 1.00 0.00 O ATOM 1200 CB ILE A 79 -4.092 -18.252 -11.828 1.00 0.00 C ATOM 1201 CG1 ILE A 79 -3.015 -17.319 -11.269 1.00 0.00 C ATOM 1202 CG2 ILE A 79 -5.232 -17.449 -12.436 1.00 0.00 C ATOM 1203 CD1 ILE A 79 -2.179 -16.653 -12.340 1.00 0.00 C ATOM 0 H ILE A 79 -4.136 -20.973 -11.692 1.00 0.00 H new ATOM 0 HA ILE A 79 -4.353 -18.766 -9.748 1.00 0.00 H new ATOM 0 HB ILE A 79 -3.646 -18.864 -12.612 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -3.491 -16.550 -10.661 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -2.360 -17.887 -10.609 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -4.842 -16.797 -13.218 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -5.968 -18.129 -12.864 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -5.704 -16.844 -11.662 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -1.436 -16.006 -11.872 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -1.674 -17.415 -12.934 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -2.823 -16.057 -12.986 1.00 0.00 H new ATOM 1215 N TRP A 80 -6.830 -18.811 -9.790 1.00 0.00 N ATOM 1216 CA TRP A 80 -8.288 -18.836 -9.770 1.00 0.00 C ATOM 1217 C TRP A 80 -8.862 -17.505 -10.243 1.00 0.00 C ATOM 1218 O TRP A 80 -8.641 -16.466 -9.620 1.00 0.00 O ATOM 1219 CB TRP A 80 -8.794 -19.152 -8.361 1.00 0.00 C ATOM 1220 CG TRP A 80 -9.017 -20.615 -8.124 1.00 0.00 C ATOM 1221 CD1 TRP A 80 -8.202 -21.641 -8.509 1.00 0.00 C ATOM 1222 CD2 TRP A 80 -10.129 -21.214 -7.450 1.00 0.00 C ATOM 1223 NE1 TRP A 80 -8.741 -22.842 -8.115 1.00 0.00 N ATOM 1224 CE2 TRP A 80 -9.922 -22.608 -7.462 1.00 0.00 C ATOM 1225 CE3 TRP A 80 -11.278 -20.710 -6.836 1.00 0.00 C ATOM 1226 CZ2 TRP A 80 -10.823 -23.499 -6.885 1.00 0.00 C ATOM 1227 CZ3 TRP A 80 -12.171 -21.596 -6.264 1.00 0.00 C ATOM 1228 CH2 TRP A 80 -11.939 -22.977 -6.291 1.00 0.00 C ATOM 0 H TRP A 80 -6.403 -18.419 -8.951 1.00 0.00 H new ATOM 0 HA TRP A 80 -8.622 -19.617 -10.452 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -8.075 -18.779 -7.632 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -9.728 -18.617 -8.190 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -7.271 -21.525 -9.044 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -8.328 -23.760 -8.282 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -11.465 -19.647 -6.809 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -10.647 -24.564 -6.906 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -13.063 -21.217 -5.788 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -12.656 -23.643 -5.834 1.00 0.00 H new ATOM 1239 N LEU A 81 -9.600 -17.543 -11.347 1.00 0.00 N ATOM 1240 CA LEU A 81 -10.206 -16.339 -11.904 1.00 0.00 C ATOM 1241 C LEU A 81 -11.722 -16.366 -11.738 1.00 0.00 C ATOM 1242 O LEU A 81 -12.425 -17.057 -12.475 1.00 0.00 O ATOM 1243 CB LEU A 81 -9.846 -16.200 -13.384 1.00 0.00 C ATOM 1244 CG LEU A 81 -10.263 -14.892 -14.056 1.00 0.00 C ATOM 1245 CD1 LEU A 81 -11.761 -14.878 -14.317 1.00 0.00 C ATOM 1246 CD2 LEU A 81 -9.858 -13.700 -13.201 1.00 0.00 C ATOM 0 H LEU A 81 -9.793 -18.395 -11.874 1.00 0.00 H new ATOM 0 HA LEU A 81 -9.814 -15.480 -11.359 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -8.766 -16.310 -13.487 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -10.303 -17.027 -13.928 1.00 0.00 H new ATOM 0 HG LEU A 81 -9.748 -14.819 -15.014 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -12.038 -13.939 -14.796 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -12.024 -15.710 -14.970 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -12.296 -14.975 -13.372 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -10.163 -12.777 -13.695 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -10.344 -13.768 -12.228 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -8.776 -13.699 -13.067 1.00 0.00 H new ATOM 1258 N ALA A 82 -12.220 -15.608 -10.766 1.00 0.00 N ATOM 1259 CA ALA A 82 -13.652 -15.541 -10.506 1.00 0.00 C ATOM 1260 C ALA A 82 -14.329 -14.525 -11.420 1.00 0.00 C ATOM 1261 O ALA A 82 -14.189 -13.317 -11.231 1.00 0.00 O ATOM 1262 CB ALA A 82 -13.909 -15.195 -9.047 1.00 0.00 C ATOM 0 H ALA A 82 -11.652 -15.031 -10.146 1.00 0.00 H new ATOM 0 HA ALA A 82 -14.080 -16.521 -10.716 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -14.983 -15.148 -8.868 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -13.467 -15.960 -8.408 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -13.461 -14.228 -8.818 1.00 0.00 H new ATOM 1268 N SER A 83 -15.063 -15.023 -12.410 1.00 0.00 N ATOM 1269 CA SER A 83 -15.758 -14.158 -13.356 1.00 0.00 C ATOM 1270 C SER A 83 -16.707 -13.210 -12.629 1.00 0.00 C ATOM 1271 O SER A 83 -16.971 -13.350 -11.434 1.00 0.00 O ATOM 1272 CB SER A 83 -16.537 -14.998 -14.370 1.00 0.00 C ATOM 1273 OG SER A 83 -17.927 -14.738 -14.288 1.00 0.00 O ATOM 0 H SER A 83 -15.192 -16.021 -12.578 1.00 0.00 H new ATOM 0 HA SER A 83 -15.012 -13.564 -13.883 1.00 0.00 H new ATOM 0 HB2 SER A 83 -16.182 -14.779 -15.377 1.00 0.00 H new ATOM 0 HB3 SER A 83 -16.351 -16.057 -14.189 1.00 0.00 H new ATOM 0 HG SER A 83 -18.402 -15.286 -14.947 1.00 0.00 H new ATOM 1279 N PRO A 84 -17.233 -12.220 -13.366 1.00 0.00 N ATOM 1280 CA PRO A 84 -18.161 -11.229 -12.813 1.00 0.00 C ATOM 1281 C PRO A 84 -19.520 -11.832 -12.477 1.00 0.00 C ATOM 1282 O PRO A 84 -20.408 -11.144 -11.971 1.00 0.00 O ATOM 1283 CB PRO A 84 -18.296 -10.203 -13.941 1.00 0.00 C ATOM 1284 CG PRO A 84 -17.986 -10.963 -15.184 1.00 0.00 C ATOM 1285 CD PRO A 84 -16.962 -11.993 -14.795 1.00 0.00 C ATOM 0 HA PRO A 84 -17.797 -10.808 -11.876 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -19.301 -9.782 -13.975 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -17.606 -9.371 -13.804 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -18.882 -11.436 -15.586 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -17.599 -10.302 -15.960 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -17.073 -12.909 -15.375 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -15.947 -11.632 -14.959 1.00 0.00 H new ATOM 1293 N LEU A 85 -19.677 -13.121 -12.759 1.00 0.00 N ATOM 1294 CA LEU A 85 -20.929 -13.818 -12.485 1.00 0.00 C ATOM 1295 C LEU A 85 -20.675 -15.118 -11.729 1.00 0.00 C ATOM 1296 O LEU A 85 -21.290 -16.144 -12.015 1.00 0.00 O ATOM 1297 CB LEU A 85 -21.669 -14.110 -13.792 1.00 0.00 C ATOM 1298 CG LEU A 85 -22.397 -12.927 -14.430 1.00 0.00 C ATOM 1299 CD1 LEU A 85 -21.554 -12.317 -15.539 1.00 0.00 C ATOM 1300 CD2 LEU A 85 -23.753 -13.362 -14.967 1.00 0.00 C ATOM 0 H LEU A 85 -18.953 -13.705 -13.177 1.00 0.00 H new ATOM 0 HA LEU A 85 -21.547 -13.172 -11.861 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -20.951 -14.501 -14.513 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -22.396 -14.901 -13.606 1.00 0.00 H new ATOM 0 HG LEU A 85 -22.558 -12.168 -13.664 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -22.088 -11.476 -15.982 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -20.607 -11.969 -15.127 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -21.362 -13.068 -16.305 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -24.257 -12.507 -15.418 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -23.614 -14.139 -15.719 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -24.360 -13.752 -14.150 1.00 0.00 H new ATOM 1312 N SER A 86 -19.765 -15.065 -10.761 1.00 0.00 N ATOM 1313 CA SER A 86 -19.428 -16.239 -9.965 1.00 0.00 C ATOM 1314 C SER A 86 -18.951 -17.382 -10.856 1.00 0.00 C ATOM 1315 O SER A 86 -19.661 -18.366 -11.056 1.00 0.00 O ATOM 1316 CB SER A 86 -20.638 -16.689 -9.143 1.00 0.00 C ATOM 1317 OG SER A 86 -21.823 -16.057 -9.594 1.00 0.00 O ATOM 0 H SER A 86 -19.249 -14.222 -10.510 1.00 0.00 H new ATOM 0 HA SER A 86 -18.618 -15.967 -9.288 1.00 0.00 H new ATOM 0 HB2 SER A 86 -20.749 -17.771 -9.215 1.00 0.00 H new ATOM 0 HB3 SER A 86 -20.475 -16.455 -8.091 1.00 0.00 H new ATOM 0 HG SER A 86 -22.106 -16.459 -10.442 1.00 0.00 H new ATOM 1323 N GLY A 87 -17.741 -17.243 -11.389 1.00 0.00 N ATOM 1324 CA GLY A 87 -17.188 -18.270 -12.253 1.00 0.00 C ATOM 1325 C GLY A 87 -15.678 -18.357 -12.158 1.00 0.00 C ATOM 1326 O GLY A 87 -14.950 -17.775 -12.963 1.00 0.00 O ATOM 0 H GLY A 87 -17.134 -16.438 -11.238 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -17.622 -19.235 -11.989 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -17.473 -18.064 -13.285 1.00 0.00 H new ATOM 1330 N PRO A 88 -15.186 -19.097 -11.154 1.00 0.00 N ATOM 1331 CA PRO A 88 -13.748 -19.274 -10.932 1.00 0.00 C ATOM 1332 C PRO A 88 -13.096 -20.130 -12.013 1.00 0.00 C ATOM 1333 O PRO A 88 -13.624 -21.174 -12.393 1.00 0.00 O ATOM 1334 CB PRO A 88 -13.683 -19.983 -9.577 1.00 0.00 C ATOM 1335 CG PRO A 88 -14.990 -20.687 -9.454 1.00 0.00 C ATOM 1336 CD PRO A 88 -15.996 -19.818 -10.158 1.00 0.00 C ATOM 0 HA PRO A 88 -13.212 -18.326 -10.958 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -12.850 -20.685 -9.537 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -13.539 -19.271 -8.764 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -14.944 -21.677 -9.908 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -15.260 -20.828 -8.408 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -16.779 -20.411 -10.630 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -16.488 -19.133 -9.468 1.00 0.00 H new ATOM 1344 N ASN A 89 -11.945 -19.681 -12.502 1.00 0.00 N ATOM 1345 CA ASN A 89 -11.221 -20.407 -13.540 1.00 0.00 C ATOM 1346 C ASN A 89 -9.858 -20.868 -13.031 1.00 0.00 C ATOM 1347 O ASN A 89 -9.028 -20.054 -12.626 1.00 0.00 O ATOM 1348 CB ASN A 89 -11.044 -19.526 -14.778 1.00 0.00 C ATOM 1349 CG ASN A 89 -11.262 -20.293 -16.068 1.00 0.00 C ATOM 1350 OD1 ASN A 89 -11.030 -21.500 -16.133 1.00 0.00 O ATOM 1351 ND2 ASN A 89 -11.711 -19.593 -17.104 1.00 0.00 N ATOM 0 H ASN A 89 -11.494 -18.819 -12.197 1.00 0.00 H new ATOM 0 HA ASN A 89 -11.806 -21.287 -13.809 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -11.745 -18.693 -14.731 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -10.041 -19.099 -14.777 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -11.877 -20.055 -17.998 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -11.890 -18.594 -17.005 1.00 0.00 H new ATOM 1358 N ARG A 90 -9.635 -22.178 -13.056 1.00 0.00 N ATOM 1359 CA ARG A 90 -8.374 -22.747 -12.596 1.00 0.00 C ATOM 1360 C ARG A 90 -7.338 -22.747 -13.716 1.00 0.00 C ATOM 1361 O ARG A 90 -7.371 -23.596 -14.608 1.00 0.00 O ATOM 1362 CB ARG A 90 -8.590 -24.173 -12.087 1.00 0.00 C ATOM 1363 CG ARG A 90 -9.871 -24.348 -11.288 1.00 0.00 C ATOM 1364 CD ARG A 90 -9.791 -25.551 -10.361 1.00 0.00 C ATOM 1365 NE ARG A 90 -10.559 -26.684 -10.868 1.00 0.00 N ATOM 1366 CZ ARG A 90 -10.431 -27.924 -10.408 1.00 0.00 C ATOM 1367 NH1 ARG A 90 -9.569 -28.187 -9.435 1.00 0.00 N ATOM 1368 NH2 ARG A 90 -11.166 -28.903 -10.920 1.00 0.00 N ATOM 0 H ARG A 90 -10.311 -22.865 -13.390 1.00 0.00 H new ATOM 0 HA ARG A 90 -8.001 -22.129 -11.779 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -8.607 -24.855 -12.938 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -7.742 -24.460 -11.465 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -10.061 -23.449 -10.703 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -10.713 -24.468 -11.970 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -8.749 -25.845 -10.238 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -10.162 -25.274 -9.374 1.00 0.00 H new ATOM 0 HE ARG A 90 -11.231 -26.515 -11.617 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -9.003 -27.437 -9.039 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -9.472 -29.139 -9.083 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -11.831 -28.704 -11.668 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -11.066 -29.854 -10.566 1.00 0.00 H new ATOM 1382 N PHE A 91 -6.419 -21.789 -13.665 1.00 0.00 N ATOM 1383 CA PHE A 91 -5.373 -21.677 -14.675 1.00 0.00 C ATOM 1384 C PHE A 91 -4.100 -22.384 -14.221 1.00 0.00 C ATOM 1385 O PHE A 91 -3.737 -22.339 -13.046 1.00 0.00 O ATOM 1386 CB PHE A 91 -5.075 -20.205 -14.970 1.00 0.00 C ATOM 1387 CG PHE A 91 -6.069 -19.566 -15.897 1.00 0.00 C ATOM 1388 CD1 PHE A 91 -5.939 -19.697 -17.271 1.00 0.00 C ATOM 1389 CD2 PHE A 91 -7.134 -18.835 -15.396 1.00 0.00 C ATOM 1390 CE1 PHE A 91 -6.852 -19.109 -18.126 1.00 0.00 C ATOM 1391 CE2 PHE A 91 -8.050 -18.246 -16.246 1.00 0.00 C ATOM 1392 CZ PHE A 91 -7.909 -18.384 -17.613 1.00 0.00 C ATOM 0 H PHE A 91 -6.377 -21.078 -12.935 1.00 0.00 H new ATOM 0 HA PHE A 91 -5.729 -22.158 -15.586 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -5.057 -19.651 -14.031 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -4.079 -20.125 -15.406 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -5.115 -20.265 -17.678 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -7.249 -18.724 -14.328 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -6.739 -19.217 -19.195 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -8.875 -17.678 -15.842 1.00 0.00 H new ATOM 0 HZ PHE A 91 -8.624 -17.925 -18.280 1.00 0.00 H new ATOM 1402 N ASP A 92 -3.427 -23.038 -15.162 1.00 0.00 N ATOM 1403 CA ASP A 92 -2.193 -23.755 -14.860 1.00 0.00 C ATOM 1404 C ASP A 92 -0.984 -23.021 -15.431 1.00 0.00 C ATOM 1405 O ASP A 92 -0.982 -22.619 -16.595 1.00 0.00 O ATOM 1406 CB ASP A 92 -2.255 -25.177 -15.421 1.00 0.00 C ATOM 1407 CG ASP A 92 -1.053 -26.010 -15.020 1.00 0.00 C ATOM 1408 OD1 ASP A 92 0.041 -25.432 -14.854 1.00 0.00 O ATOM 1409 OD2 ASP A 92 -1.208 -27.240 -14.872 1.00 0.00 O ATOM 0 H ASP A 92 -3.715 -23.086 -16.139 1.00 0.00 H new ATOM 0 HA ASP A 92 -2.086 -23.804 -13.776 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -3.165 -25.664 -15.069 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -2.317 -25.133 -16.508 1.00 0.00 H new ATOM 1414 N LEU A 93 0.042 -22.850 -14.605 1.00 0.00 N ATOM 1415 CA LEU A 93 1.258 -22.163 -15.027 1.00 0.00 C ATOM 1416 C LEU A 93 2.026 -22.995 -16.048 1.00 0.00 C ATOM 1417 O LEU A 93 2.562 -24.056 -15.724 1.00 0.00 O ATOM 1418 CB LEU A 93 2.147 -21.870 -13.818 1.00 0.00 C ATOM 1419 CG LEU A 93 3.641 -22.138 -14.003 1.00 0.00 C ATOM 1420 CD1 LEU A 93 4.156 -21.447 -15.256 1.00 0.00 C ATOM 1421 CD2 LEU A 93 4.421 -21.677 -12.780 1.00 0.00 C ATOM 0 H LEU A 93 0.056 -23.178 -13.639 1.00 0.00 H new ATOM 0 HA LEU A 93 0.971 -21.222 -15.495 1.00 0.00 H new ATOM 0 HB2 LEU A 93 2.017 -20.824 -13.542 1.00 0.00 H new ATOM 0 HB3 LEU A 93 1.792 -22.467 -12.978 1.00 0.00 H new ATOM 0 HG LEU A 93 3.786 -23.212 -14.119 1.00 0.00 H new ATOM 0 HD11 LEU A 93 5.221 -21.649 -15.371 1.00 0.00 H new ATOM 0 HD12 LEU A 93 3.619 -21.824 -16.126 1.00 0.00 H new ATOM 0 HD13 LEU A 93 3.998 -20.372 -15.170 1.00 0.00 H new ATOM 0 HD21 LEU A 93 5.482 -21.876 -12.929 1.00 0.00 H new ATOM 0 HD22 LEU A 93 4.269 -20.608 -12.633 1.00 0.00 H new ATOM 0 HD23 LEU A 93 4.071 -22.217 -11.900 1.00 0.00 H new ATOM 1433 N LEU A 94 2.079 -22.506 -17.282 1.00 0.00 N ATOM 1434 CA LEU A 94 2.785 -23.203 -18.352 1.00 0.00 C ATOM 1435 C LEU A 94 3.787 -22.278 -19.036 1.00 0.00 C ATOM 1436 O LEU A 94 3.412 -21.256 -19.609 1.00 0.00 O ATOM 1437 CB LEU A 94 1.789 -23.743 -19.379 1.00 0.00 C ATOM 1438 CG LEU A 94 1.810 -25.256 -19.604 1.00 0.00 C ATOM 1439 CD1 LEU A 94 0.728 -25.664 -20.591 1.00 0.00 C ATOM 1440 CD2 LEU A 94 3.179 -25.703 -20.095 1.00 0.00 C ATOM 0 H LEU A 94 1.642 -21.630 -17.567 1.00 0.00 H new ATOM 0 HA LEU A 94 3.331 -24.037 -17.911 1.00 0.00 H new ATOM 0 HB2 LEU A 94 0.785 -23.456 -19.067 1.00 0.00 H new ATOM 0 HB3 LEU A 94 1.979 -23.251 -20.333 1.00 0.00 H new ATOM 0 HG LEU A 94 1.609 -25.748 -18.653 1.00 0.00 H new ATOM 0 HD11 LEU A 94 0.758 -26.744 -20.738 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -0.248 -25.379 -20.199 1.00 0.00 H new ATOM 0 HD13 LEU A 94 0.897 -25.163 -21.544 1.00 0.00 H new ATOM 0 HD21 LEU A 94 3.176 -26.782 -20.250 1.00 0.00 H new ATOM 0 HD22 LEU A 94 3.410 -25.202 -21.035 1.00 0.00 H new ATOM 0 HD23 LEU A 94 3.934 -25.445 -19.352 1.00 0.00 H new ATOM 1452 N ASN A 95 5.063 -22.646 -18.972 1.00 0.00 N ATOM 1453 CA ASN A 95 6.119 -21.850 -19.587 1.00 0.00 C ATOM 1454 C ASN A 95 6.043 -20.397 -19.128 1.00 0.00 C ATOM 1455 O ASN A 95 6.194 -19.474 -19.927 1.00 0.00 O ATOM 1456 CB ASN A 95 6.017 -21.921 -21.112 1.00 0.00 C ATOM 1457 CG ASN A 95 6.045 -23.346 -21.628 1.00 0.00 C ATOM 1458 OD1 ASN A 95 6.625 -24.234 -21.002 1.00 0.00 O ATOM 1459 ND2 ASN A 95 5.417 -23.572 -22.777 1.00 0.00 N ATOM 0 H ASN A 95 5.390 -23.489 -18.501 1.00 0.00 H new ATOM 0 HA ASN A 95 7.079 -22.261 -19.274 1.00 0.00 H new ATOM 0 HB2 ASN A 95 5.094 -21.439 -21.434 1.00 0.00 H new ATOM 0 HB3 ASN A 95 6.841 -21.361 -21.555 1.00 0.00 H new ATOM 0 HD21 ASN A 95 5.403 -24.511 -23.174 1.00 0.00 H new ATOM 0 HD22 ASN A 95 4.949 -22.806 -23.262 1.00 0.00 H new ATOM 1466 N GLY A 96 5.807 -20.203 -17.834 1.00 0.00 N ATOM 1467 CA GLY A 96 5.716 -18.860 -17.290 1.00 0.00 C ATOM 1468 C GLY A 96 4.442 -18.152 -17.706 1.00 0.00 C ATOM 1469 O GLY A 96 4.359 -16.926 -17.649 1.00 0.00 O ATOM 0 H GLY A 96 5.677 -20.951 -17.153 1.00 0.00 H new ATOM 0 HA2 GLY A 96 5.763 -18.908 -16.202 1.00 0.00 H new ATOM 0 HA3 GLY A 96 6.576 -18.278 -17.621 1.00 0.00 H new ATOM 1473 N GLU A 97 3.446 -18.926 -18.128 1.00 0.00 N ATOM 1474 CA GLU A 97 2.171 -18.364 -18.557 1.00 0.00 C ATOM 1475 C GLU A 97 1.011 -19.259 -18.131 1.00 0.00 C ATOM 1476 O GLU A 97 0.912 -20.409 -18.558 1.00 0.00 O ATOM 1477 CB GLU A 97 2.156 -18.179 -20.076 1.00 0.00 C ATOM 1478 CG GLU A 97 1.202 -17.095 -20.547 1.00 0.00 C ATOM 1479 CD GLU A 97 1.914 -15.804 -20.903 1.00 0.00 C ATOM 1480 OE1 GLU A 97 3.105 -15.868 -21.274 1.00 0.00 O ATOM 1481 OE2 GLU A 97 1.282 -14.732 -20.810 1.00 0.00 O ATOM 0 H GLU A 97 3.498 -19.943 -18.182 1.00 0.00 H new ATOM 0 HA GLU A 97 2.052 -17.392 -18.078 1.00 0.00 H new ATOM 0 HB2 GLU A 97 3.164 -17.937 -20.414 1.00 0.00 H new ATOM 0 HB3 GLU A 97 1.881 -19.123 -20.546 1.00 0.00 H new ATOM 0 HG2 GLU A 97 0.652 -17.454 -21.417 1.00 0.00 H new ATOM 0 HG3 GLU A 97 0.469 -16.897 -19.765 1.00 0.00 H new ATOM 1488 N TRP A 98 0.137 -18.722 -17.288 1.00 0.00 N ATOM 1489 CA TRP A 98 -1.016 -19.472 -16.803 1.00 0.00 C ATOM 1490 C TRP A 98 -2.053 -19.650 -17.907 1.00 0.00 C ATOM 1491 O TRP A 98 -2.463 -18.683 -18.549 1.00 0.00 O ATOM 1492 CB TRP A 98 -1.647 -18.760 -15.605 1.00 0.00 C ATOM 1493 CG TRP A 98 -0.638 -18.177 -14.662 1.00 0.00 C ATOM 1494 CD1 TRP A 98 0.007 -16.980 -14.789 1.00 0.00 C ATOM 1495 CD2 TRP A 98 -0.157 -18.767 -13.449 1.00 0.00 C ATOM 1496 NE1 TRP A 98 0.860 -16.791 -13.728 1.00 0.00 N ATOM 1497 CE2 TRP A 98 0.777 -17.872 -12.892 1.00 0.00 C ATOM 1498 CE3 TRP A 98 -0.426 -19.964 -12.779 1.00 0.00 C ATOM 1499 CZ2 TRP A 98 1.441 -18.138 -11.698 1.00 0.00 C ATOM 1500 CZ3 TRP A 98 0.234 -20.226 -11.594 1.00 0.00 C ATOM 1501 CH2 TRP A 98 1.159 -19.317 -11.063 1.00 0.00 C ATOM 0 H TRP A 98 0.204 -17.771 -16.926 1.00 0.00 H new ATOM 0 HA TRP A 98 -0.671 -20.458 -16.491 1.00 0.00 H new ATOM 0 HB2 TRP A 98 -2.299 -17.964 -15.966 1.00 0.00 H new ATOM 0 HB3 TRP A 98 -2.276 -19.465 -15.062 1.00 0.00 H new ATOM 0 HD1 TRP A 98 -0.133 -16.284 -15.603 1.00 0.00 H new ATOM 0 HE1 TRP A 98 1.458 -15.977 -13.586 1.00 0.00 H new ATOM 0 HE3 TRP A 98 -1.137 -20.671 -13.180 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 2.154 -17.438 -11.287 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 0.034 -21.147 -11.068 1.00 0.00 H new ATOM 0 HH2 TRP A 98 1.659 -19.551 -10.135 1.00 0.00 H new ATOM 1512 N VAL A 99 -2.473 -20.893 -18.123 1.00 0.00 N ATOM 1513 CA VAL A 99 -3.463 -21.197 -19.149 1.00 0.00 C ATOM 1514 C VAL A 99 -4.425 -22.283 -18.680 1.00 0.00 C ATOM 1515 O VAL A 99 -4.016 -23.260 -18.052 1.00 0.00 O ATOM 1516 CB VAL A 99 -2.792 -21.652 -20.459 1.00 0.00 C ATOM 1517 CG1 VAL A 99 -2.292 -20.452 -21.248 1.00 0.00 C ATOM 1518 CG2 VAL A 99 -1.655 -22.619 -20.167 1.00 0.00 C ATOM 0 H VAL A 99 -2.143 -21.705 -17.601 1.00 0.00 H new ATOM 0 HA VAL A 99 -4.019 -20.278 -19.334 1.00 0.00 H new ATOM 0 HB VAL A 99 -3.534 -22.172 -21.065 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -1.821 -20.793 -22.170 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -3.131 -19.800 -21.489 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -1.565 -19.902 -20.651 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -1.192 -22.930 -21.104 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -0.911 -22.127 -19.541 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -2.046 -23.494 -19.647 1.00 0.00 H new ATOM 1528 N SER A 100 -5.705 -22.105 -18.989 1.00 0.00 N ATOM 1529 CA SER A 100 -6.727 -23.069 -18.596 1.00 0.00 C ATOM 1530 C SER A 100 -7.226 -23.855 -19.805 1.00 0.00 C ATOM 1531 O SER A 100 -7.155 -23.382 -20.940 1.00 0.00 O ATOM 1532 CB SER A 100 -7.899 -22.354 -17.920 1.00 0.00 C ATOM 1533 OG SER A 100 -8.564 -23.214 -17.011 1.00 0.00 O ATOM 0 H SER A 100 -6.059 -21.303 -19.510 1.00 0.00 H new ATOM 0 HA SER A 100 -6.280 -23.768 -17.889 1.00 0.00 H new ATOM 0 HB2 SER A 100 -7.536 -21.472 -17.392 1.00 0.00 H new ATOM 0 HB3 SER A 100 -8.602 -22.005 -18.677 1.00 0.00 H new ATOM 0 HG SER A 100 -8.106 -23.192 -16.145 1.00 0.00 H new ATOM 1539 N LEU A 101 -7.730 -25.058 -19.553 1.00 0.00 N ATOM 1540 CA LEU A 101 -8.241 -25.912 -20.620 1.00 0.00 C ATOM 1541 C LEU A 101 -7.099 -26.592 -21.368 1.00 0.00 C ATOM 1542 O LEU A 101 -6.936 -26.405 -22.574 1.00 0.00 O ATOM 1543 CB LEU A 101 -9.088 -25.092 -21.595 1.00 0.00 C ATOM 1544 CG LEU A 101 -10.146 -25.867 -22.381 1.00 0.00 C ATOM 1545 CD1 LEU A 101 -9.605 -27.222 -22.810 1.00 0.00 C ATOM 1546 CD2 LEU A 101 -11.411 -26.033 -21.552 1.00 0.00 C ATOM 0 H LEU A 101 -7.796 -25.464 -18.620 1.00 0.00 H new ATOM 0 HA LEU A 101 -8.864 -26.683 -20.167 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -9.587 -24.301 -21.035 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -8.420 -24.606 -22.306 1.00 0.00 H new ATOM 0 HG LEU A 101 -10.395 -25.298 -23.277 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -10.371 -27.760 -23.368 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -8.728 -27.080 -23.442 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -9.327 -27.799 -21.928 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -12.153 -26.587 -22.127 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -11.178 -26.580 -20.638 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -11.809 -25.051 -21.296 1.00 0.00 H new ATOM 1558 N ARG A 102 -6.313 -27.382 -20.645 1.00 0.00 N ATOM 1559 CA ARG A 102 -5.187 -28.091 -21.240 1.00 0.00 C ATOM 1560 C ARG A 102 -4.533 -27.252 -22.334 1.00 0.00 C ATOM 1561 O ARG A 102 -4.745 -27.489 -23.522 1.00 0.00 O ATOM 1562 CB ARG A 102 -5.647 -29.431 -21.818 1.00 0.00 C ATOM 1563 CG ARG A 102 -6.847 -29.314 -22.744 1.00 0.00 C ATOM 1564 CD ARG A 102 -6.995 -30.548 -23.622 1.00 0.00 C ATOM 1565 NE ARG A 102 -8.047 -30.385 -24.621 1.00 0.00 N ATOM 1566 CZ ARG A 102 -8.195 -31.187 -25.670 1.00 0.00 C ATOM 1567 NH1 ARG A 102 -7.361 -32.201 -25.856 1.00 0.00 N ATOM 1568 NH2 ARG A 102 -9.178 -30.974 -26.536 1.00 0.00 N ATOM 0 H ARG A 102 -6.435 -27.547 -19.646 1.00 0.00 H new ATOM 0 HA ARG A 102 -4.452 -28.274 -20.457 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -4.820 -29.885 -22.364 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -5.896 -30.105 -20.998 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -7.752 -29.176 -22.153 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -6.739 -28.430 -23.372 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -6.048 -30.753 -24.122 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -7.219 -31.413 -22.997 1.00 0.00 H new ATOM 0 HE ARG A 102 -8.704 -29.613 -24.508 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -6.604 -32.367 -25.193 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -7.477 -32.815 -26.662 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -9.820 -30.194 -26.397 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -9.291 -31.590 -27.341 1.00 0.00 H new ATOM 1582 N ASN A 103 -3.738 -26.269 -21.923 1.00 0.00 N ATOM 1583 CA ASN A 103 -3.054 -25.394 -22.868 1.00 0.00 C ATOM 1584 C ASN A 103 -4.004 -24.932 -23.968 1.00 0.00 C ATOM 1585 O ASN A 103 -3.946 -25.418 -25.097 1.00 0.00 O ATOM 1586 CB ASN A 103 -1.852 -26.113 -23.484 1.00 0.00 C ATOM 1587 CG ASN A 103 -2.206 -27.498 -23.992 1.00 0.00 C ATOM 1588 OD1 ASN A 103 -2.282 -28.453 -23.220 1.00 0.00 O ATOM 1589 ND2 ASN A 103 -2.423 -27.611 -25.297 1.00 0.00 N ATOM 0 H ASN A 103 -3.552 -26.059 -20.942 1.00 0.00 H new ATOM 0 HA ASN A 103 -2.704 -24.517 -22.324 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -1.458 -25.517 -24.307 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -1.059 -26.193 -22.740 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -2.664 -28.518 -25.697 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -2.349 -26.791 -25.899 1.00 0.00 H new ATOM 1596 N GLY A 104 -4.880 -23.990 -23.630 1.00 0.00 N ATOM 1597 CA GLY A 104 -5.830 -23.479 -24.600 1.00 0.00 C ATOM 1598 C GLY A 104 -6.090 -21.995 -24.430 1.00 0.00 C ATOM 1599 O GLY A 104 -5.882 -21.210 -25.356 1.00 0.00 O ATOM 0 H GLY A 104 -4.948 -23.572 -22.702 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -5.454 -23.666 -25.606 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -6.770 -24.023 -24.505 1.00 0.00 H new ATOM 1603 N THR A 105 -6.549 -21.608 -23.244 1.00 0.00 N ATOM 1604 CA THR A 105 -6.840 -20.209 -22.956 1.00 0.00 C ATOM 1605 C THR A 105 -5.969 -19.688 -21.819 1.00 0.00 C ATOM 1606 O THR A 105 -5.471 -20.461 -21.000 1.00 0.00 O ATOM 1607 CB THR A 105 -8.322 -20.009 -22.585 1.00 0.00 C ATOM 1608 OG1 THR A 105 -8.879 -21.241 -22.112 1.00 0.00 O ATOM 1609 CG2 THR A 105 -9.118 -19.514 -23.783 1.00 0.00 C ATOM 0 H THR A 105 -6.727 -22.244 -22.467 1.00 0.00 H new ATOM 0 HA THR A 105 -6.621 -19.647 -23.864 1.00 0.00 H new ATOM 0 HB THR A 105 -8.378 -19.259 -21.796 1.00 0.00 H new ATOM 0 HG1 THR A 105 -9.821 -21.105 -21.877 1.00 0.00 H new ATOM 0 HG21 THR A 105 -10.161 -19.380 -23.497 1.00 0.00 H new ATOM 0 HG22 THR A 105 -8.710 -18.562 -24.123 1.00 0.00 H new ATOM 0 HG23 THR A 105 -9.054 -20.245 -24.589 1.00 0.00 H new ATOM 1617 N LYS A 106 -5.788 -18.373 -21.774 1.00 0.00 N ATOM 1618 CA LYS A 106 -4.978 -17.747 -20.736 1.00 0.00 C ATOM 1619 C LYS A 106 -5.834 -16.858 -19.839 1.00 0.00 C ATOM 1620 O LYS A 106 -6.958 -16.500 -20.194 1.00 0.00 O ATOM 1621 CB LYS A 106 -3.853 -16.922 -21.366 1.00 0.00 C ATOM 1622 CG LYS A 106 -3.903 -16.885 -22.883 1.00 0.00 C ATOM 1623 CD LYS A 106 -2.946 -15.848 -23.447 1.00 0.00 C ATOM 1624 CE LYS A 106 -2.987 -15.820 -24.967 1.00 0.00 C ATOM 1625 NZ LYS A 106 -2.163 -16.908 -25.564 1.00 0.00 N ATOM 0 H LYS A 106 -6.192 -17.719 -22.445 1.00 0.00 H new ATOM 0 HA LYS A 106 -4.542 -18.537 -20.125 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -3.904 -15.902 -20.984 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -2.893 -17.332 -21.052 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -3.651 -17.868 -23.280 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -4.918 -16.660 -23.209 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -3.204 -14.863 -23.057 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -1.932 -16.068 -23.113 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -4.019 -15.919 -25.304 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -2.627 -14.855 -25.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -2.217 -16.855 -26.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -1.174 -16.799 -25.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -2.523 -17.830 -25.245 1.00 0.00 H new ATOM 1639 N LEU A 107 -5.296 -16.504 -18.678 1.00 0.00 N ATOM 1640 CA LEU A 107 -6.010 -15.655 -17.730 1.00 0.00 C ATOM 1641 C LEU A 107 -6.173 -14.242 -18.281 1.00 0.00 C ATOM 1642 O LEU A 107 -7.236 -13.878 -18.784 1.00 0.00 O ATOM 1643 CB LEU A 107 -5.268 -15.611 -16.394 1.00 0.00 C ATOM 1644 CG LEU A 107 -5.858 -14.688 -15.328 1.00 0.00 C ATOM 1645 CD1 LEU A 107 -5.413 -13.252 -15.559 1.00 0.00 C ATOM 1646 CD2 LEU A 107 -7.377 -14.783 -15.322 1.00 0.00 C ATOM 0 H LEU A 107 -4.367 -16.791 -18.370 1.00 0.00 H new ATOM 0 HA LEU A 107 -7.001 -16.081 -17.574 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -5.230 -16.622 -15.989 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -4.239 -15.304 -16.583 1.00 0.00 H new ATOM 0 HG LEU A 107 -5.490 -15.008 -14.353 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -5.843 -12.610 -14.790 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -4.325 -13.196 -15.512 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -5.751 -12.920 -16.540 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -7.780 -14.119 -14.557 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -7.764 -14.489 -16.298 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -7.677 -15.809 -15.107 1.00 0.00 H new ATOM 1658 N THR A 108 -5.110 -13.448 -18.184 1.00 0.00 N ATOM 1659 CA THR A 108 -5.135 -12.076 -18.674 1.00 0.00 C ATOM 1660 C THR A 108 -5.773 -11.996 -20.056 1.00 0.00 C ATOM 1661 O THR A 108 -6.239 -10.936 -20.474 1.00 0.00 O ATOM 1662 CB THR A 108 -3.716 -11.478 -18.740 1.00 0.00 C ATOM 1663 OG1 THR A 108 -3.775 -10.129 -19.217 1.00 0.00 O ATOM 1664 CG2 THR A 108 -2.823 -12.305 -19.652 1.00 0.00 C ATOM 0 H THR A 108 -4.222 -13.732 -17.771 1.00 0.00 H new ATOM 0 HA THR A 108 -5.733 -11.499 -17.968 1.00 0.00 H new ATOM 0 HB THR A 108 -3.293 -11.490 -17.735 1.00 0.00 H new ATOM 0 HG1 THR A 108 -2.870 -9.755 -19.255 1.00 0.00 H new ATOM 0 HG21 THR A 108 -1.827 -11.864 -19.683 1.00 0.00 H new ATOM 0 HG22 THR A 108 -2.757 -13.324 -19.270 1.00 0.00 H new ATOM 0 HG23 THR A 108 -3.244 -12.321 -20.657 1.00 0.00 H new ATOM 1672 N ASP A 109 -5.791 -13.122 -20.760 1.00 0.00 N ATOM 1673 CA ASP A 109 -6.375 -13.180 -22.095 1.00 0.00 C ATOM 1674 C ASP A 109 -7.898 -13.223 -22.021 1.00 0.00 C ATOM 1675 O ASP A 109 -8.585 -12.496 -22.739 1.00 0.00 O ATOM 1676 CB ASP A 109 -5.854 -14.403 -22.850 1.00 0.00 C ATOM 1677 CG ASP A 109 -5.259 -14.042 -24.197 1.00 0.00 C ATOM 1678 OD1 ASP A 109 -4.296 -13.247 -24.226 1.00 0.00 O ATOM 1679 OD2 ASP A 109 -5.756 -14.554 -25.222 1.00 0.00 O ATOM 0 H ASP A 109 -5.408 -14.007 -20.429 1.00 0.00 H new ATOM 0 HA ASP A 109 -6.081 -12.279 -22.633 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -5.099 -14.905 -22.245 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -6.669 -15.112 -22.994 1.00 0.00 H new ATOM 1684 N ILE A 110 -8.419 -14.079 -21.149 1.00 0.00 N ATOM 1685 CA ILE A 110 -9.860 -14.217 -20.982 1.00 0.00 C ATOM 1686 C ILE A 110 -10.437 -13.044 -20.196 1.00 0.00 C ATOM 1687 O ILE A 110 -11.581 -12.641 -20.410 1.00 0.00 O ATOM 1688 CB ILE A 110 -10.221 -15.529 -20.262 1.00 0.00 C ATOM 1689 CG1 ILE A 110 -10.549 -16.622 -21.281 1.00 0.00 C ATOM 1690 CG2 ILE A 110 -11.393 -15.310 -19.317 1.00 0.00 C ATOM 1691 CD1 ILE A 110 -9.514 -16.756 -22.376 1.00 0.00 C ATOM 0 H ILE A 110 -7.864 -14.688 -20.547 1.00 0.00 H new ATOM 0 HA ILE A 110 -10.293 -14.230 -21.982 1.00 0.00 H new ATOM 0 HB ILE A 110 -9.361 -15.852 -19.675 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -10.642 -17.576 -20.762 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -11.518 -16.408 -21.732 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -11.636 -16.247 -18.816 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -11.125 -14.559 -18.573 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -12.258 -14.967 -19.884 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -9.811 -17.549 -23.062 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -9.437 -15.815 -22.921 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -8.548 -17.001 -21.935 1.00 0.00 H new ATOM 1703 N LEU A 111 -9.637 -12.497 -19.287 1.00 0.00 N ATOM 1704 CA LEU A 111 -10.066 -11.368 -18.470 1.00 0.00 C ATOM 1705 C LEU A 111 -10.053 -10.075 -19.278 1.00 0.00 C ATOM 1706 O LEU A 111 -10.938 -9.231 -19.135 1.00 0.00 O ATOM 1707 CB LEU A 111 -9.160 -11.226 -17.245 1.00 0.00 C ATOM 1708 CG LEU A 111 -9.867 -10.972 -15.913 1.00 0.00 C ATOM 1709 CD1 LEU A 111 -10.574 -9.626 -15.933 1.00 0.00 C ATOM 1710 CD2 LEU A 111 -10.854 -12.090 -15.612 1.00 0.00 C ATOM 0 H LEU A 111 -8.687 -12.818 -19.097 1.00 0.00 H new ATOM 0 HA LEU A 111 -11.087 -11.558 -18.139 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -8.566 -12.135 -17.150 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -8.464 -10.407 -17.426 1.00 0.00 H new ATOM 0 HG LEU A 111 -9.117 -10.954 -15.123 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -11.072 -9.462 -14.977 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -9.844 -8.834 -16.103 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -11.314 -9.615 -16.734 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -11.348 -11.893 -14.661 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -11.600 -12.140 -16.405 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -10.322 -13.040 -15.555 1.00 0.00 H new ATOM 1722 N THR A 112 -9.044 -9.926 -20.131 1.00 0.00 N ATOM 1723 CA THR A 112 -8.916 -8.736 -20.964 1.00 0.00 C ATOM 1724 C THR A 112 -9.938 -8.745 -22.095 1.00 0.00 C ATOM 1725 O THR A 112 -10.513 -7.710 -22.431 1.00 0.00 O ATOM 1726 CB THR A 112 -7.503 -8.620 -21.564 1.00 0.00 C ATOM 1727 OG1 THR A 112 -6.550 -8.361 -20.528 1.00 0.00 O ATOM 1728 CG2 THR A 112 -7.445 -7.509 -22.602 1.00 0.00 C ATOM 0 H THR A 112 -8.303 -10.615 -20.263 1.00 0.00 H new ATOM 0 HA THR A 112 -9.100 -7.877 -20.319 1.00 0.00 H new ATOM 0 HB THR A 112 -7.261 -9.564 -22.051 1.00 0.00 H new ATOM 0 HG1 THR A 112 -6.289 -9.206 -20.105 1.00 0.00 H new ATOM 0 HG21 THR A 112 -6.437 -7.446 -23.012 1.00 0.00 H new ATOM 0 HG22 THR A 112 -8.150 -7.724 -23.405 1.00 0.00 H new ATOM 0 HG23 THR A 112 -7.706 -6.560 -22.134 1.00 0.00 H new ATOM 1736 N GLU A 113 -10.159 -9.919 -22.678 1.00 0.00 N ATOM 1737 CA GLU A 113 -11.112 -10.060 -23.773 1.00 0.00 C ATOM 1738 C GLU A 113 -12.546 -10.035 -23.252 1.00 0.00 C ATOM 1739 O GLU A 113 -13.440 -9.484 -23.893 1.00 0.00 O ATOM 1740 CB GLU A 113 -10.857 -11.362 -24.535 1.00 0.00 C ATOM 1741 CG GLU A 113 -11.104 -11.250 -26.030 1.00 0.00 C ATOM 1742 CD GLU A 113 -10.079 -12.010 -26.849 1.00 0.00 C ATOM 1743 OE1 GLU A 113 -8.930 -11.533 -26.953 1.00 0.00 O ATOM 1744 OE2 GLU A 113 -10.427 -13.083 -27.386 1.00 0.00 O ATOM 0 H GLU A 113 -9.692 -10.785 -22.411 1.00 0.00 H new ATOM 0 HA GLU A 113 -10.975 -9.218 -24.451 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -9.826 -11.675 -24.368 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -11.498 -12.144 -24.127 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -12.100 -11.629 -26.259 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -11.088 -10.199 -26.319 1.00 0.00 H new ATOM 1751 N GLU A 114 -12.756 -10.637 -22.085 1.00 0.00 N ATOM 1752 CA GLU A 114 -14.082 -10.685 -21.479 1.00 0.00 C ATOM 1753 C GLU A 114 -14.521 -9.297 -21.021 1.00 0.00 C ATOM 1754 O GLU A 114 -15.656 -8.884 -21.256 1.00 0.00 O ATOM 1755 CB GLU A 114 -14.090 -11.652 -20.293 1.00 0.00 C ATOM 1756 CG GLU A 114 -15.454 -11.804 -19.641 1.00 0.00 C ATOM 1757 CD GLU A 114 -15.418 -12.692 -18.413 1.00 0.00 C ATOM 1758 OE1 GLU A 114 -14.444 -13.461 -18.266 1.00 0.00 O ATOM 1759 OE2 GLU A 114 -16.362 -12.619 -17.599 1.00 0.00 O ATOM 0 H GLU A 114 -12.026 -11.097 -21.541 1.00 0.00 H new ATOM 0 HA GLU A 114 -14.786 -11.040 -22.232 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -13.747 -12.630 -20.630 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -13.376 -11.304 -19.546 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -15.831 -10.820 -19.362 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -16.154 -12.220 -20.365 1.00 0.00 H new ATOM 1766 N VAL A 115 -13.612 -8.582 -20.364 1.00 0.00 N ATOM 1767 CA VAL A 115 -13.905 -7.241 -19.872 1.00 0.00 C ATOM 1768 C VAL A 115 -14.004 -6.244 -21.022 1.00 0.00 C ATOM 1769 O VAL A 115 -14.763 -5.278 -20.954 1.00 0.00 O ATOM 1770 CB VAL A 115 -12.828 -6.759 -18.881 1.00 0.00 C ATOM 1771 CG1 VAL A 115 -13.089 -5.319 -18.468 1.00 0.00 C ATOM 1772 CG2 VAL A 115 -12.778 -7.671 -17.665 1.00 0.00 C ATOM 0 H VAL A 115 -12.668 -8.909 -20.161 1.00 0.00 H new ATOM 0 HA VAL A 115 -14.864 -7.295 -19.357 1.00 0.00 H new ATOM 0 HB VAL A 115 -11.858 -6.799 -19.377 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -12.318 -4.996 -17.768 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -13.070 -4.678 -19.350 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -14.066 -5.249 -17.990 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -12.012 -7.316 -16.975 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -13.747 -7.665 -17.166 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -12.539 -8.686 -17.981 1.00 0.00 H new ATOM 1782 N GLU A 116 -13.232 -6.486 -22.076 1.00 0.00 N ATOM 1783 CA GLU A 116 -13.234 -5.609 -23.241 1.00 0.00 C ATOM 1784 C GLU A 116 -14.557 -5.707 -23.995 1.00 0.00 C ATOM 1785 O GLU A 116 -15.162 -4.694 -24.346 1.00 0.00 O ATOM 1786 CB GLU A 116 -12.075 -5.962 -24.175 1.00 0.00 C ATOM 1787 CG GLU A 116 -11.910 -4.993 -25.334 1.00 0.00 C ATOM 1788 CD GLU A 116 -10.457 -4.659 -25.613 1.00 0.00 C ATOM 1789 OE1 GLU A 116 -9.640 -4.735 -24.672 1.00 0.00 O ATOM 1790 OE2 GLU A 116 -10.137 -4.324 -26.773 1.00 0.00 O ATOM 0 H GLU A 116 -12.597 -7.281 -22.147 1.00 0.00 H new ATOM 0 HA GLU A 116 -13.110 -4.584 -22.891 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -11.150 -5.987 -23.599 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -12.231 -6.965 -24.571 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -12.358 -5.424 -26.229 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -12.455 -4.074 -25.115 1.00 0.00 H new ATOM 1797 N LYS A 117 -15.001 -6.935 -24.241 1.00 0.00 N ATOM 1798 CA LYS A 117 -16.252 -7.169 -24.952 1.00 0.00 C ATOM 1799 C LYS A 117 -17.445 -7.044 -24.010 1.00 0.00 C ATOM 1800 O LYS A 117 -18.590 -6.956 -24.452 1.00 0.00 O ATOM 1801 CB LYS A 117 -16.243 -8.556 -25.599 1.00 0.00 C ATOM 1802 CG LYS A 117 -15.114 -8.755 -26.595 1.00 0.00 C ATOM 1803 CD LYS A 117 -14.559 -10.169 -26.534 1.00 0.00 C ATOM 1804 CE LYS A 117 -15.103 -11.031 -27.662 1.00 0.00 C ATOM 1805 NZ LYS A 117 -14.374 -10.796 -28.940 1.00 0.00 N ATOM 0 H LYS A 117 -14.512 -7.784 -23.958 1.00 0.00 H new ATOM 0 HA LYS A 117 -16.345 -6.412 -25.731 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -16.164 -9.312 -24.817 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -17.195 -8.718 -26.104 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -15.476 -8.548 -27.602 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -14.316 -8.041 -26.390 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -13.471 -10.137 -26.592 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -14.814 -10.620 -25.575 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -15.023 -12.083 -27.386 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -16.163 -10.818 -27.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -14.774 -11.402 -29.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -14.471 -9.798 -29.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -13.367 -11.024 -28.812 1.00 0.00 H new ATOM 1819 N ALA A 118 -17.168 -7.035 -22.710 1.00 0.00 N ATOM 1820 CA ALA A 118 -18.218 -6.916 -21.707 1.00 0.00 C ATOM 1821 C ALA A 118 -18.421 -5.462 -21.293 1.00 0.00 C ATOM 1822 O ALA A 118 -19.515 -5.070 -20.886 1.00 0.00 O ATOM 1823 CB ALA A 118 -17.887 -7.771 -20.493 1.00 0.00 C ATOM 0 H ALA A 118 -16.225 -7.109 -22.327 1.00 0.00 H new ATOM 0 HA ALA A 118 -19.149 -7.274 -22.147 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -18.680 -7.673 -19.752 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -17.801 -8.815 -20.796 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -16.943 -7.439 -20.061 1.00 0.00 H new ATOM 1829 N ILE A 119 -17.361 -4.669 -21.399 1.00 0.00 N ATOM 1830 CA ILE A 119 -17.424 -3.258 -21.036 1.00 0.00 C ATOM 1831 C ILE A 119 -17.712 -2.389 -22.256 1.00 0.00 C ATOM 1832 O ILE A 119 -18.328 -1.329 -22.144 1.00 0.00 O ATOM 1833 CB ILE A 119 -16.112 -2.786 -20.382 1.00 0.00 C ATOM 1834 CG1 ILE A 119 -15.953 -3.413 -18.996 1.00 0.00 C ATOM 1835 CG2 ILE A 119 -16.083 -1.268 -20.290 1.00 0.00 C ATOM 1836 CD1 ILE A 119 -14.975 -2.677 -18.108 1.00 0.00 C ATOM 0 H ILE A 119 -16.448 -4.979 -21.733 1.00 0.00 H new ATOM 0 HA ILE A 119 -18.237 -3.153 -20.318 1.00 0.00 H new ATOM 0 HB ILE A 119 -15.277 -3.109 -21.003 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -16.926 -3.442 -18.505 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -15.622 -4.446 -19.109 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -15.150 -0.949 -19.826 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -16.155 -0.841 -21.290 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -16.924 -0.924 -19.688 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -14.913 -3.178 -17.142 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -13.991 -2.671 -18.577 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -15.315 -1.651 -17.964 1.00 0.00 H new ATOM 1848 N SER A 120 -17.264 -2.846 -23.421 1.00 0.00 N ATOM 1849 CA SER A 120 -17.473 -2.110 -24.662 1.00 0.00 C ATOM 1850 C SER A 120 -18.755 -2.563 -25.354 1.00 0.00 C ATOM 1851 O SER A 120 -19.359 -1.812 -26.120 1.00 0.00 O ATOM 1852 CB SER A 120 -16.279 -2.300 -25.599 1.00 0.00 C ATOM 1853 OG SER A 120 -16.421 -1.518 -26.772 1.00 0.00 O ATOM 0 H SER A 120 -16.754 -3.722 -23.531 1.00 0.00 H new ATOM 0 HA SER A 120 -17.569 -1.052 -24.417 1.00 0.00 H new ATOM 0 HB2 SER A 120 -15.360 -2.023 -25.083 1.00 0.00 H new ATOM 0 HB3 SER A 120 -16.188 -3.352 -25.869 1.00 0.00 H new ATOM 0 HG SER A 120 -15.644 -1.656 -27.353 1.00 0.00 H new ATOM 1859 N LYS A 121 -19.164 -3.796 -25.079 1.00 0.00 N ATOM 1860 CA LYS A 121 -20.374 -4.352 -25.672 1.00 0.00 C ATOM 1861 C LYS A 121 -21.513 -3.338 -25.636 1.00 0.00 C ATOM 1862 O LYS A 121 -22.437 -3.399 -26.447 1.00 0.00 O ATOM 1863 CB LYS A 121 -20.789 -5.628 -24.936 1.00 0.00 C ATOM 1864 CG LYS A 121 -22.286 -5.737 -24.705 1.00 0.00 C ATOM 1865 CD LYS A 121 -22.643 -7.009 -23.954 1.00 0.00 C ATOM 1866 CE LYS A 121 -22.544 -6.814 -22.449 1.00 0.00 C ATOM 1867 NZ LYS A 121 -23.125 -7.963 -21.701 1.00 0.00 N ATOM 0 H LYS A 121 -18.674 -4.431 -24.448 1.00 0.00 H new ATOM 0 HA LYS A 121 -20.160 -4.595 -26.713 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -20.454 -6.493 -25.509 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -20.278 -5.665 -23.974 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -22.632 -4.871 -24.141 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -22.805 -5.721 -25.663 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -23.656 -7.316 -24.216 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -21.976 -7.814 -24.262 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -21.499 -6.689 -22.167 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -23.062 -5.898 -22.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -23.038 -7.792 -20.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -24.129 -8.067 -21.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -22.614 -8.834 -21.951 1.00 0.00 H new ATOM 1881 N SER A 122 -21.439 -2.406 -24.691 1.00 0.00 N ATOM 1882 CA SER A 122 -22.465 -1.380 -24.548 1.00 0.00 C ATOM 1883 C SER A 122 -22.641 -0.602 -25.849 1.00 0.00 C ATOM 1884 O SER A 122 -23.746 -0.509 -26.384 1.00 0.00 O ATOM 1885 CB SER A 122 -22.103 -0.421 -23.413 1.00 0.00 C ATOM 1886 OG SER A 122 -20.721 -0.106 -23.432 1.00 0.00 O ATOM 0 H SER A 122 -20.679 -2.340 -24.013 1.00 0.00 H new ATOM 0 HA SER A 122 -23.407 -1.874 -24.310 1.00 0.00 H new ATOM 0 HB2 SER A 122 -22.689 0.494 -23.505 1.00 0.00 H new ATOM 0 HB3 SER A 122 -22.363 -0.872 -22.455 1.00 0.00 H new ATOM 0 HG SER A 122 -20.232 -0.747 -22.875 1.00 0.00 H new ATOM 1892 N GLN A 123 -21.544 -0.046 -26.351 1.00 0.00 N ATOM 1893 CA GLN A 123 -21.576 0.725 -27.589 1.00 0.00 C ATOM 1894 C GLN A 123 -21.625 -0.197 -28.803 1.00 0.00 C ATOM 1895 O GLN A 123 -21.819 0.255 -29.932 1.00 0.00 O ATOM 1896 CB GLN A 123 -20.354 1.639 -27.677 1.00 0.00 C ATOM 1897 CG GLN A 123 -19.440 1.323 -28.850 1.00 0.00 C ATOM 1898 CD GLN A 123 -18.135 2.092 -28.799 1.00 0.00 C ATOM 1899 OE1 GLN A 123 -17.064 1.510 -28.628 1.00 0.00 O ATOM 1900 NE2 GLN A 123 -18.218 3.409 -28.946 1.00 0.00 N ATOM 0 H GLN A 123 -20.622 -0.115 -25.920 1.00 0.00 H new ATOM 0 HA GLN A 123 -22.478 1.337 -27.583 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -20.689 2.673 -27.757 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -19.784 1.559 -26.751 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -19.227 0.254 -28.861 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -19.957 1.555 -29.781 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -19.127 3.850 -29.086 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -17.373 3.979 -28.919 1.00 0.00 H new TER 1909 GLN A 123