USER MOD reduce.3.24.130724 H: found=0, std=0, add=937, rem=0, adj=22 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 100 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 102 THR OG1 : rot -106:sc= 0.628 USER MOD Set 1.3: A 111 ASN : amide:sc= 0.569 X(o=1.2,f=1.2) USER MOD Set 1.4: A 113 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 110 THR OG1 : rot -107:sc= 0 USER MOD Set 2.2: A 112 THR OG1 : rot 180:sc= 0.00129 USER MOD Set 3.1: A 81 THR OG1 : rot 94:sc= 1.56 USER MOD Set 3.2: A 93 THR OG1 : rot -101:sc= 1.12 USER MOD Set 4.1: A 47 HIS : no HD1:sc= 0.0576 X(o=0.11,f=0) USER MOD Set 4.2: A 64 THR OG1 : rot -119:sc= 0.0545 USER MOD Set 5.1: A 44 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 5.2: A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 TYR OH : rot -30:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0.0836 X(o=0.084,f=-0.041) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=-0.05) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= -0.0218 K(o=-0.022,f=-2!) USER MOD Single : A 14 ASN : amide:sc=-0.00407 X(o=-0.0041,f=-0.23) USER MOD Single : A 19 MET CE :methyl -161:sc= 0 (180deg=-0.0161) USER MOD Single : A 20 LYS NZ :NH3+ -140:sc= 0 (180deg=-0.0745) USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=-0.028) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 43 GLN : amide:sc= -0.0029 X(o=-0.0029,f=0.42) USER MOD Single : A 46 LYS NZ :NH3+ -120:sc= 0 (180deg=-0.209) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot -62:sc= 0.527 USER MOD Single : A 60 GLN : amide:sc= 0.00433 X(o=0.0043,f=-0.3) USER MOD Single : A 61 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 CYS SG : rot 26:sc= -0.719 USER MOD Single : A 78 LYS NZ :NH3+ -145:sc= 0.00186 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN :FLIP amide:sc= 0 F(o=-0.75,f=0) USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=-0.039) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc=0.000951 X(o=0.00095,f=0) USER MOD Single : A 114 THR OG1 : rot 39:sc= 0.0135 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 12 N PHE A 3 9.823 -9.859 -1.693 1.00 0.00 N ATOM 13 CA PHE A 3 8.817 -8.883 -1.175 1.00 0.00 C ATOM 14 C PHE A 3 8.817 -8.600 0.359 1.00 0.00 C ATOM 15 O PHE A 3 8.142 -7.647 0.759 1.00 0.00 O ATOM 16 CB PHE A 3 7.401 -9.329 -1.636 1.00 0.00 C ATOM 17 CG PHE A 3 7.069 -9.053 -3.112 1.00 0.00 C ATOM 18 CD1 PHE A 3 7.365 -10.004 -4.094 1.00 0.00 C ATOM 19 CD2 PHE A 3 6.429 -7.863 -3.480 1.00 0.00 C ATOM 20 CE1 PHE A 3 7.004 -9.780 -5.418 1.00 0.00 C ATOM 21 CE2 PHE A 3 6.075 -7.642 -4.809 1.00 0.00 C ATOM 22 CZ PHE A 3 6.346 -8.606 -5.772 1.00 0.00 C ATOM 0 HA PHE A 3 9.117 -7.927 -1.604 1.00 0.00 H new ATOM 0 HB2 PHE A 3 7.298 -10.398 -1.452 1.00 0.00 H new ATOM 0 HB3 PHE A 3 6.660 -8.826 -1.015 1.00 0.00 H new ATOM 0 HD1 PHE A 3 7.876 -10.916 -3.823 1.00 0.00 H new ATOM 0 HD2 PHE A 3 6.210 -7.115 -2.732 1.00 0.00 H new ATOM 0 HE1 PHE A 3 7.234 -10.518 -6.172 1.00 0.00 H new ATOM 0 HE2 PHE A 3 5.589 -6.720 -5.091 1.00 0.00 H new ATOM 0 HZ PHE A 3 6.046 -8.444 -6.797 1.00 0.00 H new ATOM 32 N SER A 4 9.532 -9.363 1.217 1.00 0.00 N ATOM 33 CA SER A 4 9.502 -9.165 2.691 1.00 0.00 C ATOM 34 C SER A 4 10.363 -7.934 3.107 1.00 0.00 C ATOM 35 O SER A 4 11.595 -7.999 3.137 1.00 0.00 O ATOM 36 CB SER A 4 9.930 -10.463 3.412 1.00 0.00 C ATOM 37 OG SER A 4 9.013 -11.522 3.160 1.00 0.00 O ATOM 0 H SER A 4 10.140 -10.125 0.916 1.00 0.00 H new ATOM 0 HA SER A 4 8.480 -8.944 3.001 1.00 0.00 H new ATOM 0 HB2 SER A 4 10.926 -10.755 3.079 1.00 0.00 H new ATOM 0 HB3 SER A 4 9.993 -10.282 4.485 1.00 0.00 H new ATOM 0 HG SER A 4 9.310 -12.330 3.627 1.00 0.00 H new ATOM 43 N GLY A 5 9.683 -6.809 3.388 1.00 0.00 N ATOM 44 CA GLY A 5 10.340 -5.512 3.643 1.00 0.00 C ATOM 45 C GLY A 5 9.335 -4.384 3.972 1.00 0.00 C ATOM 46 O GLY A 5 8.117 -4.514 3.805 1.00 0.00 O ATOM 0 H GLY A 5 8.665 -6.771 3.445 1.00 0.00 H new ATOM 0 HA2 GLY A 5 11.040 -5.621 4.471 1.00 0.00 H new ATOM 0 HA3 GLY A 5 10.924 -5.228 2.768 1.00 0.00 H new ATOM 50 N LYS A 6 9.890 -3.259 4.451 1.00 0.00 N ATOM 51 CA LYS A 6 9.093 -2.111 4.968 1.00 0.00 C ATOM 52 C LYS A 6 9.434 -0.869 4.101 1.00 0.00 C ATOM 53 O LYS A 6 10.457 -0.213 4.304 1.00 0.00 O ATOM 54 CB LYS A 6 9.374 -1.865 6.478 1.00 0.00 C ATOM 55 CG LYS A 6 8.955 -2.989 7.457 1.00 0.00 C ATOM 56 CD LYS A 6 10.056 -4.028 7.774 1.00 0.00 C ATOM 57 CE LYS A 6 9.601 -5.198 8.667 1.00 0.00 C ATOM 58 NZ LYS A 6 9.289 -4.794 10.052 1.00 0.00 N ATOM 0 H LYS A 6 10.898 -3.110 4.495 1.00 0.00 H new ATOM 0 HA LYS A 6 8.027 -2.325 4.893 1.00 0.00 H new ATOM 0 HB2 LYS A 6 10.443 -1.688 6.601 1.00 0.00 H new ATOM 0 HB3 LYS A 6 8.863 -0.949 6.774 1.00 0.00 H new ATOM 0 HG2 LYS A 6 8.628 -2.532 8.391 1.00 0.00 H new ATOM 0 HG3 LYS A 6 8.094 -3.511 7.039 1.00 0.00 H new ATOM 0 HD2 LYS A 6 10.436 -4.432 6.836 1.00 0.00 H new ATOM 0 HD3 LYS A 6 10.887 -3.519 8.262 1.00 0.00 H new ATOM 0 HE2 LYS A 6 8.719 -5.661 8.224 1.00 0.00 H new ATOM 0 HE3 LYS A 6 10.384 -5.956 8.686 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 8.990 -5.627 10.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 10.135 -4.378 10.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 8.522 -4.092 10.044 1.00 0.00 H new ATOM 72 N TYR A 7 8.585 -0.581 3.104 1.00 0.00 N ATOM 73 CA TYR A 7 8.958 0.274 1.944 1.00 0.00 C ATOM 74 C TYR A 7 8.391 1.702 2.167 1.00 0.00 C ATOM 75 O TYR A 7 7.182 1.915 2.025 1.00 0.00 O ATOM 76 CB TYR A 7 8.403 -0.325 0.610 1.00 0.00 C ATOM 77 CG TYR A 7 8.858 -1.740 0.186 1.00 0.00 C ATOM 78 CD1 TYR A 7 8.236 -2.871 0.727 1.00 0.00 C ATOM 79 CD2 TYR A 7 9.841 -1.910 -0.796 1.00 0.00 C ATOM 80 CE1 TYR A 7 8.615 -4.149 0.327 1.00 0.00 C ATOM 81 CE2 TYR A 7 10.208 -3.189 -1.208 1.00 0.00 C ATOM 82 CZ TYR A 7 9.607 -4.308 -0.638 1.00 0.00 C ATOM 83 OH TYR A 7 10.003 -5.563 -1.010 1.00 0.00 O ATOM 0 H TYR A 7 7.626 -0.926 3.069 1.00 0.00 H new ATOM 0 HA TYR A 7 10.044 0.316 1.866 1.00 0.00 H new ATOM 0 HB2 TYR A 7 7.315 -0.334 0.679 1.00 0.00 H new ATOM 0 HB3 TYR A 7 8.665 0.362 -0.195 1.00 0.00 H new ATOM 0 HD1 TYR A 7 7.454 -2.751 1.462 1.00 0.00 H new ATOM 0 HD2 TYR A 7 10.317 -1.046 -1.236 1.00 0.00 H new ATOM 0 HE1 TYR A 7 8.141 -5.016 0.764 1.00 0.00 H new ATOM 0 HE2 TYR A 7 10.961 -3.313 -1.972 1.00 0.00 H new ATOM 0 HH TYR A 7 9.897 -6.177 -0.254 1.00 0.00 H new ATOM 93 N GLN A 8 9.253 2.678 2.513 1.00 0.00 N ATOM 94 CA GLN A 8 8.796 4.057 2.854 1.00 0.00 C ATOM 95 C GLN A 8 8.794 4.984 1.607 1.00 0.00 C ATOM 96 O GLN A 8 9.718 4.969 0.790 1.00 0.00 O ATOM 97 CB GLN A 8 9.604 4.633 4.047 1.00 0.00 C ATOM 98 CG GLN A 8 8.990 5.928 4.634 1.00 0.00 C ATOM 99 CD GLN A 8 9.655 6.453 5.915 1.00 0.00 C ATOM 100 OE1 GLN A 8 10.853 6.295 6.155 1.00 0.00 O ATOM 101 NE2 GLN A 8 8.880 7.125 6.750 1.00 0.00 N ATOM 0 H GLN A 8 10.263 2.548 2.566 1.00 0.00 H new ATOM 0 HA GLN A 8 7.758 4.002 3.184 1.00 0.00 H new ATOM 0 HB2 GLN A 8 9.666 3.880 4.833 1.00 0.00 H new ATOM 0 HB3 GLN A 8 10.624 4.838 3.721 1.00 0.00 H new ATOM 0 HG2 GLN A 8 9.037 6.709 3.875 1.00 0.00 H new ATOM 0 HG3 GLN A 8 7.935 5.748 4.841 1.00 0.00 H new ATOM 0 HE21 GLN A 8 7.890 7.249 6.539 1.00 0.00 H new ATOM 0 HE22 GLN A 8 9.273 7.520 7.605 1.00 0.00 H new ATOM 110 N LEU A 9 7.734 5.809 1.511 1.00 0.00 N ATOM 111 CA LEU A 9 7.441 6.661 0.331 1.00 0.00 C ATOM 112 C LEU A 9 8.499 7.774 0.096 1.00 0.00 C ATOM 113 O LEU A 9 8.855 8.521 1.009 1.00 0.00 O ATOM 114 CB LEU A 9 6.012 7.238 0.540 1.00 0.00 C ATOM 115 CG LEU A 9 5.390 8.076 -0.612 1.00 0.00 C ATOM 116 CD1 LEU A 9 5.177 7.263 -1.906 1.00 0.00 C ATOM 117 CD2 LEU A 9 4.067 8.708 -0.141 1.00 0.00 C ATOM 0 H LEU A 9 7.046 5.907 2.257 1.00 0.00 H new ATOM 0 HA LEU A 9 7.488 6.061 -0.578 1.00 0.00 H new ATOM 0 HB2 LEU A 9 5.341 6.404 0.746 1.00 0.00 H new ATOM 0 HB3 LEU A 9 6.030 7.861 1.434 1.00 0.00 H new ATOM 0 HG LEU A 9 6.104 8.861 -0.861 1.00 0.00 H new ATOM 0 HD11 LEU A 9 4.740 7.905 -2.671 1.00 0.00 H new ATOM 0 HD12 LEU A 9 6.135 6.880 -2.257 1.00 0.00 H new ATOM 0 HD13 LEU A 9 4.505 6.429 -1.705 1.00 0.00 H new ATOM 0 HD21 LEU A 9 3.635 9.294 -0.952 1.00 0.00 H new ATOM 0 HD22 LEU A 9 3.371 7.921 0.149 1.00 0.00 H new ATOM 0 HD23 LEU A 9 4.258 9.357 0.714 1.00 0.00 H new ATOM 129 N GLN A 10 8.976 7.853 -1.153 1.00 0.00 N ATOM 130 CA GLN A 10 10.024 8.815 -1.585 1.00 0.00 C ATOM 131 C GLN A 10 9.394 9.901 -2.504 1.00 0.00 C ATOM 132 O GLN A 10 9.370 11.074 -2.121 1.00 0.00 O ATOM 133 CB GLN A 10 11.202 8.071 -2.273 1.00 0.00 C ATOM 134 CG GLN A 10 11.891 6.963 -1.452 1.00 0.00 C ATOM 135 CD GLN A 10 12.783 7.453 -0.296 1.00 0.00 C ATOM 136 OE1 GLN A 10 13.587 8.374 -0.441 1.00 0.00 O ATOM 137 NE2 GLN A 10 12.676 6.839 0.870 1.00 0.00 N ATOM 0 H GLN A 10 8.648 7.249 -1.907 1.00 0.00 H new ATOM 0 HA GLN A 10 10.438 9.318 -0.711 1.00 0.00 H new ATOM 0 HB2 GLN A 10 10.832 7.630 -3.198 1.00 0.00 H new ATOM 0 HB3 GLN A 10 11.955 8.808 -2.550 1.00 0.00 H new ATOM 0 HG2 GLN A 10 11.123 6.307 -1.042 1.00 0.00 H new ATOM 0 HG3 GLN A 10 12.499 6.360 -2.126 1.00 0.00 H new ATOM 0 HE21 GLN A 10 12.008 6.076 0.985 1.00 0.00 H new ATOM 0 HE22 GLN A 10 13.261 7.128 1.654 1.00 0.00 H new ATOM 146 N SER A 11 8.904 9.504 -3.700 1.00 0.00 N ATOM 147 CA SER A 11 8.342 10.432 -4.714 1.00 0.00 C ATOM 148 C SER A 11 6.930 9.935 -5.124 1.00 0.00 C ATOM 149 O SER A 11 6.770 8.813 -5.614 1.00 0.00 O ATOM 150 CB SER A 11 9.310 10.510 -5.916 1.00 0.00 C ATOM 151 OG SER A 11 8.863 11.474 -6.863 1.00 0.00 O ATOM 0 H SER A 11 8.886 8.527 -3.993 1.00 0.00 H new ATOM 0 HA SER A 11 8.235 11.439 -4.310 1.00 0.00 H new ATOM 0 HB2 SER A 11 10.309 10.772 -5.568 1.00 0.00 H new ATOM 0 HB3 SER A 11 9.385 9.533 -6.393 1.00 0.00 H new ATOM 0 HG SER A 11 9.490 11.509 -7.615 1.00 0.00 H new ATOM 157 N GLN A 12 5.917 10.797 -4.922 1.00 0.00 N ATOM 158 CA GLN A 12 4.494 10.475 -5.202 1.00 0.00 C ATOM 159 C GLN A 12 3.997 11.394 -6.352 1.00 0.00 C ATOM 160 O GLN A 12 4.012 12.625 -6.240 1.00 0.00 O ATOM 161 CB GLN A 12 3.694 10.647 -3.886 1.00 0.00 C ATOM 162 CG GLN A 12 2.231 10.149 -3.948 1.00 0.00 C ATOM 163 CD GLN A 12 1.524 10.043 -2.585 1.00 0.00 C ATOM 164 OE1 GLN A 12 1.075 8.969 -2.187 1.00 0.00 O ATOM 165 NE2 GLN A 12 1.397 11.132 -1.841 1.00 0.00 N ATOM 0 H GLN A 12 6.056 11.740 -4.559 1.00 0.00 H new ATOM 0 HA GLN A 12 4.358 9.446 -5.535 1.00 0.00 H new ATOM 0 HB2 GLN A 12 4.212 10.112 -3.090 1.00 0.00 H new ATOM 0 HB3 GLN A 12 3.693 11.702 -3.613 1.00 0.00 H new ATOM 0 HG2 GLN A 12 1.660 10.824 -4.586 1.00 0.00 H new ATOM 0 HG3 GLN A 12 2.216 9.169 -4.426 1.00 0.00 H new ATOM 0 HE21 GLN A 12 1.770 12.022 -2.172 1.00 0.00 H new ATOM 0 HE22 GLN A 12 0.927 11.080 -0.937 1.00 0.00 H new ATOM 174 N GLU A 13 3.561 10.767 -7.458 1.00 0.00 N ATOM 175 CA GLU A 13 3.217 11.475 -8.718 1.00 0.00 C ATOM 176 C GLU A 13 1.806 12.134 -8.674 1.00 0.00 C ATOM 177 O GLU A 13 1.732 13.366 -8.654 1.00 0.00 O ATOM 178 CB GLU A 13 3.465 10.502 -9.912 1.00 0.00 C ATOM 179 CG GLU A 13 3.234 11.046 -11.341 1.00 0.00 C ATOM 180 CD GLU A 13 4.124 12.228 -11.735 1.00 0.00 C ATOM 181 OE1 GLU A 13 5.273 12.004 -12.172 1.00 0.00 O ATOM 182 OE2 GLU A 13 3.675 13.389 -11.606 1.00 0.00 O ATOM 0 H GLU A 13 3.435 9.756 -7.511 1.00 0.00 H new ATOM 0 HA GLU A 13 3.871 12.335 -8.859 1.00 0.00 H new ATOM 0 HB2 GLU A 13 4.495 10.150 -9.849 1.00 0.00 H new ATOM 0 HB3 GLU A 13 2.822 9.633 -9.776 1.00 0.00 H new ATOM 0 HG2 GLU A 13 3.395 10.236 -12.052 1.00 0.00 H new ATOM 0 HG3 GLU A 13 2.191 11.349 -11.434 1.00 0.00 H new ATOM 189 N ASN A 14 0.715 11.339 -8.690 1.00 0.00 N ATOM 190 CA ASN A 14 -0.669 11.866 -8.859 1.00 0.00 C ATOM 191 C ASN A 14 -1.562 11.470 -7.648 1.00 0.00 C ATOM 192 O ASN A 14 -2.456 10.624 -7.761 1.00 0.00 O ATOM 193 CB ASN A 14 -1.217 11.381 -10.238 1.00 0.00 C ATOM 194 CG ASN A 14 -0.758 12.155 -11.495 1.00 0.00 C ATOM 195 OD1 ASN A 14 0.042 13.089 -11.450 1.00 0.00 O ATOM 196 ND2 ASN A 14 -1.265 11.767 -12.656 1.00 0.00 N ATOM 0 H ASN A 14 0.760 10.325 -8.588 1.00 0.00 H new ATOM 0 HA ASN A 14 -0.673 12.956 -8.869 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -0.936 10.336 -10.364 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -2.306 11.416 -10.199 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -0.992 12.243 -13.516 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -1.928 10.992 -12.690 1.00 0.00 H new ATOM 203 N PHE A 15 -1.342 12.133 -6.495 1.00 0.00 N ATOM 204 CA PHE A 15 -2.211 11.991 -5.288 1.00 0.00 C ATOM 205 C PHE A 15 -3.495 12.872 -5.353 1.00 0.00 C ATOM 206 O PHE A 15 -4.579 12.353 -5.082 1.00 0.00 O ATOM 207 CB PHE A 15 -1.367 12.259 -4.009 1.00 0.00 C ATOM 208 CG PHE A 15 -1.916 11.717 -2.671 1.00 0.00 C ATOM 209 CD1 PHE A 15 -2.093 10.340 -2.485 1.00 0.00 C ATOM 210 CD2 PHE A 15 -2.082 12.575 -1.578 1.00 0.00 C ATOM 211 CE1 PHE A 15 -2.420 9.830 -1.231 1.00 0.00 C ATOM 212 CE2 PHE A 15 -2.403 12.061 -0.323 1.00 0.00 C ATOM 213 CZ PHE A 15 -2.573 10.692 -0.151 1.00 0.00 C ATOM 0 H PHE A 15 -0.565 12.780 -6.365 1.00 0.00 H new ATOM 0 HA PHE A 15 -2.581 10.966 -5.254 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -0.376 11.833 -4.164 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -1.239 13.337 -3.909 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -1.975 9.668 -3.322 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -1.961 13.640 -1.708 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -2.554 8.767 -1.098 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -2.520 12.728 0.518 1.00 0.00 H new ATOM 0 HZ PHE A 15 -2.824 10.298 0.823 1.00 0.00 H new ATOM 223 N GLU A 16 -3.390 14.166 -5.732 1.00 0.00 N ATOM 224 CA GLU A 16 -4.564 15.051 -5.995 1.00 0.00 C ATOM 225 C GLU A 16 -5.528 14.552 -7.114 1.00 0.00 C ATOM 226 O GLU A 16 -6.736 14.472 -6.872 1.00 0.00 O ATOM 227 CB GLU A 16 -4.095 16.510 -6.273 1.00 0.00 C ATOM 228 CG GLU A 16 -3.482 17.262 -5.068 1.00 0.00 C ATOM 229 CD GLU A 16 -2.976 18.660 -5.425 1.00 0.00 C ATOM 230 OE1 GLU A 16 -3.780 19.619 -5.398 1.00 0.00 O ATOM 231 OE2 GLU A 16 -1.772 18.808 -5.729 1.00 0.00 O ATOM 0 H GLU A 16 -2.493 14.632 -5.866 1.00 0.00 H new ATOM 0 HA GLU A 16 -5.158 15.020 -5.082 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -3.358 16.488 -7.076 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -4.948 17.082 -6.638 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -4.231 17.344 -4.280 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -2.657 16.676 -4.664 1.00 0.00 H new ATOM 238 N ALA A 17 -5.001 14.191 -8.302 1.00 0.00 N ATOM 239 CA ALA A 17 -5.807 13.613 -9.411 1.00 0.00 C ATOM 240 C ALA A 17 -6.495 12.236 -9.134 1.00 0.00 C ATOM 241 O ALA A 17 -7.631 12.047 -9.575 1.00 0.00 O ATOM 242 CB ALA A 17 -4.907 13.558 -10.660 1.00 0.00 C ATOM 0 H ALA A 17 -4.010 14.289 -8.525 1.00 0.00 H new ATOM 0 HA ALA A 17 -6.664 14.272 -9.551 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -5.468 13.138 -11.495 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -4.577 14.565 -10.915 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -4.038 12.932 -10.455 1.00 0.00 H new ATOM 248 N PHE A 18 -5.840 11.300 -8.414 1.00 0.00 N ATOM 249 CA PHE A 18 -6.424 9.968 -8.076 1.00 0.00 C ATOM 250 C PHE A 18 -7.459 10.001 -6.914 1.00 0.00 C ATOM 251 O PHE A 18 -8.552 9.458 -7.085 1.00 0.00 O ATOM 252 CB PHE A 18 -5.264 8.963 -7.826 1.00 0.00 C ATOM 253 CG PHE A 18 -5.654 7.474 -7.739 1.00 0.00 C ATOM 254 CD1 PHE A 18 -5.693 6.672 -8.888 1.00 0.00 C ATOM 255 CD2 PHE A 18 -5.922 6.896 -6.494 1.00 0.00 C ATOM 256 CE1 PHE A 18 -5.985 5.314 -8.786 1.00 0.00 C ATOM 257 CE2 PHE A 18 -6.214 5.538 -6.395 1.00 0.00 C ATOM 258 CZ PHE A 18 -6.248 4.751 -7.541 1.00 0.00 C ATOM 0 H PHE A 18 -4.897 11.437 -8.049 1.00 0.00 H new ATOM 0 HA PHE A 18 -7.015 9.634 -8.929 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.533 9.079 -8.627 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -4.766 9.241 -6.897 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -5.496 7.109 -9.856 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -5.902 7.507 -5.604 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -6.007 4.698 -9.673 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -6.414 5.097 -5.430 1.00 0.00 H new ATOM 0 HZ PHE A 18 -6.479 3.699 -7.464 1.00 0.00 H new ATOM 268 N MET A 19 -7.120 10.603 -5.754 1.00 0.00 N ATOM 269 CA MET A 19 -8.020 10.677 -4.571 1.00 0.00 C ATOM 270 C MET A 19 -9.352 11.457 -4.794 1.00 0.00 C ATOM 271 O MET A 19 -10.398 10.944 -4.393 1.00 0.00 O ATOM 272 CB MET A 19 -7.220 11.206 -3.354 1.00 0.00 C ATOM 273 CG MET A 19 -6.366 10.163 -2.613 1.00 0.00 C ATOM 274 SD MET A 19 -5.170 9.351 -3.695 1.00 0.00 S ATOM 275 CE MET A 19 -5.012 7.759 -2.859 1.00 0.00 C ATOM 0 H MET A 19 -6.217 11.053 -5.606 1.00 0.00 H new ATOM 0 HA MET A 19 -8.363 9.661 -4.375 1.00 0.00 H new ATOM 0 HB2 MET A 19 -6.566 12.009 -3.694 1.00 0.00 H new ATOM 0 HB3 MET A 19 -7.921 11.645 -2.644 1.00 0.00 H new ATOM 0 HG2 MET A 19 -5.837 10.648 -1.792 1.00 0.00 H new ATOM 0 HG3 MET A 19 -7.020 9.411 -2.171 1.00 0.00 H new ATOM 0 HE1 MET A 19 -4.091 7.270 -3.178 1.00 0.00 H new ATOM 0 HE2 MET A 19 -4.985 7.915 -1.781 1.00 0.00 H new ATOM 0 HE3 MET A 19 -5.864 7.128 -3.113 1.00 0.00 H new ATOM 285 N LYS A 20 -9.346 12.634 -5.459 1.00 0.00 N ATOM 286 CA LYS A 20 -10.601 13.298 -5.929 1.00 0.00 C ATOM 287 C LYS A 20 -11.407 12.524 -7.025 1.00 0.00 C ATOM 288 O LYS A 20 -12.640 12.556 -6.966 1.00 0.00 O ATOM 289 CB LYS A 20 -10.321 14.762 -6.370 1.00 0.00 C ATOM 290 CG LYS A 20 -10.150 15.751 -5.193 1.00 0.00 C ATOM 291 CD LYS A 20 -9.865 17.213 -5.606 1.00 0.00 C ATOM 292 CE LYS A 20 -8.425 17.518 -6.071 1.00 0.00 C ATOM 293 NZ LYS A 20 -7.444 17.476 -4.969 1.00 0.00 N ATOM 0 H LYS A 20 -8.495 13.148 -5.686 1.00 0.00 H new ATOM 0 HA LYS A 20 -11.257 13.294 -5.058 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -9.418 14.780 -6.981 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -11.141 15.103 -7.002 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -11.055 15.730 -4.586 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -9.334 15.402 -4.560 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -10.550 17.482 -6.410 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -10.097 17.860 -4.760 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -8.135 16.798 -6.836 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -8.400 18.504 -6.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -6.759 18.250 -5.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -7.938 17.584 -4.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -6.943 16.565 -4.985 1.00 0.00 H new ATOM 307 N ALA A 21 -10.758 11.814 -7.979 1.00 0.00 N ATOM 308 CA ALA A 21 -11.461 10.876 -8.903 1.00 0.00 C ATOM 309 C ALA A 21 -12.203 9.658 -8.259 1.00 0.00 C ATOM 310 O ALA A 21 -13.211 9.223 -8.824 1.00 0.00 O ATOM 311 CB ALA A 21 -10.459 10.386 -9.965 1.00 0.00 C ATOM 0 H ALA A 21 -9.751 11.869 -8.133 1.00 0.00 H new ATOM 0 HA ALA A 21 -12.273 11.463 -9.331 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -10.959 9.699 -10.648 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -10.076 11.239 -10.525 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -9.632 9.872 -9.475 1.00 0.00 H new ATOM 317 N ILE A 22 -11.736 9.120 -7.110 1.00 0.00 N ATOM 318 CA ILE A 22 -12.409 7.997 -6.385 1.00 0.00 C ATOM 319 C ILE A 22 -13.468 8.534 -5.369 1.00 0.00 C ATOM 320 O ILE A 22 -14.650 8.199 -5.500 1.00 0.00 O ATOM 321 CB ILE A 22 -11.399 6.928 -5.819 1.00 0.00 C ATOM 322 CG1 ILE A 22 -10.377 7.461 -4.766 1.00 0.00 C ATOM 323 CG2 ILE A 22 -10.689 6.187 -6.981 1.00 0.00 C ATOM 324 CD1 ILE A 22 -9.345 6.467 -4.214 1.00 0.00 C ATOM 0 H ILE A 22 -10.884 9.445 -6.653 1.00 0.00 H new ATOM 0 HA ILE A 22 -12.981 7.421 -7.112 1.00 0.00 H new ATOM 0 HB ILE A 22 -12.011 6.224 -5.255 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -9.835 8.294 -5.214 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -10.940 7.863 -3.924 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -9.995 5.452 -6.574 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -11.432 5.681 -7.598 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -10.140 6.906 -7.590 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -8.701 6.973 -3.494 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -9.861 5.642 -3.723 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -8.739 6.079 -5.033 1.00 0.00 H new ATOM 336 N GLY A 23 -13.059 9.357 -4.385 1.00 0.00 N ATOM 337 CA GLY A 23 -13.972 9.962 -3.392 1.00 0.00 C ATOM 338 C GLY A 23 -13.272 10.207 -2.042 1.00 0.00 C ATOM 339 O GLY A 23 -13.575 9.515 -1.068 1.00 0.00 O ATOM 0 H GLY A 23 -12.083 9.623 -4.254 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -14.355 10.906 -3.779 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -14.831 9.307 -3.242 1.00 0.00 H new ATOM 343 N LEU A 24 -12.361 11.201 -1.994 1.00 0.00 N ATOM 344 CA LEU A 24 -11.620 11.581 -0.760 1.00 0.00 C ATOM 345 C LEU A 24 -11.583 13.139 -0.562 1.00 0.00 C ATOM 346 O LEU A 24 -11.617 13.875 -1.556 1.00 0.00 O ATOM 347 CB LEU A 24 -10.177 10.985 -0.782 1.00 0.00 C ATOM 348 CG LEU A 24 -9.958 9.746 0.136 1.00 0.00 C ATOM 349 CD1 LEU A 24 -10.084 8.422 -0.642 1.00 0.00 C ATOM 350 CD2 LEU A 24 -8.608 9.816 0.877 1.00 0.00 C ATOM 0 H LEU A 24 -12.114 11.766 -2.806 1.00 0.00 H new ATOM 0 HA LEU A 24 -12.154 11.160 0.091 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -9.932 10.706 -1.807 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -9.474 11.765 -0.487 1.00 0.00 H new ATOM 0 HG LEU A 24 -10.752 9.768 0.882 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -9.924 7.584 0.037 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -11.080 8.350 -1.079 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -9.337 8.394 -1.435 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -8.493 8.934 1.507 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -7.796 9.852 0.151 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -8.580 10.711 1.498 1.00 0.00 H new ATOM 362 N PRO A 25 -11.463 13.687 0.690 1.00 0.00 N ATOM 363 CA PRO A 25 -11.422 15.152 0.938 1.00 0.00 C ATOM 364 C PRO A 25 -10.057 15.812 0.605 1.00 0.00 C ATOM 365 O PRO A 25 -8.997 15.204 0.772 1.00 0.00 O ATOM 366 CB PRO A 25 -11.713 15.243 2.449 1.00 0.00 C ATOM 367 CG PRO A 25 -11.221 13.926 3.048 1.00 0.00 C ATOM 368 CD PRO A 25 -11.367 12.891 1.934 1.00 0.00 C ATOM 0 HA PRO A 25 -12.127 15.685 0.301 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -11.197 16.093 2.896 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -12.778 15.383 2.634 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -10.184 14.007 3.375 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -11.810 13.648 3.922 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -10.512 12.216 1.907 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -12.255 12.275 2.080 1.00 0.00 H new ATOM 376 N GLU A 26 -10.102 17.099 0.226 1.00 0.00 N ATOM 377 CA GLU A 26 -8.895 17.952 0.070 1.00 0.00 C ATOM 378 C GLU A 26 -8.004 18.144 1.340 1.00 0.00 C ATOM 379 O GLU A 26 -6.786 18.255 1.188 1.00 0.00 O ATOM 380 CB GLU A 26 -9.353 19.304 -0.519 1.00 0.00 C ATOM 381 CG GLU A 26 -9.695 19.275 -2.027 1.00 0.00 C ATOM 382 CD GLU A 26 -10.072 20.650 -2.578 1.00 0.00 C ATOM 383 OE1 GLU A 26 -11.259 21.036 -2.485 1.00 0.00 O ATOM 384 OE2 GLU A 26 -9.182 21.353 -3.109 1.00 0.00 O ATOM 0 H GLU A 26 -10.974 17.586 0.017 1.00 0.00 H new ATOM 0 HA GLU A 26 -8.220 17.421 -0.601 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -10.230 19.645 0.031 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -8.567 20.041 -0.354 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -8.839 18.889 -2.581 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -10.521 18.583 -2.194 1.00 0.00 H new ATOM 391 N GLU A 27 -8.572 18.146 2.565 1.00 0.00 N ATOM 392 CA GLU A 27 -7.784 18.113 3.828 1.00 0.00 C ATOM 393 C GLU A 27 -6.902 16.838 4.010 1.00 0.00 C ATOM 394 O GLU A 27 -5.709 17.008 4.265 1.00 0.00 O ATOM 395 CB GLU A 27 -8.713 18.398 5.035 1.00 0.00 C ATOM 396 CG GLU A 27 -8.018 18.562 6.405 1.00 0.00 C ATOM 397 CD GLU A 27 -6.969 19.678 6.498 1.00 0.00 C ATOM 398 OE1 GLU A 27 -7.352 20.860 6.640 1.00 0.00 O ATOM 399 OE2 GLU A 27 -5.757 19.374 6.428 1.00 0.00 O ATOM 0 H GLU A 27 -9.581 18.170 2.712 1.00 0.00 H new ATOM 0 HA GLU A 27 -7.046 18.913 3.766 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -9.278 19.307 4.826 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -9.435 17.585 5.112 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -8.784 18.746 7.159 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -7.539 17.618 6.662 1.00 0.00 H new ATOM 406 N LEU A 28 -7.435 15.602 3.866 1.00 0.00 N ATOM 407 CA LEU A 28 -6.588 14.364 3.897 1.00 0.00 C ATOM 408 C LEU A 28 -5.606 14.154 2.693 1.00 0.00 C ATOM 409 O LEU A 28 -4.590 13.474 2.863 1.00 0.00 O ATOM 410 CB LEU A 28 -7.450 13.089 4.116 1.00 0.00 C ATOM 411 CG LEU A 28 -8.267 12.984 5.438 1.00 0.00 C ATOM 412 CD1 LEU A 28 -9.150 11.721 5.425 1.00 0.00 C ATOM 413 CD2 LEU A 28 -7.386 12.994 6.707 1.00 0.00 C ATOM 0 H LEU A 28 -8.430 15.426 3.729 1.00 0.00 H new ATOM 0 HA LEU A 28 -5.936 14.535 4.754 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -8.149 13.010 3.283 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -6.789 12.224 4.061 1.00 0.00 H new ATOM 0 HG LEU A 28 -8.891 13.876 5.481 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -9.714 11.662 6.356 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -9.841 11.769 4.584 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -8.520 10.837 5.327 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -8.020 12.918 7.591 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -6.699 12.148 6.680 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -6.817 13.923 6.748 1.00 0.00 H new ATOM 425 N ILE A 29 -5.872 14.749 1.513 1.00 0.00 N ATOM 426 CA ILE A 29 -4.920 14.804 0.363 1.00 0.00 C ATOM 427 C ILE A 29 -3.693 15.717 0.688 1.00 0.00 C ATOM 428 O ILE A 29 -2.552 15.264 0.586 1.00 0.00 O ATOM 429 CB ILE A 29 -5.693 15.202 -0.948 1.00 0.00 C ATOM 430 CG1 ILE A 29 -6.786 14.158 -1.322 1.00 0.00 C ATOM 431 CG2 ILE A 29 -4.763 15.423 -2.166 1.00 0.00 C ATOM 432 CD1 ILE A 29 -7.809 14.598 -2.380 1.00 0.00 C ATOM 0 H ILE A 29 -6.760 15.212 1.320 1.00 0.00 H new ATOM 0 HA ILE A 29 -4.495 13.816 0.185 1.00 0.00 H new ATOM 0 HB ILE A 29 -6.169 16.154 -0.712 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -6.290 13.255 -1.679 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -7.326 13.887 -0.415 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -5.361 15.695 -3.036 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -4.059 16.225 -1.945 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -4.214 14.505 -2.376 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -8.519 13.790 -2.558 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -8.344 15.479 -2.025 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -7.292 14.838 -3.309 1.00 0.00 H new ATOM 444 N GLN A 30 -3.932 16.983 1.079 1.00 0.00 N ATOM 445 CA GLN A 30 -2.861 17.922 1.520 1.00 0.00 C ATOM 446 C GLN A 30 -2.110 17.564 2.849 1.00 0.00 C ATOM 447 O GLN A 30 -0.967 17.998 3.026 1.00 0.00 O ATOM 448 CB GLN A 30 -3.453 19.361 1.545 1.00 0.00 C ATOM 449 CG GLN A 30 -3.390 20.159 0.216 1.00 0.00 C ATOM 450 CD GLN A 30 -3.875 19.482 -1.084 1.00 0.00 C ATOM 451 OE1 GLN A 30 -3.080 19.103 -1.945 1.00 0.00 O ATOM 452 NE2 GLN A 30 -5.175 19.319 -1.256 1.00 0.00 N ATOM 0 H GLN A 30 -4.867 17.391 1.101 1.00 0.00 H new ATOM 0 HA GLN A 30 -2.060 17.836 0.786 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -4.496 19.295 1.854 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -2.929 19.932 2.311 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -3.973 21.070 0.351 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -2.355 20.463 0.063 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -5.828 19.635 -0.539 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -5.526 18.877 -2.106 1.00 0.00 H new ATOM 461 N LYS A 31 -2.718 16.767 3.747 1.00 0.00 N ATOM 462 CA LYS A 31 -2.052 16.193 4.946 1.00 0.00 C ATOM 463 C LYS A 31 -1.145 14.972 4.585 1.00 0.00 C ATOM 464 O LYS A 31 0.051 15.005 4.886 1.00 0.00 O ATOM 465 CB LYS A 31 -3.170 15.874 5.976 1.00 0.00 C ATOM 466 CG LYS A 31 -2.703 15.462 7.389 1.00 0.00 C ATOM 467 CD LYS A 31 -3.847 15.028 8.331 1.00 0.00 C ATOM 468 CE LYS A 31 -4.834 16.149 8.716 1.00 0.00 C ATOM 469 NZ LYS A 31 -5.890 15.651 9.615 1.00 0.00 N ATOM 0 H LYS A 31 -3.698 16.496 3.665 1.00 0.00 H new ATOM 0 HA LYS A 31 -1.356 16.905 5.390 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -3.809 16.752 6.070 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -3.788 15.072 5.573 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -1.990 14.642 7.299 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -2.171 16.299 7.842 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -4.404 14.222 7.854 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -3.412 14.619 9.243 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -4.293 16.961 9.202 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -5.287 16.563 7.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -6.537 16.429 9.855 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -6.421 14.893 9.140 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -5.458 15.279 10.485 1.00 0.00 H new ATOM 483 N GLY A 32 -1.701 13.923 3.939 1.00 0.00 N ATOM 484 CA GLY A 32 -0.932 12.725 3.519 1.00 0.00 C ATOM 485 C GLY A 32 0.113 12.844 2.376 1.00 0.00 C ATOM 486 O GLY A 32 0.945 11.939 2.263 1.00 0.00 O ATOM 0 H GLY A 32 -2.690 13.880 3.694 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -0.411 12.347 4.399 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -1.653 11.962 3.224 1.00 0.00 H new ATOM 490 N LYS A 33 0.111 13.921 1.559 1.00 0.00 N ATOM 491 CA LYS A 33 1.222 14.218 0.606 1.00 0.00 C ATOM 492 C LYS A 33 2.590 14.557 1.284 1.00 0.00 C ATOM 493 O LYS A 33 3.623 14.024 0.870 1.00 0.00 O ATOM 494 CB LYS A 33 0.774 15.255 -0.463 1.00 0.00 C ATOM 495 CG LYS A 33 0.592 16.722 -0.010 1.00 0.00 C ATOM 496 CD LYS A 33 0.001 17.659 -1.082 1.00 0.00 C ATOM 497 CE LYS A 33 0.902 17.968 -2.294 1.00 0.00 C ATOM 498 NZ LYS A 33 2.112 18.741 -1.951 1.00 0.00 N ATOM 0 H LYS A 33 -0.646 14.604 1.535 1.00 0.00 H new ATOM 0 HA LYS A 33 1.436 13.286 0.083 1.00 0.00 H new ATOM 0 HB2 LYS A 33 1.506 15.242 -1.270 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -0.172 14.915 -0.885 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -0.057 16.740 0.866 1.00 0.00 H new ATOM 0 HG3 LYS A 33 1.560 17.114 0.302 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -0.925 17.217 -1.449 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -0.263 18.602 -0.603 1.00 0.00 H new ATOM 0 HE2 LYS A 33 1.201 17.030 -2.762 1.00 0.00 H new ATOM 0 HE3 LYS A 33 0.324 18.523 -3.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 2.670 18.912 -2.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 1.835 19.651 -1.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 2.685 18.205 -1.268 1.00 0.00 H new ATOM 512 N ASP A 34 2.581 15.395 2.342 1.00 0.00 N ATOM 513 CA ASP A 34 3.763 15.644 3.218 1.00 0.00 C ATOM 514 C ASP A 34 4.211 14.425 4.090 1.00 0.00 C ATOM 515 O ASP A 34 5.418 14.250 4.285 1.00 0.00 O ATOM 516 CB ASP A 34 3.497 16.874 4.130 1.00 0.00 C ATOM 517 CG ASP A 34 3.339 18.219 3.400 1.00 0.00 C ATOM 518 OD1 ASP A 34 4.364 18.878 3.117 1.00 0.00 O ATOM 519 OD2 ASP A 34 2.189 18.614 3.102 1.00 0.00 O ATOM 0 H ASP A 34 1.754 15.924 2.620 1.00 0.00 H new ATOM 0 HA ASP A 34 4.592 15.833 2.536 1.00 0.00 H new ATOM 0 HB2 ASP A 34 2.593 16.686 4.709 1.00 0.00 H new ATOM 0 HB3 ASP A 34 4.318 16.961 4.841 1.00 0.00 H new ATOM 524 N ILE A 35 3.272 13.594 4.598 1.00 0.00 N ATOM 525 CA ILE A 35 3.585 12.390 5.421 1.00 0.00 C ATOM 526 C ILE A 35 4.114 11.273 4.464 1.00 0.00 C ATOM 527 O ILE A 35 3.415 10.844 3.539 1.00 0.00 O ATOM 528 CB ILE A 35 2.333 11.926 6.260 1.00 0.00 C ATOM 529 CG1 ILE A 35 1.780 13.027 7.221 1.00 0.00 C ATOM 530 CG2 ILE A 35 2.613 10.635 7.081 1.00 0.00 C ATOM 531 CD1 ILE A 35 0.340 12.801 7.712 1.00 0.00 C ATOM 0 H ILE A 35 2.272 13.735 4.452 1.00 0.00 H new ATOM 0 HA ILE A 35 4.357 12.624 6.154 1.00 0.00 H new ATOM 0 HB ILE A 35 1.571 11.718 5.509 1.00 0.00 H new ATOM 0 HG12 ILE A 35 2.437 13.094 8.088 1.00 0.00 H new ATOM 0 HG13 ILE A 35 1.827 13.989 6.711 1.00 0.00 H new ATOM 0 HG21 ILE A 35 1.719 10.359 7.640 1.00 0.00 H new ATOM 0 HG22 ILE A 35 2.882 9.824 6.404 1.00 0.00 H new ATOM 0 HG23 ILE A 35 3.434 10.816 7.775 1.00 0.00 H new ATOM 0 HD11 ILE A 35 0.048 13.618 8.372 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -0.335 12.767 6.857 1.00 0.00 H new ATOM 0 HD13 ILE A 35 0.285 11.858 8.255 1.00 0.00 H new ATOM 543 N LYS A 36 5.341 10.795 4.741 1.00 0.00 N ATOM 544 CA LYS A 36 5.947 9.651 4.011 1.00 0.00 C ATOM 545 C LYS A 36 5.488 8.331 4.691 1.00 0.00 C ATOM 546 O LYS A 36 5.914 8.009 5.806 1.00 0.00 O ATOM 547 CB LYS A 36 7.494 9.778 3.981 1.00 0.00 C ATOM 548 CG LYS A 36 8.035 10.887 3.052 1.00 0.00 C ATOM 549 CD LYS A 36 9.575 10.936 3.008 1.00 0.00 C ATOM 550 CE LYS A 36 10.106 11.868 1.903 1.00 0.00 C ATOM 551 NZ LYS A 36 11.575 11.817 1.818 1.00 0.00 N ATOM 0 H LYS A 36 5.941 11.182 5.469 1.00 0.00 H new ATOM 0 HA LYS A 36 5.612 9.648 2.974 1.00 0.00 H new ATOM 0 HB2 LYS A 36 7.849 9.967 4.994 1.00 0.00 H new ATOM 0 HB3 LYS A 36 7.917 8.823 3.668 1.00 0.00 H new ATOM 0 HG2 LYS A 36 7.653 10.727 2.044 1.00 0.00 H new ATOM 0 HG3 LYS A 36 7.655 11.852 3.388 1.00 0.00 H new ATOM 0 HD2 LYS A 36 9.952 11.272 3.974 1.00 0.00 H new ATOM 0 HD3 LYS A 36 9.962 9.930 2.847 1.00 0.00 H new ATOM 0 HE2 LYS A 36 9.674 11.581 0.944 1.00 0.00 H new ATOM 0 HE3 LYS A 36 9.787 12.891 2.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 11.902 12.455 1.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 11.986 12.114 2.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 11.877 10.845 1.603 1.00 0.00 H new ATOM 565 N GLY A 37 4.586 7.598 4.015 1.00 0.00 N ATOM 566 CA GLY A 37 3.941 6.398 4.589 1.00 0.00 C ATOM 567 C GLY A 37 4.742 5.102 4.365 1.00 0.00 C ATOM 568 O GLY A 37 5.133 4.786 3.237 1.00 0.00 O ATOM 0 H GLY A 37 4.284 7.815 3.065 1.00 0.00 H new ATOM 0 HA2 GLY A 37 3.800 6.548 5.659 1.00 0.00 H new ATOM 0 HA3 GLY A 37 2.950 6.283 4.150 1.00 0.00 H new ATOM 572 N VAL A 38 4.931 4.340 5.456 1.00 0.00 N ATOM 573 CA VAL A 38 5.619 3.018 5.420 1.00 0.00 C ATOM 574 C VAL A 38 4.582 1.960 4.934 1.00 0.00 C ATOM 575 O VAL A 38 3.584 1.684 5.608 1.00 0.00 O ATOM 576 CB VAL A 38 6.276 2.625 6.791 1.00 0.00 C ATOM 577 CG1 VAL A 38 7.137 1.344 6.674 1.00 0.00 C ATOM 578 CG2 VAL A 38 7.169 3.723 7.420 1.00 0.00 C ATOM 0 H VAL A 38 4.617 4.612 6.387 1.00 0.00 H new ATOM 0 HA VAL A 38 6.458 3.068 4.726 1.00 0.00 H new ATOM 0 HB VAL A 38 5.417 2.467 7.443 1.00 0.00 H new ATOM 0 HG11 VAL A 38 7.573 1.108 7.645 1.00 0.00 H new ATOM 0 HG12 VAL A 38 6.511 0.514 6.346 1.00 0.00 H new ATOM 0 HG13 VAL A 38 7.934 1.506 5.949 1.00 0.00 H new ATOM 0 HG21 VAL A 38 7.579 3.362 8.363 1.00 0.00 H new ATOM 0 HG22 VAL A 38 7.985 3.964 6.738 1.00 0.00 H new ATOM 0 HG23 VAL A 38 6.573 4.617 7.602 1.00 0.00 H new ATOM 588 N SER A 39 4.852 1.390 3.752 1.00 0.00 N ATOM 589 CA SER A 39 3.995 0.357 3.126 1.00 0.00 C ATOM 590 C SER A 39 4.704 -1.004 3.302 1.00 0.00 C ATOM 591 O SER A 39 5.626 -1.357 2.561 1.00 0.00 O ATOM 592 CB SER A 39 3.764 0.682 1.639 1.00 0.00 C ATOM 593 OG SER A 39 3.074 1.916 1.472 1.00 0.00 O ATOM 0 H SER A 39 5.673 1.629 3.196 1.00 0.00 H new ATOM 0 HA SER A 39 3.014 0.327 3.600 1.00 0.00 H new ATOM 0 HB2 SER A 39 4.723 0.728 1.123 1.00 0.00 H new ATOM 0 HB3 SER A 39 3.191 -0.121 1.175 1.00 0.00 H new ATOM 0 HG SER A 39 2.946 2.092 0.517 1.00 0.00 H new ATOM 599 N GLU A 40 4.251 -1.755 4.312 1.00 0.00 N ATOM 600 CA GLU A 40 4.790 -3.089 4.643 1.00 0.00 C ATOM 601 C GLU A 40 4.167 -4.169 3.726 1.00 0.00 C ATOM 602 O GLU A 40 3.000 -4.093 3.330 1.00 0.00 O ATOM 603 CB GLU A 40 4.495 -3.421 6.126 1.00 0.00 C ATOM 604 CG GLU A 40 5.255 -2.594 7.181 1.00 0.00 C ATOM 605 CD GLU A 40 4.391 -1.571 7.927 1.00 0.00 C ATOM 606 OE1 GLU A 40 3.796 -1.927 8.968 1.00 0.00 O ATOM 607 OE2 GLU A 40 4.295 -0.410 7.473 1.00 0.00 O ATOM 0 H GLU A 40 3.496 -1.457 4.929 1.00 0.00 H new ATOM 0 HA GLU A 40 5.868 -3.079 4.484 1.00 0.00 H new ATOM 0 HB2 GLU A 40 3.426 -3.293 6.298 1.00 0.00 H new ATOM 0 HB3 GLU A 40 4.721 -4.474 6.291 1.00 0.00 H new ATOM 0 HG2 GLU A 40 5.699 -3.275 7.907 1.00 0.00 H new ATOM 0 HG3 GLU A 40 6.076 -2.070 6.692 1.00 0.00 H new ATOM 614 N ILE A 41 4.991 -5.172 3.402 1.00 0.00 N ATOM 615 CA ILE A 41 4.564 -6.348 2.594 1.00 0.00 C ATOM 616 C ILE A 41 5.336 -7.556 3.208 1.00 0.00 C ATOM 617 O ILE A 41 6.561 -7.510 3.353 1.00 0.00 O ATOM 618 CB ILE A 41 4.820 -6.214 1.042 1.00 0.00 C ATOM 619 CG1 ILE A 41 4.312 -4.884 0.403 1.00 0.00 C ATOM 620 CG2 ILE A 41 4.202 -7.421 0.285 1.00 0.00 C ATOM 621 CD1 ILE A 41 4.750 -4.620 -1.047 1.00 0.00 C ATOM 0 H ILE A 41 5.970 -5.203 3.685 1.00 0.00 H new ATOM 0 HA ILE A 41 3.481 -6.463 2.648 1.00 0.00 H new ATOM 0 HB ILE A 41 5.905 -6.202 0.936 1.00 0.00 H new ATOM 0 HG12 ILE A 41 3.223 -4.881 0.438 1.00 0.00 H new ATOM 0 HG13 ILE A 41 4.654 -4.054 1.021 1.00 0.00 H new ATOM 0 HG21 ILE A 41 4.387 -7.314 -0.784 1.00 0.00 H new ATOM 0 HG22 ILE A 41 4.657 -8.345 0.641 1.00 0.00 H new ATOM 0 HG23 ILE A 41 3.128 -7.452 0.466 1.00 0.00 H new ATOM 0 HD11 ILE A 41 4.338 -3.669 -1.384 1.00 0.00 H new ATOM 0 HD12 ILE A 41 5.838 -4.582 -1.097 1.00 0.00 H new ATOM 0 HD13 ILE A 41 4.385 -5.422 -1.689 1.00 0.00 H new ATOM 633 N VAL A 42 4.608 -8.638 3.538 1.00 0.00 N ATOM 634 CA VAL A 42 5.204 -9.883 4.103 1.00 0.00 C ATOM 635 C VAL A 42 4.759 -11.030 3.153 1.00 0.00 C ATOM 636 O VAL A 42 3.595 -11.446 3.200 1.00 0.00 O ATOM 637 CB VAL A 42 4.773 -10.123 5.596 1.00 0.00 C ATOM 638 CG1 VAL A 42 5.361 -11.426 6.190 1.00 0.00 C ATOM 639 CG2 VAL A 42 5.146 -8.961 6.548 1.00 0.00 C ATOM 0 H VAL A 42 3.595 -8.684 3.425 1.00 0.00 H new ATOM 0 HA VAL A 42 6.291 -9.820 4.149 1.00 0.00 H new ATOM 0 HB VAL A 42 3.687 -10.198 5.536 1.00 0.00 H new ATOM 0 HG11 VAL A 42 5.029 -11.538 7.222 1.00 0.00 H new ATOM 0 HG12 VAL A 42 5.019 -12.279 5.605 1.00 0.00 H new ATOM 0 HG13 VAL A 42 6.450 -11.380 6.162 1.00 0.00 H new ATOM 0 HG21 VAL A 42 4.817 -9.199 7.559 1.00 0.00 H new ATOM 0 HG22 VAL A 42 6.227 -8.819 6.542 1.00 0.00 H new ATOM 0 HG23 VAL A 42 4.658 -8.046 6.214 1.00 0.00 H new ATOM 649 N GLN A 43 5.688 -11.572 2.337 1.00 0.00 N ATOM 650 CA GLN A 43 5.416 -12.797 1.539 1.00 0.00 C ATOM 651 C GLN A 43 5.768 -14.054 2.384 1.00 0.00 C ATOM 652 O GLN A 43 6.920 -14.267 2.777 1.00 0.00 O ATOM 653 CB GLN A 43 6.165 -12.786 0.180 1.00 0.00 C ATOM 654 CG GLN A 43 5.851 -14.012 -0.730 1.00 0.00 C ATOM 655 CD GLN A 43 6.380 -14.056 -2.177 1.00 0.00 C ATOM 656 OE1 GLN A 43 5.852 -14.796 -3.006 1.00 0.00 O ATOM 657 NE2 GLN A 43 7.412 -13.311 -2.538 1.00 0.00 N ATOM 0 H GLN A 43 6.625 -11.189 2.211 1.00 0.00 H new ATOM 0 HA GLN A 43 4.354 -12.824 1.296 1.00 0.00 H new ATOM 0 HB2 GLN A 43 5.908 -11.873 -0.357 1.00 0.00 H new ATOM 0 HB3 GLN A 43 7.238 -12.753 0.369 1.00 0.00 H new ATOM 0 HG2 GLN A 43 6.228 -14.899 -0.220 1.00 0.00 H new ATOM 0 HG3 GLN A 43 4.766 -14.110 -0.779 1.00 0.00 H new ATOM 0 HE21 GLN A 43 7.858 -12.694 -1.859 1.00 0.00 H new ATOM 0 HE22 GLN A 43 7.762 -13.354 -3.495 1.00 0.00 H new ATOM 666 N ASN A 44 4.753 -14.911 2.562 1.00 0.00 N ATOM 667 CA ASN A 44 4.944 -16.339 2.934 1.00 0.00 C ATOM 668 C ASN A 44 5.135 -17.191 1.640 1.00 0.00 C ATOM 669 O ASN A 44 6.199 -17.790 1.465 1.00 0.00 O ATOM 670 CB ASN A 44 3.772 -16.838 3.828 1.00 0.00 C ATOM 671 CG ASN A 44 3.736 -16.260 5.257 1.00 0.00 C ATOM 672 OD1 ASN A 44 4.265 -16.849 6.199 1.00 0.00 O ATOM 673 ND2 ASN A 44 3.119 -15.103 5.448 1.00 0.00 N ATOM 0 H ASN A 44 3.774 -14.644 2.455 1.00 0.00 H new ATOM 0 HA ASN A 44 5.847 -16.450 3.534 1.00 0.00 H new ATOM 0 HB2 ASN A 44 2.832 -16.596 3.333 1.00 0.00 H new ATOM 0 HB3 ASN A 44 3.826 -17.925 3.895 1.00 0.00 H new ATOM 0 HD21 ASN A 44 3.080 -14.694 6.382 1.00 0.00 H new ATOM 0 HD22 ASN A 44 2.683 -14.621 4.661 1.00 0.00 H new ATOM 680 N GLY A 45 4.138 -17.207 0.733 1.00 0.00 N ATOM 681 CA GLY A 45 4.276 -17.805 -0.609 1.00 0.00 C ATOM 682 C GLY A 45 3.149 -17.275 -1.505 1.00 0.00 C ATOM 683 O GLY A 45 3.292 -16.226 -2.140 1.00 0.00 O ATOM 0 H GLY A 45 3.217 -16.807 0.910 1.00 0.00 H new ATOM 0 HA2 GLY A 45 5.247 -17.554 -1.036 1.00 0.00 H new ATOM 0 HA3 GLY A 45 4.227 -18.892 -0.545 1.00 0.00 H new ATOM 687 N LYS A 46 2.009 -17.984 -1.490 1.00 0.00 N ATOM 688 CA LYS A 46 0.717 -17.457 -2.012 1.00 0.00 C ATOM 689 C LYS A 46 0.059 -16.391 -1.075 1.00 0.00 C ATOM 690 O LYS A 46 -0.466 -15.401 -1.589 1.00 0.00 O ATOM 691 CB LYS A 46 -0.247 -18.639 -2.309 1.00 0.00 C ATOM 692 CG LYS A 46 0.164 -19.531 -3.509 1.00 0.00 C ATOM 693 CD LYS A 46 -0.567 -20.888 -3.631 1.00 0.00 C ATOM 694 CE LYS A 46 -2.020 -20.867 -4.143 1.00 0.00 C ATOM 695 NZ LYS A 46 -3.000 -20.460 -3.121 1.00 0.00 N ATOM 0 H LYS A 46 1.946 -18.933 -1.121 1.00 0.00 H new ATOM 0 HA LYS A 46 0.930 -16.927 -2.940 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -0.318 -19.263 -1.418 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -1.243 -18.238 -2.497 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -0.002 -18.968 -4.427 1.00 0.00 H new ATOM 0 HG3 LYS A 46 1.235 -19.723 -3.442 1.00 0.00 H new ATOM 0 HD2 LYS A 46 0.015 -21.526 -4.296 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -0.562 -21.362 -2.650 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -2.088 -20.185 -4.991 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -2.281 -21.859 -4.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -3.687 -21.227 -2.974 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -2.507 -20.260 -2.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -3.499 -19.605 -3.440 1.00 0.00 H new ATOM 709 N HIS A 47 0.098 -16.557 0.267 1.00 0.00 N ATOM 710 CA HIS A 47 -0.436 -15.556 1.233 1.00 0.00 C ATOM 711 C HIS A 47 0.512 -14.325 1.364 1.00 0.00 C ATOM 712 O HIS A 47 1.737 -14.454 1.462 1.00 0.00 O ATOM 713 CB HIS A 47 -0.674 -16.213 2.622 1.00 0.00 C ATOM 714 CG HIS A 47 -1.904 -17.124 2.698 1.00 0.00 C ATOM 715 ND1 HIS A 47 -1.937 -18.450 2.302 1.00 0.00 N ATOM 716 CD2 HIS A 47 -3.175 -16.735 3.162 1.00 0.00 C ATOM 717 CE1 HIS A 47 -3.249 -18.741 2.560 1.00 0.00 C ATOM 718 NE2 HIS A 47 -4.082 -17.783 3.083 1.00 0.00 N ATOM 0 H HIS A 47 0.497 -17.382 0.714 1.00 0.00 H new ATOM 0 HA HIS A 47 -1.390 -15.198 0.847 1.00 0.00 H new ATOM 0 HB2 HIS A 47 0.208 -16.794 2.890 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -0.776 -15.425 3.369 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -3.414 -15.749 3.532 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -3.631 -19.729 2.351 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -5.069 -17.828 3.337 1.00 0.00 H new ATOM 726 N PHE A 48 -0.106 -13.133 1.356 1.00 0.00 N ATOM 727 CA PHE A 48 0.599 -11.827 1.379 1.00 0.00 C ATOM 728 C PHE A 48 -0.116 -10.941 2.431 1.00 0.00 C ATOM 729 O PHE A 48 -1.232 -10.472 2.192 1.00 0.00 O ATOM 730 CB PHE A 48 0.545 -11.158 -0.025 1.00 0.00 C ATOM 731 CG PHE A 48 1.722 -11.464 -0.963 1.00 0.00 C ATOM 732 CD1 PHE A 48 1.748 -12.616 -1.756 1.00 0.00 C ATOM 733 CD2 PHE A 48 2.739 -10.517 -1.101 1.00 0.00 C ATOM 734 CE1 PHE A 48 2.778 -12.812 -2.675 1.00 0.00 C ATOM 735 CE2 PHE A 48 3.762 -10.708 -2.023 1.00 0.00 C ATOM 736 CZ PHE A 48 3.783 -11.856 -2.807 1.00 0.00 C ATOM 0 H PHE A 48 -1.122 -13.041 1.333 1.00 0.00 H new ATOM 0 HA PHE A 48 1.650 -11.959 1.638 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -0.376 -11.468 -0.518 1.00 0.00 H new ATOM 0 HB3 PHE A 48 0.486 -10.078 0.111 1.00 0.00 H new ATOM 0 HD1 PHE A 48 0.968 -13.356 -1.656 1.00 0.00 H new ATOM 0 HD2 PHE A 48 2.731 -9.629 -0.486 1.00 0.00 H new ATOM 0 HE1 PHE A 48 2.797 -13.704 -3.284 1.00 0.00 H new ATOM 0 HE2 PHE A 48 4.539 -9.966 -2.130 1.00 0.00 H new ATOM 0 HZ PHE A 48 4.580 -12.007 -3.520 1.00 0.00 H new ATOM 746 N LYS A 49 0.547 -10.702 3.577 1.00 0.00 N ATOM 747 CA LYS A 49 -0.005 -9.864 4.677 1.00 0.00 C ATOM 748 C LYS A 49 0.672 -8.471 4.623 1.00 0.00 C ATOM 749 O LYS A 49 1.833 -8.309 5.015 1.00 0.00 O ATOM 750 CB LYS A 49 0.189 -10.578 6.042 1.00 0.00 C ATOM 751 CG LYS A 49 -0.870 -11.672 6.320 1.00 0.00 C ATOM 752 CD LYS A 49 -0.672 -12.454 7.635 1.00 0.00 C ATOM 753 CE LYS A 49 0.416 -13.544 7.603 1.00 0.00 C ATOM 754 NZ LYS A 49 0.017 -14.725 6.810 1.00 0.00 N ATOM 0 H LYS A 49 1.475 -11.078 3.774 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.079 -9.721 4.555 1.00 0.00 H new ATOM 0 HB2 LYS A 49 1.181 -11.028 6.070 1.00 0.00 H new ATOM 0 HB3 LYS A 49 0.152 -9.836 6.840 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -1.855 -11.206 6.337 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -0.866 -12.379 5.491 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -0.427 -11.745 8.426 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -1.620 -12.919 7.906 1.00 0.00 H new ATOM 0 HE2 LYS A 49 1.332 -13.125 7.187 1.00 0.00 H new ATOM 0 HE3 LYS A 49 0.642 -13.856 8.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 0.785 -15.427 6.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -0.842 -15.145 7.220 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -0.173 -14.436 5.829 1.00 0.00 H new ATOM 768 N PHE A 50 -0.081 -7.482 4.111 1.00 0.00 N ATOM 769 CA PHE A 50 0.425 -6.109 3.848 1.00 0.00 C ATOM 770 C PHE A 50 -0.241 -5.087 4.815 1.00 0.00 C ATOM 771 O PHE A 50 -1.453 -5.136 5.050 1.00 0.00 O ATOM 772 CB PHE A 50 0.266 -5.754 2.337 1.00 0.00 C ATOM 773 CG PHE A 50 -1.158 -5.576 1.766 1.00 0.00 C ATOM 774 CD1 PHE A 50 -1.910 -6.680 1.348 1.00 0.00 C ATOM 775 CD2 PHE A 50 -1.710 -4.295 1.662 1.00 0.00 C ATOM 776 CE1 PHE A 50 -3.198 -6.503 0.851 1.00 0.00 C ATOM 777 CE2 PHE A 50 -2.989 -4.117 1.143 1.00 0.00 C ATOM 778 CZ PHE A 50 -3.729 -5.221 0.731 1.00 0.00 C ATOM 0 H PHE A 50 -1.063 -7.606 3.864 1.00 0.00 H new ATOM 0 HA PHE A 50 1.494 -6.061 4.057 1.00 0.00 H new ATOM 0 HB2 PHE A 50 0.814 -4.830 2.155 1.00 0.00 H new ATOM 0 HB3 PHE A 50 0.759 -6.536 1.759 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -1.489 -7.673 1.411 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -1.139 -3.438 1.987 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -3.786 -7.360 0.558 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -3.406 -3.124 1.060 1.00 0.00 H new ATOM 0 HZ PHE A 50 -4.717 -5.084 0.317 1.00 0.00 H new ATOM 788 N THR A 51 0.572 -4.164 5.363 1.00 0.00 N ATOM 789 CA THR A 51 0.107 -3.160 6.365 1.00 0.00 C ATOM 790 C THR A 51 0.543 -1.759 5.855 1.00 0.00 C ATOM 791 O THR A 51 1.722 -1.403 5.928 1.00 0.00 O ATOM 792 CB THR A 51 0.644 -3.529 7.784 1.00 0.00 C ATOM 793 OG1 THR A 51 0.116 -4.792 8.179 1.00 0.00 O ATOM 794 CG2 THR A 51 0.291 -2.523 8.894 1.00 0.00 C ATOM 0 H THR A 51 1.563 -4.085 5.133 1.00 0.00 H new ATOM 0 HA THR A 51 -0.978 -3.152 6.470 1.00 0.00 H new ATOM 0 HB THR A 51 1.729 -3.533 7.681 1.00 0.00 H new ATOM 0 HG1 THR A 51 0.455 -5.024 9.069 1.00 0.00 H new ATOM 0 HG21 THR A 51 0.707 -2.866 9.841 1.00 0.00 H new ATOM 0 HG22 THR A 51 0.708 -1.547 8.646 1.00 0.00 H new ATOM 0 HG23 THR A 51 -0.793 -2.443 8.981 1.00 0.00 H new ATOM 802 N ILE A 52 -0.425 -0.964 5.358 1.00 0.00 N ATOM 803 CA ILE A 52 -0.153 0.392 4.801 1.00 0.00 C ATOM 804 C ILE A 52 -0.458 1.404 5.941 1.00 0.00 C ATOM 805 O ILE A 52 -1.596 1.492 6.412 1.00 0.00 O ATOM 806 CB ILE A 52 -0.985 0.705 3.504 1.00 0.00 C ATOM 807 CG1 ILE A 52 -1.017 -0.414 2.417 1.00 0.00 C ATOM 808 CG2 ILE A 52 -0.583 2.056 2.856 1.00 0.00 C ATOM 809 CD1 ILE A 52 0.331 -0.838 1.812 1.00 0.00 C ATOM 0 H ILE A 52 -1.409 -1.232 5.327 1.00 0.00 H new ATOM 0 HA ILE A 52 0.886 0.460 4.478 1.00 0.00 H new ATOM 0 HB ILE A 52 -2.003 0.765 3.888 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -1.485 -1.297 2.853 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -1.662 -0.079 1.605 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -1.186 2.226 1.964 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -0.751 2.865 3.567 1.00 0.00 H new ATOM 0 HG23 ILE A 52 0.471 2.028 2.581 1.00 0.00 H new ATOM 0 HD11 ILE A 52 0.167 -1.621 1.072 1.00 0.00 H new ATOM 0 HD12 ILE A 52 0.801 0.021 1.334 1.00 0.00 H new ATOM 0 HD13 ILE A 52 0.981 -1.215 2.601 1.00 0.00 H new ATOM 821 N THR A 53 0.558 2.186 6.339 1.00 0.00 N ATOM 822 CA THR A 53 0.389 3.280 7.339 1.00 0.00 C ATOM 823 C THR A 53 0.052 4.586 6.558 1.00 0.00 C ATOM 824 O THR A 53 0.946 5.310 6.108 1.00 0.00 O ATOM 825 CB THR A 53 1.614 3.409 8.298 1.00 0.00 C ATOM 826 OG1 THR A 53 2.796 3.763 7.592 1.00 0.00 O ATOM 827 CG2 THR A 53 1.926 2.154 9.137 1.00 0.00 C ATOM 0 H THR A 53 1.511 2.089 5.989 1.00 0.00 H new ATOM 0 HA THR A 53 -0.437 3.053 8.014 1.00 0.00 H new ATOM 0 HB THR A 53 1.311 4.197 8.987 1.00 0.00 H new ATOM 0 HG1 THR A 53 3.020 3.054 6.953 1.00 0.00 H new ATOM 0 HG21 THR A 53 2.793 2.345 9.769 1.00 0.00 H new ATOM 0 HG22 THR A 53 1.067 1.912 9.763 1.00 0.00 H new ATOM 0 HG23 THR A 53 2.139 1.316 8.473 1.00 0.00 H new ATOM 901 N ILE A 59 -4.348 0.943 7.515 1.00 0.00 N ATOM 902 CA ILE A 59 -5.308 0.089 6.757 1.00 0.00 C ATOM 903 C ILE A 59 -4.504 -1.188 6.364 1.00 0.00 C ATOM 904 O ILE A 59 -3.640 -1.144 5.480 1.00 0.00 O ATOM 905 CB ILE A 59 -5.945 0.871 5.549 1.00 0.00 C ATOM 906 CG1 ILE A 59 -6.785 2.106 6.009 1.00 0.00 C ATOM 907 CG2 ILE A 59 -6.820 -0.052 4.657 1.00 0.00 C ATOM 908 CD1 ILE A 59 -7.177 3.103 4.906 1.00 0.00 C ATOM 0 HA ILE A 59 -6.178 -0.200 7.347 1.00 0.00 H new ATOM 0 HB ILE A 59 -5.104 1.235 4.959 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -7.696 1.744 6.484 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -6.219 2.642 6.771 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -7.240 0.528 3.835 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -6.206 -0.858 4.255 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -7.628 -0.474 5.254 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -7.756 3.917 5.341 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -6.276 3.506 4.443 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -7.777 2.594 4.152 1.00 0.00 H new ATOM 920 N GLN A 60 -4.823 -2.312 7.032 1.00 0.00 N ATOM 921 CA GLN A 60 -4.152 -3.620 6.825 1.00 0.00 C ATOM 922 C GLN A 60 -5.159 -4.666 6.271 1.00 0.00 C ATOM 923 O GLN A 60 -6.264 -4.841 6.797 1.00 0.00 O ATOM 924 CB GLN A 60 -3.422 -4.112 8.107 1.00 0.00 C ATOM 925 CG GLN A 60 -4.225 -4.417 9.399 1.00 0.00 C ATOM 926 CD GLN A 60 -4.706 -3.184 10.188 1.00 0.00 C ATOM 927 OE1 GLN A 60 -5.848 -2.742 10.051 1.00 0.00 O ATOM 928 NE2 GLN A 60 -3.856 -2.606 11.023 1.00 0.00 N ATOM 0 H GLN A 60 -5.559 -2.344 7.738 1.00 0.00 H new ATOM 0 HA GLN A 60 -3.373 -3.486 6.075 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -2.881 -5.021 7.841 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -2.675 -3.360 8.362 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -5.095 -5.018 9.132 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -3.605 -5.028 10.056 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -2.913 -2.979 11.130 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -4.145 -1.788 11.559 1.00 0.00 H new ATOM 937 N ASN A 61 -4.741 -5.357 5.197 1.00 0.00 N ATOM 938 CA ASN A 61 -5.538 -6.435 4.539 1.00 0.00 C ATOM 939 C ASN A 61 -4.572 -7.570 4.059 1.00 0.00 C ATOM 940 O ASN A 61 -3.341 -7.454 4.138 1.00 0.00 O ATOM 941 CB ASN A 61 -6.390 -5.861 3.365 1.00 0.00 C ATOM 942 CG ASN A 61 -7.516 -4.876 3.733 1.00 0.00 C ATOM 943 OD1 ASN A 61 -8.582 -5.267 4.206 1.00 0.00 O ATOM 944 ND2 ASN A 61 -7.301 -3.587 3.520 1.00 0.00 N ATOM 0 H ASN A 61 -3.839 -5.192 4.751 1.00 0.00 H new ATOM 0 HA ASN A 61 -6.240 -6.859 5.257 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -5.716 -5.360 2.671 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -6.835 -6.699 2.828 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -8.024 -2.905 3.749 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -6.412 -3.276 3.127 1.00 0.00 H new ATOM 951 N GLU A 62 -5.135 -8.693 3.556 1.00 0.00 N ATOM 952 CA GLU A 62 -4.328 -9.814 2.996 1.00 0.00 C ATOM 953 C GLU A 62 -5.007 -10.471 1.763 1.00 0.00 C ATOM 954 O GLU A 62 -6.201 -10.789 1.789 1.00 0.00 O ATOM 955 CB GLU A 62 -3.917 -10.847 4.081 1.00 0.00 C ATOM 956 CG GLU A 62 -5.033 -11.648 4.788 1.00 0.00 C ATOM 957 CD GLU A 62 -4.473 -12.650 5.803 1.00 0.00 C ATOM 958 OE1 GLU A 62 -4.016 -13.739 5.389 1.00 0.00 O ATOM 959 OE2 GLU A 62 -4.481 -12.349 7.016 1.00 0.00 O ATOM 0 H GLU A 62 -6.142 -8.851 3.524 1.00 0.00 H new ATOM 0 HA GLU A 62 -3.399 -9.377 2.631 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -3.236 -11.562 3.619 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -3.351 -10.317 4.847 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -5.707 -10.958 5.295 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -5.624 -12.180 4.042 1.00 0.00 H new ATOM 966 N PHE A 63 -4.205 -10.699 0.703 1.00 0.00 N ATOM 967 CA PHE A 63 -4.625 -11.464 -0.505 1.00 0.00 C ATOM 968 C PHE A 63 -3.896 -12.833 -0.588 1.00 0.00 C ATOM 969 O PHE A 63 -2.729 -12.966 -0.205 1.00 0.00 O ATOM 970 CB PHE A 63 -4.451 -10.636 -1.816 1.00 0.00 C ATOM 971 CG PHE A 63 -3.029 -10.193 -2.223 1.00 0.00 C ATOM 972 CD1 PHE A 63 -2.184 -11.061 -2.926 1.00 0.00 C ATOM 973 CD2 PHE A 63 -2.572 -8.913 -1.896 1.00 0.00 C ATOM 974 CE1 PHE A 63 -0.901 -10.656 -3.280 1.00 0.00 C ATOM 975 CE2 PHE A 63 -1.283 -8.515 -2.238 1.00 0.00 C ATOM 976 CZ PHE A 63 -0.449 -9.388 -2.929 1.00 0.00 C ATOM 0 H PHE A 63 -3.244 -10.360 0.654 1.00 0.00 H new ATOM 0 HA PHE A 63 -5.691 -11.665 -0.402 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -4.863 -11.223 -2.637 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -5.065 -9.740 -1.726 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -2.530 -12.048 -3.194 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -3.224 -8.228 -1.374 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -0.255 -11.327 -3.828 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -0.931 -7.530 -1.968 1.00 0.00 H new ATOM 0 HZ PHE A 63 0.552 -9.081 -3.194 1.00 0.00 H new ATOM 986 N THR A 64 -4.587 -13.823 -1.176 1.00 0.00 N ATOM 987 CA THR A 64 -3.981 -15.127 -1.559 1.00 0.00 C ATOM 988 C THR A 64 -3.887 -15.145 -3.112 1.00 0.00 C ATOM 989 O THR A 64 -4.894 -14.967 -3.804 1.00 0.00 O ATOM 990 CB THR A 64 -4.824 -16.306 -0.987 1.00 0.00 C ATOM 991 OG1 THR A 64 -5.013 -16.149 0.417 1.00 0.00 O ATOM 992 CG2 THR A 64 -4.177 -17.684 -1.198 1.00 0.00 C ATOM 0 H THR A 64 -5.579 -13.751 -1.402 1.00 0.00 H new ATOM 0 HA THR A 64 -2.983 -15.249 -1.139 1.00 0.00 H new ATOM 0 HB THR A 64 -5.767 -16.272 -1.533 1.00 0.00 H new ATOM 0 HG1 THR A 64 -4.613 -16.909 0.888 1.00 0.00 H new ATOM 0 HG21 THR A 64 -4.819 -18.456 -0.775 1.00 0.00 H new ATOM 0 HG22 THR A 64 -4.046 -17.865 -2.265 1.00 0.00 H new ATOM 0 HG23 THR A 64 -3.206 -17.709 -0.704 1.00 0.00 H new ATOM 1000 N VAL A 65 -2.679 -15.387 -3.656 1.00 0.00 N ATOM 1001 CA VAL A 65 -2.409 -15.366 -5.126 1.00 0.00 C ATOM 1002 C VAL A 65 -3.111 -16.585 -5.805 1.00 0.00 C ATOM 1003 O VAL A 65 -2.898 -17.738 -5.415 1.00 0.00 O ATOM 1004 CB VAL A 65 -0.862 -15.318 -5.395 1.00 0.00 C ATOM 1005 CG1 VAL A 65 -0.442 -15.460 -6.879 1.00 0.00 C ATOM 1006 CG2 VAL A 65 -0.187 -14.031 -4.859 1.00 0.00 C ATOM 0 H VAL A 65 -1.854 -15.604 -3.096 1.00 0.00 H new ATOM 0 HA VAL A 65 -2.828 -14.464 -5.572 1.00 0.00 H new ATOM 0 HB VAL A 65 -0.518 -16.196 -4.849 1.00 0.00 H new ATOM 0 HG11 VAL A 65 0.644 -15.414 -6.956 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -0.793 -16.416 -7.267 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -0.881 -14.650 -7.461 1.00 0.00 H new ATOM 0 HG21 VAL A 65 0.880 -14.062 -5.078 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -0.631 -13.160 -5.341 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -0.335 -13.964 -3.781 1.00 0.00 H new ATOM 1016 N GLY A 66 -3.961 -16.286 -6.803 1.00 0.00 N ATOM 1017 CA GLY A 66 -4.826 -17.304 -7.454 1.00 0.00 C ATOM 1018 C GLY A 66 -6.276 -17.438 -6.918 1.00 0.00 C ATOM 1019 O GLY A 66 -7.205 -17.569 -7.719 1.00 0.00 O ATOM 0 H GLY A 66 -4.073 -15.346 -7.182 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -4.877 -17.075 -8.518 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.338 -18.274 -7.360 1.00 0.00 H new ATOM 1023 N GLU A 67 -6.454 -17.450 -5.583 1.00 0.00 N ATOM 1024 CA GLU A 67 -7.760 -17.704 -4.913 1.00 0.00 C ATOM 1025 C GLU A 67 -8.377 -16.365 -4.417 1.00 0.00 C ATOM 1026 O GLU A 67 -7.698 -15.558 -3.771 1.00 0.00 O ATOM 1027 CB GLU A 67 -7.489 -18.716 -3.758 1.00 0.00 C ATOM 1028 CG GLU A 67 -8.712 -19.310 -3.022 1.00 0.00 C ATOM 1029 CD GLU A 67 -9.367 -18.396 -1.976 1.00 0.00 C ATOM 1030 OE1 GLU A 67 -8.684 -17.991 -1.009 1.00 0.00 O ATOM 1031 OE2 GLU A 67 -10.569 -18.080 -2.119 1.00 0.00 O ATOM 0 H GLU A 67 -5.692 -17.283 -4.926 1.00 0.00 H new ATOM 0 HA GLU A 67 -8.493 -18.133 -5.597 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -6.909 -19.543 -4.166 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -6.860 -18.220 -3.018 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -9.464 -19.580 -3.764 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -8.404 -20.233 -2.530 1.00 0.00 H new ATOM 1038 N GLU A 68 -9.679 -16.159 -4.707 1.00 0.00 N ATOM 1039 CA GLU A 68 -10.404 -14.880 -4.455 1.00 0.00 C ATOM 1040 C GLU A 68 -10.279 -14.280 -3.017 1.00 0.00 C ATOM 1041 O GLU A 68 -10.374 -15.002 -2.019 1.00 0.00 O ATOM 1042 CB GLU A 68 -11.876 -14.981 -4.939 1.00 0.00 C ATOM 1043 CG GLU A 68 -12.785 -15.954 -4.162 1.00 0.00 C ATOM 1044 CD GLU A 68 -14.254 -15.873 -4.583 1.00 0.00 C ATOM 1045 OE1 GLU A 68 -14.628 -16.499 -5.601 1.00 0.00 O ATOM 1046 OE2 GLU A 68 -15.042 -15.182 -3.901 1.00 0.00 O ATOM 0 H GLU A 68 -10.268 -16.878 -5.127 1.00 0.00 H new ATOM 0 HA GLU A 68 -9.879 -14.140 -5.059 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -12.320 -13.987 -4.893 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -11.872 -15.280 -5.987 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -12.427 -16.973 -4.311 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -12.707 -15.741 -3.096 1.00 0.00 H new ATOM 1053 N CYS A 69 -10.033 -12.959 -2.956 1.00 0.00 N ATOM 1054 CA CYS A 69 -9.769 -12.228 -1.691 1.00 0.00 C ATOM 1055 C CYS A 69 -10.591 -10.919 -1.624 1.00 0.00 C ATOM 1056 O CYS A 69 -10.689 -10.153 -2.589 1.00 0.00 O ATOM 1057 CB CYS A 69 -8.268 -11.922 -1.535 1.00 0.00 C ATOM 1058 SG CYS A 69 -7.602 -11.016 -2.970 1.00 0.00 S ATOM 0 H CYS A 69 -10.010 -12.361 -3.782 1.00 0.00 H new ATOM 0 HA CYS A 69 -10.078 -12.871 -0.867 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -8.110 -11.335 -0.630 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -7.719 -12.855 -1.409 1.00 0.00 H new ATOM 0 HG CYS A 69 -8.558 -10.346 -3.542 1.00 0.00 H new ATOM 1064 N GLU A 70 -11.139 -10.678 -0.425 1.00 0.00 N ATOM 1065 CA GLU A 70 -11.963 -9.479 -0.116 1.00 0.00 C ATOM 1066 C GLU A 70 -11.084 -8.378 0.544 1.00 0.00 C ATOM 1067 O GLU A 70 -10.851 -8.378 1.757 1.00 0.00 O ATOM 1068 CB GLU A 70 -13.263 -9.841 0.654 1.00 0.00 C ATOM 1069 CG GLU A 70 -13.095 -10.680 1.936 1.00 0.00 C ATOM 1070 CD GLU A 70 -14.361 -10.838 2.783 1.00 0.00 C ATOM 1071 OE1 GLU A 70 -15.438 -11.157 2.232 1.00 0.00 O ATOM 1072 OE2 GLU A 70 -14.277 -10.661 4.019 1.00 0.00 O ATOM 0 H GLU A 70 -11.028 -11.308 0.370 1.00 0.00 H new ATOM 0 HA GLU A 70 -12.332 -9.046 -1.046 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -13.772 -8.914 0.918 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -13.921 -10.384 -0.025 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -12.737 -11.671 1.658 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -12.320 -10.223 2.551 1.00 0.00 H new ATOM 1079 N LEU A 71 -10.591 -7.446 -0.289 1.00 0.00 N ATOM 1080 CA LEU A 71 -9.740 -6.309 0.158 1.00 0.00 C ATOM 1081 C LEU A 71 -10.615 -5.034 0.324 1.00 0.00 C ATOM 1082 O LEU A 71 -11.541 -4.801 -0.458 1.00 0.00 O ATOM 1083 CB LEU A 71 -8.593 -6.051 -0.866 1.00 0.00 C ATOM 1084 CG LEU A 71 -7.601 -7.216 -1.164 1.00 0.00 C ATOM 1085 CD1 LEU A 71 -6.571 -6.791 -2.230 1.00 0.00 C ATOM 1086 CD2 LEU A 71 -6.872 -7.734 0.090 1.00 0.00 C ATOM 0 H LEU A 71 -10.766 -7.452 -1.294 1.00 0.00 H new ATOM 0 HA LEU A 71 -9.290 -6.559 1.119 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -9.049 -5.751 -1.810 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -8.012 -5.201 -0.509 1.00 0.00 H new ATOM 0 HG LEU A 71 -8.207 -8.040 -1.541 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -5.887 -7.617 -2.425 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -7.089 -6.524 -3.151 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -6.007 -5.931 -1.869 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.198 -8.544 -0.189 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -6.299 -6.923 0.539 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -7.603 -8.103 0.810 1.00 0.00 H new ATOM 1180 N LYS A 78 -15.666 -3.340 0.459 1.00 0.00 N ATOM 1181 CA LYS A 78 -15.072 -4.635 0.027 1.00 0.00 C ATOM 1182 C LYS A 78 -15.098 -4.732 -1.523 1.00 0.00 C ATOM 1183 O LYS A 78 -16.008 -4.252 -2.208 1.00 0.00 O ATOM 1184 CB LYS A 78 -15.804 -5.857 0.659 1.00 0.00 C ATOM 1185 CG LYS A 78 -15.367 -6.174 2.103 1.00 0.00 C ATOM 1186 CD LYS A 78 -16.220 -7.262 2.780 1.00 0.00 C ATOM 1187 CE LYS A 78 -15.768 -7.532 4.227 1.00 0.00 C ATOM 1188 NZ LYS A 78 -16.628 -8.535 4.880 1.00 0.00 N ATOM 0 HA LYS A 78 -14.041 -4.662 0.379 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -16.878 -5.669 0.649 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -15.628 -6.734 0.037 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -14.325 -6.493 2.097 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -15.418 -5.262 2.698 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -17.266 -6.956 2.778 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -16.157 -8.184 2.202 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -14.735 -7.880 4.228 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -15.792 -6.603 4.797 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -16.733 -8.299 5.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -17.563 -8.539 4.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -16.195 -9.476 4.789 1.00 0.00 H new ATOM 1202 N VAL A 79 -14.059 -5.404 -2.044 1.00 0.00 N ATOM 1203 CA VAL A 79 -13.858 -5.624 -3.498 1.00 0.00 C ATOM 1204 C VAL A 79 -13.204 -7.028 -3.678 1.00 0.00 C ATOM 1205 O VAL A 79 -12.137 -7.309 -3.123 1.00 0.00 O ATOM 1206 CB VAL A 79 -13.086 -4.437 -4.178 1.00 0.00 C ATOM 1207 CG1 VAL A 79 -11.693 -4.084 -3.606 1.00 0.00 C ATOM 1208 CG2 VAL A 79 -12.976 -4.616 -5.703 1.00 0.00 C ATOM 0 H VAL A 79 -13.325 -5.816 -1.469 1.00 0.00 H new ATOM 0 HA VAL A 79 -14.811 -5.628 -4.028 1.00 0.00 H new ATOM 0 HB VAL A 79 -13.721 -3.587 -3.930 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -11.271 -3.249 -4.165 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -11.790 -3.806 -2.557 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -11.034 -4.948 -3.693 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -12.435 -3.772 -6.130 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -12.440 -5.539 -5.923 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -13.975 -4.664 -6.137 1.00 0.00 H new ATOM 1218 N LYS A 80 -13.836 -7.881 -4.510 1.00 0.00 N ATOM 1219 CA LYS A 80 -13.249 -9.179 -4.943 1.00 0.00 C ATOM 1220 C LYS A 80 -12.288 -8.918 -6.140 1.00 0.00 C ATOM 1221 O LYS A 80 -12.718 -8.584 -7.249 1.00 0.00 O ATOM 1222 CB LYS A 80 -14.347 -10.212 -5.309 1.00 0.00 C ATOM 1223 CG LYS A 80 -15.133 -10.766 -4.099 1.00 0.00 C ATOM 1224 CD LYS A 80 -16.188 -11.816 -4.497 1.00 0.00 C ATOM 1225 CE LYS A 80 -16.955 -12.369 -3.281 1.00 0.00 C ATOM 1226 NZ LYS A 80 -17.959 -13.369 -3.684 1.00 0.00 N ATOM 0 H LYS A 80 -14.760 -7.698 -4.901 1.00 0.00 H new ATOM 0 HA LYS A 80 -12.687 -9.612 -4.115 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -15.049 -9.747 -6.001 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -13.883 -11.045 -5.837 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -14.434 -11.212 -3.391 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -15.625 -9.941 -3.584 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -16.895 -11.370 -5.196 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -15.699 -12.638 -5.019 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -16.252 -12.820 -2.581 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -17.446 -11.550 -2.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -18.457 -13.720 -2.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -18.644 -12.931 -4.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -17.486 -14.162 -4.163 1.00 0.00 H new ATOM 1240 N THR A 81 -10.982 -9.030 -5.860 1.00 0.00 N ATOM 1241 CA THR A 81 -9.900 -8.625 -6.797 1.00 0.00 C ATOM 1242 C THR A 81 -8.650 -9.456 -6.396 1.00 0.00 C ATOM 1243 O THR A 81 -8.028 -9.180 -5.364 1.00 0.00 O ATOM 1244 CB THR A 81 -9.662 -7.078 -6.805 1.00 0.00 C ATOM 1245 OG1 THR A 81 -8.595 -6.766 -7.686 1.00 0.00 O ATOM 1246 CG2 THR A 81 -9.358 -6.411 -5.454 1.00 0.00 C ATOM 0 H THR A 81 -10.635 -9.404 -4.977 1.00 0.00 H new ATOM 0 HA THR A 81 -10.169 -8.837 -7.832 1.00 0.00 H new ATOM 0 HB THR A 81 -10.624 -6.675 -7.122 1.00 0.00 H new ATOM 0 HG1 THR A 81 -8.955 -6.542 -8.570 1.00 0.00 H new ATOM 0 HG21 THR A 81 -9.214 -5.341 -5.601 1.00 0.00 H new ATOM 0 HG22 THR A 81 -10.192 -6.575 -4.771 1.00 0.00 H new ATOM 0 HG23 THR A 81 -8.452 -6.844 -5.030 1.00 0.00 H new ATOM 1254 N VAL A 82 -8.302 -10.478 -7.206 1.00 0.00 N ATOM 1255 CA VAL A 82 -7.175 -11.401 -6.896 1.00 0.00 C ATOM 1256 C VAL A 82 -5.933 -11.067 -7.772 1.00 0.00 C ATOM 1257 O VAL A 82 -6.010 -10.827 -8.982 1.00 0.00 O ATOM 1258 CB VAL A 82 -7.605 -12.903 -6.868 1.00 0.00 C ATOM 1259 CG1 VAL A 82 -8.049 -13.552 -8.194 1.00 0.00 C ATOM 1260 CG2 VAL A 82 -6.510 -13.782 -6.237 1.00 0.00 C ATOM 0 H VAL A 82 -8.782 -10.690 -8.081 1.00 0.00 H new ATOM 0 HA VAL A 82 -6.856 -11.228 -5.868 1.00 0.00 H new ATOM 0 HB VAL A 82 -8.510 -12.863 -6.262 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -8.317 -14.594 -8.017 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -8.913 -13.017 -8.590 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -7.232 -13.505 -8.914 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -6.837 -14.822 -6.231 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -5.592 -13.693 -6.818 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -6.325 -13.454 -5.214 1.00 0.00 H new ATOM 1270 N VAL A 83 -4.782 -11.081 -7.088 1.00 0.00 N ATOM 1271 CA VAL A 83 -3.476 -10.648 -7.632 1.00 0.00 C ATOM 1272 C VAL A 83 -2.770 -11.878 -8.278 1.00 0.00 C ATOM 1273 O VAL A 83 -2.721 -12.965 -7.694 1.00 0.00 O ATOM 1274 CB VAL A 83 -2.637 -10.027 -6.465 1.00 0.00 C ATOM 1275 CG1 VAL A 83 -1.257 -9.519 -6.923 1.00 0.00 C ATOM 1276 CG2 VAL A 83 -3.316 -8.858 -5.701 1.00 0.00 C ATOM 0 H VAL A 83 -4.725 -11.399 -6.121 1.00 0.00 H new ATOM 0 HA VAL A 83 -3.594 -9.889 -8.406 1.00 0.00 H new ATOM 0 HB VAL A 83 -2.542 -10.874 -5.785 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -0.722 -9.100 -6.071 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -0.684 -10.348 -7.339 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -1.387 -8.750 -7.684 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -2.650 -8.502 -4.915 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -3.527 -8.044 -6.394 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -4.248 -9.207 -5.257 1.00 0.00 H new ATOM 1286 N GLN A 84 -2.187 -11.658 -9.468 1.00 0.00 N ATOM 1287 CA GLN A 84 -1.313 -12.654 -10.143 1.00 0.00 C ATOM 1288 C GLN A 84 0.159 -12.167 -10.044 1.00 0.00 C ATOM 1289 O GLN A 84 0.477 -10.997 -10.286 1.00 0.00 O ATOM 1290 CB GLN A 84 -1.733 -12.853 -11.624 1.00 0.00 C ATOM 1291 CG GLN A 84 -2.941 -13.784 -11.892 1.00 0.00 C ATOM 1292 CD GLN A 84 -4.301 -13.329 -11.325 1.00 0.00 C ATOM 1293 OE1 GLN A 84 -4.865 -14.088 -10.396 1.00 0.00 O flip ATOM 1294 NE2 GLN A 84 -4.851 -12.300 -11.715 1.00 0.00 N flip ATOM 0 H GLN A 84 -2.302 -10.792 -9.994 1.00 0.00 H new ATOM 0 HA GLN A 84 -1.414 -13.621 -9.650 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -1.959 -11.874 -12.047 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -0.875 -13.245 -12.170 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -3.045 -13.906 -12.970 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -2.712 -14.767 -11.481 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -4.407 -11.724 -12.430 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -5.751 -12.023 -11.323 1.00 0.00 H new ATOM 1303 N LEU A 85 1.046 -13.110 -9.694 1.00 0.00 N ATOM 1304 CA LEU A 85 2.480 -12.838 -9.457 1.00 0.00 C ATOM 1305 C LEU A 85 3.307 -13.363 -10.664 1.00 0.00 C ATOM 1306 O LEU A 85 3.449 -14.578 -10.849 1.00 0.00 O ATOM 1307 CB LEU A 85 2.868 -13.457 -8.084 1.00 0.00 C ATOM 1308 CG LEU A 85 4.358 -13.357 -7.665 1.00 0.00 C ATOM 1309 CD1 LEU A 85 4.922 -11.922 -7.706 1.00 0.00 C ATOM 1310 CD2 LEU A 85 4.584 -13.979 -6.273 1.00 0.00 C ATOM 0 H LEU A 85 0.792 -14.089 -9.566 1.00 0.00 H new ATOM 0 HA LEU A 85 2.698 -11.772 -9.394 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.266 -12.976 -7.313 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.589 -14.511 -8.096 1.00 0.00 H new ATOM 0 HG LEU A 85 4.910 -13.927 -8.412 1.00 0.00 H new ATOM 0 HD11 LEU A 85 5.968 -11.933 -7.400 1.00 0.00 H new ATOM 0 HD12 LEU A 85 4.845 -11.529 -8.720 1.00 0.00 H new ATOM 0 HD13 LEU A 85 4.352 -11.288 -7.027 1.00 0.00 H new ATOM 0 HD21 LEU A 85 5.637 -13.895 -6.004 1.00 0.00 H new ATOM 0 HD22 LEU A 85 3.978 -13.452 -5.536 1.00 0.00 H new ATOM 0 HD23 LEU A 85 4.297 -15.030 -6.293 1.00 0.00 H new ATOM 1322 N GLU A 86 3.864 -12.424 -11.452 1.00 0.00 N ATOM 1323 CA GLU A 86 4.764 -12.739 -12.593 1.00 0.00 C ATOM 1324 C GLU A 86 6.230 -12.397 -12.198 1.00 0.00 C ATOM 1325 O GLU A 86 6.539 -11.279 -11.769 1.00 0.00 O ATOM 1326 CB GLU A 86 4.318 -11.936 -13.840 1.00 0.00 C ATOM 1327 CG GLU A 86 4.957 -12.388 -15.173 1.00 0.00 C ATOM 1328 CD GLU A 86 4.550 -11.491 -16.344 1.00 0.00 C ATOM 1329 OE1 GLU A 86 3.501 -11.756 -16.974 1.00 0.00 O ATOM 1330 OE2 GLU A 86 5.273 -10.512 -16.636 1.00 0.00 O ATOM 0 H GLU A 86 3.707 -11.425 -11.321 1.00 0.00 H new ATOM 0 HA GLU A 86 4.710 -13.801 -12.834 1.00 0.00 H new ATOM 0 HB2 GLU A 86 3.234 -12.009 -13.931 1.00 0.00 H new ATOM 0 HB3 GLU A 86 4.555 -10.884 -13.680 1.00 0.00 H new ATOM 0 HG2 GLU A 86 6.042 -12.382 -15.074 1.00 0.00 H new ATOM 0 HG3 GLU A 86 4.662 -13.416 -15.385 1.00 0.00 H new ATOM 1337 N GLY A 87 7.121 -13.379 -12.388 1.00 0.00 N ATOM 1338 CA GLY A 87 8.589 -13.192 -12.213 1.00 0.00 C ATOM 1339 C GLY A 87 9.217 -13.016 -10.808 1.00 0.00 C ATOM 1340 O GLY A 87 10.399 -12.673 -10.719 1.00 0.00 O ATOM 0 H GLY A 87 6.859 -14.325 -12.666 1.00 0.00 H new ATOM 0 HA2 GLY A 87 9.076 -14.052 -12.673 1.00 0.00 H new ATOM 0 HA3 GLY A 87 8.870 -12.316 -12.798 1.00 0.00 H new ATOM 1344 N ASP A 88 8.430 -13.188 -9.734 1.00 0.00 N ATOM 1345 CA ASP A 88 8.752 -12.685 -8.363 1.00 0.00 C ATOM 1346 C ASP A 88 9.051 -11.144 -8.276 1.00 0.00 C ATOM 1347 O ASP A 88 10.012 -10.721 -7.625 1.00 0.00 O ATOM 1348 CB ASP A 88 9.768 -13.611 -7.630 1.00 0.00 C ATOM 1349 CG ASP A 88 9.730 -13.498 -6.096 1.00 0.00 C ATOM 1350 OD1 ASP A 88 8.795 -14.049 -5.472 1.00 0.00 O ATOM 1351 OD2 ASP A 88 10.628 -12.854 -5.510 1.00 0.00 O ATOM 0 H ASP A 88 7.540 -13.684 -9.780 1.00 0.00 H new ATOM 0 HA ASP A 88 7.829 -12.758 -7.788 1.00 0.00 H new ATOM 0 HB2 ASP A 88 9.569 -14.645 -7.912 1.00 0.00 H new ATOM 0 HB3 ASP A 88 10.774 -13.374 -7.976 1.00 0.00 H new ATOM 1356 N ASN A 89 8.211 -10.311 -8.930 1.00 0.00 N ATOM 1357 CA ASN A 89 8.376 -8.832 -8.966 1.00 0.00 C ATOM 1358 C ASN A 89 7.056 -8.066 -9.276 1.00 0.00 C ATOM 1359 O ASN A 89 6.794 -7.065 -8.607 1.00 0.00 O ATOM 1360 CB ASN A 89 9.570 -8.347 -9.838 1.00 0.00 C ATOM 1361 CG ASN A 89 9.489 -8.519 -11.372 1.00 0.00 C ATOM 1362 OD1 ASN A 89 9.188 -9.595 -11.888 1.00 0.00 O ATOM 1363 ND2 ASN A 89 9.773 -7.466 -12.126 1.00 0.00 N ATOM 0 H ASN A 89 7.398 -10.641 -9.450 1.00 0.00 H new ATOM 0 HA ASN A 89 8.642 -8.568 -7.943 1.00 0.00 H new ATOM 0 HB2 ASN A 89 9.720 -7.287 -9.632 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.463 -8.868 -9.494 1.00 0.00 H new ATOM 0 HD21 ASN A 89 9.743 -7.544 -13.143 1.00 0.00 H new ATOM 0 HD22 ASN A 89 10.021 -6.578 -11.689 1.00 0.00 H new ATOM 1370 N LYS A 90 6.241 -8.494 -10.264 1.00 0.00 N ATOM 1371 CA LYS A 90 4.980 -7.798 -10.633 1.00 0.00 C ATOM 1372 C LYS A 90 3.772 -8.399 -9.870 1.00 0.00 C ATOM 1373 O LYS A 90 3.500 -9.597 -9.964 1.00 0.00 O ATOM 1374 CB LYS A 90 4.719 -7.889 -12.161 1.00 0.00 C ATOM 1375 CG LYS A 90 5.634 -7.029 -13.054 1.00 0.00 C ATOM 1376 CD LYS A 90 5.278 -7.153 -14.552 1.00 0.00 C ATOM 1377 CE LYS A 90 6.125 -6.277 -15.494 1.00 0.00 C ATOM 1378 NZ LYS A 90 5.791 -4.841 -15.408 1.00 0.00 N ATOM 0 H LYS A 90 6.432 -9.323 -10.826 1.00 0.00 H new ATOM 0 HA LYS A 90 5.094 -6.750 -10.354 1.00 0.00 H new ATOM 0 HB2 LYS A 90 4.822 -8.930 -12.466 1.00 0.00 H new ATOM 0 HB3 LYS A 90 3.685 -7.602 -12.351 1.00 0.00 H new ATOM 0 HG2 LYS A 90 5.557 -5.985 -12.750 1.00 0.00 H new ATOM 0 HG3 LYS A 90 6.671 -7.329 -12.903 1.00 0.00 H new ATOM 0 HD2 LYS A 90 5.388 -8.195 -14.852 1.00 0.00 H new ATOM 0 HD3 LYS A 90 4.228 -6.893 -14.684 1.00 0.00 H new ATOM 0 HE2 LYS A 90 7.180 -6.413 -15.256 1.00 0.00 H new ATOM 0 HE3 LYS A 90 5.983 -6.616 -16.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 6.394 -4.305 -16.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 4.792 -4.701 -15.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 5.952 -4.505 -14.437 1.00 0.00 H new ATOM 1392 N LEU A 91 3.025 -7.530 -9.170 1.00 0.00 N ATOM 1393 CA LEU A 91 1.718 -7.875 -8.555 1.00 0.00 C ATOM 1394 C LEU A 91 0.633 -7.092 -9.348 1.00 0.00 C ATOM 1395 O LEU A 91 0.467 -5.882 -9.160 1.00 0.00 O ATOM 1396 CB LEU A 91 1.711 -7.499 -7.046 1.00 0.00 C ATOM 1397 CG LEU A 91 2.615 -8.306 -6.077 1.00 0.00 C ATOM 1398 CD1 LEU A 91 2.639 -7.624 -4.693 1.00 0.00 C ATOM 1399 CD2 LEU A 91 2.230 -9.791 -5.931 1.00 0.00 C ATOM 0 H LEU A 91 3.305 -6.562 -9.010 1.00 0.00 H new ATOM 0 HA LEU A 91 1.523 -8.946 -8.606 1.00 0.00 H new ATOM 0 HB2 LEU A 91 1.993 -6.449 -6.965 1.00 0.00 H new ATOM 0 HB3 LEU A 91 0.685 -7.582 -6.689 1.00 0.00 H new ATOM 0 HG LEU A 91 3.609 -8.304 -6.524 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.275 -8.195 -4.017 1.00 0.00 H new ATOM 0 HD12 LEU A 91 3.032 -6.612 -4.793 1.00 0.00 H new ATOM 0 HD13 LEU A 91 1.627 -7.582 -4.290 1.00 0.00 H new ATOM 0 HD21 LEU A 91 2.914 -10.278 -5.236 1.00 0.00 H new ATOM 0 HD22 LEU A 91 1.211 -9.867 -5.551 1.00 0.00 H new ATOM 0 HD23 LEU A 91 2.292 -10.280 -6.903 1.00 0.00 H new ATOM 1411 N VAL A 92 -0.078 -7.793 -10.253 1.00 0.00 N ATOM 1412 CA VAL A 92 -1.046 -7.168 -11.205 1.00 0.00 C ATOM 1413 C VAL A 92 -2.499 -7.546 -10.793 1.00 0.00 C ATOM 1414 O VAL A 92 -2.817 -8.732 -10.649 1.00 0.00 O ATOM 1415 CB VAL A 92 -0.732 -7.501 -12.705 1.00 0.00 C ATOM 1416 CG1 VAL A 92 0.586 -6.854 -13.189 1.00 0.00 C ATOM 1417 CG2 VAL A 92 -0.740 -8.999 -13.093 1.00 0.00 C ATOM 0 H VAL A 92 -0.005 -8.806 -10.353 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.940 -6.085 -11.137 1.00 0.00 H new ATOM 0 HB VAL A 92 -1.583 -7.057 -13.221 1.00 0.00 H new ATOM 0 HG11 VAL A 92 0.757 -7.115 -14.233 1.00 0.00 H new ATOM 0 HG12 VAL A 92 0.516 -5.771 -13.093 1.00 0.00 H new ATOM 0 HG13 VAL A 92 1.415 -7.220 -12.583 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -0.510 -9.101 -14.153 1.00 0.00 H new ATOM 0 HG22 VAL A 92 0.009 -9.531 -12.506 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -1.725 -9.421 -12.893 1.00 0.00 H new ATOM 1427 N THR A 93 -3.377 -6.536 -10.620 1.00 0.00 N ATOM 1428 CA THR A 93 -4.815 -6.773 -10.275 1.00 0.00 C ATOM 1429 C THR A 93 -5.753 -5.668 -10.855 1.00 0.00 C ATOM 1430 O THR A 93 -5.332 -4.535 -11.100 1.00 0.00 O ATOM 1431 CB THR A 93 -4.995 -7.036 -8.744 1.00 0.00 C ATOM 1432 OG1 THR A 93 -6.205 -7.749 -8.532 1.00 0.00 O ATOM 1433 CG2 THR A 93 -4.971 -5.814 -7.801 1.00 0.00 C ATOM 0 H THR A 93 -3.128 -5.551 -10.710 1.00 0.00 H new ATOM 0 HA THR A 93 -5.136 -7.689 -10.770 1.00 0.00 H new ATOM 0 HB THR A 93 -4.104 -7.602 -8.473 1.00 0.00 H new ATOM 0 HG1 THR A 93 -6.900 -7.130 -8.225 1.00 0.00 H new ATOM 0 HG21 THR A 93 -5.107 -6.146 -6.772 1.00 0.00 H new ATOM 0 HG22 THR A 93 -4.013 -5.302 -7.893 1.00 0.00 H new ATOM 0 HG23 THR A 93 -5.776 -5.130 -8.071 1.00 0.00 H new ATOM 1441 N THR A 94 -7.043 -6.018 -11.040 1.00 0.00 N ATOM 1442 CA THR A 94 -8.097 -5.067 -11.501 1.00 0.00 C ATOM 1443 C THR A 94 -9.078 -4.871 -10.309 1.00 0.00 C ATOM 1444 O THR A 94 -9.876 -5.756 -9.984 1.00 0.00 O ATOM 1445 CB THR A 94 -8.779 -5.573 -12.807 1.00 0.00 C ATOM 1446 OG1 THR A 94 -7.797 -5.751 -13.826 1.00 0.00 O ATOM 1447 CG2 THR A 94 -9.841 -4.610 -13.372 1.00 0.00 C ATOM 0 H THR A 94 -7.391 -6.963 -10.877 1.00 0.00 H new ATOM 0 HA THR A 94 -7.678 -4.099 -11.775 1.00 0.00 H new ATOM 0 HB THR A 94 -9.273 -6.505 -12.533 1.00 0.00 H new ATOM 0 HG1 THR A 94 -8.230 -6.071 -14.645 1.00 0.00 H new ATOM 0 HG21 THR A 94 -10.269 -5.033 -14.281 1.00 0.00 H new ATOM 0 HG22 THR A 94 -10.629 -4.464 -12.633 1.00 0.00 H new ATOM 0 HG23 THR A 94 -9.377 -3.651 -13.602 1.00 0.00 H new ATOM 1455 N PHE A 95 -8.979 -3.699 -9.660 1.00 0.00 N ATOM 1456 CA PHE A 95 -9.555 -3.440 -8.312 1.00 0.00 C ATOM 1457 C PHE A 95 -10.996 -2.869 -8.479 1.00 0.00 C ATOM 1458 O PHE A 95 -11.914 -3.647 -8.761 1.00 0.00 O ATOM 1459 CB PHE A 95 -8.460 -2.617 -7.562 1.00 0.00 C ATOM 1460 CG PHE A 95 -8.548 -2.439 -6.038 1.00 0.00 C ATOM 1461 CD1 PHE A 95 -9.205 -1.332 -5.485 1.00 0.00 C ATOM 1462 CD2 PHE A 95 -7.831 -3.296 -5.195 1.00 0.00 C ATOM 1463 CE1 PHE A 95 -9.163 -1.104 -4.113 1.00 0.00 C ATOM 1464 CE2 PHE A 95 -7.810 -3.079 -3.819 1.00 0.00 C ATOM 1465 CZ PHE A 95 -8.476 -1.984 -3.279 1.00 0.00 C ATOM 0 H PHE A 95 -8.494 -2.892 -10.052 1.00 0.00 H new ATOM 0 HA PHE A 95 -9.751 -4.302 -7.674 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -7.498 -3.081 -7.780 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -8.441 -1.621 -8.005 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -9.746 -0.653 -6.127 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -7.290 -4.132 -5.614 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -9.664 -0.244 -3.694 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -7.277 -3.760 -3.172 1.00 0.00 H new ATOM 0 HZ PHE A 95 -8.461 -1.816 -2.212 1.00 0.00 H new ATOM 1475 N LYS A 96 -11.192 -1.545 -8.348 1.00 0.00 N ATOM 1476 CA LYS A 96 -12.474 -0.858 -8.689 1.00 0.00 C ATOM 1477 C LYS A 96 -12.226 0.008 -9.957 1.00 0.00 C ATOM 1478 O LYS A 96 -12.012 1.221 -9.872 1.00 0.00 O ATOM 1479 CB LYS A 96 -12.973 0.000 -7.487 1.00 0.00 C ATOM 1480 CG LYS A 96 -13.519 -0.750 -6.251 1.00 0.00 C ATOM 1481 CD LYS A 96 -14.828 -1.549 -6.437 1.00 0.00 C ATOM 1482 CE LYS A 96 -16.068 -0.684 -6.740 1.00 0.00 C ATOM 1483 NZ LYS A 96 -17.294 -1.500 -6.809 1.00 0.00 N ATOM 0 H LYS A 96 -10.472 -0.910 -8.003 1.00 0.00 H new ATOM 0 HA LYS A 96 -13.258 -1.586 -8.896 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -12.147 0.632 -7.159 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -13.757 0.664 -7.851 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -12.748 -1.439 -5.905 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -13.677 -0.022 -5.455 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -14.691 -2.262 -7.250 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -15.017 -2.128 -5.533 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -16.179 0.077 -5.967 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -15.925 -0.160 -7.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -18.108 -0.886 -7.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -17.197 -2.210 -7.563 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -17.443 -1.980 -5.899 1.00 0.00 H new ATOM 1497 N ASN A 97 -12.200 -0.643 -11.142 1.00 0.00 N ATOM 1498 CA ASN A 97 -11.692 -0.057 -12.417 1.00 0.00 C ATOM 1499 C ASN A 97 -10.268 0.614 -12.352 1.00 0.00 C ATOM 1500 O ASN A 97 -10.039 1.687 -12.917 1.00 0.00 O ATOM 1501 CB ASN A 97 -12.782 0.820 -13.095 1.00 0.00 C ATOM 1502 CG ASN A 97 -14.154 0.168 -13.382 1.00 0.00 C ATOM 1503 OD1 ASN A 97 -15.084 0.267 -12.581 1.00 0.00 O ATOM 1504 ND2 ASN A 97 -14.308 -0.506 -14.512 1.00 0.00 N ATOM 0 H ASN A 97 -12.533 -1.601 -11.248 1.00 0.00 H new ATOM 0 HA ASN A 97 -11.496 -0.907 -13.071 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -12.951 1.692 -12.464 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -12.379 1.184 -14.040 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -15.202 -0.948 -14.724 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -13.532 -0.583 -15.170 1.00 0.00 H new ATOM 1511 N ILE A 98 -9.321 -0.040 -11.648 1.00 0.00 N ATOM 1512 CA ILE A 98 -7.969 0.505 -11.352 1.00 0.00 C ATOM 1513 C ILE A 98 -7.022 -0.679 -11.683 1.00 0.00 C ATOM 1514 O ILE A 98 -7.033 -1.698 -10.980 1.00 0.00 O ATOM 1515 CB ILE A 98 -7.830 0.974 -9.854 1.00 0.00 C ATOM 1516 CG1 ILE A 98 -8.750 2.168 -9.462 1.00 0.00 C ATOM 1517 CG2 ILE A 98 -6.370 1.324 -9.465 1.00 0.00 C ATOM 1518 CD1 ILE A 98 -9.167 2.203 -7.982 1.00 0.00 C ATOM 0 H ILE A 98 -9.470 -0.972 -11.262 1.00 0.00 H new ATOM 0 HA ILE A 98 -7.742 1.400 -11.931 1.00 0.00 H new ATOM 0 HB ILE A 98 -8.160 0.101 -9.291 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -8.236 3.099 -9.702 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -9.649 2.133 -10.077 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -6.337 1.640 -8.422 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -5.738 0.446 -9.598 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -6.008 2.132 -10.101 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -9.805 3.068 -7.804 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -9.713 1.292 -7.736 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -8.278 2.273 -7.355 1.00 0.00 H new ATOM 1530 N LYS A 99 -6.161 -0.516 -12.703 1.00 0.00 N ATOM 1531 CA LYS A 99 -5.126 -1.534 -13.028 1.00 0.00 C ATOM 1532 C LYS A 99 -3.865 -1.269 -12.149 1.00 0.00 C ATOM 1533 O LYS A 99 -3.006 -0.452 -12.497 1.00 0.00 O ATOM 1534 CB LYS A 99 -4.858 -1.557 -14.556 1.00 0.00 C ATOM 1535 CG LYS A 99 -4.145 -2.839 -15.044 1.00 0.00 C ATOM 1536 CD LYS A 99 -3.812 -2.866 -16.553 1.00 0.00 C ATOM 1537 CE LYS A 99 -5.006 -2.963 -17.527 1.00 0.00 C ATOM 1538 NZ LYS A 99 -5.740 -4.239 -17.423 1.00 0.00 N ATOM 0 H LYS A 99 -6.154 0.300 -13.315 1.00 0.00 H new ATOM 0 HA LYS A 99 -5.468 -2.540 -12.785 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -5.807 -1.457 -15.084 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -4.252 -0.691 -14.822 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -3.220 -2.959 -14.481 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -4.774 -3.698 -14.810 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -3.250 -1.964 -16.793 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -3.151 -3.712 -16.740 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -5.693 -2.139 -17.332 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -4.644 -2.842 -18.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -6.528 -4.242 -18.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -5.097 -5.028 -17.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -6.113 -4.347 -16.458 1.00 0.00 H new ATOM 1552 N SER A 100 -3.797 -1.961 -10.994 1.00 0.00 N ATOM 1553 CA SER A 100 -2.723 -1.782 -9.986 1.00 0.00 C ATOM 1554 C SER A 100 -1.510 -2.680 -10.342 1.00 0.00 C ATOM 1555 O SER A 100 -1.483 -3.872 -10.019 1.00 0.00 O ATOM 1556 CB SER A 100 -3.309 -2.089 -8.588 1.00 0.00 C ATOM 1557 OG SER A 100 -2.348 -1.839 -7.569 1.00 0.00 O ATOM 0 H SER A 100 -4.487 -2.664 -10.729 1.00 0.00 H new ATOM 0 HA SER A 100 -2.357 -0.755 -9.980 1.00 0.00 H new ATOM 0 HB2 SER A 100 -4.194 -1.476 -8.417 1.00 0.00 H new ATOM 0 HB3 SER A 100 -3.629 -3.130 -8.544 1.00 0.00 H new ATOM 0 HG SER A 100 -2.740 -2.038 -6.693 1.00 0.00 H new ATOM 1563 N VAL A 101 -0.527 -2.074 -11.026 1.00 0.00 N ATOM 1564 CA VAL A 101 0.668 -2.784 -11.559 1.00 0.00 C ATOM 1565 C VAL A 101 1.836 -2.411 -10.604 1.00 0.00 C ATOM 1566 O VAL A 101 2.355 -1.292 -10.663 1.00 0.00 O ATOM 1567 CB VAL A 101 0.935 -2.353 -13.046 1.00 0.00 C ATOM 1568 CG1 VAL A 101 2.278 -2.876 -13.605 1.00 0.00 C ATOM 1569 CG2 VAL A 101 -0.199 -2.763 -14.016 1.00 0.00 C ATOM 0 H VAL A 101 -0.530 -1.075 -11.231 1.00 0.00 H new ATOM 0 HA VAL A 101 0.538 -3.866 -11.587 1.00 0.00 H new ATOM 0 HB VAL A 101 0.977 -1.265 -12.994 1.00 0.00 H new ATOM 0 HG11 VAL A 101 2.398 -2.542 -14.635 1.00 0.00 H new ATOM 0 HG12 VAL A 101 3.099 -2.490 -13.000 1.00 0.00 H new ATOM 0 HG13 VAL A 101 2.285 -3.966 -13.574 1.00 0.00 H new ATOM 0 HG21 VAL A 101 0.049 -2.435 -15.025 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -0.313 -3.847 -14.005 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -1.133 -2.296 -13.702 1.00 0.00 H new ATOM 1579 N THR A 102 2.241 -3.352 -9.736 1.00 0.00 N ATOM 1580 CA THR A 102 3.161 -3.051 -8.606 1.00 0.00 C ATOM 1581 C THR A 102 4.482 -3.845 -8.823 1.00 0.00 C ATOM 1582 O THR A 102 4.596 -4.995 -8.389 1.00 0.00 O ATOM 1583 CB THR A 102 2.403 -3.326 -7.269 1.00 0.00 C ATOM 1584 OG1 THR A 102 1.203 -2.561 -7.216 1.00 0.00 O ATOM 1585 CG2 THR A 102 3.189 -3.018 -5.986 1.00 0.00 C ATOM 0 H THR A 102 1.951 -4.329 -9.787 1.00 0.00 H new ATOM 0 HA THR A 102 3.461 -2.004 -8.556 1.00 0.00 H new ATOM 0 HB THR A 102 2.221 -4.401 -7.288 1.00 0.00 H new ATOM 0 HG1 THR A 102 1.316 -1.818 -6.587 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.571 -3.244 -5.117 1.00 0.00 H new ATOM 0 HG22 THR A 102 4.092 -3.628 -5.957 1.00 0.00 H new ATOM 0 HG23 THR A 102 3.463 -1.963 -5.972 1.00 0.00 H new ATOM 1593 N GLU A 103 5.468 -3.226 -9.512 1.00 0.00 N ATOM 1594 CA GLU A 103 6.723 -3.911 -9.930 1.00 0.00 C ATOM 1595 C GLU A 103 7.864 -3.648 -8.910 1.00 0.00 C ATOM 1596 O GLU A 103 8.035 -2.526 -8.426 1.00 0.00 O ATOM 1597 CB GLU A 103 7.130 -3.420 -11.345 1.00 0.00 C ATOM 1598 CG GLU A 103 8.192 -4.290 -12.056 1.00 0.00 C ATOM 1599 CD GLU A 103 8.602 -3.827 -13.461 1.00 0.00 C ATOM 1600 OE1 GLU A 103 8.524 -2.617 -13.774 1.00 0.00 O ATOM 1601 OE2 GLU A 103 9.031 -4.687 -14.261 1.00 0.00 O ATOM 0 H GLU A 103 5.422 -2.247 -9.794 1.00 0.00 H new ATOM 0 HA GLU A 103 6.547 -4.986 -9.959 1.00 0.00 H new ATOM 0 HB2 GLU A 103 6.238 -3.379 -11.970 1.00 0.00 H new ATOM 0 HB3 GLU A 103 7.510 -2.402 -11.265 1.00 0.00 H new ATOM 0 HG2 GLU A 103 9.084 -4.325 -11.431 1.00 0.00 H new ATOM 0 HG3 GLU A 103 7.812 -5.309 -12.126 1.00 0.00 H new ATOM 1608 N LEU A 104 8.669 -4.685 -8.638 1.00 0.00 N ATOM 1609 CA LEU A 104 9.811 -4.599 -7.695 1.00 0.00 C ATOM 1610 C LEU A 104 11.131 -4.578 -8.520 1.00 0.00 C ATOM 1611 O LEU A 104 11.515 -5.587 -9.123 1.00 0.00 O ATOM 1612 CB LEU A 104 9.728 -5.781 -6.682 1.00 0.00 C ATOM 1613 CG LEU A 104 10.325 -5.508 -5.278 1.00 0.00 C ATOM 1614 CD1 LEU A 104 10.160 -6.744 -4.380 1.00 0.00 C ATOM 1615 CD2 LEU A 104 11.797 -5.056 -5.295 1.00 0.00 C ATOM 0 H LEU A 104 8.554 -5.607 -9.060 1.00 0.00 H new ATOM 0 HA LEU A 104 9.783 -3.682 -7.106 1.00 0.00 H new ATOM 0 HB2 LEU A 104 8.681 -6.060 -6.563 1.00 0.00 H new ATOM 0 HB3 LEU A 104 10.240 -6.641 -7.113 1.00 0.00 H new ATOM 0 HG LEU A 104 9.759 -4.669 -4.872 1.00 0.00 H new ATOM 0 HD11 LEU A 104 10.584 -6.539 -3.397 1.00 0.00 H new ATOM 0 HD12 LEU A 104 9.101 -6.980 -4.277 1.00 0.00 H new ATOM 0 HD13 LEU A 104 10.678 -7.591 -4.829 1.00 0.00 H new ATOM 0 HD21 LEU A 104 12.137 -4.886 -4.273 1.00 0.00 H new ATOM 0 HD22 LEU A 104 12.410 -5.830 -5.758 1.00 0.00 H new ATOM 0 HD23 LEU A 104 11.887 -4.132 -5.866 1.00 0.00 H new ATOM 1627 N ASN A 105 11.819 -3.422 -8.528 1.00 0.00 N ATOM 1628 CA ASN A 105 13.080 -3.232 -9.297 1.00 0.00 C ATOM 1629 C ASN A 105 14.264 -3.097 -8.296 1.00 0.00 C ATOM 1630 O ASN A 105 14.581 -1.997 -7.836 1.00 0.00 O ATOM 1631 CB ASN A 105 12.954 -1.994 -10.234 1.00 0.00 C ATOM 1632 CG ASN A 105 12.022 -2.150 -11.456 1.00 0.00 C ATOM 1633 OD1 ASN A 105 12.464 -2.470 -12.559 1.00 0.00 O ATOM 1634 ND2 ASN A 105 10.729 -1.912 -11.298 1.00 0.00 N ATOM 0 H ASN A 105 11.526 -2.594 -8.009 1.00 0.00 H new ATOM 0 HA ASN A 105 13.271 -4.095 -9.935 1.00 0.00 H new ATOM 0 HB2 ASN A 105 12.601 -1.151 -9.640 1.00 0.00 H new ATOM 0 HB3 ASN A 105 13.950 -1.735 -10.594 1.00 0.00 H new ATOM 0 HD21 ASN A 105 10.095 -1.994 -12.093 1.00 0.00 H new ATOM 0 HD22 ASN A 105 10.367 -1.647 -10.382 1.00 0.00 H new ATOM 1641 N GLY A 106 14.917 -4.227 -7.958 1.00 0.00 N ATOM 1642 CA GLY A 106 16.105 -4.230 -7.070 1.00 0.00 C ATOM 1643 C GLY A 106 15.752 -4.098 -5.573 1.00 0.00 C ATOM 1644 O GLY A 106 15.176 -5.025 -4.995 1.00 0.00 O ATOM 0 H GLY A 106 14.643 -5.153 -8.286 1.00 0.00 H new ATOM 0 HA2 GLY A 106 16.662 -5.154 -7.224 1.00 0.00 H new ATOM 0 HA3 GLY A 106 16.764 -3.409 -7.354 1.00 0.00 H new ATOM 1648 N ASP A 107 16.092 -2.943 -4.971 1.00 0.00 N ATOM 1649 CA ASP A 107 15.655 -2.594 -3.583 1.00 0.00 C ATOM 1650 C ASP A 107 14.781 -1.295 -3.561 1.00 0.00 C ATOM 1651 O ASP A 107 15.019 -0.375 -2.771 1.00 0.00 O ATOM 1652 CB ASP A 107 16.883 -2.518 -2.632 1.00 0.00 C ATOM 1653 CG ASP A 107 17.652 -3.833 -2.424 1.00 0.00 C ATOM 1654 OD1 ASP A 107 17.185 -4.691 -1.642 1.00 0.00 O ATOM 1655 OD2 ASP A 107 18.719 -4.014 -3.049 1.00 0.00 O ATOM 0 H ASP A 107 16.668 -2.228 -5.415 1.00 0.00 H new ATOM 0 HA ASP A 107 15.010 -3.390 -3.211 1.00 0.00 H new ATOM 0 HB2 ASP A 107 17.575 -1.772 -3.023 1.00 0.00 H new ATOM 0 HB3 ASP A 107 16.544 -2.160 -1.660 1.00 0.00 H new ATOM 1660 N ILE A 108 13.721 -1.261 -4.392 1.00 0.00 N ATOM 1661 CA ILE A 108 12.619 -0.264 -4.314 1.00 0.00 C ATOM 1662 C ILE A 108 11.255 -1.030 -4.462 1.00 0.00 C ATOM 1663 O ILE A 108 11.189 -2.259 -4.372 1.00 0.00 O ATOM 1664 CB ILE A 108 12.819 0.934 -5.315 1.00 0.00 C ATOM 1665 CG1 ILE A 108 12.821 0.534 -6.818 1.00 0.00 C ATOM 1666 CG2 ILE A 108 14.019 1.852 -4.986 1.00 0.00 C ATOM 1667 CD1 ILE A 108 12.250 1.603 -7.755 1.00 0.00 C ATOM 0 H ILE A 108 13.598 -1.933 -5.150 1.00 0.00 H new ATOM 0 HA ILE A 108 12.620 0.228 -3.342 1.00 0.00 H new ATOM 0 HB ILE A 108 11.917 1.523 -5.152 1.00 0.00 H new ATOM 0 HG12 ILE A 108 13.844 0.310 -7.121 1.00 0.00 H new ATOM 0 HG13 ILE A 108 12.245 -0.384 -6.939 1.00 0.00 H new ATOM 0 HG21 ILE A 108 14.081 2.649 -5.727 1.00 0.00 H new ATOM 0 HG22 ILE A 108 13.884 2.287 -3.996 1.00 0.00 H new ATOM 0 HG23 ILE A 108 14.939 1.268 -5.004 1.00 0.00 H new ATOM 0 HD11 ILE A 108 12.289 1.244 -8.783 1.00 0.00 H new ATOM 0 HD12 ILE A 108 11.216 1.811 -7.482 1.00 0.00 H new ATOM 0 HD13 ILE A 108 12.839 2.516 -7.667 1.00 0.00 H new ATOM 1679 N ILE A 109 10.148 -0.306 -4.703 1.00 0.00 N ATOM 1680 CA ILE A 109 8.915 -0.883 -5.293 1.00 0.00 C ATOM 1681 C ILE A 109 8.111 0.286 -5.926 1.00 0.00 C ATOM 1682 O ILE A 109 7.769 1.255 -5.239 1.00 0.00 O ATOM 1683 CB ILE A 109 8.088 -1.776 -4.295 1.00 0.00 C ATOM 1684 CG1 ILE A 109 7.127 -2.733 -5.053 1.00 0.00 C ATOM 1685 CG2 ILE A 109 7.363 -1.003 -3.162 1.00 0.00 C ATOM 1686 CD1 ILE A 109 6.571 -3.895 -4.221 1.00 0.00 C ATOM 0 H ILE A 109 10.077 0.691 -4.498 1.00 0.00 H new ATOM 0 HA ILE A 109 9.179 -1.599 -6.071 1.00 0.00 H new ATOM 0 HB ILE A 109 8.834 -2.375 -3.773 1.00 0.00 H new ATOM 0 HG12 ILE A 109 6.290 -2.151 -5.439 1.00 0.00 H new ATOM 0 HG13 ILE A 109 7.654 -3.144 -5.914 1.00 0.00 H new ATOM 0 HG21 ILE A 109 6.822 -1.707 -2.529 1.00 0.00 H new ATOM 0 HG22 ILE A 109 8.097 -0.465 -2.561 1.00 0.00 H new ATOM 0 HG23 ILE A 109 6.660 -0.293 -3.598 1.00 0.00 H new ATOM 0 HD11 ILE A 109 5.912 -4.503 -4.840 1.00 0.00 H new ATOM 0 HD12 ILE A 109 7.395 -4.508 -3.856 1.00 0.00 H new ATOM 0 HD13 ILE A 109 6.010 -3.500 -3.374 1.00 0.00 H new ATOM 1698 N THR A 110 7.754 0.154 -7.219 1.00 0.00 N ATOM 1699 CA THR A 110 6.711 1.024 -7.835 1.00 0.00 C ATOM 1700 C THR A 110 5.283 0.469 -7.538 1.00 0.00 C ATOM 1701 O THR A 110 5.091 -0.744 -7.427 1.00 0.00 O ATOM 1702 CB THR A 110 6.987 1.299 -9.344 1.00 0.00 C ATOM 1703 OG1 THR A 110 6.286 2.472 -9.742 1.00 0.00 O ATOM 1704 CG2 THR A 110 6.628 0.182 -10.332 1.00 0.00 C ATOM 0 H THR A 110 8.160 -0.532 -7.855 1.00 0.00 H new ATOM 0 HA THR A 110 6.761 2.006 -7.365 1.00 0.00 H new ATOM 0 HB THR A 110 8.071 1.396 -9.397 1.00 0.00 H new ATOM 0 HG1 THR A 110 5.526 2.223 -10.308 1.00 0.00 H new ATOM 0 HG21 THR A 110 6.869 0.501 -11.346 1.00 0.00 H new ATOM 0 HG22 THR A 110 7.197 -0.715 -10.089 1.00 0.00 H new ATOM 0 HG23 THR A 110 5.562 -0.035 -10.264 1.00 0.00 H new ATOM 1712 N ASN A 111 4.299 1.374 -7.446 1.00 0.00 N ATOM 1713 CA ASN A 111 2.854 1.020 -7.386 1.00 0.00 C ATOM 1714 C ASN A 111 2.146 1.970 -8.385 1.00 0.00 C ATOM 1715 O ASN A 111 1.844 3.122 -8.054 1.00 0.00 O ATOM 1716 CB ASN A 111 2.354 1.139 -5.921 1.00 0.00 C ATOM 1717 CG ASN A 111 0.858 0.853 -5.676 1.00 0.00 C ATOM 1718 OD1 ASN A 111 0.384 -0.274 -5.810 1.00 0.00 O ATOM 1719 ND2 ASN A 111 0.088 1.861 -5.294 1.00 0.00 N ATOM 0 H ASN A 111 4.472 2.379 -7.410 1.00 0.00 H new ATOM 0 HA ASN A 111 2.641 -0.010 -7.673 1.00 0.00 H new ATOM 0 HB2 ASN A 111 2.937 0.454 -5.305 1.00 0.00 H new ATOM 0 HB3 ASN A 111 2.570 2.147 -5.568 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -0.903 1.704 -5.109 1.00 0.00 H new ATOM 0 HD22 ASN A 111 0.486 2.794 -5.184 1.00 0.00 H new ATOM 1726 N THR A 112 1.904 1.468 -9.609 1.00 0.00 N ATOM 1727 CA THR A 112 1.361 2.281 -10.730 1.00 0.00 C ATOM 1728 C THR A 112 -0.142 1.912 -10.903 1.00 0.00 C ATOM 1729 O THR A 112 -0.500 0.979 -11.630 1.00 0.00 O ATOM 1730 CB THR A 112 2.222 2.076 -12.013 1.00 0.00 C ATOM 1731 OG1 THR A 112 3.609 2.259 -11.734 1.00 0.00 O ATOM 1732 CG2 THR A 112 1.869 3.049 -13.151 1.00 0.00 C ATOM 0 H THR A 112 2.076 0.493 -9.856 1.00 0.00 H new ATOM 0 HA THR A 112 1.417 3.349 -10.519 1.00 0.00 H new ATOM 0 HB THR A 112 2.004 1.057 -12.332 1.00 0.00 H new ATOM 0 HG1 THR A 112 4.128 2.123 -12.554 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.507 2.849 -14.012 1.00 0.00 H new ATOM 0 HG22 THR A 112 0.825 2.914 -13.434 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.024 4.074 -12.815 1.00 0.00 H new ATOM 1740 N MET A 113 -1.004 2.671 -10.208 1.00 0.00 N ATOM 1741 CA MET A 113 -2.476 2.467 -10.197 1.00 0.00 C ATOM 1742 C MET A 113 -3.121 3.371 -11.279 1.00 0.00 C ATOM 1743 O MET A 113 -3.253 4.585 -11.100 1.00 0.00 O ATOM 1744 CB MET A 113 -3.034 2.787 -8.786 1.00 0.00 C ATOM 1745 CG MET A 113 -2.792 1.709 -7.719 1.00 0.00 C ATOM 1746 SD MET A 113 -3.511 2.258 -6.157 1.00 0.00 S ATOM 1747 CE MET A 113 -3.579 0.702 -5.246 1.00 0.00 C ATOM 0 H MET A 113 -0.703 3.455 -9.629 1.00 0.00 H new ATOM 0 HA MET A 113 -2.716 1.429 -10.426 1.00 0.00 H new ATOM 0 HB2 MET A 113 -2.589 3.721 -8.442 1.00 0.00 H new ATOM 0 HB3 MET A 113 -4.107 2.957 -8.869 1.00 0.00 H new ATOM 0 HG2 MET A 113 -3.240 0.765 -8.029 1.00 0.00 H new ATOM 0 HG3 MET A 113 -1.723 1.530 -7.600 1.00 0.00 H new ATOM 0 HE1 MET A 113 -4.002 0.878 -4.257 1.00 0.00 H new ATOM 0 HE2 MET A 113 -4.203 -0.009 -5.787 1.00 0.00 H new ATOM 0 HE3 MET A 113 -2.573 0.296 -5.143 1.00 0.00 H new ATOM 1757 N THR A 114 -3.505 2.755 -12.411 1.00 0.00 N ATOM 1758 CA THR A 114 -3.993 3.492 -13.608 1.00 0.00 C ATOM 1759 C THR A 114 -5.546 3.446 -13.641 1.00 0.00 C ATOM 1760 O THR A 114 -6.143 2.409 -13.950 1.00 0.00 O ATOM 1761 CB THR A 114 -3.346 2.987 -14.931 1.00 0.00 C ATOM 1762 OG1 THR A 114 -3.599 1.605 -15.146 1.00 0.00 O ATOM 1763 CG2 THR A 114 -1.829 3.212 -15.027 1.00 0.00 C ATOM 0 H THR A 114 -3.489 1.742 -12.530 1.00 0.00 H new ATOM 0 HA THR A 114 -3.680 4.533 -13.526 1.00 0.00 H new ATOM 0 HB THR A 114 -3.822 3.594 -15.701 1.00 0.00 H new ATOM 0 HG1 THR A 114 -4.513 1.392 -14.864 1.00 0.00 H new ATOM 0 HG21 THR A 114 -1.464 2.830 -15.980 1.00 0.00 H new ATOM 0 HG22 THR A 114 -1.614 4.278 -14.957 1.00 0.00 H new ATOM 0 HG23 THR A 114 -1.331 2.687 -14.212 1.00 0.00 H new ATOM 1771 N LEU A 115 -6.181 4.589 -13.326 1.00 0.00 N ATOM 1772 CA LEU A 115 -7.661 4.743 -13.357 1.00 0.00 C ATOM 1773 C LEU A 115 -8.041 5.528 -14.646 1.00 0.00 C ATOM 1774 O LEU A 115 -8.232 6.748 -14.608 1.00 0.00 O ATOM 1775 CB LEU A 115 -8.076 5.424 -12.015 1.00 0.00 C ATOM 1776 CG LEU A 115 -9.548 5.883 -11.811 1.00 0.00 C ATOM 1777 CD1 LEU A 115 -10.588 4.758 -11.964 1.00 0.00 C ATOM 1778 CD2 LEU A 115 -9.697 6.559 -10.435 1.00 0.00 C ATOM 0 H LEU A 115 -5.690 5.437 -13.042 1.00 0.00 H new ATOM 0 HA LEU A 115 -8.206 3.801 -13.416 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -7.836 4.731 -11.209 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -7.440 6.299 -11.883 1.00 0.00 H new ATOM 0 HG LEU A 115 -9.758 6.592 -12.612 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -11.588 5.163 -11.806 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -10.522 4.335 -12.966 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -10.392 3.979 -11.228 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -10.730 6.879 -10.297 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -9.428 5.851 -9.651 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -9.039 7.426 -10.382 1.00 0.00 H new ATOM 1790 N GLY A 116 -8.128 4.818 -15.791 1.00 0.00 N ATOM 1791 CA GLY A 116 -8.482 5.427 -17.095 1.00 0.00 C ATOM 1792 C GLY A 116 -7.373 6.312 -17.706 1.00 0.00 C ATOM 1793 O GLY A 116 -6.416 5.805 -18.297 1.00 0.00 O ATOM 0 H GLY A 116 -7.957 3.814 -15.840 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -8.726 4.632 -17.800 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -9.382 6.028 -16.969 1.00 0.00 H new ATOM 1797 N ASP A 117 -7.532 7.633 -17.528 1.00 0.00 N ATOM 1798 CA ASP A 117 -6.488 8.645 -17.882 1.00 0.00 C ATOM 1799 C ASP A 117 -5.480 8.969 -16.729 1.00 0.00 C ATOM 1800 O ASP A 117 -4.352 9.379 -17.017 1.00 0.00 O ATOM 1801 CB ASP A 117 -7.162 9.958 -18.372 1.00 0.00 C ATOM 1802 CG ASP A 117 -7.898 9.855 -19.717 1.00 0.00 C ATOM 1803 OD1 ASP A 117 -7.241 9.963 -20.776 1.00 0.00 O ATOM 1804 OD2 ASP A 117 -9.134 9.660 -19.716 1.00 0.00 O ATOM 0 H ASP A 117 -8.380 8.043 -17.137 1.00 0.00 H new ATOM 0 HA ASP A 117 -5.898 8.191 -18.678 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -7.871 10.288 -17.613 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -6.398 10.731 -18.453 1.00 0.00 H new ATOM 1809 N ILE A 118 -5.870 8.791 -15.447 1.00 0.00 N ATOM 1810 CA ILE A 118 -5.011 9.017 -14.253 1.00 0.00 C ATOM 1811 C ILE A 118 -3.857 7.956 -14.222 1.00 0.00 C ATOM 1812 O ILE A 118 -4.093 6.774 -14.495 1.00 0.00 O ATOM 1813 CB ILE A 118 -5.888 8.930 -12.947 1.00 0.00 C ATOM 1814 CG1 ILE A 118 -7.276 9.651 -12.926 1.00 0.00 C ATOM 1815 CG2 ILE A 118 -5.089 9.315 -11.676 1.00 0.00 C ATOM 1816 CD1 ILE A 118 -7.283 11.183 -13.022 1.00 0.00 C ATOM 0 H ILE A 118 -6.810 8.480 -15.204 1.00 0.00 H new ATOM 0 HA ILE A 118 -4.564 10.010 -14.305 1.00 0.00 H new ATOM 0 HB ILE A 118 -6.144 7.871 -12.953 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -7.870 9.260 -13.752 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -7.787 9.370 -12.005 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -5.737 9.240 -10.802 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -4.242 8.638 -11.560 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -4.725 10.338 -11.771 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -8.311 11.545 -12.996 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -6.729 11.603 -12.182 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -6.814 11.491 -13.956 1.00 0.00 H new ATOM 1828 N VAL A 119 -2.630 8.387 -13.870 1.00 0.00 N ATOM 1829 CA VAL A 119 -1.481 7.460 -13.648 1.00 0.00 C ATOM 1830 C VAL A 119 -0.908 7.824 -12.245 1.00 0.00 C ATOM 1831 O VAL A 119 -0.056 8.712 -12.124 1.00 0.00 O ATOM 1832 CB VAL A 119 -0.420 7.507 -14.806 1.00 0.00 C ATOM 1833 CG1 VAL A 119 0.739 6.507 -14.580 1.00 0.00 C ATOM 1834 CG2 VAL A 119 -1.001 7.236 -16.217 1.00 0.00 C ATOM 0 H VAL A 119 -2.400 9.371 -13.731 1.00 0.00 H new ATOM 0 HA VAL A 119 -1.803 6.419 -13.665 1.00 0.00 H new ATOM 0 HB VAL A 119 -0.057 8.534 -14.773 1.00 0.00 H new ATOM 0 HG11 VAL A 119 1.446 6.577 -15.407 1.00 0.00 H new ATOM 0 HG12 VAL A 119 1.248 6.745 -13.646 1.00 0.00 H new ATOM 0 HG13 VAL A 119 0.340 5.494 -14.528 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -0.201 7.288 -16.956 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -1.453 6.244 -16.240 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -1.758 7.985 -16.449 1.00 0.00 H new ATOM 1844 N PHE A 120 -1.369 7.110 -11.199 1.00 0.00 N ATOM 1845 CA PHE A 120 -0.900 7.306 -9.801 1.00 0.00 C ATOM 1846 C PHE A 120 0.348 6.431 -9.541 1.00 0.00 C ATOM 1847 O PHE A 120 0.223 5.239 -9.251 1.00 0.00 O ATOM 1848 CB PHE A 120 -2.073 7.010 -8.824 1.00 0.00 C ATOM 1849 CG PHE A 120 -1.802 7.060 -7.301 1.00 0.00 C ATOM 1850 CD1 PHE A 120 -0.981 8.039 -6.725 1.00 0.00 C ATOM 1851 CD2 PHE A 120 -2.408 6.110 -6.471 1.00 0.00 C ATOM 1852 CE1 PHE A 120 -0.780 8.069 -5.350 1.00 0.00 C ATOM 1853 CE2 PHE A 120 -2.197 6.135 -5.096 1.00 0.00 C ATOM 1854 CZ PHE A 120 -1.391 7.121 -4.537 1.00 0.00 C ATOM 0 H PHE A 120 -2.076 6.381 -11.293 1.00 0.00 H new ATOM 0 HA PHE A 120 -0.595 8.339 -9.634 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -2.871 7.720 -9.041 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -2.457 6.017 -9.059 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -0.501 8.775 -7.354 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -3.045 5.351 -6.901 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -0.149 8.829 -4.913 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -2.658 5.390 -4.464 1.00 0.00 H new ATOM 0 HZ PHE A 120 -1.239 7.150 -3.468 1.00 0.00 H new ATOM 1864 N LYS A 121 1.535 7.055 -9.627 1.00 0.00 N ATOM 1865 CA LYS A 121 2.823 6.333 -9.465 1.00 0.00 C ATOM 1866 C LYS A 121 3.488 6.726 -8.118 1.00 0.00 C ATOM 1867 O LYS A 121 4.091 7.794 -7.991 1.00 0.00 O ATOM 1868 CB LYS A 121 3.735 6.573 -10.698 1.00 0.00 C ATOM 1869 CG LYS A 121 4.927 5.591 -10.771 1.00 0.00 C ATOM 1870 CD LYS A 121 5.831 5.817 -11.996 1.00 0.00 C ATOM 1871 CE LYS A 121 6.960 4.775 -12.087 1.00 0.00 C ATOM 1872 NZ LYS A 121 7.827 5.015 -13.254 1.00 0.00 N ATOM 0 H LYS A 121 1.637 8.054 -9.807 1.00 0.00 H new ATOM 0 HA LYS A 121 2.644 5.259 -9.422 1.00 0.00 H new ATOM 0 HB2 LYS A 121 3.140 6.480 -11.606 1.00 0.00 H new ATOM 0 HB3 LYS A 121 4.115 7.594 -10.668 1.00 0.00 H new ATOM 0 HG2 LYS A 121 5.525 5.689 -9.865 1.00 0.00 H new ATOM 0 HG3 LYS A 121 4.546 4.570 -10.793 1.00 0.00 H new ATOM 0 HD2 LYS A 121 5.228 5.776 -12.903 1.00 0.00 H new ATOM 0 HD3 LYS A 121 6.264 6.816 -11.946 1.00 0.00 H new ATOM 0 HE2 LYS A 121 7.558 4.805 -11.176 1.00 0.00 H new ATOM 0 HE3 LYS A 121 6.529 3.776 -12.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 8.576 4.294 -13.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 7.260 4.961 -14.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 8.257 5.959 -13.179 1.00 0.00 H new ATOM 1886 N ARG A 122 3.420 5.806 -7.139 1.00 0.00 N ATOM 1887 CA ARG A 122 4.276 5.855 -5.924 1.00 0.00 C ATOM 1888 C ARG A 122 5.639 5.165 -6.220 1.00 0.00 C ATOM 1889 O ARG A 122 5.700 4.143 -6.909 1.00 0.00 O ATOM 1890 CB ARG A 122 3.599 5.132 -4.729 1.00 0.00 C ATOM 1891 CG ARG A 122 2.393 5.851 -4.092 1.00 0.00 C ATOM 1892 CD ARG A 122 1.831 5.057 -2.895 1.00 0.00 C ATOM 1893 NE ARG A 122 0.800 5.836 -2.175 1.00 0.00 N ATOM 1894 CZ ARG A 122 0.089 5.384 -1.126 1.00 0.00 C ATOM 1895 NH1 ARG A 122 0.243 4.174 -0.587 1.00 0.00 N ATOM 1896 NH2 ARG A 122 -0.815 6.189 -0.601 1.00 0.00 N ATOM 0 H ARG A 122 2.779 5.013 -7.160 1.00 0.00 H new ATOM 0 HA ARG A 122 4.427 6.902 -5.660 1.00 0.00 H new ATOM 0 HB2 ARG A 122 3.273 4.148 -5.065 1.00 0.00 H new ATOM 0 HB3 ARG A 122 4.350 4.972 -3.955 1.00 0.00 H new ATOM 0 HG2 ARG A 122 2.693 6.845 -3.762 1.00 0.00 H new ATOM 0 HG3 ARG A 122 1.612 5.986 -4.840 1.00 0.00 H new ATOM 0 HD2 ARG A 122 1.402 4.118 -3.246 1.00 0.00 H new ATOM 0 HD3 ARG A 122 2.641 4.801 -2.212 1.00 0.00 H new ATOM 0 HE ARG A 122 0.614 6.786 -2.498 1.00 0.00 H new ATOM 0 HH11 ARG A 122 0.934 3.529 -0.971 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -0.330 3.894 0.209 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -0.956 7.121 -0.991 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -1.373 5.880 0.195 1.00 0.00 H new ATOM 1910 N ILE A 123 6.722 5.732 -5.666 1.00 0.00 N ATOM 1911 CA ILE A 123 8.082 5.126 -5.715 1.00 0.00 C ATOM 1912 C ILE A 123 8.502 5.063 -4.218 1.00 0.00 C ATOM 1913 O ILE A 123 8.822 6.096 -3.624 1.00 0.00 O ATOM 1914 CB ILE A 123 9.087 5.918 -6.631 1.00 0.00 C ATOM 1915 CG1 ILE A 123 8.649 6.049 -8.127 1.00 0.00 C ATOM 1916 CG2 ILE A 123 10.497 5.269 -6.601 1.00 0.00 C ATOM 1917 CD1 ILE A 123 7.747 7.250 -8.456 1.00 0.00 C ATOM 0 H ILE A 123 6.690 6.623 -5.170 1.00 0.00 H new ATOM 0 HA ILE A 123 8.087 4.141 -6.182 1.00 0.00 H new ATOM 0 HB ILE A 123 9.099 6.922 -6.206 1.00 0.00 H new ATOM 0 HG12 ILE A 123 9.545 6.111 -8.744 1.00 0.00 H new ATOM 0 HG13 ILE A 123 8.127 5.137 -8.415 1.00 0.00 H new ATOM 0 HG21 ILE A 123 11.172 5.836 -7.242 1.00 0.00 H new ATOM 0 HG22 ILE A 123 10.878 5.273 -5.580 1.00 0.00 H new ATOM 0 HG23 ILE A 123 10.432 4.242 -6.960 1.00 0.00 H new ATOM 0 HD11 ILE A 123 7.505 7.243 -9.519 1.00 0.00 H new ATOM 0 HD12 ILE A 123 6.828 7.185 -7.874 1.00 0.00 H new ATOM 0 HD13 ILE A 123 8.268 8.175 -8.209 1.00 0.00 H new ATOM 1929 N SER A 124 8.483 3.855 -3.625 1.00 0.00 N ATOM 1930 CA SER A 124 8.739 3.657 -2.173 1.00 0.00 C ATOM 1931 C SER A 124 9.956 2.716 -1.987 1.00 0.00 C ATOM 1932 O SER A 124 9.947 1.573 -2.450 1.00 0.00 O ATOM 1933 CB SER A 124 7.484 3.059 -1.492 1.00 0.00 C ATOM 1934 OG SER A 124 6.356 3.921 -1.604 1.00 0.00 O ATOM 0 H SER A 124 8.292 2.989 -4.129 1.00 0.00 H new ATOM 0 HA SER A 124 8.959 4.618 -1.708 1.00 0.00 H new ATOM 0 HB2 SER A 124 7.250 2.095 -1.944 1.00 0.00 H new ATOM 0 HB3 SER A 124 7.696 2.874 -0.439 1.00 0.00 H new ATOM 0 HG SER A 124 5.584 3.508 -1.164 1.00 0.00 H new ATOM 1940 N LYS A 125 11.007 3.202 -1.304 1.00 0.00 N ATOM 1941 CA LYS A 125 12.313 2.504 -1.213 1.00 0.00 C ATOM 1942 C LYS A 125 12.339 1.472 -0.056 1.00 0.00 C ATOM 1943 O LYS A 125 11.846 1.748 1.041 1.00 0.00 O ATOM 1944 CB LYS A 125 13.409 3.590 -1.081 1.00 0.00 C ATOM 1945 CG LYS A 125 14.853 3.062 -1.171 1.00 0.00 C ATOM 1946 CD LYS A 125 15.894 4.172 -1.425 1.00 0.00 C ATOM 1947 CE LYS A 125 17.247 3.654 -1.944 1.00 0.00 C ATOM 1948 NZ LYS A 125 18.024 2.916 -0.930 1.00 0.00 N ATOM 0 H LYS A 125 10.981 4.088 -0.798 1.00 0.00 H new ATOM 0 HA LYS A 125 12.495 1.914 -2.111 1.00 0.00 H new ATOM 0 HB2 LYS A 125 13.260 4.334 -1.863 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.282 4.101 -0.126 1.00 0.00 H new ATOM 0 HG2 LYS A 125 15.102 2.545 -0.244 1.00 0.00 H new ATOM 0 HG3 LYS A 125 14.914 2.326 -1.973 1.00 0.00 H new ATOM 0 HD2 LYS A 125 15.486 4.880 -2.147 1.00 0.00 H new ATOM 0 HD3 LYS A 125 16.058 4.721 -0.498 1.00 0.00 H new ATOM 0 HE2 LYS A 125 17.073 3.003 -2.801 1.00 0.00 H new ATOM 0 HE3 LYS A 125 17.838 4.498 -2.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 18.922 2.596 -1.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 18.220 3.540 -0.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 17.479 2.091 -0.607 1.00 0.00 H new ATOM 1962 N ARG A 126 12.959 0.302 -0.307 1.00 0.00 N ATOM 1963 CA ARG A 126 13.008 -0.825 0.655 1.00 0.00 C ATOM 1964 C ARG A 126 13.906 -0.497 1.881 1.00 0.00 C ATOM 1965 O ARG A 126 15.115 -0.277 1.754 1.00 0.00 O ATOM 1966 CB ARG A 126 13.501 -2.067 -0.131 1.00 0.00 C ATOM 1967 CG ARG A 126 13.295 -3.402 0.604 1.00 0.00 C ATOM 1968 CD ARG A 126 13.708 -4.603 -0.262 1.00 0.00 C ATOM 1969 NE ARG A 126 13.468 -5.889 0.435 1.00 0.00 N ATOM 1970 CZ ARG A 126 13.890 -7.084 -0.022 1.00 0.00 C ATOM 1971 NH1 ARG A 126 14.553 -7.250 -1.167 1.00 0.00 N ATOM 1972 NH2 ARG A 126 13.630 -8.155 0.704 1.00 0.00 N ATOM 0 H ARG A 126 13.442 0.108 -1.184 1.00 0.00 H new ATOM 0 HA ARG A 126 12.021 -1.019 1.075 1.00 0.00 H new ATOM 0 HB2 ARG A 126 12.980 -2.108 -1.088 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.562 -1.946 -0.351 1.00 0.00 H new ATOM 0 HG2 ARG A 126 13.876 -3.402 1.526 1.00 0.00 H new ATOM 0 HG3 ARG A 126 12.247 -3.502 0.888 1.00 0.00 H new ATOM 0 HD2 ARG A 126 13.149 -4.586 -1.198 1.00 0.00 H new ATOM 0 HD3 ARG A 126 14.764 -4.520 -0.520 1.00 0.00 H new ATOM 0 HE ARG A 126 12.952 -5.868 1.314 1.00 0.00 H new ATOM 0 HH11 ARG A 126 14.768 -6.444 -1.753 1.00 0.00 H new ATOM 0 HH12 ARG A 126 14.845 -8.183 -1.457 1.00 0.00 H new ATOM 0 HH21 ARG A 126 13.123 -8.064 1.584 1.00 0.00 H new ATOM 0 HH22 ARG A 126 13.936 -9.074 0.385 1.00 0.00 H new ATOM 1986 N ILE A 127 13.251 -0.406 3.047 1.00 0.00 N ATOM 1987 CA ILE A 127 13.815 0.231 4.261 1.00 0.00 C ATOM 1988 C ILE A 127 13.386 -0.740 5.374 1.00 0.00 C ATOM 1989 O ILE A 127 14.168 -1.066 6.267 1.00 0.00 O ATOM 1990 CB ILE A 127 13.299 1.716 4.392 1.00 0.00 C ATOM 1991 CG1 ILE A 127 14.035 2.661 3.392 1.00 0.00 C ATOM 1992 CG2 ILE A 127 13.401 2.284 5.829 1.00 0.00 C ATOM 1993 CD1 ILE A 127 13.402 4.038 3.144 1.00 0.00 C ATOM 0 H ILE A 127 12.309 -0.772 3.182 1.00 0.00 H new ATOM 0 HA ILE A 127 14.897 0.362 4.274 1.00 0.00 H new ATOM 0 HB ILE A 127 12.239 1.678 4.142 1.00 0.00 H new ATOM 0 HG12 ILE A 127 15.051 2.815 3.756 1.00 0.00 H new ATOM 0 HG13 ILE A 127 14.114 2.146 2.434 1.00 0.00 H new ATOM 0 HG21 ILE A 127 13.029 3.308 5.843 1.00 0.00 H new ATOM 0 HG22 ILE A 127 12.804 1.672 6.505 1.00 0.00 H new ATOM 0 HG23 ILE A 127 14.442 2.272 6.152 1.00 0.00 H new ATOM 0 HD11 ILE A 127 14.010 4.595 2.431 1.00 0.00 H new ATOM 0 HD12 ILE A 127 12.397 3.909 2.741 1.00 0.00 H new ATOM 0 HD13 ILE A 127 13.349 4.588 4.083 1.00 0.00 H new