USER MOD reduce.3.24.130724 H: found=0, std=0, add=751, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 755 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 62 LYS NZ :NH3+ 172:sc= 0.699 (180deg=0) USER MOD Set 1.2: A 120 ASN : amide:sc= 0.615 K(o=1.3,f=-1.2) USER MOD Set 2.1: A 32 GLN : amide:sc= 0.419 K(o=0.88,f=-0.4) USER MOD Set 2.2: A 123 THR OG1 : rot -72:sc= 0.463 USER MOD Set 3.1: A 29 MET CE :methyl 175:sc= -0.554 (180deg=-0.635) USER MOD Set 3.2: A 112 MET CE :methyl 180:sc= -1.09 (180deg=-1.08) USER MOD Set 4.1: A 9 GLN : amide:sc= 0.656 K(o=1.3,f=-5.3!) USER MOD Set 4.2: A 12 LYS NZ :NH3+ -120:sc= 0.635 (180deg=0) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 3 GLN : amide:sc= 0.0204 K(o=0.02,f=-2.3!) USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 18 LYS NZ :NH3+ -137:sc= -0.275 (180deg=-2.09!) USER MOD Single : A 26 HIS : no HD1:sc= 0 X(o=0,f=-0.00047) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot -115:sc= 0.255 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 ASN : amide:sc= -1.17 K(o=-1.2,f=-5.8!) USER MOD Single : A 64 SER OG : rot 180:sc= -0.332 USER MOD Single : A 65 SER OG : rot 180:sc= -0.833 USER MOD Single : A 71 GLN :FLIP amide:sc= -0.214 F(o=-0.93,f=-0.21) USER MOD Single : A 72 SER OG : rot 84:sc= 0.891 USER MOD Single : A 74 SER OG : rot 54:sc= 0.569 USER MOD Single : A 75 GLN :FLIP amide:sc= -0.0445 F(o=-2.8!,f=-0.045) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 MET CE :methyl 129:sc= -0.921 (180deg=-1.8!) USER MOD Single : A 81 GLN : amide:sc= -0.444 X(o=-0.44,f=0) USER MOD Single : A 83 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 MET CE :methyl -121:sc= -0.371 (180deg=-5.01!) USER MOD Single : A 101 MET CE :methyl 132:sc= 0 (180deg=-1.5) USER MOD Single : A 104 ASN :FLIP amide:sc=-0.00285 F(o=-0.85,f=-0.0029) USER MOD Single : A 109 ASN : amide:sc= -0.0359 K(o=-0.036,f=-0.96) USER MOD Single : A 110 LYS NZ :NH3+ -176:sc= -1.24! (180deg=-1.49!) USER MOD Single : A 111 THR OG1 : rot -52:sc= -0.953 USER MOD Single : A 116 SER OG : rot -2:sc= 0.28 USER MOD Single : A 118 ASN :FLIP amide:sc=-0.00579 F(o=-1.7!,f=-0.0058) USER MOD Single : A 128 THR OG1 : rot -55:sc= 0.743 USER MOD ----------------------------------------------------------------- ATOM 15 N GLN A 2 0.597 -2.393 -0.232 1.00 0.00 N ATOM 16 CA GLN A 2 0.743 -3.817 -0.565 1.00 0.00 C ATOM 17 C GLN A 2 -0.492 -4.280 -1.327 1.00 0.00 C ATOM 18 O GLN A 2 -0.382 -4.775 -2.434 1.00 0.00 O ATOM 19 CB GLN A 2 0.967 -4.678 0.705 1.00 0.00 C ATOM 20 CG GLN A 2 2.306 -4.406 1.422 1.00 0.00 C ATOM 21 CD GLN A 2 2.504 -5.214 2.709 1.00 0.00 C ATOM 22 OE1 GLN A 2 1.993 -6.322 2.848 1.00 0.00 O ATOM 23 NE2 GLN A 2 3.261 -4.674 3.653 1.00 0.00 N ATOM 0 HA GLN A 2 1.625 -3.943 -1.193 1.00 0.00 H new ATOM 0 HB2 GLN A 2 0.150 -4.496 1.403 1.00 0.00 H new ATOM 0 HB3 GLN A 2 0.922 -5.732 0.429 1.00 0.00 H new ATOM 0 HG2 GLN A 2 3.124 -4.629 0.737 1.00 0.00 H new ATOM 0 HG3 GLN A 2 2.369 -3.344 1.659 1.00 0.00 H new ATOM 0 HE21 GLN A 2 3.673 -3.752 3.511 1.00 0.00 H new ATOM 0 HE22 GLN A 2 3.432 -5.181 4.522 1.00 0.00 H new ATOM 32 N GLN A 3 -1.665 -4.015 -0.731 1.00 0.00 N ATOM 33 CA GLN A 3 -2.982 -4.336 -1.317 1.00 0.00 C ATOM 34 C GLN A 3 -3.146 -3.809 -2.760 1.00 0.00 C ATOM 35 O GLN A 3 -3.819 -4.438 -3.566 1.00 0.00 O ATOM 36 CB GLN A 3 -4.153 -3.802 -0.435 1.00 0.00 C ATOM 37 CG GLN A 3 -4.091 -2.302 -0.055 1.00 0.00 C ATOM 38 CD GLN A 3 -3.259 -2.016 1.192 1.00 0.00 C ATOM 39 OE1 GLN A 3 -2.054 -1.838 1.117 1.00 0.00 O ATOM 40 NE2 GLN A 3 -3.901 -2.018 2.348 1.00 0.00 N ATOM 0 H GLN A 3 -1.730 -3.566 0.183 1.00 0.00 H new ATOM 0 HA GLN A 3 -3.024 -5.425 -1.351 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -5.090 -3.984 -0.962 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -4.185 -4.388 0.484 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -3.677 -1.741 -0.893 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -5.105 -1.935 0.104 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -4.909 -2.170 2.371 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -3.388 -1.867 3.217 1.00 0.00 H new ATOM 49 N LEU A 4 -2.510 -2.665 -3.055 1.00 0.00 N ATOM 50 CA LEU A 4 -2.587 -2.002 -4.370 1.00 0.00 C ATOM 51 C LEU A 4 -1.925 -2.855 -5.474 1.00 0.00 C ATOM 52 O LEU A 4 -2.482 -3.010 -6.569 1.00 0.00 O ATOM 53 CB LEU A 4 -1.929 -0.599 -4.278 1.00 0.00 C ATOM 54 CG LEU A 4 -1.998 0.298 -5.552 1.00 0.00 C ATOM 55 CD1 LEU A 4 -3.450 0.482 -6.032 1.00 0.00 C ATOM 56 CD2 LEU A 4 -1.326 1.668 -5.291 1.00 0.00 C ATOM 0 H LEU A 4 -1.923 -2.169 -2.384 1.00 0.00 H new ATOM 0 HA LEU A 4 -3.636 -1.888 -4.644 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -2.398 -0.058 -3.456 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -0.880 -0.733 -4.014 1.00 0.00 H new ATOM 0 HG LEU A 4 -1.450 -0.208 -6.347 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -3.462 1.112 -6.921 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -3.880 -0.491 -6.270 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -4.036 0.955 -5.244 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -1.384 2.279 -6.192 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -1.839 2.175 -4.474 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -0.280 1.515 -5.023 1.00 0.00 H new ATOM 68 N VAL A 5 -0.730 -3.397 -5.181 1.00 0.00 N ATOM 69 CA VAL A 5 0.003 -4.246 -6.144 1.00 0.00 C ATOM 70 C VAL A 5 -0.503 -5.711 -6.097 1.00 0.00 C ATOM 71 O VAL A 5 -0.507 -6.398 -7.117 1.00 0.00 O ATOM 72 CB VAL A 5 1.565 -4.159 -5.933 1.00 0.00 C ATOM 73 CG1 VAL A 5 1.993 -4.686 -4.546 1.00 0.00 C ATOM 74 CG2 VAL A 5 2.334 -4.876 -7.080 1.00 0.00 C ATOM 0 H VAL A 5 -0.251 -3.265 -4.290 1.00 0.00 H new ATOM 0 HA VAL A 5 -0.202 -3.860 -7.142 1.00 0.00 H new ATOM 0 HB VAL A 5 1.834 -3.103 -5.967 1.00 0.00 H new ATOM 0 HG11 VAL A 5 3.075 -4.607 -4.445 1.00 0.00 H new ATOM 0 HG12 VAL A 5 1.512 -4.094 -3.767 1.00 0.00 H new ATOM 0 HG13 VAL A 5 1.694 -5.729 -4.445 1.00 0.00 H new ATOM 0 HG21 VAL A 5 3.407 -4.797 -6.904 1.00 0.00 H new ATOM 0 HG22 VAL A 5 2.047 -5.927 -7.109 1.00 0.00 H new ATOM 0 HG23 VAL A 5 2.087 -4.407 -8.032 1.00 0.00 H new ATOM 84 N GLU A 6 -0.979 -6.162 -4.918 1.00 0.00 N ATOM 85 CA GLU A 6 -1.473 -7.545 -4.725 1.00 0.00 C ATOM 86 C GLU A 6 -2.794 -7.769 -5.464 1.00 0.00 C ATOM 87 O GLU A 6 -3.006 -8.832 -6.042 1.00 0.00 O ATOM 88 CB GLU A 6 -1.641 -7.891 -3.220 1.00 0.00 C ATOM 89 CG GLU A 6 -0.333 -7.877 -2.401 1.00 0.00 C ATOM 90 CD GLU A 6 0.742 -8.838 -2.931 1.00 0.00 C ATOM 91 OE1 GLU A 6 0.762 -10.013 -2.518 1.00 0.00 O ATOM 92 OE2 GLU A 6 1.582 -8.420 -3.763 1.00 0.00 O ATOM 0 H GLU A 6 -1.033 -5.585 -4.079 1.00 0.00 H new ATOM 0 HA GLU A 6 -0.720 -8.212 -5.145 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -2.339 -7.182 -2.775 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -2.094 -8.879 -3.137 1.00 0.00 H new ATOM 0 HG2 GLU A 6 0.070 -6.864 -2.395 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -0.560 -8.136 -1.367 1.00 0.00 H new ATOM 99 N ARG A 7 -3.671 -6.745 -5.452 1.00 0.00 N ATOM 100 CA ARG A 7 -4.960 -6.791 -6.175 1.00 0.00 C ATOM 101 C ARG A 7 -4.708 -6.765 -7.692 1.00 0.00 C ATOM 102 O ARG A 7 -5.421 -7.416 -8.450 1.00 0.00 O ATOM 103 CB ARG A 7 -5.895 -5.620 -5.742 1.00 0.00 C ATOM 104 CG ARG A 7 -5.481 -4.190 -6.245 1.00 0.00 C ATOM 105 CD ARG A 7 -6.461 -3.594 -7.279 1.00 0.00 C ATOM 106 NE ARG A 7 -7.833 -3.541 -6.736 1.00 0.00 N ATOM 107 CZ ARG A 7 -8.962 -3.809 -7.409 1.00 0.00 C ATOM 108 NH1 ARG A 7 -8.944 -4.072 -8.700 1.00 0.00 N ATOM 109 NH2 ARG A 7 -10.119 -3.802 -6.767 1.00 0.00 N ATOM 0 H ARG A 7 -3.510 -5.873 -4.948 1.00 0.00 H new ATOM 0 HA ARG A 7 -5.468 -7.721 -5.919 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -6.902 -5.833 -6.101 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -5.942 -5.602 -4.653 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -5.414 -3.518 -5.390 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -4.486 -4.243 -6.687 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -6.137 -2.591 -7.557 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -6.448 -4.196 -8.187 1.00 0.00 H new ATOM 0 HE ARG A 7 -7.932 -3.275 -5.756 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -8.059 -4.075 -9.208 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -9.815 -4.273 -9.192 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -10.147 -3.594 -5.769 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -10.983 -4.005 -7.270 1.00 0.00 H new ATOM 123 N LEU A 8 -3.645 -6.024 -8.101 1.00 0.00 N ATOM 124 CA LEU A 8 -3.192 -5.937 -9.502 1.00 0.00 C ATOM 125 C LEU A 8 -2.809 -7.352 -9.980 1.00 0.00 C ATOM 126 O LEU A 8 -3.125 -7.738 -11.103 1.00 0.00 O ATOM 127 CB LEU A 8 -1.989 -4.939 -9.588 1.00 0.00 C ATOM 128 CG LEU A 8 -1.515 -4.405 -11.000 1.00 0.00 C ATOM 129 CD1 LEU A 8 -0.495 -3.251 -10.828 1.00 0.00 C ATOM 130 CD2 LEU A 8 -0.901 -5.507 -11.907 1.00 0.00 C ATOM 0 H LEU A 8 -3.079 -5.469 -7.459 1.00 0.00 H new ATOM 0 HA LEU A 8 -3.981 -5.560 -10.152 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -2.242 -4.071 -8.979 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -1.132 -5.420 -9.117 1.00 0.00 H new ATOM 0 HG LEU A 8 -2.414 -4.045 -11.500 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -0.179 -2.895 -11.809 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -0.960 -2.433 -10.278 1.00 0.00 H new ATOM 0 HD13 LEU A 8 0.373 -3.612 -10.276 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -0.599 -5.069 -12.858 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -0.031 -5.941 -11.414 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -1.642 -6.286 -12.086 1.00 0.00 H new ATOM 142 N GLN A 9 -2.144 -8.115 -9.086 1.00 0.00 N ATOM 143 CA GLN A 9 -1.709 -9.494 -9.369 1.00 0.00 C ATOM 144 C GLN A 9 -2.902 -10.472 -9.385 1.00 0.00 C ATOM 145 O GLN A 9 -2.965 -11.371 -10.237 1.00 0.00 O ATOM 146 CB GLN A 9 -0.618 -9.956 -8.372 1.00 0.00 C ATOM 147 CG GLN A 9 0.664 -9.094 -8.390 1.00 0.00 C ATOM 148 CD GLN A 9 1.842 -9.758 -7.683 1.00 0.00 C ATOM 149 OE1 GLN A 9 2.628 -10.464 -8.307 1.00 0.00 O ATOM 150 NE2 GLN A 9 1.959 -9.566 -6.382 1.00 0.00 N ATOM 0 H GLN A 9 -1.896 -7.791 -8.151 1.00 0.00 H new ATOM 0 HA GLN A 9 -1.269 -9.498 -10.366 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -1.035 -9.946 -7.365 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -0.351 -10.989 -8.596 1.00 0.00 H new ATOM 0 HG2 GLN A 9 0.939 -8.885 -9.424 1.00 0.00 H new ATOM 0 HG3 GLN A 9 0.457 -8.135 -7.915 1.00 0.00 H new ATOM 0 HE21 GLN A 9 1.289 -8.973 -5.892 1.00 0.00 H new ATOM 0 HE22 GLN A 9 2.719 -10.010 -5.867 1.00 0.00 H new ATOM 159 N GLU A 10 -3.862 -10.263 -8.466 1.00 0.00 N ATOM 160 CA GLU A 10 -5.116 -11.043 -8.416 1.00 0.00 C ATOM 161 C GLU A 10 -5.969 -10.816 -9.682 1.00 0.00 C ATOM 162 O GLU A 10 -6.808 -11.652 -10.030 1.00 0.00 O ATOM 163 CB GLU A 10 -5.925 -10.700 -7.133 1.00 0.00 C ATOM 164 CG GLU A 10 -5.294 -11.231 -5.827 1.00 0.00 C ATOM 165 CD GLU A 10 -5.136 -12.766 -5.825 1.00 0.00 C ATOM 166 OE1 GLU A 10 -6.172 -13.475 -5.817 1.00 0.00 O ATOM 167 OE2 GLU A 10 -3.991 -13.274 -5.851 1.00 0.00 O ATOM 0 H GLU A 10 -3.793 -9.551 -7.738 1.00 0.00 H new ATOM 0 HA GLU A 10 -4.851 -12.100 -8.382 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -6.027 -9.617 -7.060 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -6.930 -11.109 -7.230 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -4.317 -10.769 -5.686 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -5.913 -10.932 -4.981 1.00 0.00 H new ATOM 174 N GLU A 11 -5.742 -9.680 -10.353 1.00 0.00 N ATOM 175 CA GLU A 11 -6.353 -9.369 -11.646 1.00 0.00 C ATOM 176 C GLU A 11 -5.503 -9.926 -12.812 1.00 0.00 C ATOM 177 O GLU A 11 -6.060 -10.475 -13.748 1.00 0.00 O ATOM 178 CB GLU A 11 -6.522 -7.840 -11.791 1.00 0.00 C ATOM 179 CG GLU A 11 -7.520 -7.190 -10.816 1.00 0.00 C ATOM 180 CD GLU A 11 -7.515 -5.660 -10.931 1.00 0.00 C ATOM 181 OE1 GLU A 11 -6.638 -5.011 -10.318 1.00 0.00 O ATOM 182 OE2 GLU A 11 -8.334 -5.091 -11.680 1.00 0.00 O ATOM 0 H GLU A 11 -5.123 -8.946 -10.008 1.00 0.00 H new ATOM 0 HA GLU A 11 -7.333 -9.845 -11.687 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -5.548 -7.369 -11.655 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -6.841 -7.622 -12.810 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -8.523 -7.566 -11.018 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -7.271 -7.479 -9.795 1.00 0.00 H new ATOM 189 N LYS A 12 -4.155 -9.801 -12.730 1.00 0.00 N ATOM 190 CA LYS A 12 -3.241 -10.103 -13.873 1.00 0.00 C ATOM 191 C LYS A 12 -3.218 -11.602 -14.209 1.00 0.00 C ATOM 192 O LYS A 12 -2.946 -11.979 -15.344 1.00 0.00 O ATOM 193 CB LYS A 12 -1.785 -9.600 -13.599 1.00 0.00 C ATOM 194 CG LYS A 12 -0.914 -10.565 -12.753 1.00 0.00 C ATOM 195 CD LYS A 12 0.507 -10.036 -12.453 1.00 0.00 C ATOM 196 CE LYS A 12 1.319 -11.041 -11.607 1.00 0.00 C ATOM 197 NZ LYS A 12 2.686 -10.556 -11.293 1.00 0.00 N ATOM 0 H LYS A 12 -3.671 -9.493 -11.886 1.00 0.00 H new ATOM 0 HA LYS A 12 -3.639 -9.564 -14.733 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -1.289 -9.428 -14.554 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -1.837 -8.638 -13.089 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -1.423 -10.763 -11.810 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -0.832 -11.517 -13.277 1.00 0.00 H new ATOM 0 HD2 LYS A 12 1.029 -9.842 -13.390 1.00 0.00 H new ATOM 0 HD3 LYS A 12 0.438 -9.086 -11.924 1.00 0.00 H new ATOM 0 HE2 LYS A 12 0.786 -11.240 -10.677 1.00 0.00 H new ATOM 0 HE3 LYS A 12 1.388 -11.988 -12.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 3.387 -11.218 -11.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 2.826 -9.616 -11.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 2.804 -10.494 -10.262 1.00 0.00 H new ATOM 211 N ARG A 13 -3.535 -12.438 -13.205 1.00 0.00 N ATOM 212 CA ARG A 13 -3.455 -13.909 -13.301 1.00 0.00 C ATOM 213 C ARG A 13 -4.412 -14.512 -14.358 1.00 0.00 C ATOM 214 O ARG A 13 -4.298 -15.702 -14.676 1.00 0.00 O ATOM 215 CB ARG A 13 -3.694 -14.527 -11.900 1.00 0.00 C ATOM 216 CG ARG A 13 -5.083 -14.226 -11.290 1.00 0.00 C ATOM 217 CD ARG A 13 -5.163 -14.596 -9.794 1.00 0.00 C ATOM 218 NE ARG A 13 -4.843 -16.013 -9.536 1.00 0.00 N ATOM 219 CZ ARG A 13 -4.363 -16.503 -8.383 1.00 0.00 C ATOM 220 NH1 ARG A 13 -4.032 -15.702 -7.381 1.00 0.00 N ATOM 221 NH2 ARG A 13 -4.203 -17.802 -8.249 1.00 0.00 N ATOM 0 H ARG A 13 -3.857 -12.110 -12.295 1.00 0.00 H new ATOM 0 HA ARG A 13 -2.453 -14.161 -13.648 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -3.569 -15.608 -11.968 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -2.926 -14.159 -11.220 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -5.308 -13.166 -11.412 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -5.845 -14.779 -11.839 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -4.475 -13.965 -9.231 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -6.166 -14.382 -9.425 1.00 0.00 H new ATOM 0 HE ARG A 13 -5.000 -16.674 -10.297 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -4.140 -14.692 -7.478 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -3.669 -16.095 -6.513 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -4.443 -18.427 -9.018 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -3.839 -18.184 -7.376 1.00 0.00 H new ATOM 235 N ILE A 14 -5.352 -13.690 -14.905 1.00 0.00 N ATOM 236 CA ILE A 14 -6.269 -14.134 -15.988 1.00 0.00 C ATOM 237 C ILE A 14 -5.484 -14.501 -17.269 1.00 0.00 C ATOM 238 O ILE A 14 -5.952 -15.310 -18.070 1.00 0.00 O ATOM 239 CB ILE A 14 -7.412 -13.085 -16.334 1.00 0.00 C ATOM 240 CG1 ILE A 14 -6.952 -11.931 -17.305 1.00 0.00 C ATOM 241 CG2 ILE A 14 -8.050 -12.516 -15.046 1.00 0.00 C ATOM 242 CD1 ILE A 14 -5.804 -11.058 -16.838 1.00 0.00 C ATOM 0 H ILE A 14 -5.492 -12.723 -14.614 1.00 0.00 H new ATOM 0 HA ILE A 14 -6.767 -15.021 -15.597 1.00 0.00 H new ATOM 0 HB ILE A 14 -8.170 -13.642 -16.885 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -6.670 -12.381 -18.257 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -7.811 -11.288 -17.498 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -8.829 -11.801 -15.311 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -8.486 -13.329 -14.466 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -7.285 -12.016 -14.451 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -5.587 -10.306 -17.596 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -6.078 -10.565 -15.905 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -4.920 -11.675 -16.676 1.00 0.00 H new ATOM 254 N GLU A 15 -4.272 -13.901 -17.418 1.00 0.00 N ATOM 255 CA GLU A 15 -3.394 -14.072 -18.590 1.00 0.00 C ATOM 256 C GLU A 15 -2.963 -15.536 -18.780 1.00 0.00 C ATOM 257 O GLU A 15 -2.600 -15.939 -19.887 1.00 0.00 O ATOM 258 CB GLU A 15 -2.137 -13.169 -18.464 1.00 0.00 C ATOM 259 CG GLU A 15 -1.143 -13.589 -17.358 1.00 0.00 C ATOM 260 CD GLU A 15 0.099 -12.690 -17.296 1.00 0.00 C ATOM 261 OE1 GLU A 15 1.047 -12.911 -18.089 1.00 0.00 O ATOM 262 OE2 GLU A 15 0.132 -11.750 -16.469 1.00 0.00 O ATOM 0 H GLU A 15 -3.879 -13.278 -16.713 1.00 0.00 H new ATOM 0 HA GLU A 15 -3.970 -13.776 -19.467 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -1.614 -13.164 -19.420 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -2.460 -12.146 -18.272 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -1.650 -13.566 -16.393 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -0.831 -14.619 -17.530 1.00 0.00 H new ATOM 269 N ALA A 16 -3.028 -16.328 -17.688 1.00 0.00 N ATOM 270 CA ALA A 16 -2.693 -17.764 -17.705 1.00 0.00 C ATOM 271 C ALA A 16 -3.541 -18.542 -18.737 1.00 0.00 C ATOM 272 O ALA A 16 -3.122 -19.601 -19.205 1.00 0.00 O ATOM 273 CB ALA A 16 -2.849 -18.354 -16.292 1.00 0.00 C ATOM 0 H ALA A 16 -3.315 -15.987 -16.770 1.00 0.00 H new ATOM 0 HA ALA A 16 -1.653 -17.867 -18.015 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -2.600 -19.415 -16.311 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -2.179 -17.836 -15.606 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -3.879 -18.229 -15.957 1.00 0.00 H new ATOM 279 N GLN A 17 -4.715 -17.982 -19.112 1.00 0.00 N ATOM 280 CA GLN A 17 -5.592 -18.564 -20.151 1.00 0.00 C ATOM 281 C GLN A 17 -5.931 -17.518 -21.247 1.00 0.00 C ATOM 282 O GLN A 17 -5.910 -17.833 -22.438 1.00 0.00 O ATOM 283 CB GLN A 17 -6.887 -19.116 -19.491 1.00 0.00 C ATOM 284 CG GLN A 17 -7.738 -20.019 -20.409 1.00 0.00 C ATOM 285 CD GLN A 17 -9.006 -20.568 -19.750 1.00 0.00 C ATOM 286 OE1 GLN A 17 -9.602 -19.930 -18.882 1.00 0.00 O ATOM 287 NE2 GLN A 17 -9.423 -21.759 -20.159 1.00 0.00 N ATOM 0 H GLN A 17 -5.078 -17.120 -18.705 1.00 0.00 H new ATOM 0 HA GLN A 17 -5.064 -19.385 -20.636 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -6.613 -19.681 -18.600 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -7.498 -18.276 -19.161 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -8.020 -19.453 -21.297 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -7.126 -20.856 -20.746 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -8.905 -22.261 -20.881 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -10.262 -22.173 -19.752 1.00 0.00 H new ATOM 296 N LYS A 18 -6.219 -16.267 -20.827 1.00 0.00 N ATOM 297 CA LYS A 18 -6.731 -15.186 -21.723 1.00 0.00 C ATOM 298 C LYS A 18 -5.650 -14.637 -22.681 1.00 0.00 C ATOM 299 O LYS A 18 -5.970 -14.201 -23.798 1.00 0.00 O ATOM 300 CB LYS A 18 -7.352 -14.044 -20.869 1.00 0.00 C ATOM 301 CG LYS A 18 -7.976 -12.857 -21.657 1.00 0.00 C ATOM 302 CD LYS A 18 -9.142 -13.245 -22.620 1.00 0.00 C ATOM 303 CE LYS A 18 -10.442 -13.707 -21.916 1.00 0.00 C ATOM 304 NZ LYS A 18 -10.352 -15.075 -21.330 1.00 0.00 N ATOM 0 H LYS A 18 -6.106 -15.969 -19.858 1.00 0.00 H new ATOM 0 HA LYS A 18 -7.502 -15.625 -22.357 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -8.124 -14.475 -20.231 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -6.578 -13.649 -20.211 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -8.344 -12.120 -20.943 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -7.191 -12.373 -22.238 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -9.373 -12.387 -23.252 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -8.800 -14.043 -23.279 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -10.688 -12.998 -21.125 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -11.262 -13.682 -22.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -11.226 -15.599 -21.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -9.541 -15.577 -21.744 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -10.226 -15.004 -20.300 1.00 0.00 H new ATOM 445 N HIS A 26 -11.484 -11.187 -32.296 1.00 0.00 N ATOM 446 CA HIS A 26 -12.774 -10.850 -31.625 1.00 0.00 C ATOM 447 C HIS A 26 -12.613 -10.192 -30.213 1.00 0.00 C ATOM 448 O HIS A 26 -13.610 -9.919 -29.545 1.00 0.00 O ATOM 449 CB HIS A 26 -13.654 -12.122 -31.518 1.00 0.00 C ATOM 450 CG HIS A 26 -13.128 -13.164 -30.561 1.00 0.00 C ATOM 451 ND1 HIS A 26 -13.578 -13.291 -29.266 1.00 0.00 N ATOM 452 CD2 HIS A 26 -12.182 -14.118 -30.713 1.00 0.00 C ATOM 453 CE1 HIS A 26 -12.930 -14.264 -28.668 1.00 0.00 C ATOM 454 NE2 HIS A 26 -12.083 -14.786 -29.522 1.00 0.00 N ATOM 0 HA HIS A 26 -13.254 -10.098 -32.251 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -14.656 -11.831 -31.204 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -13.747 -12.569 -32.508 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -11.611 -14.316 -31.608 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -13.071 -14.581 -27.645 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -11.452 -15.564 -29.330 1.00 0.00 H new ATOM 463 N LEU A 27 -11.360 -9.922 -29.788 1.00 0.00 N ATOM 464 CA LEU A 27 -11.038 -9.271 -28.502 1.00 0.00 C ATOM 465 C LEU A 27 -11.342 -7.741 -28.514 1.00 0.00 C ATOM 466 O LEU A 27 -11.042 -7.066 -27.540 1.00 0.00 O ATOM 467 CB LEU A 27 -9.533 -9.515 -28.141 1.00 0.00 C ATOM 468 CG LEU A 27 -9.043 -11.008 -27.993 1.00 0.00 C ATOM 469 CD1 LEU A 27 -10.000 -11.873 -27.140 1.00 0.00 C ATOM 470 CD2 LEU A 27 -8.754 -11.664 -29.359 1.00 0.00 C ATOM 0 H LEU A 27 -10.533 -10.154 -30.337 1.00 0.00 H new ATOM 0 HA LEU A 27 -11.679 -9.721 -27.744 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.923 -9.037 -28.908 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -9.326 -9.000 -27.203 1.00 0.00 H new ATOM 0 HG LEU A 27 -8.100 -10.959 -27.449 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -9.611 -12.889 -27.074 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -10.079 -11.449 -26.139 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -10.986 -11.892 -27.605 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -8.420 -12.690 -29.206 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -9.662 -11.664 -29.962 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -7.976 -11.102 -29.875 1.00 0.00 H new ATOM 482 N TYR A 28 -11.952 -7.242 -29.612 1.00 0.00 N ATOM 483 CA TYR A 28 -12.364 -5.825 -29.859 1.00 0.00 C ATOM 484 C TYR A 28 -13.416 -5.225 -28.879 1.00 0.00 C ATOM 485 O TYR A 28 -14.128 -4.319 -29.303 1.00 0.00 O ATOM 486 CB TYR A 28 -12.845 -5.622 -31.326 1.00 0.00 C ATOM 487 CG TYR A 28 -11.725 -5.476 -32.364 1.00 0.00 C ATOM 488 CD1 TYR A 28 -10.915 -4.336 -32.383 1.00 0.00 C ATOM 489 CD2 TYR A 28 -11.495 -6.443 -33.336 1.00 0.00 C ATOM 490 CE1 TYR A 28 -9.923 -4.179 -33.331 1.00 0.00 C ATOM 491 CE2 TYR A 28 -10.502 -6.295 -34.279 1.00 0.00 C ATOM 492 CZ TYR A 28 -9.718 -5.165 -34.276 1.00 0.00 C ATOM 493 OH TYR A 28 -8.730 -5.018 -35.230 1.00 0.00 O ATOM 0 H TYR A 28 -12.188 -7.845 -30.400 1.00 0.00 H new ATOM 0 HA TYR A 28 -11.447 -5.267 -29.668 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -13.471 -6.469 -31.607 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -13.474 -4.733 -31.366 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -11.068 -3.564 -31.643 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -12.109 -7.331 -33.352 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -9.311 -3.289 -33.333 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -10.339 -7.065 -35.019 1.00 0.00 H new ATOM 0 HH TYR A 28 -8.721 -5.804 -35.815 1.00 0.00 H new ATOM 503 N MET A 29 -13.542 -5.747 -27.629 1.00 0.00 N ATOM 504 CA MET A 29 -14.622 -5.388 -26.653 1.00 0.00 C ATOM 505 C MET A 29 -15.044 -3.898 -26.731 1.00 0.00 C ATOM 506 O MET A 29 -14.206 -2.993 -26.642 1.00 0.00 O ATOM 507 CB MET A 29 -14.186 -5.711 -25.189 1.00 0.00 C ATOM 508 CG MET A 29 -12.860 -5.066 -24.732 1.00 0.00 C ATOM 509 SD MET A 29 -12.698 -4.972 -22.934 1.00 0.00 S ATOM 510 CE MET A 29 -13.871 -3.666 -22.551 1.00 0.00 C ATOM 0 H MET A 29 -12.890 -6.439 -27.260 1.00 0.00 H new ATOM 0 HA MET A 29 -15.482 -5.996 -26.932 1.00 0.00 H new ATOM 0 HB2 MET A 29 -14.978 -5.389 -24.513 1.00 0.00 H new ATOM 0 HB3 MET A 29 -14.098 -6.792 -25.085 1.00 0.00 H new ATOM 0 HG2 MET A 29 -12.026 -5.640 -25.136 1.00 0.00 H new ATOM 0 HG3 MET A 29 -12.789 -4.062 -25.150 1.00 0.00 H new ATOM 0 HE1 MET A 29 -13.950 -3.553 -21.470 1.00 0.00 H new ATOM 0 HE2 MET A 29 -13.528 -2.729 -22.989 1.00 0.00 H new ATOM 0 HE3 MET A 29 -14.848 -3.922 -22.961 1.00 0.00 H new ATOM 520 N GLN A 30 -16.345 -3.667 -26.912 1.00 0.00 N ATOM 521 CA GLN A 30 -16.885 -2.322 -27.129 1.00 0.00 C ATOM 522 C GLN A 30 -17.117 -1.674 -25.779 1.00 0.00 C ATOM 523 O GLN A 30 -17.996 -2.068 -25.040 1.00 0.00 O ATOM 524 CB GLN A 30 -18.202 -2.419 -27.955 1.00 0.00 C ATOM 525 CG GLN A 30 -17.950 -2.648 -29.458 1.00 0.00 C ATOM 526 CD GLN A 30 -19.199 -2.964 -30.283 1.00 0.00 C ATOM 527 OE1 GLN A 30 -20.305 -2.542 -29.952 1.00 0.00 O ATOM 528 NE2 GLN A 30 -19.024 -3.676 -31.390 1.00 0.00 N ATOM 0 H GLN A 30 -17.052 -4.402 -26.913 1.00 0.00 H new ATOM 0 HA GLN A 30 -16.184 -1.708 -27.695 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -18.811 -3.235 -27.565 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -18.776 -1.502 -27.823 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -17.476 -1.758 -29.871 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -17.241 -3.468 -29.571 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -18.094 -4.012 -31.638 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -19.820 -3.886 -31.992 1.00 0.00 H new ATOM 537 N VAL A 31 -16.289 -0.694 -25.448 1.00 0.00 N ATOM 538 CA VAL A 31 -16.370 -0.002 -24.174 1.00 0.00 C ATOM 539 C VAL A 31 -17.265 1.250 -24.340 1.00 0.00 C ATOM 540 O VAL A 31 -17.037 2.105 -25.207 1.00 0.00 O ATOM 541 CB VAL A 31 -14.928 0.308 -23.618 1.00 0.00 C ATOM 542 CG1 VAL A 31 -14.174 1.351 -24.456 1.00 0.00 C ATOM 543 CG2 VAL A 31 -14.959 0.666 -22.112 1.00 0.00 C ATOM 0 H VAL A 31 -15.543 -0.358 -26.056 1.00 0.00 H new ATOM 0 HA VAL A 31 -16.839 -0.634 -23.419 1.00 0.00 H new ATOM 0 HB VAL A 31 -14.355 -0.614 -23.714 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -13.188 1.522 -24.023 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -14.064 0.986 -25.477 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -14.734 2.286 -24.463 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -13.946 0.873 -21.766 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -15.581 1.548 -21.960 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -15.371 -0.170 -21.548 1.00 0.00 H new ATOM 553 N GLN A 32 -18.346 1.261 -23.560 1.00 0.00 N ATOM 554 CA GLN A 32 -19.344 2.327 -23.519 1.00 0.00 C ATOM 555 C GLN A 32 -18.846 3.452 -22.625 1.00 0.00 C ATOM 556 O GLN A 32 -18.732 3.278 -21.416 1.00 0.00 O ATOM 557 CB GLN A 32 -20.697 1.748 -22.991 1.00 0.00 C ATOM 558 CG GLN A 32 -21.672 1.343 -24.096 1.00 0.00 C ATOM 559 CD GLN A 32 -22.964 0.703 -23.588 1.00 0.00 C ATOM 560 OE1 GLN A 32 -23.444 1.025 -22.499 1.00 0.00 O ATOM 561 NE2 GLN A 32 -23.539 -0.194 -24.373 1.00 0.00 N ATOM 0 H GLN A 32 -18.557 0.499 -22.916 1.00 0.00 H new ATOM 0 HA GLN A 32 -19.506 2.729 -24.519 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -20.490 0.879 -22.367 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -21.175 2.492 -22.353 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -21.924 2.225 -24.684 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -21.173 0.644 -24.767 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -23.113 -0.436 -25.268 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -24.408 -0.643 -24.083 1.00 0.00 H new ATOM 570 N ILE A 33 -18.519 4.599 -23.231 1.00 0.00 N ATOM 571 CA ILE A 33 -17.980 5.758 -22.504 1.00 0.00 C ATOM 572 C ILE A 33 -18.957 6.931 -22.605 1.00 0.00 C ATOM 573 O ILE A 33 -19.556 7.157 -23.656 1.00 0.00 O ATOM 574 CB ILE A 33 -16.571 6.205 -23.068 1.00 0.00 C ATOM 575 CG1 ILE A 33 -15.650 4.976 -23.320 1.00 0.00 C ATOM 576 CG2 ILE A 33 -15.880 7.224 -22.115 1.00 0.00 C ATOM 577 CD1 ILE A 33 -15.381 4.151 -22.087 1.00 0.00 C ATOM 0 H ILE A 33 -18.619 4.752 -24.235 1.00 0.00 H new ATOM 0 HA ILE A 33 -17.850 5.462 -21.463 1.00 0.00 H new ATOM 0 HB ILE A 33 -16.743 6.700 -24.024 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -16.108 4.340 -24.078 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -14.700 5.323 -23.727 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -14.914 7.512 -22.529 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -16.509 8.108 -22.010 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -15.733 6.766 -21.137 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -14.732 3.314 -22.344 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -14.893 4.770 -21.334 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -16.323 3.772 -21.690 1.00 0.00 H new ATOM 589 N VAL A 34 -19.127 7.652 -21.494 1.00 0.00 N ATOM 590 CA VAL A 34 -19.820 8.951 -21.464 1.00 0.00 C ATOM 591 C VAL A 34 -18.972 9.956 -20.674 1.00 0.00 C ATOM 592 O VAL A 34 -18.395 9.616 -19.636 1.00 0.00 O ATOM 593 CB VAL A 34 -21.278 8.872 -20.849 1.00 0.00 C ATOM 594 CG1 VAL A 34 -22.305 8.384 -21.902 1.00 0.00 C ATOM 595 CG2 VAL A 34 -21.303 7.969 -19.585 1.00 0.00 C ATOM 0 H VAL A 34 -18.786 7.352 -20.581 1.00 0.00 H new ATOM 0 HA VAL A 34 -19.941 9.275 -22.498 1.00 0.00 H new ATOM 0 HB VAL A 34 -21.565 9.879 -20.547 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -23.296 8.340 -21.450 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -22.320 9.076 -22.744 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -22.022 7.392 -22.254 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -22.316 7.933 -19.184 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -20.982 6.962 -19.851 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -20.629 8.378 -18.832 1.00 0.00 H new ATOM 605 N ALA A 35 -18.889 11.185 -21.199 1.00 0.00 N ATOM 606 CA ALA A 35 -18.239 12.318 -20.531 1.00 0.00 C ATOM 607 C ALA A 35 -19.106 13.560 -20.749 1.00 0.00 C ATOM 608 O ALA A 35 -18.996 14.237 -21.784 1.00 0.00 O ATOM 609 CB ALA A 35 -16.807 12.534 -21.052 1.00 0.00 C ATOM 0 H ALA A 35 -19.277 11.423 -22.112 1.00 0.00 H new ATOM 0 HA ALA A 35 -18.149 12.113 -19.464 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -16.356 13.381 -20.535 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -16.214 11.638 -20.867 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -16.836 12.736 -22.123 1.00 0.00 H new ATOM 883 N LYS A 54 -23.933 10.680 -26.135 1.00 0.00 N ATOM 884 CA LYS A 54 -24.362 9.436 -25.500 1.00 0.00 C ATOM 885 C LYS A 54 -23.190 8.441 -25.477 1.00 0.00 C ATOM 886 O LYS A 54 -22.037 8.819 -25.752 1.00 0.00 O ATOM 887 CB LYS A 54 -25.603 8.847 -26.257 1.00 0.00 C ATOM 888 CG LYS A 54 -26.864 9.759 -26.275 1.00 0.00 C ATOM 889 CD LYS A 54 -26.740 10.958 -27.251 1.00 0.00 C ATOM 890 CE LYS A 54 -27.858 11.994 -27.083 1.00 0.00 C ATOM 891 NZ LYS A 54 -27.674 13.156 -27.988 1.00 0.00 N ATOM 0 HA LYS A 54 -24.664 9.631 -24.471 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -25.313 8.635 -27.286 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -25.870 7.895 -25.798 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -27.732 9.161 -26.553 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -27.046 10.136 -25.269 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -25.777 11.445 -27.097 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -26.749 10.586 -28.276 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -28.821 11.525 -27.285 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -27.882 12.339 -26.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -28.450 13.834 -27.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -26.766 13.619 -27.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -27.677 12.831 -28.976 1.00 0.00 H new ATOM 905 N TYR A 55 -23.491 7.177 -25.128 1.00 0.00 N ATOM 906 CA TYR A 55 -22.493 6.107 -25.023 1.00 0.00 C ATOM 907 C TYR A 55 -21.718 5.894 -26.332 1.00 0.00 C ATOM 908 O TYR A 55 -22.216 5.277 -27.282 1.00 0.00 O ATOM 909 CB TYR A 55 -23.157 4.794 -24.533 1.00 0.00 C ATOM 910 CG TYR A 55 -23.314 4.768 -23.016 1.00 0.00 C ATOM 911 CD1 TYR A 55 -22.176 4.795 -22.222 1.00 0.00 C ATOM 912 CD2 TYR A 55 -24.553 4.747 -22.379 1.00 0.00 C ATOM 913 CE1 TYR A 55 -22.254 4.805 -20.865 1.00 0.00 C ATOM 914 CE2 TYR A 55 -24.640 4.754 -21.005 1.00 0.00 C ATOM 915 CZ TYR A 55 -23.489 4.786 -20.252 1.00 0.00 C ATOM 916 OH TYR A 55 -23.575 4.802 -18.881 1.00 0.00 O ATOM 0 H TYR A 55 -24.440 6.872 -24.911 1.00 0.00 H new ATOM 0 HA TYR A 55 -21.757 6.419 -24.282 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -24.135 4.685 -25.001 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -22.555 3.942 -24.850 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -21.205 4.808 -22.694 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -25.456 4.725 -22.970 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -21.353 4.828 -20.270 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -25.605 4.734 -20.521 1.00 0.00 H new ATOM 0 HH TYR A 55 -24.517 4.786 -18.612 1.00 0.00 H new ATOM 926 N THR A 56 -20.511 6.476 -26.364 1.00 0.00 N ATOM 927 CA THR A 56 -19.579 6.345 -27.470 1.00 0.00 C ATOM 928 C THR A 56 -18.901 4.956 -27.407 1.00 0.00 C ATOM 929 O THR A 56 -18.367 4.540 -26.367 1.00 0.00 O ATOM 930 CB THR A 56 -18.544 7.527 -27.478 1.00 0.00 C ATOM 931 OG1 THR A 56 -17.770 7.515 -28.691 1.00 0.00 O ATOM 932 CG2 THR A 56 -17.601 7.517 -26.274 1.00 0.00 C ATOM 0 H THR A 56 -20.158 7.059 -25.605 1.00 0.00 H new ATOM 0 HA THR A 56 -20.119 6.411 -28.415 1.00 0.00 H new ATOM 0 HB THR A 56 -19.135 8.441 -27.418 1.00 0.00 H new ATOM 0 HG1 THR A 56 -16.830 7.337 -28.478 1.00 0.00 H new ATOM 0 HG21 THR A 56 -16.913 8.360 -26.343 1.00 0.00 H new ATOM 0 HG22 THR A 56 -18.183 7.598 -25.356 1.00 0.00 H new ATOM 0 HG23 THR A 56 -17.034 6.586 -26.264 1.00 0.00 H new ATOM 940 N VAL A 57 -19.007 4.233 -28.519 1.00 0.00 N ATOM 941 CA VAL A 57 -18.556 2.843 -28.657 1.00 0.00 C ATOM 942 C VAL A 57 -17.118 2.815 -29.198 1.00 0.00 C ATOM 943 O VAL A 57 -16.879 3.152 -30.371 1.00 0.00 O ATOM 944 CB VAL A 57 -19.545 2.071 -29.613 1.00 0.00 C ATOM 945 CG1 VAL A 57 -19.015 0.677 -30.000 1.00 0.00 C ATOM 946 CG2 VAL A 57 -20.953 1.970 -28.970 1.00 0.00 C ATOM 0 H VAL A 57 -19.420 4.604 -29.375 1.00 0.00 H new ATOM 0 HA VAL A 57 -18.558 2.349 -27.685 1.00 0.00 H new ATOM 0 HB VAL A 57 -19.621 2.647 -30.535 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -19.731 0.185 -30.659 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -18.060 0.781 -30.515 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -18.878 0.077 -29.100 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -21.623 1.435 -29.643 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -20.883 1.433 -28.024 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -21.344 2.972 -28.791 1.00 0.00 H new ATOM 956 N PHE A 58 -16.162 2.457 -28.323 1.00 0.00 N ATOM 957 CA PHE A 58 -14.756 2.261 -28.707 1.00 0.00 C ATOM 958 C PHE A 58 -14.437 0.762 -28.666 1.00 0.00 C ATOM 959 O PHE A 58 -14.349 0.169 -27.586 1.00 0.00 O ATOM 960 CB PHE A 58 -13.790 3.055 -27.773 1.00 0.00 C ATOM 961 CG PHE A 58 -13.982 4.574 -27.772 1.00 0.00 C ATOM 962 CD1 PHE A 58 -14.276 5.265 -28.949 1.00 0.00 C ATOM 963 CD2 PHE A 58 -13.868 5.312 -26.592 1.00 0.00 C ATOM 964 CE1 PHE A 58 -14.450 6.633 -28.945 1.00 0.00 C ATOM 965 CE2 PHE A 58 -14.043 6.681 -26.590 1.00 0.00 C ATOM 966 CZ PHE A 58 -14.333 7.340 -27.766 1.00 0.00 C ATOM 0 H PHE A 58 -16.343 2.296 -27.332 1.00 0.00 H new ATOM 0 HA PHE A 58 -14.609 2.644 -29.717 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -13.914 2.689 -26.754 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -12.764 2.835 -28.068 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -14.369 4.720 -29.877 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -13.639 4.804 -25.667 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -14.678 7.151 -29.865 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -13.953 7.236 -25.668 1.00 0.00 H new ATOM 0 HZ PHE A 58 -14.469 8.411 -27.764 1.00 0.00 H new ATOM 976 N LYS A 59 -14.306 0.146 -29.851 1.00 0.00 N ATOM 977 CA LYS A 59 -13.905 -1.262 -29.966 1.00 0.00 C ATOM 978 C LYS A 59 -12.393 -1.363 -29.687 1.00 0.00 C ATOM 979 O LYS A 59 -11.560 -0.833 -30.437 1.00 0.00 O ATOM 980 CB LYS A 59 -14.312 -1.894 -31.345 1.00 0.00 C ATOM 981 CG LYS A 59 -13.509 -1.477 -32.609 1.00 0.00 C ATOM 982 CD LYS A 59 -13.685 0.000 -33.014 1.00 0.00 C ATOM 983 CE LYS A 59 -15.141 0.346 -33.338 1.00 0.00 C ATOM 984 NZ LYS A 59 -15.280 1.690 -33.953 1.00 0.00 N ATOM 0 H LYS A 59 -14.473 0.605 -30.746 1.00 0.00 H new ATOM 0 HA LYS A 59 -14.444 -1.851 -29.224 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -14.242 -2.977 -31.248 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -15.361 -1.657 -31.523 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -12.451 -1.670 -32.433 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -13.813 -2.109 -33.443 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -13.333 0.640 -32.205 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -13.062 0.213 -33.883 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -15.548 -0.405 -34.016 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -15.733 0.305 -32.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -16.283 1.878 -34.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -14.917 2.411 -33.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -14.737 1.724 -34.840 1.00 0.00 H new ATOM 998 N VAL A 60 -12.041 -1.975 -28.553 1.00 0.00 N ATOM 999 CA VAL A 60 -10.656 -2.028 -28.066 1.00 0.00 C ATOM 1000 C VAL A 60 -10.285 -3.455 -27.662 1.00 0.00 C ATOM 1001 O VAL A 60 -11.132 -4.231 -27.203 1.00 0.00 O ATOM 1002 CB VAL A 60 -10.438 -1.033 -26.854 1.00 0.00 C ATOM 1003 CG1 VAL A 60 -10.402 0.447 -27.327 1.00 0.00 C ATOM 1004 CG2 VAL A 60 -11.534 -1.232 -25.774 1.00 0.00 C ATOM 0 H VAL A 60 -12.708 -2.449 -27.944 1.00 0.00 H new ATOM 0 HA VAL A 60 -10.001 -1.715 -28.879 1.00 0.00 H new ATOM 0 HB VAL A 60 -9.469 -1.264 -26.413 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -10.251 1.100 -26.468 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -9.584 0.583 -28.034 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -11.346 0.697 -27.811 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -11.364 -0.538 -24.951 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -12.514 -1.043 -26.211 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -11.495 -2.255 -25.400 1.00 0.00 H new ATOM 1014 N LEU A 61 -9.002 -3.792 -27.844 1.00 0.00 N ATOM 1015 CA LEU A 61 -8.480 -5.127 -27.561 1.00 0.00 C ATOM 1016 C LEU A 61 -8.304 -5.298 -26.037 1.00 0.00 C ATOM 1017 O LEU A 61 -7.531 -4.574 -25.404 1.00 0.00 O ATOM 1018 CB LEU A 61 -7.153 -5.381 -28.342 1.00 0.00 C ATOM 1019 CG LEU A 61 -7.252 -5.470 -29.912 1.00 0.00 C ATOM 1020 CD1 LEU A 61 -8.283 -6.529 -30.361 1.00 0.00 C ATOM 1021 CD2 LEU A 61 -7.521 -4.095 -30.565 1.00 0.00 C ATOM 0 H LEU A 61 -8.298 -3.142 -28.193 1.00 0.00 H new ATOM 0 HA LEU A 61 -9.192 -5.878 -27.905 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -6.455 -4.583 -28.091 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -6.718 -6.311 -27.977 1.00 0.00 H new ATOM 0 HG LEU A 61 -6.275 -5.797 -30.268 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -8.322 -6.560 -31.450 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -7.989 -7.507 -29.980 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -9.266 -6.268 -29.970 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -7.580 -4.211 -31.647 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -8.463 -3.693 -30.191 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -6.710 -3.410 -30.318 1.00 0.00 H new ATOM 1033 N LYS A 62 -9.082 -6.234 -25.464 1.00 0.00 N ATOM 1034 CA LYS A 62 -9.051 -6.579 -24.028 1.00 0.00 C ATOM 1035 C LYS A 62 -7.687 -7.171 -23.610 1.00 0.00 C ATOM 1036 O LYS A 62 -7.293 -7.077 -22.444 1.00 0.00 O ATOM 1037 CB LYS A 62 -10.211 -7.566 -23.714 1.00 0.00 C ATOM 1038 CG LYS A 62 -10.223 -8.851 -24.583 1.00 0.00 C ATOM 1039 CD LYS A 62 -11.438 -9.781 -24.324 1.00 0.00 C ATOM 1040 CE LYS A 62 -12.800 -9.084 -24.532 1.00 0.00 C ATOM 1041 NZ LYS A 62 -13.942 -9.986 -24.237 1.00 0.00 N ATOM 0 H LYS A 62 -9.761 -6.781 -25.993 1.00 0.00 H new ATOM 0 HA LYS A 62 -9.186 -5.667 -23.447 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -10.150 -7.854 -22.665 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -11.159 -7.045 -23.847 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -10.216 -8.565 -25.635 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -9.306 -9.410 -24.398 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -11.374 -10.643 -24.988 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -11.385 -10.160 -23.304 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -12.858 -8.205 -23.890 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -12.873 -8.733 -25.561 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -14.828 -9.442 -24.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -13.982 -10.741 -24.952 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -13.817 -10.408 -23.295 1.00 0.00 H new ATOM 1055 N ASN A 63 -6.977 -7.764 -24.591 1.00 0.00 N ATOM 1056 CA ASN A 63 -5.625 -8.333 -24.394 1.00 0.00 C ATOM 1057 C ASN A 63 -4.538 -7.225 -24.362 1.00 0.00 C ATOM 1058 O ASN A 63 -3.394 -7.487 -23.984 1.00 0.00 O ATOM 1059 CB ASN A 63 -5.320 -9.405 -25.491 1.00 0.00 C ATOM 1060 CG ASN A 63 -5.402 -8.899 -26.952 1.00 0.00 C ATOM 1061 OD1 ASN A 63 -5.154 -7.734 -27.251 1.00 0.00 O ATOM 1062 ND2 ASN A 63 -5.749 -9.788 -27.877 1.00 0.00 N ATOM 0 H ASN A 63 -7.324 -7.863 -25.545 1.00 0.00 H new ATOM 0 HA ASN A 63 -5.603 -8.826 -23.422 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -4.321 -9.804 -25.318 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -6.019 -10.233 -25.371 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -5.813 -9.507 -28.855 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -5.951 -10.751 -27.608 1.00 0.00 H new ATOM 1069 N SER A 64 -4.914 -6.002 -24.781 1.00 0.00 N ATOM 1070 CA SER A 64 -4.033 -4.821 -24.768 1.00 0.00 C ATOM 1071 C SER A 64 -4.209 -4.046 -23.443 1.00 0.00 C ATOM 1072 O SER A 64 -5.215 -4.227 -22.734 1.00 0.00 O ATOM 1073 CB SER A 64 -4.366 -3.921 -25.983 1.00 0.00 C ATOM 1074 OG SER A 64 -3.487 -2.816 -26.075 1.00 0.00 O ATOM 0 H SER A 64 -5.848 -5.805 -25.142 1.00 0.00 H new ATOM 0 HA SER A 64 -2.992 -5.137 -24.840 1.00 0.00 H new ATOM 0 HB2 SER A 64 -4.307 -4.510 -26.898 1.00 0.00 H new ATOM 0 HB3 SER A 64 -5.392 -3.563 -25.900 1.00 0.00 H new ATOM 0 HG SER A 64 -3.726 -2.272 -26.854 1.00 0.00 H new ATOM 1080 N SER A 65 -3.230 -3.171 -23.128 1.00 0.00 N ATOM 1081 CA SER A 65 -3.186 -2.434 -21.856 1.00 0.00 C ATOM 1082 C SER A 65 -4.182 -1.260 -21.855 1.00 0.00 C ATOM 1083 O SER A 65 -4.596 -0.765 -22.914 1.00 0.00 O ATOM 1084 CB SER A 65 -1.748 -1.930 -21.560 1.00 0.00 C ATOM 1085 OG SER A 65 -1.308 -0.980 -22.517 1.00 0.00 O ATOM 0 H SER A 65 -2.451 -2.959 -23.751 1.00 0.00 H new ATOM 0 HA SER A 65 -3.479 -3.123 -21.064 1.00 0.00 H new ATOM 0 HB2 SER A 65 -1.718 -1.483 -20.566 1.00 0.00 H new ATOM 0 HB3 SER A 65 -1.062 -2.777 -21.549 1.00 0.00 H new ATOM 0 HG SER A 65 -0.400 -0.687 -22.294 1.00 0.00 H new ATOM 1091 N LEU A 66 -4.536 -0.821 -20.640 1.00 0.00 N ATOM 1092 CA LEU A 66 -5.482 0.282 -20.408 1.00 0.00 C ATOM 1093 C LEU A 66 -4.847 1.621 -20.850 1.00 0.00 C ATOM 1094 O LEU A 66 -5.560 2.538 -21.236 1.00 0.00 O ATOM 1095 CB LEU A 66 -5.884 0.293 -18.899 1.00 0.00 C ATOM 1096 CG LEU A 66 -7.232 0.982 -18.478 1.00 0.00 C ATOM 1097 CD1 LEU A 66 -7.130 2.507 -18.408 1.00 0.00 C ATOM 1098 CD2 LEU A 66 -8.392 0.538 -19.385 1.00 0.00 C ATOM 0 H LEU A 66 -4.170 -1.226 -19.779 1.00 0.00 H new ATOM 0 HA LEU A 66 -6.386 0.142 -21.001 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -5.923 -0.742 -18.561 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -5.079 0.778 -18.347 1.00 0.00 H new ATOM 0 HG LEU A 66 -7.445 0.645 -17.463 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -8.093 2.923 -18.112 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -6.373 2.788 -17.676 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -6.851 2.898 -19.386 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -9.311 1.032 -19.069 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -8.171 0.809 -20.417 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -8.517 -0.542 -19.313 1.00 0.00 H new ATOM 1110 N ALA A 67 -3.498 1.699 -20.807 1.00 0.00 N ATOM 1111 CA ALA A 67 -2.723 2.883 -21.263 1.00 0.00 C ATOM 1112 C ALA A 67 -3.003 3.225 -22.741 1.00 0.00 C ATOM 1113 O ALA A 67 -3.025 4.403 -23.126 1.00 0.00 O ATOM 1114 CB ALA A 67 -1.225 2.632 -21.039 1.00 0.00 C ATOM 0 H ALA A 67 -2.911 0.943 -20.455 1.00 0.00 H new ATOM 0 HA ALA A 67 -3.041 3.743 -20.674 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -0.657 3.500 -21.373 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -1.039 2.463 -19.978 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -0.914 1.755 -21.606 1.00 0.00 H new ATOM 1120 N GLU A 68 -3.242 2.180 -23.550 1.00 0.00 N ATOM 1121 CA GLU A 68 -3.579 2.332 -24.978 1.00 0.00 C ATOM 1122 C GLU A 68 -4.972 2.962 -25.130 1.00 0.00 C ATOM 1123 O GLU A 68 -5.204 3.805 -26.005 1.00 0.00 O ATOM 1124 CB GLU A 68 -3.520 0.960 -25.695 1.00 0.00 C ATOM 1125 CG GLU A 68 -2.207 0.182 -25.476 1.00 0.00 C ATOM 1126 CD GLU A 68 -0.953 0.935 -25.951 1.00 0.00 C ATOM 1127 OE1 GLU A 68 -0.603 0.836 -27.151 1.00 0.00 O ATOM 1128 OE2 GLU A 68 -0.300 1.621 -25.127 1.00 0.00 O ATOM 0 H GLU A 68 -3.208 1.210 -23.236 1.00 0.00 H new ATOM 0 HA GLU A 68 -2.847 2.993 -25.442 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -4.353 0.347 -25.350 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -3.661 1.116 -26.764 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -2.103 -0.045 -24.415 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -2.268 -0.771 -26.002 1.00 0.00 H new ATOM 1135 N PHE A 69 -5.883 2.554 -24.241 1.00 0.00 N ATOM 1136 CA PHE A 69 -7.241 3.094 -24.178 1.00 0.00 C ATOM 1137 C PHE A 69 -7.236 4.576 -23.699 1.00 0.00 C ATOM 1138 O PHE A 69 -7.975 5.405 -24.241 1.00 0.00 O ATOM 1139 CB PHE A 69 -8.098 2.192 -23.255 1.00 0.00 C ATOM 1140 CG PHE A 69 -9.484 2.740 -22.982 1.00 0.00 C ATOM 1141 CD1 PHE A 69 -10.370 2.968 -24.029 1.00 0.00 C ATOM 1142 CD2 PHE A 69 -9.884 3.064 -21.689 1.00 0.00 C ATOM 1143 CE1 PHE A 69 -11.609 3.496 -23.789 1.00 0.00 C ATOM 1144 CE2 PHE A 69 -11.127 3.594 -21.455 1.00 0.00 C ATOM 1145 CZ PHE A 69 -11.985 3.806 -22.503 1.00 0.00 C ATOM 0 H PHE A 69 -5.696 1.835 -23.542 1.00 0.00 H new ATOM 0 HA PHE A 69 -7.680 3.094 -25.176 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -8.190 1.206 -23.710 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -7.577 2.058 -22.307 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -10.078 2.726 -25.040 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -9.209 2.897 -20.862 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -12.291 3.669 -24.608 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -11.429 3.844 -20.449 1.00 0.00 H new ATOM 0 HZ PHE A 69 -12.965 4.220 -22.317 1.00 0.00 H new ATOM 1155 N VAL A 70 -6.383 4.884 -22.702 1.00 0.00 N ATOM 1156 CA VAL A 70 -6.259 6.235 -22.108 1.00 0.00 C ATOM 1157 C VAL A 70 -5.801 7.261 -23.161 1.00 0.00 C ATOM 1158 O VAL A 70 -6.433 8.304 -23.323 1.00 0.00 O ATOM 1159 CB VAL A 70 -5.259 6.233 -20.884 1.00 0.00 C ATOM 1160 CG1 VAL A 70 -4.908 7.653 -20.411 1.00 0.00 C ATOM 1161 CG2 VAL A 70 -5.813 5.410 -19.707 1.00 0.00 C ATOM 0 H VAL A 70 -5.755 4.199 -22.282 1.00 0.00 H new ATOM 0 HA VAL A 70 -7.246 6.523 -21.746 1.00 0.00 H new ATOM 0 HB VAL A 70 -4.342 5.765 -21.241 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -4.219 7.596 -19.569 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -4.439 8.203 -21.227 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -5.817 8.168 -20.101 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -5.101 5.429 -18.882 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -6.760 5.837 -19.378 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -5.971 4.380 -20.026 1.00 0.00 H new ATOM 1171 N GLN A 71 -4.719 6.931 -23.884 1.00 0.00 N ATOM 1172 CA GLN A 71 -4.137 7.827 -24.905 1.00 0.00 C ATOM 1173 C GLN A 71 -5.148 8.076 -26.057 1.00 0.00 C ATOM 1174 O GLN A 71 -5.278 9.208 -26.545 1.00 0.00 O ATOM 1175 CB GLN A 71 -2.785 7.254 -25.423 1.00 0.00 C ATOM 1176 CG GLN A 71 -2.895 5.938 -26.211 1.00 0.00 C ATOM 1177 CD GLN A 71 -1.546 5.332 -26.606 1.00 0.00 C ATOM 1178 OE1 GLN A 71 -0.982 4.502 -25.738 1.00 0.00 O flip ATOM 1179 NE2 GLN A 71 -1.010 5.620 -27.676 1.00 0.00 N flip ATOM 0 H GLN A 71 -4.224 6.045 -23.782 1.00 0.00 H new ATOM 0 HA GLN A 71 -3.927 8.794 -24.449 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -2.311 8.002 -26.059 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -2.125 7.095 -24.570 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -3.445 5.213 -25.612 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -3.480 6.115 -27.114 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -1.471 6.262 -28.321 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -0.105 5.217 -27.918 1.00 0.00 H new ATOM 1188 N SER A 72 -5.909 7.019 -26.429 1.00 0.00 N ATOM 1189 CA SER A 72 -6.979 7.114 -27.444 1.00 0.00 C ATOM 1190 C SER A 72 -8.100 8.067 -26.987 1.00 0.00 C ATOM 1191 O SER A 72 -8.547 8.937 -27.747 1.00 0.00 O ATOM 1192 CB SER A 72 -7.564 5.716 -27.729 1.00 0.00 C ATOM 1193 OG SER A 72 -6.578 4.852 -28.272 1.00 0.00 O ATOM 0 H SER A 72 -5.798 6.084 -26.036 1.00 0.00 H new ATOM 0 HA SER A 72 -6.541 7.517 -28.357 1.00 0.00 H new ATOM 0 HB2 SER A 72 -7.959 5.289 -26.807 1.00 0.00 H new ATOM 0 HB3 SER A 72 -8.399 5.802 -28.424 1.00 0.00 H new ATOM 0 HG SER A 72 -6.058 4.451 -27.545 1.00 0.00 H new ATOM 1199 N LEU A 73 -8.512 7.904 -25.719 1.00 0.00 N ATOM 1200 CA LEU A 73 -9.610 8.679 -25.117 1.00 0.00 C ATOM 1201 C LEU A 73 -9.186 10.157 -24.905 1.00 0.00 C ATOM 1202 O LEU A 73 -10.020 11.075 -24.936 1.00 0.00 O ATOM 1203 CB LEU A 73 -10.077 8.006 -23.777 1.00 0.00 C ATOM 1204 CG LEU A 73 -11.610 7.727 -23.626 1.00 0.00 C ATOM 1205 CD1 LEU A 73 -11.944 7.218 -22.208 1.00 0.00 C ATOM 1206 CD2 LEU A 73 -12.444 8.955 -23.984 1.00 0.00 C ATOM 0 H LEU A 73 -8.092 7.229 -25.080 1.00 0.00 H new ATOM 0 HA LEU A 73 -10.459 8.682 -25.801 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -9.547 7.060 -23.669 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -9.764 8.643 -22.950 1.00 0.00 H new ATOM 0 HG LEU A 73 -11.871 6.941 -24.334 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -13.015 7.032 -22.131 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -11.401 6.293 -22.016 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -11.652 7.969 -21.474 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -13.503 8.723 -23.867 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -12.179 9.780 -23.323 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -12.247 9.240 -25.018 1.00 0.00 H new ATOM 1218 N SER A 74 -7.874 10.362 -24.719 1.00 0.00 N ATOM 1219 CA SER A 74 -7.277 11.687 -24.508 1.00 0.00 C ATOM 1220 C SER A 74 -7.333 12.529 -25.789 1.00 0.00 C ATOM 1221 O SER A 74 -7.516 13.746 -25.731 1.00 0.00 O ATOM 1222 CB SER A 74 -5.819 11.535 -24.011 1.00 0.00 C ATOM 1223 OG SER A 74 -5.201 12.791 -23.771 1.00 0.00 O ATOM 0 H SER A 74 -7.191 9.604 -24.711 1.00 0.00 H new ATOM 0 HA SER A 74 -7.855 12.210 -23.746 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.809 10.946 -23.094 1.00 0.00 H new ATOM 0 HB3 SER A 74 -5.240 10.983 -24.751 1.00 0.00 H new ATOM 0 HG SER A 74 -5.758 13.319 -23.161 1.00 0.00 H new ATOM 1229 N GLN A 75 -7.174 11.865 -26.943 1.00 0.00 N ATOM 1230 CA GLN A 75 -7.218 12.537 -28.253 1.00 0.00 C ATOM 1231 C GLN A 75 -8.665 12.836 -28.697 1.00 0.00 C ATOM 1232 O GLN A 75 -8.921 13.883 -29.301 1.00 0.00 O ATOM 1233 CB GLN A 75 -6.484 11.685 -29.325 1.00 0.00 C ATOM 1234 CG GLN A 75 -5.018 11.303 -28.988 1.00 0.00 C ATOM 1235 CD GLN A 75 -3.956 12.425 -29.079 1.00 0.00 C ATOM 1236 OE1 GLN A 75 -4.296 13.680 -28.784 1.00 0.00 O flip ATOM 1237 NE2 GLN A 75 -2.801 12.146 -29.398 1.00 0.00 N flip ATOM 0 H GLN A 75 -7.013 10.859 -26.997 1.00 0.00 H new ATOM 0 HA GLN A 75 -6.705 13.493 -28.149 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -7.052 10.769 -29.486 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -6.490 12.234 -30.267 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -4.998 10.900 -27.975 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -4.716 10.497 -29.657 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -2.552 11.182 -29.622 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -2.092 12.878 -29.439 1.00 0.00 H new ATOM 1246 N THR A 76 -9.609 11.927 -28.380 1.00 0.00 N ATOM 1247 CA THR A 76 -10.993 12.022 -28.892 1.00 0.00 C ATOM 1248 C THR A 76 -11.855 13.037 -28.098 1.00 0.00 C ATOM 1249 O THR A 76 -12.691 13.723 -28.693 1.00 0.00 O ATOM 1250 CB THR A 76 -11.697 10.619 -28.954 1.00 0.00 C ATOM 1251 OG1 THR A 76 -12.969 10.720 -29.626 1.00 0.00 O ATOM 1252 CG2 THR A 76 -11.916 10.005 -27.571 1.00 0.00 C ATOM 0 H THR A 76 -9.441 11.123 -27.776 1.00 0.00 H new ATOM 0 HA THR A 76 -10.908 12.399 -29.911 1.00 0.00 H new ATOM 0 HB THR A 76 -11.025 9.965 -29.510 1.00 0.00 H new ATOM 0 HG1 THR A 76 -13.393 9.837 -29.657 1.00 0.00 H new ATOM 0 HG21 THR A 76 -12.406 9.037 -27.676 1.00 0.00 H new ATOM 0 HG22 THR A 76 -10.954 9.873 -27.075 1.00 0.00 H new ATOM 0 HG23 THR A 76 -12.544 10.667 -26.975 1.00 0.00 H new ATOM 1260 N MET A 77 -11.653 13.142 -26.764 1.00 0.00 N ATOM 1261 CA MET A 77 -12.449 14.064 -25.900 1.00 0.00 C ATOM 1262 C MET A 77 -11.614 15.257 -25.413 1.00 0.00 C ATOM 1263 O MET A 77 -12.167 16.232 -24.887 1.00 0.00 O ATOM 1264 CB MET A 77 -13.056 13.306 -24.685 1.00 0.00 C ATOM 1265 CG MET A 77 -13.954 12.123 -25.064 1.00 0.00 C ATOM 1266 SD MET A 77 -14.978 11.555 -23.692 1.00 0.00 S ATOM 1267 CE MET A 77 -15.782 10.120 -24.403 1.00 0.00 C ATOM 0 H MET A 77 -10.949 12.604 -26.258 1.00 0.00 H new ATOM 0 HA MET A 77 -13.261 14.452 -26.515 1.00 0.00 H new ATOM 0 HB2 MET A 77 -12.244 12.943 -24.055 1.00 0.00 H new ATOM 0 HB3 MET A 77 -13.635 14.009 -24.085 1.00 0.00 H new ATOM 0 HG2 MET A 77 -14.597 12.412 -25.895 1.00 0.00 H new ATOM 0 HG3 MET A 77 -13.333 11.298 -25.413 1.00 0.00 H new ATOM 0 HE1 MET A 77 -15.661 9.267 -23.735 1.00 0.00 H new ATOM 0 HE2 MET A 77 -16.844 10.327 -24.538 1.00 0.00 H new ATOM 0 HE3 MET A 77 -15.331 9.892 -25.369 1.00 0.00 H new ATOM 1277 N GLY A 78 -10.284 15.168 -25.577 1.00 0.00 N ATOM 1278 CA GLY A 78 -9.371 16.222 -25.123 1.00 0.00 C ATOM 1279 C GLY A 78 -9.119 16.194 -23.612 1.00 0.00 C ATOM 1280 O GLY A 78 -8.518 17.130 -23.069 1.00 0.00 O ATOM 0 H GLY A 78 -9.820 14.376 -26.021 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -8.420 16.119 -25.645 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -9.782 17.193 -25.398 1.00 0.00 H new ATOM 1284 N PHE A 79 -9.575 15.117 -22.933 1.00 0.00 N ATOM 1285 CA PHE A 79 -9.325 14.906 -21.492 1.00 0.00 C ATOM 1286 C PHE A 79 -7.849 14.531 -21.306 1.00 0.00 C ATOM 1287 O PHE A 79 -7.360 13.677 -22.044 1.00 0.00 O ATOM 1288 CB PHE A 79 -10.260 13.795 -20.904 1.00 0.00 C ATOM 1289 CG PHE A 79 -11.649 14.277 -20.488 1.00 0.00 C ATOM 1290 CD1 PHE A 79 -12.408 15.117 -21.305 1.00 0.00 C ATOM 1291 CD2 PHE A 79 -12.192 13.897 -19.259 1.00 0.00 C ATOM 1292 CE1 PHE A 79 -13.654 15.554 -20.904 1.00 0.00 C ATOM 1293 CE2 PHE A 79 -13.435 14.335 -18.866 1.00 0.00 C ATOM 1294 CZ PHE A 79 -14.165 15.164 -19.682 1.00 0.00 C ATOM 0 H PHE A 79 -10.123 14.375 -23.367 1.00 0.00 H new ATOM 0 HA PHE A 79 -9.547 15.825 -20.950 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -10.373 13.005 -21.647 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -9.771 13.350 -20.037 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -12.015 15.428 -22.262 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -11.627 13.248 -18.606 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -14.231 16.202 -21.547 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -13.838 14.026 -17.913 1.00 0.00 H new ATOM 0 HZ PHE A 79 -15.138 15.511 -19.368 1.00 0.00 H new ATOM 1304 N PRO A 80 -7.109 15.177 -20.351 1.00 0.00 N ATOM 1305 CA PRO A 80 -5.677 14.885 -20.138 1.00 0.00 C ATOM 1306 C PRO A 80 -5.469 13.421 -19.724 1.00 0.00 C ATOM 1307 O PRO A 80 -6.110 12.948 -18.789 1.00 0.00 O ATOM 1308 CB PRO A 80 -5.252 15.880 -19.025 1.00 0.00 C ATOM 1309 CG PRO A 80 -6.531 16.278 -18.347 1.00 0.00 C ATOM 1310 CD PRO A 80 -7.598 16.231 -19.413 1.00 0.00 C ATOM 0 HA PRO A 80 -5.077 15.008 -21.040 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -4.562 15.414 -18.322 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -4.742 16.747 -19.445 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -6.767 15.598 -17.528 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -6.451 17.277 -17.918 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -8.572 15.976 -18.995 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -7.708 17.193 -19.913 1.00 0.00 H new ATOM 1318 N GLN A 81 -4.587 12.715 -20.459 1.00 0.00 N ATOM 1319 CA GLN A 81 -4.260 11.295 -20.203 1.00 0.00 C ATOM 1320 C GLN A 81 -3.634 11.086 -18.803 1.00 0.00 C ATOM 1321 O GLN A 81 -3.630 9.974 -18.272 1.00 0.00 O ATOM 1322 CB GLN A 81 -3.328 10.753 -21.316 1.00 0.00 C ATOM 1323 CG GLN A 81 -2.018 11.542 -21.513 1.00 0.00 C ATOM 1324 CD GLN A 81 -1.105 10.971 -22.606 1.00 0.00 C ATOM 1325 OE1 GLN A 81 0.117 11.022 -22.488 1.00 0.00 O ATOM 1326 NE2 GLN A 81 -1.684 10.464 -23.695 1.00 0.00 N ATOM 0 H GLN A 81 -4.079 13.113 -21.249 1.00 0.00 H new ATOM 0 HA GLN A 81 -5.192 10.731 -20.219 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -3.079 9.717 -21.087 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -3.877 10.749 -22.258 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -2.262 12.575 -21.760 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -1.471 11.560 -20.570 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -2.701 10.435 -23.765 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -1.110 10.105 -24.458 1.00 0.00 H new ATOM 1335 N ASP A 82 -3.113 12.184 -18.237 1.00 0.00 N ATOM 1336 CA ASP A 82 -2.593 12.242 -16.857 1.00 0.00 C ATOM 1337 C ASP A 82 -3.736 12.108 -15.821 1.00 0.00 C ATOM 1338 O ASP A 82 -3.535 11.579 -14.724 1.00 0.00 O ATOM 1339 CB ASP A 82 -1.849 13.595 -16.677 1.00 0.00 C ATOM 1340 CG ASP A 82 -1.283 13.823 -15.266 1.00 0.00 C ATOM 1341 OD1 ASP A 82 -0.244 13.223 -14.929 1.00 0.00 O ATOM 1342 OD2 ASP A 82 -1.876 14.615 -14.493 1.00 0.00 O ATOM 0 H ASP A 82 -3.038 13.073 -18.731 1.00 0.00 H new ATOM 0 HA ASP A 82 -1.909 11.410 -16.689 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -1.031 13.645 -17.396 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -2.535 14.408 -16.917 1.00 0.00 H new ATOM 1347 N GLN A 83 -4.941 12.582 -16.197 1.00 0.00 N ATOM 1348 CA GLN A 83 -6.118 12.633 -15.303 1.00 0.00 C ATOM 1349 C GLN A 83 -7.280 11.733 -15.780 1.00 0.00 C ATOM 1350 O GLN A 83 -8.340 11.758 -15.153 1.00 0.00 O ATOM 1351 CB GLN A 83 -6.610 14.103 -15.142 1.00 0.00 C ATOM 1352 CG GLN A 83 -5.646 15.034 -14.384 1.00 0.00 C ATOM 1353 CD GLN A 83 -6.236 16.429 -14.152 1.00 0.00 C ATOM 1354 OE1 GLN A 83 -6.897 16.672 -13.143 1.00 0.00 O ATOM 1355 NE2 GLN A 83 -6.009 17.348 -15.084 1.00 0.00 N ATOM 0 H GLN A 83 -5.127 12.942 -17.133 1.00 0.00 H new ATOM 0 HA GLN A 83 -5.794 12.244 -14.338 1.00 0.00 H new ATOM 0 HB2 GLN A 83 -6.790 14.520 -16.133 1.00 0.00 H new ATOM 0 HB3 GLN A 83 -7.567 14.095 -14.621 1.00 0.00 H new ATOM 0 HG2 GLN A 83 -5.394 14.586 -13.423 1.00 0.00 H new ATOM 0 HG3 GLN A 83 -4.717 15.125 -14.947 1.00 0.00 H new ATOM 0 HE21 GLN A 83 -5.457 17.113 -15.908 1.00 0.00 H new ATOM 0 HE22 GLN A 83 -6.387 18.289 -14.975 1.00 0.00 H new ATOM 1364 N ILE A 84 -7.105 10.933 -16.863 1.00 0.00 N ATOM 1365 CA ILE A 84 -8.173 10.001 -17.308 1.00 0.00 C ATOM 1366 C ILE A 84 -8.371 8.889 -16.254 1.00 0.00 C ATOM 1367 O ILE A 84 -7.601 7.922 -16.185 1.00 0.00 O ATOM 1368 CB ILE A 84 -7.928 9.390 -18.748 1.00 0.00 C ATOM 1369 CG1 ILE A 84 -7.986 10.524 -19.825 1.00 0.00 C ATOM 1370 CG2 ILE A 84 -8.930 8.247 -19.080 1.00 0.00 C ATOM 1371 CD1 ILE A 84 -8.115 10.061 -21.264 1.00 0.00 C ATOM 0 H ILE A 84 -6.258 10.913 -17.431 1.00 0.00 H new ATOM 0 HA ILE A 84 -9.087 10.588 -17.397 1.00 0.00 H new ATOM 0 HB ILE A 84 -6.934 8.943 -18.757 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -8.830 11.175 -19.595 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -7.084 11.129 -19.737 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -8.723 7.860 -20.077 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -8.822 7.445 -18.350 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -9.948 8.634 -19.046 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -8.146 10.928 -21.924 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -7.259 9.438 -21.524 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -9.032 9.484 -21.380 1.00 0.00 H new ATOM 1383 N ARG A 85 -9.379 9.102 -15.387 1.00 0.00 N ATOM 1384 CA ARG A 85 -9.780 8.159 -14.336 1.00 0.00 C ATOM 1385 C ARG A 85 -11.116 7.525 -14.719 1.00 0.00 C ATOM 1386 O ARG A 85 -12.088 8.222 -15.016 1.00 0.00 O ATOM 1387 CB ARG A 85 -9.866 8.890 -12.969 1.00 0.00 C ATOM 1388 CG ARG A 85 -8.487 9.336 -12.442 1.00 0.00 C ATOM 1389 CD ARG A 85 -8.558 10.185 -11.159 1.00 0.00 C ATOM 1390 NE ARG A 85 -7.204 10.499 -10.662 1.00 0.00 N ATOM 1391 CZ ARG A 85 -6.428 11.513 -11.089 1.00 0.00 C ATOM 1392 NH1 ARG A 85 -6.869 12.406 -11.973 1.00 0.00 N ATOM 1393 NH2 ARG A 85 -5.202 11.636 -10.606 1.00 0.00 N ATOM 0 H ARG A 85 -9.945 9.950 -15.401 1.00 0.00 H new ATOM 0 HA ARG A 85 -9.036 7.368 -14.238 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -10.511 9.763 -13.069 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -10.333 8.230 -12.238 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -7.879 8.452 -12.249 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -7.979 9.909 -13.218 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -9.100 11.109 -11.359 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -9.116 9.647 -10.392 1.00 0.00 H new ATOM 0 HE ARG A 85 -6.824 9.896 -9.932 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -7.816 12.332 -12.344 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -6.260 13.164 -12.279 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -4.855 10.967 -9.919 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -4.604 12.400 -10.921 1.00 0.00 H new ATOM 1407 N LEU A 86 -11.135 6.200 -14.740 1.00 0.00 N ATOM 1408 CA LEU A 86 -12.278 5.406 -15.193 1.00 0.00 C ATOM 1409 C LEU A 86 -13.175 5.055 -13.998 1.00 0.00 C ATOM 1410 O LEU A 86 -12.673 4.625 -12.964 1.00 0.00 O ATOM 1411 CB LEU A 86 -11.763 4.112 -15.884 1.00 0.00 C ATOM 1412 CG LEU A 86 -11.088 4.254 -17.293 1.00 0.00 C ATOM 1413 CD1 LEU A 86 -9.772 5.065 -17.253 1.00 0.00 C ATOM 1414 CD2 LEU A 86 -10.860 2.859 -17.912 1.00 0.00 C ATOM 0 H LEU A 86 -10.344 5.632 -14.438 1.00 0.00 H new ATOM 0 HA LEU A 86 -12.865 5.982 -15.908 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -11.045 3.638 -15.215 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -12.605 3.428 -15.984 1.00 0.00 H new ATOM 0 HG LEU A 86 -11.773 4.821 -17.923 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -9.353 5.128 -18.257 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -9.975 6.069 -16.880 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -9.059 4.570 -16.593 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -10.391 2.967 -18.890 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -10.211 2.274 -17.261 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -11.817 2.349 -18.023 1.00 0.00 H new ATOM 1426 N TRP A 87 -14.495 5.263 -14.135 1.00 0.00 N ATOM 1427 CA TRP A 87 -15.493 4.904 -13.098 1.00 0.00 C ATOM 1428 C TRP A 87 -16.467 3.880 -13.697 1.00 0.00 C ATOM 1429 O TRP A 87 -17.259 4.247 -14.562 1.00 0.00 O ATOM 1430 CB TRP A 87 -16.276 6.164 -12.608 1.00 0.00 C ATOM 1431 CG TRP A 87 -15.446 7.133 -11.801 1.00 0.00 C ATOM 1432 CD1 TRP A 87 -14.327 7.790 -12.213 1.00 0.00 C ATOM 1433 CD2 TRP A 87 -15.679 7.560 -10.451 1.00 0.00 C ATOM 1434 NE1 TRP A 87 -13.842 8.575 -11.206 1.00 0.00 N ATOM 1435 CE2 TRP A 87 -14.653 8.459 -10.120 1.00 0.00 C ATOM 1436 CE3 TRP A 87 -16.649 7.269 -9.491 1.00 0.00 C ATOM 1437 CZ2 TRP A 87 -14.565 9.069 -8.880 1.00 0.00 C ATOM 1438 CZ3 TRP A 87 -16.560 7.881 -8.253 1.00 0.00 C ATOM 1439 CH2 TRP A 87 -15.522 8.768 -7.955 1.00 0.00 C ATOM 0 H TRP A 87 -14.907 5.685 -14.967 1.00 0.00 H new ATOM 0 HA TRP A 87 -14.978 4.480 -12.236 1.00 0.00 H new ATOM 0 HB2 TRP A 87 -16.682 6.685 -13.475 1.00 0.00 H new ATOM 0 HB3 TRP A 87 -17.124 5.839 -12.005 1.00 0.00 H new ATOM 0 HD1 TRP A 87 -13.886 7.703 -13.195 1.00 0.00 H new ATOM 0 HE1 TRP A 87 -13.005 9.156 -11.260 1.00 0.00 H new ATOM 0 HE3 TRP A 87 -17.452 6.581 -9.710 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 -13.766 9.759 -8.653 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 -17.307 7.669 -7.503 1.00 0.00 H new ATOM 0 HH2 TRP A 87 -15.476 9.223 -6.976 1.00 0.00 H new ATOM 1450 N PRO A 88 -16.443 2.581 -13.255 1.00 0.00 N ATOM 1451 CA PRO A 88 -17.325 1.532 -13.831 1.00 0.00 C ATOM 1452 C PRO A 88 -18.802 1.759 -13.461 1.00 0.00 C ATOM 1453 O PRO A 88 -19.093 2.503 -12.511 1.00 0.00 O ATOM 1454 CB PRO A 88 -16.763 0.222 -13.221 1.00 0.00 C ATOM 1455 CG PRO A 88 -16.140 0.643 -11.921 1.00 0.00 C ATOM 1456 CD PRO A 88 -15.593 2.041 -12.157 1.00 0.00 C ATOM 0 HA PRO A 88 -17.321 1.523 -14.921 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -17.553 -0.512 -13.062 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -16.028 -0.239 -13.881 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -16.875 0.642 -11.117 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -15.346 -0.043 -11.628 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -15.664 2.654 -11.259 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -14.541 2.015 -12.442 1.00 0.00 H new ATOM 1464 N MET A 89 -19.729 1.160 -14.248 1.00 0.00 N ATOM 1465 CA MET A 89 -21.169 1.156 -13.917 1.00 0.00 C ATOM 1466 C MET A 89 -21.404 0.401 -12.582 1.00 0.00 C ATOM 1467 O MET A 89 -21.665 -0.803 -12.529 1.00 0.00 O ATOM 1468 CB MET A 89 -22.061 0.608 -15.087 1.00 0.00 C ATOM 1469 CG MET A 89 -21.950 -0.896 -15.480 1.00 0.00 C ATOM 1470 SD MET A 89 -20.455 -1.352 -16.395 1.00 0.00 S ATOM 1471 CE MET A 89 -19.302 -1.838 -15.122 1.00 0.00 C ATOM 0 H MET A 89 -19.502 0.674 -15.116 1.00 0.00 H new ATOM 0 HA MET A 89 -21.486 2.190 -13.782 1.00 0.00 H new ATOM 0 HB2 MET A 89 -23.101 0.805 -14.828 1.00 0.00 H new ATOM 0 HB3 MET A 89 -21.837 1.198 -15.976 1.00 0.00 H new ATOM 0 HG2 MET A 89 -21.996 -1.496 -14.571 1.00 0.00 H new ATOM 0 HG3 MET A 89 -22.819 -1.162 -16.082 1.00 0.00 H new ATOM 0 HE1 MET A 89 -18.414 -1.208 -15.175 1.00 0.00 H new ATOM 0 HE2 MET A 89 -19.770 -1.723 -14.144 1.00 0.00 H new ATOM 0 HE3 MET A 89 -19.017 -2.880 -15.268 1.00 0.00 H new ATOM 1638 N ALA A 100 -16.209 4.702 -6.561 1.00 0.00 N ATOM 1639 CA ALA A 100 -14.764 4.935 -6.718 1.00 0.00 C ATOM 1640 C ALA A 100 -14.335 4.694 -8.170 1.00 0.00 C ATOM 1641 O ALA A 100 -15.023 4.001 -8.933 1.00 0.00 O ATOM 1642 CB ALA A 100 -13.958 4.042 -5.754 1.00 0.00 C ATOM 0 HA ALA A 100 -14.556 5.975 -6.468 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -12.893 4.231 -5.888 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -14.241 4.269 -4.726 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -14.170 2.994 -5.966 1.00 0.00 H new ATOM 1648 N MET A 101 -13.203 5.306 -8.541 1.00 0.00 N ATOM 1649 CA MET A 101 -12.524 5.051 -9.819 1.00 0.00 C ATOM 1650 C MET A 101 -11.698 3.758 -9.713 1.00 0.00 C ATOM 1651 O MET A 101 -11.605 3.155 -8.630 1.00 0.00 O ATOM 1652 CB MET A 101 -11.609 6.264 -10.200 1.00 0.00 C ATOM 1653 CG MET A 101 -10.362 6.470 -9.312 1.00 0.00 C ATOM 1654 SD MET A 101 -10.749 6.918 -7.602 1.00 0.00 S ATOM 1655 CE MET A 101 -11.231 8.640 -7.760 1.00 0.00 C ATOM 0 H MET A 101 -12.729 5.997 -7.959 1.00 0.00 H new ATOM 0 HA MET A 101 -13.269 4.930 -10.605 1.00 0.00 H new ATOM 0 HB2 MET A 101 -11.280 6.137 -11.231 1.00 0.00 H new ATOM 0 HB3 MET A 101 -12.210 7.173 -10.166 1.00 0.00 H new ATOM 0 HG2 MET A 101 -9.771 5.554 -9.313 1.00 0.00 H new ATOM 0 HG3 MET A 101 -9.740 7.251 -9.750 1.00 0.00 H new ATOM 0 HE1 MET A 101 -12.164 8.807 -7.222 1.00 0.00 H new ATOM 0 HE2 MET A 101 -10.452 9.276 -7.340 1.00 0.00 H new ATOM 0 HE3 MET A 101 -11.370 8.884 -8.813 1.00 0.00 H new ATOM 1665 N LEU A 102 -11.114 3.321 -10.837 1.00 0.00 N ATOM 1666 CA LEU A 102 -10.130 2.230 -10.832 1.00 0.00 C ATOM 1667 C LEU A 102 -8.817 2.731 -10.232 1.00 0.00 C ATOM 1668 O LEU A 102 -8.511 3.935 -10.286 1.00 0.00 O ATOM 1669 CB LEU A 102 -9.891 1.642 -12.259 1.00 0.00 C ATOM 1670 CG LEU A 102 -11.013 0.711 -12.823 1.00 0.00 C ATOM 1671 CD1 LEU A 102 -11.390 -0.394 -11.817 1.00 0.00 C ATOM 1672 CD2 LEU A 102 -12.241 1.492 -13.290 1.00 0.00 C ATOM 0 H LEU A 102 -11.306 3.706 -11.762 1.00 0.00 H new ATOM 0 HA LEU A 102 -10.529 1.421 -10.221 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -9.755 2.472 -12.952 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -8.956 1.081 -12.246 1.00 0.00 H new ATOM 0 HG LEU A 102 -10.601 0.225 -13.707 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -12.173 -1.022 -12.243 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -10.513 -1.004 -11.601 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -11.752 0.061 -10.895 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -12.990 0.798 -13.672 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -12.658 2.050 -12.452 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -11.952 2.186 -14.080 1.00 0.00 H new ATOM 1684 N ASP A 103 -8.066 1.792 -9.650 1.00 0.00 N ATOM 1685 CA ASP A 103 -6.765 2.064 -9.034 1.00 0.00 C ATOM 1686 C ASP A 103 -5.822 2.560 -10.129 1.00 0.00 C ATOM 1687 O ASP A 103 -5.457 1.781 -10.990 1.00 0.00 O ATOM 1688 CB ASP A 103 -6.210 0.768 -8.388 1.00 0.00 C ATOM 1689 CG ASP A 103 -7.146 0.138 -7.338 1.00 0.00 C ATOM 1690 OD1 ASP A 103 -8.202 -0.418 -7.723 1.00 0.00 O ATOM 1691 OD2 ASP A 103 -6.830 0.185 -6.133 1.00 0.00 O ATOM 0 H ASP A 103 -8.347 0.813 -9.593 1.00 0.00 H new ATOM 0 HA ASP A 103 -6.859 2.819 -8.253 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -6.018 0.037 -9.173 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -5.252 0.990 -7.918 1.00 0.00 H new ATOM 1696 N ASN A 104 -5.466 3.861 -10.112 1.00 0.00 N ATOM 1697 CA ASN A 104 -4.749 4.513 -11.239 1.00 0.00 C ATOM 1698 C ASN A 104 -3.312 3.952 -11.407 1.00 0.00 C ATOM 1699 O ASN A 104 -2.695 4.070 -12.474 1.00 0.00 O ATOM 1700 CB ASN A 104 -4.748 6.061 -11.076 1.00 0.00 C ATOM 1701 CG ASN A 104 -4.352 6.831 -12.354 1.00 0.00 C ATOM 1702 OD1 ASN A 104 -4.712 6.308 -13.533 1.00 0.00 O flip ATOM 1703 ND2 ASN A 104 -3.746 7.903 -12.278 1.00 0.00 N flip ATOM 0 H ASN A 104 -5.662 4.486 -9.330 1.00 0.00 H new ATOM 0 HA ASN A 104 -5.289 4.277 -12.156 1.00 0.00 H new ATOM 0 HB2 ASN A 104 -5.742 6.383 -10.764 1.00 0.00 H new ATOM 0 HB3 ASN A 104 -4.060 6.330 -10.275 1.00 0.00 H new ATOM 0 HD21 ASN A 104 -3.484 8.277 -11.366 1.00 0.00 H new ATOM 0 HD22 ASN A 104 -3.507 8.415 -13.127 1.00 0.00 H new ATOM 1710 N GLU A 105 -2.809 3.326 -10.333 1.00 0.00 N ATOM 1711 CA GLU A 105 -1.533 2.593 -10.339 1.00 0.00 C ATOM 1712 C GLU A 105 -1.708 1.190 -10.964 1.00 0.00 C ATOM 1713 O GLU A 105 -0.785 0.653 -11.576 1.00 0.00 O ATOM 1714 CB GLU A 105 -1.002 2.486 -8.890 1.00 0.00 C ATOM 1715 CG GLU A 105 0.362 1.774 -8.729 1.00 0.00 C ATOM 1716 CD GLU A 105 1.531 2.497 -9.425 1.00 0.00 C ATOM 1717 OE1 GLU A 105 2.060 3.479 -8.855 1.00 0.00 O ATOM 1718 OE2 GLU A 105 1.933 2.096 -10.539 1.00 0.00 O ATOM 0 H GLU A 105 -3.280 3.314 -9.428 1.00 0.00 H new ATOM 0 HA GLU A 105 -0.810 3.136 -10.948 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -0.918 3.492 -8.478 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -1.741 1.956 -8.289 1.00 0.00 H new ATOM 0 HG2 GLU A 105 0.588 1.679 -7.667 1.00 0.00 H new ATOM 0 HG3 GLU A 105 0.283 0.764 -9.130 1.00 0.00 H new ATOM 1725 N ALA A 106 -2.895 0.595 -10.799 1.00 0.00 N ATOM 1726 CA ALA A 106 -3.178 -0.756 -11.310 1.00 0.00 C ATOM 1727 C ALA A 106 -3.575 -0.724 -12.793 1.00 0.00 C ATOM 1728 O ALA A 106 -2.916 -1.357 -13.621 1.00 0.00 O ATOM 1729 CB ALA A 106 -4.263 -1.443 -10.465 1.00 0.00 C ATOM 0 H ALA A 106 -3.680 1.029 -10.313 1.00 0.00 H new ATOM 0 HA ALA A 106 -2.261 -1.340 -11.228 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -4.456 -2.440 -10.861 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -3.924 -1.522 -9.432 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -5.180 -0.855 -10.502 1.00 0.00 H new ATOM 1735 N ASP A 107 -4.599 0.084 -13.113 1.00 0.00 N ATOM 1736 CA ASP A 107 -5.376 -0.037 -14.359 1.00 0.00 C ATOM 1737 C ASP A 107 -4.505 0.168 -15.608 1.00 0.00 C ATOM 1738 O ASP A 107 -4.410 -0.737 -16.444 1.00 0.00 O ATOM 1739 CB ASP A 107 -6.629 0.899 -14.344 1.00 0.00 C ATOM 1740 CG ASP A 107 -6.381 2.422 -14.445 1.00 0.00 C ATOM 1741 OD1 ASP A 107 -5.363 2.912 -13.923 1.00 0.00 O ATOM 1742 OD2 ASP A 107 -7.237 3.135 -15.021 1.00 0.00 O ATOM 0 H ASP A 107 -4.914 0.845 -12.511 1.00 0.00 H new ATOM 0 HA ASP A 107 -5.745 -1.061 -14.412 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -7.277 0.608 -15.171 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -7.181 0.708 -13.424 1.00 0.00 H new ATOM 1747 N GLY A 108 -3.779 1.295 -15.654 1.00 0.00 N ATOM 1748 CA GLY A 108 -3.020 1.708 -16.837 1.00 0.00 C ATOM 1749 C GLY A 108 -1.806 0.822 -17.127 1.00 0.00 C ATOM 1750 O GLY A 108 -1.314 0.781 -18.260 1.00 0.00 O ATOM 0 H GLY A 108 -3.704 1.944 -14.870 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -3.681 1.699 -17.704 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -2.685 2.736 -16.702 1.00 0.00 H new ATOM 1754 N ASN A 109 -1.360 0.074 -16.107 1.00 0.00 N ATOM 1755 CA ASN A 109 -0.097 -0.700 -16.147 1.00 0.00 C ATOM 1756 C ASN A 109 -0.333 -2.162 -16.565 1.00 0.00 C ATOM 1757 O ASN A 109 0.628 -2.920 -16.729 1.00 0.00 O ATOM 1758 CB ASN A 109 0.625 -0.626 -14.768 1.00 0.00 C ATOM 1759 CG ASN A 109 1.200 0.762 -14.458 1.00 0.00 C ATOM 1760 OD1 ASN A 109 1.547 1.523 -15.359 1.00 0.00 O ATOM 1761 ND2 ASN A 109 1.339 1.092 -13.188 1.00 0.00 N ATOM 0 H ASN A 109 -1.863 -0.016 -15.224 1.00 0.00 H new ATOM 0 HA ASN A 109 0.545 -0.250 -16.905 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -0.078 -0.904 -13.982 1.00 0.00 H new ATOM 0 HB3 ASN A 109 1.432 -1.359 -14.748 1.00 0.00 H new ATOM 0 HD21 ASN A 109 1.742 1.995 -12.937 1.00 0.00 H new ATOM 0 HD22 ASN A 109 1.044 0.444 -12.457 1.00 0.00 H new ATOM 1768 N LYS A 110 -1.608 -2.554 -16.751 1.00 0.00 N ATOM 1769 CA LYS A 110 -1.978 -3.913 -17.196 1.00 0.00 C ATOM 1770 C LYS A 110 -3.167 -3.857 -18.176 1.00 0.00 C ATOM 1771 O LYS A 110 -3.591 -2.768 -18.577 1.00 0.00 O ATOM 1772 CB LYS A 110 -2.224 -4.845 -15.963 1.00 0.00 C ATOM 1773 CG LYS A 110 -3.088 -4.277 -14.812 1.00 0.00 C ATOM 1774 CD LYS A 110 -4.557 -3.979 -15.192 1.00 0.00 C ATOM 1775 CE LYS A 110 -5.423 -3.711 -13.961 1.00 0.00 C ATOM 1776 NZ LYS A 110 -5.366 -4.830 -12.993 1.00 0.00 N ATOM 0 H LYS A 110 -2.408 -1.941 -16.598 1.00 0.00 H new ATOM 0 HA LYS A 110 -1.150 -4.354 -17.750 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -2.695 -5.761 -16.320 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -1.254 -5.125 -15.552 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -3.078 -4.986 -13.984 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -2.627 -3.358 -14.450 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -4.592 -3.115 -15.855 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -4.967 -4.823 -15.747 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -5.090 -2.793 -13.476 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -6.456 -3.551 -14.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -6.018 -4.641 -12.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -5.643 -5.713 -13.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -4.397 -4.923 -12.626 1.00 0.00 H new ATOM 1790 N THR A 111 -3.693 -5.040 -18.547 1.00 0.00 N ATOM 1791 CA THR A 111 -4.729 -5.175 -19.588 1.00 0.00 C ATOM 1792 C THR A 111 -6.122 -4.782 -19.057 1.00 0.00 C ATOM 1793 O THR A 111 -6.383 -4.840 -17.849 1.00 0.00 O ATOM 1794 CB THR A 111 -4.756 -6.631 -20.163 1.00 0.00 C ATOM 1795 OG1 THR A 111 -5.123 -7.559 -19.145 1.00 0.00 O ATOM 1796 CG2 THR A 111 -3.393 -7.050 -20.728 1.00 0.00 C ATOM 0 H THR A 111 -3.411 -5.929 -18.133 1.00 0.00 H new ATOM 0 HA THR A 111 -4.472 -4.487 -20.393 1.00 0.00 H new ATOM 0 HB THR A 111 -5.489 -6.638 -20.969 1.00 0.00 H new ATOM 0 HG1 THR A 111 -4.553 -7.425 -18.359 1.00 0.00 H new ATOM 0 HG21 THR A 111 -3.457 -8.066 -21.116 1.00 0.00 H new ATOM 0 HG22 THR A 111 -3.108 -6.372 -21.532 1.00 0.00 H new ATOM 0 HG23 THR A 111 -2.644 -7.010 -19.937 1.00 0.00 H new ATOM 1804 N MET A 112 -7.013 -4.361 -19.972 1.00 0.00 N ATOM 1805 CA MET A 112 -8.360 -3.878 -19.608 1.00 0.00 C ATOM 1806 C MET A 112 -9.385 -5.022 -19.477 1.00 0.00 C ATOM 1807 O MET A 112 -10.538 -4.777 -19.094 1.00 0.00 O ATOM 1808 CB MET A 112 -8.836 -2.800 -20.612 1.00 0.00 C ATOM 1809 CG MET A 112 -9.073 -3.271 -22.054 1.00 0.00 C ATOM 1810 SD MET A 112 -9.405 -1.894 -23.176 1.00 0.00 S ATOM 1811 CE MET A 112 -10.745 -1.035 -22.341 1.00 0.00 C ATOM 0 H MET A 112 -6.824 -4.345 -20.974 1.00 0.00 H new ATOM 0 HA MET A 112 -8.287 -3.423 -18.620 1.00 0.00 H new ATOM 0 HB2 MET A 112 -9.764 -2.368 -20.236 1.00 0.00 H new ATOM 0 HB3 MET A 112 -8.096 -1.999 -20.631 1.00 0.00 H new ATOM 0 HG2 MET A 112 -8.198 -3.820 -22.404 1.00 0.00 H new ATOM 0 HG3 MET A 112 -9.913 -3.965 -22.074 1.00 0.00 H new ATOM 0 HE1 MET A 112 -11.043 -0.167 -22.929 1.00 0.00 H new ATOM 0 HE2 MET A 112 -11.596 -1.708 -22.231 1.00 0.00 H new ATOM 0 HE3 MET A 112 -10.410 -0.709 -21.356 1.00 0.00 H new ATOM 1821 N ILE A 113 -8.963 -6.268 -19.786 1.00 0.00 N ATOM 1822 CA ILE A 113 -9.797 -7.478 -19.576 1.00 0.00 C ATOM 1823 C ILE A 113 -10.043 -7.718 -18.078 1.00 0.00 C ATOM 1824 O ILE A 113 -11.116 -8.188 -17.664 1.00 0.00 O ATOM 1825 CB ILE A 113 -9.146 -8.763 -20.224 1.00 0.00 C ATOM 1826 CG1 ILE A 113 -10.100 -9.998 -20.133 1.00 0.00 C ATOM 1827 CG2 ILE A 113 -7.767 -9.094 -19.618 1.00 0.00 C ATOM 1828 CD1 ILE A 113 -11.474 -9.776 -20.726 1.00 0.00 C ATOM 0 H ILE A 113 -8.045 -6.465 -20.184 1.00 0.00 H new ATOM 0 HA ILE A 113 -10.751 -7.297 -20.072 1.00 0.00 H new ATOM 0 HB ILE A 113 -8.989 -8.529 -21.277 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -9.631 -10.841 -20.641 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -10.211 -10.278 -19.086 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -7.363 -9.985 -20.098 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -7.088 -8.256 -19.779 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -7.873 -9.275 -18.548 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -12.068 -10.684 -20.619 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -11.967 -8.956 -20.204 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -11.378 -9.528 -21.783 1.00 0.00 H new ATOM 1840 N GLU A 114 -9.033 -7.351 -17.293 1.00 0.00 N ATOM 1841 CA GLU A 114 -9.005 -7.549 -15.842 1.00 0.00 C ATOM 1842 C GLU A 114 -10.075 -6.664 -15.189 1.00 0.00 C ATOM 1843 O GLU A 114 -10.866 -7.117 -14.358 1.00 0.00 O ATOM 1844 CB GLU A 114 -7.587 -7.198 -15.306 1.00 0.00 C ATOM 1845 CG GLU A 114 -6.439 -7.621 -16.253 1.00 0.00 C ATOM 1846 CD GLU A 114 -5.012 -7.502 -15.687 1.00 0.00 C ATOM 1847 OE1 GLU A 114 -4.844 -7.182 -14.494 1.00 0.00 O ATOM 1848 OE2 GLU A 114 -4.044 -7.720 -16.452 1.00 0.00 O ATOM 0 H GLU A 114 -8.193 -6.898 -17.653 1.00 0.00 H new ATOM 0 HA GLU A 114 -9.221 -8.589 -15.597 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -7.529 -6.123 -15.137 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -7.444 -7.681 -14.339 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -6.604 -8.657 -16.551 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -6.500 -7.016 -17.157 1.00 0.00 H new ATOM 1855 N LEU A 115 -10.108 -5.410 -15.662 1.00 0.00 N ATOM 1856 CA LEU A 115 -10.996 -4.349 -15.167 1.00 0.00 C ATOM 1857 C LEU A 115 -12.452 -4.594 -15.581 1.00 0.00 C ATOM 1858 O LEU A 115 -13.371 -4.393 -14.784 1.00 0.00 O ATOM 1859 CB LEU A 115 -10.514 -3.003 -15.728 1.00 0.00 C ATOM 1860 CG LEU A 115 -9.043 -2.631 -15.405 1.00 0.00 C ATOM 1861 CD1 LEU A 115 -8.614 -1.403 -16.213 1.00 0.00 C ATOM 1862 CD2 LEU A 115 -8.843 -2.412 -13.886 1.00 0.00 C ATOM 0 H LEU A 115 -9.501 -5.098 -16.420 1.00 0.00 H new ATOM 0 HA LEU A 115 -10.961 -4.343 -14.078 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -10.637 -3.016 -16.811 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -11.162 -2.216 -15.343 1.00 0.00 H new ATOM 0 HG LEU A 115 -8.404 -3.465 -15.696 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -7.580 -1.154 -15.975 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -8.700 -1.620 -17.278 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -9.257 -0.559 -15.962 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -7.803 -2.153 -13.690 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -9.489 -1.602 -13.547 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -9.096 -3.327 -13.350 1.00 0.00 H new ATOM 1874 N SER A 116 -12.643 -5.014 -16.850 1.00 0.00 N ATOM 1875 CA SER A 116 -13.977 -5.338 -17.391 1.00 0.00 C ATOM 1876 C SER A 116 -14.557 -6.571 -16.690 1.00 0.00 C ATOM 1877 O SER A 116 -15.771 -6.714 -16.601 1.00 0.00 O ATOM 1878 CB SER A 116 -13.910 -5.567 -18.925 1.00 0.00 C ATOM 1879 OG SER A 116 -13.006 -6.604 -19.261 1.00 0.00 O ATOM 0 H SER A 116 -11.884 -5.137 -17.521 1.00 0.00 H new ATOM 0 HA SER A 116 -14.635 -4.490 -17.201 1.00 0.00 H new ATOM 0 HB2 SER A 116 -14.903 -5.815 -19.300 1.00 0.00 H new ATOM 0 HB3 SER A 116 -13.604 -4.644 -19.418 1.00 0.00 H new ATOM 0 HG SER A 116 -12.578 -6.941 -18.447 1.00 0.00 H new ATOM 1885 N ASP A 117 -13.654 -7.446 -16.179 1.00 0.00 N ATOM 1886 CA ASP A 117 -14.022 -8.718 -15.532 1.00 0.00 C ATOM 1887 C ASP A 117 -14.699 -9.633 -16.582 1.00 0.00 C ATOM 1888 O ASP A 117 -15.684 -10.329 -16.309 1.00 0.00 O ATOM 1889 CB ASP A 117 -14.893 -8.449 -14.255 1.00 0.00 C ATOM 1890 CG ASP A 117 -15.192 -9.691 -13.391 1.00 0.00 C ATOM 1891 OD1 ASP A 117 -14.280 -10.161 -12.679 1.00 0.00 O ATOM 1892 OD2 ASP A 117 -16.345 -10.179 -13.387 1.00 0.00 O ATOM 0 H ASP A 117 -12.648 -7.282 -16.208 1.00 0.00 H new ATOM 0 HA ASP A 117 -13.139 -9.246 -15.172 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -14.384 -7.710 -13.637 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -15.839 -8.007 -14.567 1.00 0.00 H new ATOM 1897 N ASN A 118 -14.129 -9.575 -17.810 1.00 0.00 N ATOM 1898 CA ASN A 118 -14.500 -10.439 -18.950 1.00 0.00 C ATOM 1899 C ASN A 118 -15.919 -10.134 -19.479 1.00 0.00 C ATOM 1900 O ASN A 118 -16.608 -11.037 -19.969 1.00 0.00 O ATOM 1901 CB ASN A 118 -14.324 -11.963 -18.604 1.00 0.00 C ATOM 1902 CG ASN A 118 -12.871 -12.432 -18.399 1.00 0.00 C ATOM 1903 OD1 ASN A 118 -12.011 -11.596 -17.820 1.00 0.00 O flip ATOM 1904 ND2 ASN A 118 -12.525 -13.562 -18.743 1.00 0.00 N flip ATOM 0 H ASN A 118 -13.386 -8.914 -18.037 1.00 0.00 H new ATOM 0 HA ASN A 118 -13.808 -10.206 -19.759 1.00 0.00 H new ATOM 0 HB2 ASN A 118 -14.889 -12.180 -17.697 1.00 0.00 H new ATOM 0 HB3 ASN A 118 -14.769 -12.553 -19.405 1.00 0.00 H new ATOM 0 HD21 ASN A 118 -13.197 -14.189 -19.185 1.00 0.00 H new ATOM 0 HD22 ASN A 118 -11.566 -13.872 -18.586 1.00 0.00 H new ATOM 1911 N GLU A 119 -16.344 -8.850 -19.424 1.00 0.00 N ATOM 1912 CA GLU A 119 -17.663 -8.429 -19.969 1.00 0.00 C ATOM 1913 C GLU A 119 -17.505 -7.380 -21.086 1.00 0.00 C ATOM 1914 O GLU A 119 -16.534 -6.606 -21.109 1.00 0.00 O ATOM 1915 CB GLU A 119 -18.603 -7.897 -18.850 1.00 0.00 C ATOM 1916 CG GLU A 119 -18.288 -6.480 -18.333 1.00 0.00 C ATOM 1917 CD GLU A 119 -19.223 -6.047 -17.195 1.00 0.00 C ATOM 1918 OE1 GLU A 119 -20.364 -5.629 -17.490 1.00 0.00 O ATOM 1919 OE2 GLU A 119 -18.839 -6.147 -16.007 1.00 0.00 O ATOM 0 H GLU A 119 -15.801 -8.091 -19.012 1.00 0.00 H new ATOM 0 HA GLU A 119 -18.124 -9.317 -20.402 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -19.627 -7.908 -19.224 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -18.564 -8.588 -18.008 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -17.256 -6.445 -17.984 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -18.370 -5.770 -19.156 1.00 0.00 H new ATOM 1926 N ASN A 120 -18.477 -7.397 -22.015 1.00 0.00 N ATOM 1927 CA ASN A 120 -18.599 -6.435 -23.121 1.00 0.00 C ATOM 1928 C ASN A 120 -20.061 -6.453 -23.643 1.00 0.00 C ATOM 1929 O ASN A 120 -20.648 -7.536 -23.740 1.00 0.00 O ATOM 1930 CB ASN A 120 -17.570 -6.727 -24.258 1.00 0.00 C ATOM 1931 CG ASN A 120 -17.502 -8.197 -24.694 1.00 0.00 C ATOM 1932 OD1 ASN A 120 -16.713 -8.978 -24.157 1.00 0.00 O ATOM 1933 ND2 ASN A 120 -18.314 -8.580 -25.667 1.00 0.00 N ATOM 0 H ASN A 120 -19.217 -8.099 -22.016 1.00 0.00 H new ATOM 0 HA ASN A 120 -18.365 -5.435 -22.754 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -17.822 -6.116 -25.124 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -16.581 -6.414 -23.924 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -18.299 -9.546 -25.993 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -18.955 -7.909 -26.090 1.00 0.00 H new ATOM 1940 N PRO A 121 -20.700 -5.273 -23.988 1.00 0.00 N ATOM 1941 CA PRO A 121 -20.069 -3.934 -23.973 1.00 0.00 C ATOM 1942 C PRO A 121 -19.936 -3.348 -22.539 1.00 0.00 C ATOM 1943 O PRO A 121 -20.905 -3.322 -21.774 1.00 0.00 O ATOM 1944 CB PRO A 121 -21.009 -3.088 -24.871 1.00 0.00 C ATOM 1945 CG PRO A 121 -22.363 -3.715 -24.700 1.00 0.00 C ATOM 1946 CD PRO A 121 -22.126 -5.192 -24.421 1.00 0.00 C ATOM 0 HA PRO A 121 -19.041 -3.953 -24.335 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -21.015 -2.042 -24.564 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -20.690 -3.113 -25.913 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -22.905 -3.248 -23.878 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -22.968 -3.582 -25.597 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -22.797 -5.561 -23.645 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -22.305 -5.796 -25.310 1.00 0.00 H new ATOM 1954 N TRP A 122 -18.718 -2.890 -22.195 1.00 0.00 N ATOM 1955 CA TRP A 122 -18.364 -2.484 -20.822 1.00 0.00 C ATOM 1956 C TRP A 122 -18.650 -0.981 -20.604 1.00 0.00 C ATOM 1957 O TRP A 122 -17.965 -0.126 -21.155 1.00 0.00 O ATOM 1958 CB TRP A 122 -16.874 -2.825 -20.541 1.00 0.00 C ATOM 1959 CG TRP A 122 -16.415 -2.512 -19.134 1.00 0.00 C ATOM 1960 CD1 TRP A 122 -17.134 -2.677 -17.985 1.00 0.00 C ATOM 1961 CD2 TRP A 122 -15.124 -2.020 -18.725 1.00 0.00 C ATOM 1962 NE1 TRP A 122 -16.396 -2.279 -16.910 1.00 0.00 N ATOM 1963 CE2 TRP A 122 -15.165 -1.884 -17.328 1.00 0.00 C ATOM 1964 CE3 TRP A 122 -13.947 -1.673 -19.402 1.00 0.00 C ATOM 1965 CZ2 TRP A 122 -14.086 -1.423 -16.592 1.00 0.00 C ATOM 1966 CZ3 TRP A 122 -12.865 -1.219 -18.668 1.00 0.00 C ATOM 1967 CH2 TRP A 122 -12.945 -1.095 -17.273 1.00 0.00 C ATOM 0 H TRP A 122 -17.952 -2.791 -22.861 1.00 0.00 H new ATOM 0 HA TRP A 122 -18.983 -3.038 -20.116 1.00 0.00 H new ATOM 0 HB2 TRP A 122 -16.714 -3.886 -20.735 1.00 0.00 H new ATOM 0 HB3 TRP A 122 -16.249 -2.275 -21.245 1.00 0.00 H new ATOM 0 HD1 TRP A 122 -18.140 -3.066 -17.935 1.00 0.00 H new ATOM 0 HE1 TRP A 122 -16.718 -2.278 -15.942 1.00 0.00 H new ATOM 0 HE3 TRP A 122 -13.885 -1.758 -20.477 1.00 0.00 H new ATOM 0 HZ2 TRP A 122 -14.143 -1.326 -15.518 1.00 0.00 H new ATOM 0 HZ3 TRP A 122 -11.948 -0.957 -19.175 1.00 0.00 H new ATOM 0 HH2 TRP A 122 -12.088 -0.733 -16.725 1.00 0.00 H new ATOM 1978 N THR A 123 -19.659 -0.695 -19.781 1.00 0.00 N ATOM 1979 CA THR A 123 -20.123 0.665 -19.473 1.00 0.00 C ATOM 1980 C THR A 123 -19.213 1.354 -18.427 1.00 0.00 C ATOM 1981 O THR A 123 -18.856 0.755 -17.403 1.00 0.00 O ATOM 1982 CB THR A 123 -21.597 0.601 -18.967 1.00 0.00 C ATOM 1983 OG1 THR A 123 -22.427 0.042 -19.994 1.00 0.00 O ATOM 1984 CG2 THR A 123 -22.152 1.970 -18.551 1.00 0.00 C ATOM 0 H THR A 123 -20.192 -1.417 -19.296 1.00 0.00 H new ATOM 0 HA THR A 123 -20.075 1.265 -20.382 1.00 0.00 H new ATOM 0 HB THR A 123 -21.602 -0.028 -18.077 1.00 0.00 H new ATOM 0 HG1 THR A 123 -22.529 0.691 -20.722 1.00 0.00 H new ATOM 0 HG21 THR A 123 -23.181 1.857 -18.209 1.00 0.00 H new ATOM 0 HG22 THR A 123 -21.544 2.379 -17.744 1.00 0.00 H new ATOM 0 HG23 THR A 123 -22.126 2.648 -19.404 1.00 0.00 H new ATOM 1992 N ILE A 124 -18.858 2.621 -18.696 1.00 0.00 N ATOM 1993 CA ILE A 124 -17.957 3.414 -17.851 1.00 0.00 C ATOM 1994 C ILE A 124 -18.243 4.926 -18.036 1.00 0.00 C ATOM 1995 O ILE A 124 -18.735 5.361 -19.085 1.00 0.00 O ATOM 1996 CB ILE A 124 -16.427 3.046 -18.153 1.00 0.00 C ATOM 1997 CG1 ILE A 124 -15.771 2.380 -16.915 1.00 0.00 C ATOM 1998 CG2 ILE A 124 -15.565 4.251 -18.635 1.00 0.00 C ATOM 1999 CD1 ILE A 124 -14.340 1.970 -17.098 1.00 0.00 C ATOM 0 H ILE A 124 -19.193 3.127 -19.516 1.00 0.00 H new ATOM 0 HA ILE A 124 -18.142 3.170 -16.805 1.00 0.00 H new ATOM 0 HB ILE A 124 -16.453 2.342 -18.984 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -15.830 3.072 -16.075 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -16.353 1.499 -16.644 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -14.543 3.918 -18.817 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -15.985 4.653 -19.557 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -15.562 5.026 -17.869 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -13.971 1.515 -16.179 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -14.269 1.250 -17.913 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -13.738 2.847 -17.335 1.00 0.00 H new ATOM 2011 N PHE A 125 -17.935 5.705 -16.987 1.00 0.00 N ATOM 2012 CA PHE A 125 -17.953 7.176 -16.998 1.00 0.00 C ATOM 2013 C PHE A 125 -16.496 7.681 -16.990 1.00 0.00 C ATOM 2014 O PHE A 125 -15.643 7.112 -16.295 1.00 0.00 O ATOM 2015 CB PHE A 125 -18.733 7.707 -15.760 1.00 0.00 C ATOM 2016 CG PHE A 125 -18.779 9.233 -15.651 1.00 0.00 C ATOM 2017 CD1 PHE A 125 -19.550 9.989 -16.536 1.00 0.00 C ATOM 2018 CD2 PHE A 125 -18.037 9.912 -14.678 1.00 0.00 C ATOM 2019 CE1 PHE A 125 -19.580 11.368 -16.455 1.00 0.00 C ATOM 2020 CE2 PHE A 125 -18.065 11.293 -14.600 1.00 0.00 C ATOM 2021 CZ PHE A 125 -18.837 12.021 -15.487 1.00 0.00 C ATOM 0 H PHE A 125 -17.659 5.319 -16.084 1.00 0.00 H new ATOM 0 HA PHE A 125 -18.458 7.543 -17.892 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -19.754 7.326 -15.798 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -18.275 7.304 -14.857 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -20.132 9.488 -17.296 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -17.435 9.351 -13.979 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -20.183 11.936 -17.147 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -17.484 11.803 -13.846 1.00 0.00 H new ATOM 0 HZ PHE A 125 -18.860 13.099 -15.424 1.00 0.00 H new ATOM 2031 N LEU A 126 -16.226 8.747 -17.759 1.00 0.00 N ATOM 2032 CA LEU A 126 -14.895 9.366 -17.852 1.00 0.00 C ATOM 2033 C LEU A 126 -14.805 10.503 -16.808 1.00 0.00 C ATOM 2034 O LEU A 126 -15.637 11.415 -16.806 1.00 0.00 O ATOM 2035 CB LEU A 126 -14.657 9.929 -19.292 1.00 0.00 C ATOM 2036 CG LEU A 126 -13.186 9.917 -19.859 1.00 0.00 C ATOM 2037 CD1 LEU A 126 -13.062 10.830 -21.089 1.00 0.00 C ATOM 2038 CD2 LEU A 126 -12.106 10.266 -18.808 1.00 0.00 C ATOM 0 H LEU A 126 -16.929 9.206 -18.337 1.00 0.00 H new ATOM 0 HA LEU A 126 -14.126 8.620 -17.651 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -15.284 9.362 -19.980 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -15.013 10.959 -19.311 1.00 0.00 H new ATOM 0 HG LEU A 126 -12.994 8.886 -20.156 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -12.037 10.803 -21.460 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -13.740 10.483 -21.869 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -13.321 11.852 -20.811 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -11.121 10.237 -19.275 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -12.291 11.265 -18.414 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -12.143 9.542 -17.994 1.00 0.00 H new ATOM 2050 N GLU A 127 -13.779 10.436 -15.955 1.00 0.00 N ATOM 2051 CA GLU A 127 -13.478 11.458 -14.936 1.00 0.00 C ATOM 2052 C GLU A 127 -12.146 12.153 -15.268 1.00 0.00 C ATOM 2053 O GLU A 127 -11.265 11.562 -15.905 1.00 0.00 O ATOM 2054 CB GLU A 127 -13.388 10.780 -13.545 1.00 0.00 C ATOM 2055 CG GLU A 127 -13.044 11.695 -12.350 1.00 0.00 C ATOM 2056 CD GLU A 127 -14.149 12.707 -12.014 1.00 0.00 C ATOM 2057 OE1 GLU A 127 -15.075 12.356 -11.244 1.00 0.00 O ATOM 2058 OE2 GLU A 127 -14.095 13.863 -12.499 1.00 0.00 O ATOM 0 H GLU A 127 -13.120 9.658 -15.949 1.00 0.00 H new ATOM 0 HA GLU A 127 -14.271 12.206 -14.925 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -14.343 10.296 -13.340 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -12.636 9.992 -13.598 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -12.850 11.077 -11.474 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -12.123 12.235 -12.569 1.00 0.00 H new ATOM 2065 N THR A 128 -12.018 13.404 -14.815 1.00 0.00 N ATOM 2066 CA THR A 128 -10.776 14.178 -14.894 1.00 0.00 C ATOM 2067 C THR A 128 -10.195 14.255 -13.454 1.00 0.00 C ATOM 2068 O THR A 128 -9.313 13.450 -13.099 1.00 0.00 O ATOM 2069 CB THR A 128 -11.067 15.615 -15.474 1.00 0.00 C ATOM 2070 OG1 THR A 128 -12.138 15.549 -16.417 1.00 0.00 O ATOM 2071 CG2 THR A 128 -9.843 16.228 -16.171 1.00 0.00 C ATOM 2072 OXT THR A 128 -10.706 15.064 -12.650 1.00 0.00 O ATOM 0 H THR A 128 -12.785 13.914 -14.377 1.00 0.00 H new ATOM 0 HA THR A 128 -10.057 13.705 -15.563 1.00 0.00 H new ATOM 0 HB THR A 128 -11.330 16.249 -14.627 1.00 0.00 H new ATOM 0 HG1 THR A 128 -11.926 14.886 -17.107 1.00 0.00 H new ATOM 0 HG21 THR A 128 -10.098 17.217 -16.552 1.00 0.00 H new ATOM 0 HG22 THR A 128 -9.023 16.314 -15.458 1.00 0.00 H new ATOM 0 HG23 THR A 128 -9.537 15.588 -16.999 1.00 0.00 H new