USER MOD reduce.3.24.130724 H: found=0, std=0, add=893, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 895 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 99 HIS : no HE2:sc= 0.329 K(o=0.55,f=-6.4!) USER MOD Set 1.2: A 115 TYR OH : rot 106:sc= 0.222 USER MOD Set 2.1: A 82 TYR OH : rot 130:sc= 0.405 USER MOD Set 2.2: A 91 TYR OH : rot 10:sc= 1.69 USER MOD Set 2.3: A 121 TYR OH : rot 106:sc= 0.789 USER MOD Single : A 8 ASN : amide:sc= -0.032 X(o=-0.032,f=0) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 72:sc= 0.967 USER MOD Single : A 22 TYR OH : rot -140:sc= 0.888 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot -93:sc= 1.28 USER MOD Single : A 46 ASN : amide:sc= 1.18 K(o=1.2,f=-0.013) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot -68:sc= -0.366 USER MOD Single : A 60 LYS NZ :NH3+ -178:sc= 0.381! (180deg=0.301!) USER MOD Single : A 61 SER OG : rot -88:sc= 1.57 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 GLN : amide:sc= -0.151 K(o=-0.15,f=-0.76) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 ASN : amide:sc= 1.33 K(o=1.3,f=-0.97) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 HIS : no HE2:sc= -0.0136 K(o=-0.014,f=-0.81) USER MOD Single : A 94 SER OG : rot 91:sc= 1.3 USER MOD Single : A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 ASN : amide:sc= -1.06 K(o=-1.1,f=0.095) USER MOD Single : A 114 SER OG : rot 65:sc= 0.27 USER MOD Single : A 118 SER OG : rot -162:sc= 0.511 USER MOD Single : A 122 THR OG1 : rot 97:sc= 1.65 USER MOD Single : A 123 ASN : amide:sc= 1.16 K(o=1.2,f=-0.0099) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 132 TYR OH : rot 30:sc= 0.274 USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 20 N PRO A 2 -8.302 2.814 -12.888 1.00 0.00 N ATOM 21 CA PRO A 2 -7.618 3.076 -11.619 1.00 0.00 C ATOM 22 C PRO A 2 -8.539 3.712 -10.582 1.00 0.00 C ATOM 23 O PRO A 2 -9.274 4.653 -10.885 1.00 0.00 O ATOM 24 CB PRO A 2 -6.498 4.056 -11.996 1.00 0.00 C ATOM 25 CG PRO A 2 -6.390 3.989 -13.482 1.00 0.00 C ATOM 26 CD PRO A 2 -7.761 3.640 -13.979 1.00 0.00 C ATOM 0 HA PRO A 2 -7.259 2.153 -11.164 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -6.734 5.067 -11.665 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -5.557 3.777 -11.522 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -6.057 4.942 -13.893 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -5.661 3.238 -13.787 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -8.367 4.529 -14.152 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -7.723 3.092 -14.921 1.00 0.00 H new ATOM 34 N VAL A 3 -8.501 3.192 -9.363 1.00 0.00 N ATOM 35 CA VAL A 3 -9.286 3.751 -8.274 1.00 0.00 C ATOM 36 C VAL A 3 -8.490 4.850 -7.586 1.00 0.00 C ATOM 37 O VAL A 3 -7.358 4.629 -7.165 1.00 0.00 O ATOM 38 CB VAL A 3 -9.670 2.676 -7.234 1.00 0.00 C ATOM 39 CG1 VAL A 3 -10.588 3.261 -6.168 1.00 0.00 C ATOM 40 CG2 VAL A 3 -10.323 1.480 -7.912 1.00 0.00 C ATOM 0 H VAL A 3 -7.935 2.384 -9.105 1.00 0.00 H new ATOM 0 HA VAL A 3 -10.205 4.155 -8.699 1.00 0.00 H new ATOM 0 HB VAL A 3 -8.758 2.333 -6.746 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -10.846 2.487 -5.446 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -10.078 4.078 -5.658 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -11.497 3.637 -6.637 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -10.586 0.735 -7.161 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -11.224 1.804 -8.432 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -9.627 1.044 -8.629 1.00 0.00 H new ATOM 50 N GLU A 4 -9.068 6.031 -7.486 1.00 0.00 N ATOM 51 CA GLU A 4 -8.380 7.163 -6.886 1.00 0.00 C ATOM 52 C GLU A 4 -9.325 7.936 -5.980 1.00 0.00 C ATOM 53 O GLU A 4 -10.524 8.001 -6.241 1.00 0.00 O ATOM 54 CB GLU A 4 -7.827 8.084 -7.981 1.00 0.00 C ATOM 55 CG GLU A 4 -8.893 8.566 -8.958 1.00 0.00 C ATOM 56 CD GLU A 4 -8.356 9.488 -10.033 1.00 0.00 C ATOM 57 OE1 GLU A 4 -7.991 10.638 -9.711 1.00 0.00 O ATOM 58 OE2 GLU A 4 -8.336 9.084 -11.215 1.00 0.00 O ATOM 0 H GLU A 4 -10.013 6.234 -7.812 1.00 0.00 H new ATOM 0 HA GLU A 4 -7.550 6.789 -6.286 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -7.354 8.948 -7.515 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -7.050 7.555 -8.533 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -9.358 7.701 -9.431 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -9.675 9.085 -8.403 1.00 0.00 H new ATOM 65 N LEU A 5 -8.791 8.500 -4.910 1.00 0.00 N ATOM 66 CA LEU A 5 -9.578 9.352 -4.039 1.00 0.00 C ATOM 67 C LEU A 5 -9.293 10.808 -4.366 1.00 0.00 C ATOM 68 O LEU A 5 -8.210 11.322 -4.083 1.00 0.00 O ATOM 69 CB LEU A 5 -9.281 9.072 -2.564 1.00 0.00 C ATOM 70 CG LEU A 5 -10.113 9.901 -1.577 1.00 0.00 C ATOM 71 CD1 LEU A 5 -11.597 9.606 -1.744 1.00 0.00 C ATOM 72 CD2 LEU A 5 -9.675 9.638 -0.146 1.00 0.00 C ATOM 0 H LEU A 5 -7.819 8.383 -4.625 1.00 0.00 H new ATOM 0 HA LEU A 5 -10.633 9.137 -4.208 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -9.455 8.014 -2.366 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -8.224 9.262 -2.377 1.00 0.00 H new ATOM 0 HG LEU A 5 -9.945 10.955 -1.796 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -12.169 10.204 -1.035 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -11.905 9.854 -2.760 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -11.781 8.548 -1.557 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -10.279 10.237 0.535 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -9.806 8.581 0.086 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -8.625 9.907 -0.032 1.00 0.00 H new ATOM 84 N ARG A 6 -10.261 11.455 -4.986 1.00 0.00 N ATOM 85 CA ARG A 6 -10.114 12.841 -5.395 1.00 0.00 C ATOM 86 C ARG A 6 -10.584 13.765 -4.279 1.00 0.00 C ATOM 87 O ARG A 6 -11.323 13.344 -3.397 1.00 0.00 O ATOM 88 CB ARG A 6 -10.896 13.082 -6.689 1.00 0.00 C ATOM 89 CG ARG A 6 -10.416 12.191 -7.822 1.00 0.00 C ATOM 90 CD ARG A 6 -11.192 12.399 -9.113 1.00 0.00 C ATOM 91 NE ARG A 6 -10.678 11.531 -10.175 1.00 0.00 N ATOM 92 CZ ARG A 6 -11.401 11.076 -11.200 1.00 0.00 C ATOM 93 NH1 ARG A 6 -12.664 11.456 -11.352 1.00 0.00 N ATOM 94 NH2 ARG A 6 -10.855 10.237 -12.075 1.00 0.00 N ATOM 0 H ARG A 6 -11.164 11.041 -5.219 1.00 0.00 H new ATOM 0 HA ARG A 6 -9.063 13.058 -5.588 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -11.956 12.901 -6.510 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -10.796 14.127 -6.983 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -9.359 12.384 -8.005 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -10.502 11.148 -7.517 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -12.248 12.189 -8.945 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -11.119 13.442 -9.422 1.00 0.00 H new ATOM 0 HE ARG A 6 -9.697 11.255 -10.128 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -13.087 12.099 -10.683 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -13.211 11.105 -12.138 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -9.885 9.942 -11.962 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -11.406 9.888 -12.859 1.00 0.00 H new ATOM 108 N ALA A 7 -10.143 15.018 -4.309 1.00 0.00 N ATOM 109 CA ALA A 7 -10.493 15.976 -3.264 1.00 0.00 C ATOM 110 C ALA A 7 -11.974 16.313 -3.326 1.00 0.00 C ATOM 111 O ALA A 7 -12.610 16.595 -2.309 1.00 0.00 O ATOM 112 CB ALA A 7 -9.649 17.234 -3.393 1.00 0.00 C ATOM 0 H ALA A 7 -9.544 15.394 -5.044 1.00 0.00 H new ATOM 0 HA ALA A 7 -10.286 15.523 -2.294 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -9.922 17.938 -2.607 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -8.594 16.976 -3.298 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -9.825 17.692 -4.367 1.00 0.00 H new ATOM 118 N ASN A 8 -12.512 16.284 -4.531 1.00 0.00 N ATOM 119 CA ASN A 8 -13.937 16.459 -4.735 1.00 0.00 C ATOM 120 C ASN A 8 -14.574 15.094 -4.962 1.00 0.00 C ATOM 121 O ASN A 8 -14.695 14.634 -6.097 1.00 0.00 O ATOM 122 CB ASN A 8 -14.188 17.397 -5.925 1.00 0.00 C ATOM 123 CG ASN A 8 -15.661 17.623 -6.213 1.00 0.00 C ATOM 124 OD1 ASN A 8 -16.294 18.500 -5.627 1.00 0.00 O ATOM 125 ND2 ASN A 8 -16.212 16.853 -7.136 1.00 0.00 N ATOM 0 H ASN A 8 -11.979 16.140 -5.389 1.00 0.00 H new ATOM 0 HA ASN A 8 -14.388 16.916 -3.854 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -13.712 18.358 -5.728 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -13.711 16.981 -6.813 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -17.194 16.976 -7.383 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -15.655 16.136 -7.601 1.00 0.00 H new ATOM 132 N TRP A 9 -14.931 14.428 -3.871 1.00 0.00 N ATOM 133 CA TRP A 9 -15.443 13.067 -3.945 1.00 0.00 C ATOM 134 C TRP A 9 -16.866 12.962 -3.408 1.00 0.00 C ATOM 135 O TRP A 9 -17.281 13.725 -2.536 1.00 0.00 O ATOM 136 CB TRP A 9 -14.522 12.104 -3.174 1.00 0.00 C ATOM 137 CG TRP A 9 -14.293 12.477 -1.731 1.00 0.00 C ATOM 138 CD1 TRP A 9 -13.271 13.235 -1.236 1.00 0.00 C ATOM 139 CD2 TRP A 9 -15.090 12.101 -0.598 1.00 0.00 C ATOM 140 NE1 TRP A 9 -13.381 13.354 0.128 1.00 0.00 N ATOM 141 CE2 TRP A 9 -14.491 12.669 0.544 1.00 0.00 C ATOM 142 CE3 TRP A 9 -16.250 11.343 -0.438 1.00 0.00 C ATOM 143 CZ2 TRP A 9 -15.017 12.500 1.823 1.00 0.00 C ATOM 144 CZ3 TRP A 9 -16.772 11.176 0.830 1.00 0.00 C ATOM 145 CH2 TRP A 9 -16.156 11.753 1.947 1.00 0.00 C ATOM 0 H TRP A 9 -14.875 14.808 -2.926 1.00 0.00 H new ATOM 0 HA TRP A 9 -15.462 12.787 -4.998 1.00 0.00 H new ATOM 0 HB2 TRP A 9 -14.950 11.102 -3.213 1.00 0.00 H new ATOM 0 HB3 TRP A 9 -13.558 12.059 -3.682 1.00 0.00 H new ATOM 0 HD1 TRP A 9 -12.487 13.678 -1.832 1.00 0.00 H new ATOM 0 HE1 TRP A 9 -12.740 13.869 0.732 1.00 0.00 H new ATOM 0 HE3 TRP A 9 -16.733 10.893 -1.293 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 -14.542 12.943 2.686 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 -17.670 10.591 0.962 1.00 0.00 H new ATOM 0 HH2 TRP A 9 -16.589 11.605 2.926 1.00 0.00 H new ATOM 156 N SER A 10 -17.609 12.017 -3.956 1.00 0.00 N ATOM 157 CA SER A 10 -18.912 11.651 -3.426 1.00 0.00 C ATOM 158 C SER A 10 -18.736 10.413 -2.557 1.00 0.00 C ATOM 159 O SER A 10 -17.777 9.663 -2.755 1.00 0.00 O ATOM 160 CB SER A 10 -19.894 11.374 -4.573 1.00 0.00 C ATOM 161 OG SER A 10 -21.154 10.947 -4.085 1.00 0.00 O ATOM 0 H SER A 10 -17.328 11.483 -4.778 1.00 0.00 H new ATOM 0 HA SER A 10 -19.322 12.467 -2.831 1.00 0.00 H new ATOM 0 HB2 SER A 10 -20.021 12.276 -5.171 1.00 0.00 H new ATOM 0 HB3 SER A 10 -19.480 10.611 -5.232 1.00 0.00 H new ATOM 0 HG SER A 10 -21.757 10.780 -4.839 1.00 0.00 H new ATOM 167 N GLU A 11 -19.635 10.187 -1.602 1.00 0.00 N ATOM 168 CA GLU A 11 -19.484 9.057 -0.692 1.00 0.00 C ATOM 169 C GLU A 11 -19.418 7.746 -1.462 1.00 0.00 C ATOM 170 O GLU A 11 -18.609 6.886 -1.142 1.00 0.00 O ATOM 171 CB GLU A 11 -20.603 9.007 0.349 1.00 0.00 C ATOM 172 CG GLU A 11 -20.521 10.124 1.376 1.00 0.00 C ATOM 173 CD GLU A 11 -21.396 9.875 2.587 1.00 0.00 C ATOM 174 OE1 GLU A 11 -22.611 10.142 2.518 1.00 0.00 O ATOM 175 OE2 GLU A 11 -20.867 9.425 3.627 1.00 0.00 O ATOM 0 H GLU A 11 -20.462 10.761 -1.440 1.00 0.00 H new ATOM 0 HA GLU A 11 -18.544 9.199 -0.159 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -21.565 9.061 -0.160 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -20.568 8.047 0.864 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -19.486 10.239 1.699 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -20.815 11.064 0.908 1.00 0.00 H new ATOM 182 N GLU A 12 -20.242 7.617 -2.499 1.00 0.00 N ATOM 183 CA GLU A 12 -20.259 6.410 -3.331 1.00 0.00 C ATOM 184 C GLU A 12 -18.878 6.104 -3.910 1.00 0.00 C ATOM 185 O GLU A 12 -18.481 4.941 -4.029 1.00 0.00 O ATOM 186 CB GLU A 12 -21.272 6.570 -4.462 1.00 0.00 C ATOM 187 CG GLU A 12 -22.712 6.419 -4.007 1.00 0.00 C ATOM 188 CD GLU A 12 -23.044 4.990 -3.635 1.00 0.00 C ATOM 189 OE1 GLU A 12 -22.788 4.593 -2.482 1.00 0.00 O ATOM 190 OE2 GLU A 12 -23.551 4.250 -4.507 1.00 0.00 O ATOM 0 H GLU A 12 -20.909 8.333 -2.786 1.00 0.00 H new ATOM 0 HA GLU A 12 -20.548 5.573 -2.696 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -21.144 7.552 -4.918 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -21.063 5.830 -5.234 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -22.891 7.067 -3.149 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -23.380 6.751 -4.802 1.00 0.00 H new ATOM 197 N ASP A 13 -18.148 7.154 -4.253 1.00 0.00 N ATOM 198 CA ASP A 13 -16.805 7.006 -4.797 1.00 0.00 C ATOM 199 C ASP A 13 -15.870 6.469 -3.720 1.00 0.00 C ATOM 200 O ASP A 13 -15.105 5.532 -3.952 1.00 0.00 O ATOM 201 CB ASP A 13 -16.302 8.351 -5.329 1.00 0.00 C ATOM 202 CG ASP A 13 -14.972 8.243 -6.047 1.00 0.00 C ATOM 203 OD1 ASP A 13 -14.937 7.659 -7.154 1.00 0.00 O ATOM 204 OD2 ASP A 13 -13.971 8.774 -5.531 1.00 0.00 O ATOM 0 H ASP A 13 -18.463 8.120 -4.164 1.00 0.00 H new ATOM 0 HA ASP A 13 -16.828 6.297 -5.625 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -17.044 8.766 -6.011 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -16.205 9.051 -4.499 1.00 0.00 H new ATOM 209 N LEU A 14 -15.981 7.038 -2.525 1.00 0.00 N ATOM 210 CA LEU A 14 -15.172 6.615 -1.390 1.00 0.00 C ATOM 211 C LEU A 14 -15.536 5.195 -0.947 1.00 0.00 C ATOM 212 O LEU A 14 -14.660 4.418 -0.557 1.00 0.00 O ATOM 213 CB LEU A 14 -15.346 7.590 -0.225 1.00 0.00 C ATOM 214 CG LEU A 14 -14.543 7.256 1.034 1.00 0.00 C ATOM 215 CD1 LEU A 14 -13.049 7.303 0.756 1.00 0.00 C ATOM 216 CD2 LEU A 14 -14.906 8.210 2.153 1.00 0.00 C ATOM 0 H LEU A 14 -16.628 7.798 -2.317 1.00 0.00 H new ATOM 0 HA LEU A 14 -14.128 6.614 -1.703 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -15.063 8.587 -0.562 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -16.403 7.630 0.038 1.00 0.00 H new ATOM 0 HG LEU A 14 -14.795 6.241 1.342 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -12.502 7.062 1.667 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -12.800 6.578 -0.019 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -12.773 8.303 0.421 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -14.328 7.963 3.044 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -14.682 9.232 1.847 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -15.970 8.123 2.375 1.00 0.00 H new ATOM 228 N GLU A 15 -16.826 4.858 -1.010 1.00 0.00 N ATOM 229 CA GLU A 15 -17.286 3.509 -0.679 1.00 0.00 C ATOM 230 C GLU A 15 -16.587 2.497 -1.575 1.00 0.00 C ATOM 231 O GLU A 15 -16.249 1.391 -1.149 1.00 0.00 O ATOM 232 CB GLU A 15 -18.806 3.382 -0.853 1.00 0.00 C ATOM 233 CG GLU A 15 -19.621 4.409 -0.078 1.00 0.00 C ATOM 234 CD GLU A 15 -19.502 4.292 1.431 1.00 0.00 C ATOM 235 OE1 GLU A 15 -18.390 4.065 1.941 1.00 0.00 O ATOM 236 OE2 GLU A 15 -20.530 4.462 2.119 1.00 0.00 O ATOM 0 H GLU A 15 -17.569 5.500 -1.287 1.00 0.00 H new ATOM 0 HA GLU A 15 -17.043 3.313 0.365 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -19.046 3.472 -1.912 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -19.112 2.384 -0.540 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -19.306 5.408 -0.379 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -20.670 4.308 -0.357 1.00 0.00 H new ATOM 243 N THR A 16 -16.370 2.899 -2.818 1.00 0.00 N ATOM 244 CA THR A 16 -15.658 2.081 -3.781 1.00 0.00 C ATOM 245 C THR A 16 -14.187 1.934 -3.373 1.00 0.00 C ATOM 246 O THR A 16 -13.623 0.838 -3.422 1.00 0.00 O ATOM 247 CB THR A 16 -15.749 2.707 -5.188 1.00 0.00 C ATOM 248 OG1 THR A 16 -17.125 2.984 -5.504 1.00 0.00 O ATOM 249 CG2 THR A 16 -15.155 1.781 -6.241 1.00 0.00 C ATOM 0 H THR A 16 -16.682 3.798 -3.184 1.00 0.00 H new ATOM 0 HA THR A 16 -16.120 1.094 -3.801 1.00 0.00 H new ATOM 0 HB THR A 16 -15.176 3.634 -5.189 1.00 0.00 H new ATOM 0 HG1 THR A 16 -17.435 3.748 -4.975 1.00 0.00 H new ATOM 0 HG21 THR A 16 -15.233 2.249 -7.223 1.00 0.00 H new ATOM 0 HG22 THR A 16 -14.106 1.594 -6.011 1.00 0.00 H new ATOM 0 HG23 THR A 16 -15.700 0.837 -6.244 1.00 0.00 H new ATOM 257 N VAL A 17 -13.592 3.045 -2.945 1.00 0.00 N ATOM 258 CA VAL A 17 -12.196 3.073 -2.519 1.00 0.00 C ATOM 259 C VAL A 17 -11.953 2.132 -1.339 1.00 0.00 C ATOM 260 O VAL A 17 -11.104 1.243 -1.413 1.00 0.00 O ATOM 261 CB VAL A 17 -11.759 4.502 -2.124 1.00 0.00 C ATOM 262 CG1 VAL A 17 -10.315 4.514 -1.642 1.00 0.00 C ATOM 263 CG2 VAL A 17 -11.938 5.461 -3.293 1.00 0.00 C ATOM 0 H VAL A 17 -14.063 3.948 -2.884 1.00 0.00 H new ATOM 0 HA VAL A 17 -11.601 2.738 -3.369 1.00 0.00 H new ATOM 0 HB VAL A 17 -12.395 4.835 -1.304 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -10.031 5.530 -1.370 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -10.216 3.864 -0.772 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -9.663 4.156 -2.438 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -11.625 6.461 -2.994 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -11.331 5.127 -4.134 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -12.987 5.482 -3.589 1.00 0.00 H new ATOM 273 N ILE A 18 -12.713 2.313 -0.262 1.00 0.00 N ATOM 274 CA ILE A 18 -12.505 1.533 0.957 1.00 0.00 C ATOM 275 C ILE A 18 -12.749 0.043 0.717 1.00 0.00 C ATOM 276 O ILE A 18 -12.062 -0.800 1.286 1.00 0.00 O ATOM 277 CB ILE A 18 -13.392 2.020 2.127 1.00 0.00 C ATOM 278 CG1 ILE A 18 -14.877 1.964 1.754 1.00 0.00 C ATOM 279 CG2 ILE A 18 -12.993 3.431 2.545 1.00 0.00 C ATOM 280 CD1 ILE A 18 -15.803 2.302 2.901 1.00 0.00 C ATOM 0 H ILE A 18 -13.475 2.989 -0.207 1.00 0.00 H new ATOM 0 HA ILE A 18 -11.462 1.683 1.236 1.00 0.00 H new ATOM 0 HB ILE A 18 -13.236 1.351 2.973 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -15.063 2.656 0.932 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -15.114 0.965 1.389 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -13.626 3.759 3.369 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -11.951 3.435 2.865 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -13.116 4.109 1.701 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -16.838 2.242 2.563 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -15.646 1.595 3.716 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -15.594 3.313 3.252 1.00 0.00 H new ATOM 292 N ARG A 19 -13.708 -0.277 -0.145 1.00 0.00 N ATOM 293 CA ARG A 19 -14.030 -1.669 -0.445 1.00 0.00 C ATOM 294 C ARG A 19 -12.983 -2.303 -1.356 1.00 0.00 C ATOM 295 O ARG A 19 -12.869 -3.527 -1.427 1.00 0.00 O ATOM 296 CB ARG A 19 -15.423 -1.770 -1.065 1.00 0.00 C ATOM 297 CG ARG A 19 -16.540 -1.641 -0.040 1.00 0.00 C ATOM 298 CD ARG A 19 -17.902 -1.513 -0.700 1.00 0.00 C ATOM 299 NE ARG A 19 -18.991 -1.593 0.274 1.00 0.00 N ATOM 300 CZ ARG A 19 -19.401 -0.573 1.030 1.00 0.00 C ATOM 301 NH1 ARG A 19 -18.806 0.611 0.943 1.00 0.00 N ATOM 302 NH2 ARG A 19 -20.403 -0.738 1.882 1.00 0.00 N ATOM 0 H ARG A 19 -14.275 0.406 -0.648 1.00 0.00 H new ATOM 0 HA ARG A 19 -14.024 -2.224 0.493 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -15.537 -0.991 -1.818 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -15.518 -2.727 -1.579 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -16.534 -2.512 0.615 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -16.358 -0.769 0.588 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -17.960 -0.563 -1.232 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -18.021 -2.302 -1.443 1.00 0.00 H new ATOM 0 HE ARG A 19 -19.468 -2.488 0.382 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -18.030 0.745 0.295 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -19.125 1.386 1.524 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -20.862 -1.646 1.960 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -20.715 0.043 2.459 1.00 0.00 H new ATOM 316 N ALA A 20 -12.221 -1.472 -2.051 1.00 0.00 N ATOM 317 CA ALA A 20 -11.146 -1.963 -2.900 1.00 0.00 C ATOM 318 C ALA A 20 -9.919 -2.320 -2.067 1.00 0.00 C ATOM 319 O ALA A 20 -9.210 -3.279 -2.372 1.00 0.00 O ATOM 320 CB ALA A 20 -10.786 -0.931 -3.958 1.00 0.00 C ATOM 0 H ALA A 20 -12.326 -0.457 -2.044 1.00 0.00 H new ATOM 0 HA ALA A 20 -11.495 -2.866 -3.401 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -9.980 -1.316 -4.583 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -11.659 -0.725 -4.577 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -10.460 -0.011 -3.473 1.00 0.00 H new ATOM 326 N VAL A 21 -9.683 -1.551 -1.008 1.00 0.00 N ATOM 327 CA VAL A 21 -8.511 -1.753 -0.160 1.00 0.00 C ATOM 328 C VAL A 21 -8.768 -2.821 0.904 1.00 0.00 C ATOM 329 O VAL A 21 -7.909 -3.664 1.162 1.00 0.00 O ATOM 330 CB VAL A 21 -8.077 -0.440 0.532 1.00 0.00 C ATOM 331 CG1 VAL A 21 -6.779 -0.635 1.303 1.00 0.00 C ATOM 332 CG2 VAL A 21 -7.929 0.683 -0.483 1.00 0.00 C ATOM 0 H VAL A 21 -10.287 -0.783 -0.716 1.00 0.00 H new ATOM 0 HA VAL A 21 -7.708 -2.090 -0.815 1.00 0.00 H new ATOM 0 HB VAL A 21 -8.857 -0.162 1.241 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -6.495 0.303 1.781 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -6.920 -1.402 2.065 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -5.991 -0.946 0.617 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -7.623 1.596 0.027 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -7.175 0.409 -1.221 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -8.883 0.849 -0.984 1.00 0.00 H new ATOM 342 N TYR A 22 -9.950 -2.777 1.517 1.00 0.00 N ATOM 343 CA TYR A 22 -10.315 -3.731 2.564 1.00 0.00 C ATOM 344 C TYR A 22 -10.322 -5.159 2.032 1.00 0.00 C ATOM 345 O TYR A 22 -10.657 -5.398 0.868 1.00 0.00 O ATOM 346 CB TYR A 22 -11.692 -3.394 3.134 1.00 0.00 C ATOM 347 CG TYR A 22 -11.654 -2.855 4.544 1.00 0.00 C ATOM 348 CD1 TYR A 22 -11.602 -3.718 5.630 1.00 0.00 C ATOM 349 CD2 TYR A 22 -11.674 -1.488 4.794 1.00 0.00 C ATOM 350 CE1 TYR A 22 -11.570 -3.238 6.923 1.00 0.00 C ATOM 351 CE2 TYR A 22 -11.643 -1.000 6.088 1.00 0.00 C ATOM 352 CZ TYR A 22 -11.592 -1.881 7.147 1.00 0.00 C ATOM 353 OH TYR A 22 -11.561 -1.405 8.436 1.00 0.00 O ATOM 0 H TYR A 22 -10.673 -2.089 1.306 1.00 0.00 H new ATOM 0 HA TYR A 22 -9.567 -3.658 3.353 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -12.173 -2.660 2.487 1.00 0.00 H new ATOM 0 HB3 TYR A 22 -12.312 -4.290 3.114 1.00 0.00 H new ATOM 0 HD1 TYR A 22 -11.586 -4.784 5.460 1.00 0.00 H new ATOM 0 HD2 TYR A 22 -11.714 -0.796 3.966 1.00 0.00 H new ATOM 0 HE1 TYR A 22 -11.528 -3.925 7.756 1.00 0.00 H new ATOM 0 HE2 TYR A 22 -11.659 0.065 6.268 1.00 0.00 H new ATOM 0 HH TYR A 22 -12.169 -0.640 8.517 1.00 0.00 H new ATOM 586 N LEU A 37 -11.099 -1.334 11.174 1.00 0.00 N ATOM 587 CA LEU A 37 -10.241 -0.186 11.402 1.00 0.00 C ATOM 588 C LEU A 37 -11.095 1.063 11.561 1.00 0.00 C ATOM 589 O LEU A 37 -11.046 1.970 10.732 1.00 0.00 O ATOM 590 CB LEU A 37 -9.275 -0.010 10.234 1.00 0.00 C ATOM 591 CG LEU A 37 -8.440 -1.241 9.895 1.00 0.00 C ATOM 592 CD1 LEU A 37 -7.766 -1.064 8.549 1.00 0.00 C ATOM 593 CD2 LEU A 37 -7.401 -1.495 10.976 1.00 0.00 C ATOM 0 HA LEU A 37 -9.663 -0.348 12.312 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -9.845 0.278 9.351 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -8.601 0.816 10.461 1.00 0.00 H new ATOM 0 HG LEU A 37 -9.103 -2.105 9.844 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -7.173 -1.950 8.320 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -8.524 -0.925 7.778 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -7.115 -0.190 8.580 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -6.815 -2.377 10.717 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -6.741 -0.631 11.056 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -7.901 -1.659 11.930 1.00 0.00 H new ATOM 605 N VAL A 38 -11.877 1.098 12.636 1.00 0.00 N ATOM 606 CA VAL A 38 -12.845 2.168 12.861 1.00 0.00 C ATOM 607 C VAL A 38 -12.188 3.555 12.819 1.00 0.00 C ATOM 608 O VAL A 38 -12.795 4.527 12.361 1.00 0.00 O ATOM 609 CB VAL A 38 -13.590 1.968 14.205 1.00 0.00 C ATOM 610 CG1 VAL A 38 -12.624 1.973 15.381 1.00 0.00 C ATOM 611 CG2 VAL A 38 -14.668 3.024 14.391 1.00 0.00 C ATOM 0 H VAL A 38 -11.859 0.391 13.371 1.00 0.00 H new ATOM 0 HA VAL A 38 -13.569 2.119 12.047 1.00 0.00 H new ATOM 0 HB VAL A 38 -14.071 0.990 14.172 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -13.179 1.830 16.308 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -11.902 1.165 15.262 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -12.098 2.927 15.416 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -15.176 2.862 15.342 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -14.212 4.014 14.388 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -15.390 2.954 13.577 1.00 0.00 H new ATOM 621 N SER A 39 -10.943 3.640 13.266 1.00 0.00 N ATOM 622 CA SER A 39 -10.230 4.905 13.277 1.00 0.00 C ATOM 623 C SER A 39 -9.765 5.275 11.870 1.00 0.00 C ATOM 624 O SER A 39 -9.940 6.410 11.430 1.00 0.00 O ATOM 625 CB SER A 39 -9.047 4.831 14.242 1.00 0.00 C ATOM 626 OG SER A 39 -9.492 4.520 15.554 1.00 0.00 O ATOM 0 H SER A 39 -10.409 2.849 13.625 1.00 0.00 H new ATOM 0 HA SER A 39 -10.908 5.687 13.620 1.00 0.00 H new ATOM 0 HB2 SER A 39 -8.340 4.074 13.903 1.00 0.00 H new ATOM 0 HB3 SER A 39 -8.516 5.783 14.248 1.00 0.00 H new ATOM 0 HG SER A 39 -8.722 4.475 16.158 1.00 0.00 H new ATOM 632 N ALA A 40 -9.201 4.306 11.159 1.00 0.00 N ATOM 633 CA ALA A 40 -8.729 4.533 9.798 1.00 0.00 C ATOM 634 C ALA A 40 -9.891 4.897 8.878 1.00 0.00 C ATOM 635 O ALA A 40 -9.778 5.800 8.047 1.00 0.00 O ATOM 636 CB ALA A 40 -7.998 3.305 9.272 1.00 0.00 C ATOM 0 H ALA A 40 -9.059 3.356 11.502 1.00 0.00 H new ATOM 0 HA ALA A 40 -8.030 5.369 9.815 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -7.654 3.494 8.255 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -7.142 3.090 9.911 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -8.675 2.451 9.273 1.00 0.00 H new ATOM 642 N GLU A 41 -11.010 4.199 9.046 1.00 0.00 N ATOM 643 CA GLU A 41 -12.210 4.454 8.256 1.00 0.00 C ATOM 644 C GLU A 41 -12.689 5.891 8.431 1.00 0.00 C ATOM 645 O GLU A 41 -12.915 6.601 7.452 1.00 0.00 O ATOM 646 CB GLU A 41 -13.323 3.485 8.657 1.00 0.00 C ATOM 647 CG GLU A 41 -13.036 2.037 8.296 1.00 0.00 C ATOM 648 CD GLU A 41 -13.995 1.071 8.965 1.00 0.00 C ATOM 649 OE1 GLU A 41 -15.149 1.459 9.236 1.00 0.00 O ATOM 650 OE2 GLU A 41 -13.590 -0.077 9.240 1.00 0.00 O ATOM 0 H GLU A 41 -11.111 3.447 9.728 1.00 0.00 H new ATOM 0 HA GLU A 41 -11.959 4.301 7.206 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -13.484 3.556 9.733 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -14.251 3.793 8.175 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -13.099 1.916 7.215 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -12.015 1.789 8.585 1.00 0.00 H new ATOM 657 N SER A 42 -12.819 6.320 9.679 1.00 0.00 N ATOM 658 CA SER A 42 -13.332 7.649 9.978 1.00 0.00 C ATOM 659 C SER A 42 -12.347 8.736 9.548 1.00 0.00 C ATOM 660 O SER A 42 -12.753 9.769 9.013 1.00 0.00 O ATOM 661 CB SER A 42 -13.662 7.767 11.470 1.00 0.00 C ATOM 662 OG SER A 42 -12.631 7.217 12.272 1.00 0.00 O ATOM 0 H SER A 42 -12.576 5.766 10.501 1.00 0.00 H new ATOM 0 HA SER A 42 -14.249 7.796 9.407 1.00 0.00 H new ATOM 0 HB2 SER A 42 -13.808 8.815 11.730 1.00 0.00 H new ATOM 0 HB3 SER A 42 -14.601 7.253 11.678 1.00 0.00 H new ATOM 0 HG SER A 42 -12.837 6.280 12.473 1.00 0.00 H new ATOM 668 N LEU A 43 -11.056 8.496 9.756 1.00 0.00 N ATOM 669 CA LEU A 43 -10.033 9.466 9.383 1.00 0.00 C ATOM 670 C LEU A 43 -9.930 9.604 7.866 1.00 0.00 C ATOM 671 O LEU A 43 -9.737 10.706 7.350 1.00 0.00 O ATOM 672 CB LEU A 43 -8.674 9.076 9.970 1.00 0.00 C ATOM 673 CG LEU A 43 -8.580 9.135 11.496 1.00 0.00 C ATOM 674 CD1 LEU A 43 -7.199 8.699 11.962 1.00 0.00 C ATOM 675 CD2 LEU A 43 -8.894 10.538 11.997 1.00 0.00 C ATOM 0 H LEU A 43 -10.695 7.641 10.179 1.00 0.00 H new ATOM 0 HA LEU A 43 -10.328 10.431 9.795 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -8.434 8.063 9.647 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -7.913 9.734 9.550 1.00 0.00 H new ATOM 0 HG LEU A 43 -9.317 8.448 11.913 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -7.150 8.747 13.050 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.011 7.676 11.635 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -6.445 9.361 11.535 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -8.822 10.561 13.084 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -8.181 11.244 11.571 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -9.904 10.815 11.694 1.00 0.00 H new ATOM 687 N LEU A 44 -10.063 8.490 7.154 1.00 0.00 N ATOM 688 CA LEU A 44 -10.027 8.514 5.696 1.00 0.00 C ATOM 689 C LEU A 44 -11.299 9.144 5.144 1.00 0.00 C ATOM 690 O LEU A 44 -11.261 9.908 4.183 1.00 0.00 O ATOM 691 CB LEU A 44 -9.863 7.104 5.127 1.00 0.00 C ATOM 692 CG LEU A 44 -9.740 7.035 3.601 1.00 0.00 C ATOM 693 CD1 LEU A 44 -8.429 7.653 3.143 1.00 0.00 C ATOM 694 CD2 LEU A 44 -9.847 5.598 3.121 1.00 0.00 C ATOM 0 H LEU A 44 -10.196 7.564 7.560 1.00 0.00 H new ATOM 0 HA LEU A 44 -9.168 9.113 5.393 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -8.976 6.650 5.569 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -10.717 6.502 5.436 1.00 0.00 H new ATOM 0 HG LEU A 44 -10.560 7.605 3.165 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -8.359 7.595 2.057 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -8.391 8.697 3.454 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -7.596 7.111 3.590 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -9.757 5.570 2.035 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -9.048 5.005 3.567 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -10.812 5.187 3.416 1.00 0.00 H new ATOM 706 N ARG A 45 -12.423 8.835 5.777 1.00 0.00 N ATOM 707 CA ARG A 45 -13.716 9.344 5.337 1.00 0.00 C ATOM 708 C ARG A 45 -13.822 10.847 5.599 1.00 0.00 C ATOM 709 O ARG A 45 -14.655 11.535 5.015 1.00 0.00 O ATOM 710 CB ARG A 45 -14.845 8.584 6.043 1.00 0.00 C ATOM 711 CG ARG A 45 -16.202 8.738 5.376 1.00 0.00 C ATOM 712 CD ARG A 45 -17.177 7.672 5.852 1.00 0.00 C ATOM 713 NE ARG A 45 -18.421 7.688 5.085 1.00 0.00 N ATOM 714 CZ ARG A 45 -18.778 6.740 4.215 1.00 0.00 C ATOM 715 NH1 ARG A 45 -17.991 5.689 4.005 1.00 0.00 N ATOM 716 NH2 ARG A 45 -19.924 6.842 3.554 1.00 0.00 N ATOM 0 H ARG A 45 -12.466 8.233 6.599 1.00 0.00 H new ATOM 0 HA ARG A 45 -13.810 9.185 4.263 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -14.588 7.525 6.082 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -14.916 8.933 7.073 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -16.606 9.727 5.594 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -16.087 8.672 4.294 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -16.711 6.690 5.767 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -17.399 7.829 6.907 1.00 0.00 H new ATOM 0 HE ARG A 45 -19.057 8.473 5.223 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -17.109 5.603 4.510 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -18.269 4.968 3.339 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -20.533 7.645 3.710 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -20.196 6.117 2.890 1.00 0.00 H new ATOM 730 N ASN A 46 -12.966 11.347 6.481 1.00 0.00 N ATOM 731 CA ASN A 46 -12.883 12.780 6.748 1.00 0.00 C ATOM 732 C ASN A 46 -11.799 13.423 5.896 1.00 0.00 C ATOM 733 O ASN A 46 -11.609 14.637 5.931 1.00 0.00 O ATOM 734 CB ASN A 46 -12.608 13.038 8.233 1.00 0.00 C ATOM 735 CG ASN A 46 -13.879 13.111 9.060 1.00 0.00 C ATOM 736 OD1 ASN A 46 -14.430 14.192 9.275 1.00 0.00 O ATOM 737 ND2 ASN A 46 -14.347 11.968 9.537 1.00 0.00 N ATOM 0 H ASN A 46 -12.316 10.780 7.026 1.00 0.00 H new ATOM 0 HA ASN A 46 -13.842 13.228 6.488 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -11.970 12.245 8.623 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -12.056 13.972 8.339 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -15.194 11.961 10.106 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -13.861 11.094 9.336 1.00 0.00 H new ATOM 744 N GLY A 47 -11.098 12.600 5.125 1.00 0.00 N ATOM 745 CA GLY A 47 -10.039 13.094 4.268 1.00 0.00 C ATOM 746 C GLY A 47 -8.879 13.683 5.048 1.00 0.00 C ATOM 747 O GLY A 47 -8.356 14.737 4.690 1.00 0.00 O ATOM 0 H GLY A 47 -11.247 11.592 5.079 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -9.674 12.279 3.643 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -10.444 13.853 3.599 1.00 0.00 H new ATOM 751 N LYS A 48 -8.484 13.015 6.125 1.00 0.00 N ATOM 752 CA LYS A 48 -7.372 13.488 6.940 1.00 0.00 C ATOM 753 C LYS A 48 -6.126 12.635 6.721 1.00 0.00 C ATOM 754 O LYS A 48 -5.005 13.144 6.721 1.00 0.00 O ATOM 755 CB LYS A 48 -7.752 13.504 8.423 1.00 0.00 C ATOM 756 CG LYS A 48 -8.948 14.393 8.737 1.00 0.00 C ATOM 757 CD LYS A 48 -9.091 14.636 10.233 1.00 0.00 C ATOM 758 CE LYS A 48 -7.894 15.398 10.786 1.00 0.00 C ATOM 759 NZ LYS A 48 -8.057 15.739 12.224 1.00 0.00 N ATOM 0 H LYS A 48 -8.914 12.150 6.453 1.00 0.00 H new ATOM 0 HA LYS A 48 -7.145 14.508 6.629 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -7.973 12.486 8.744 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -6.895 13.843 9.005 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -8.837 15.347 8.222 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -9.857 13.928 8.355 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -10.004 15.199 10.427 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -9.189 13.682 10.751 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -6.993 14.798 10.657 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -7.752 16.313 10.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -7.218 16.257 12.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -8.901 16.334 12.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -8.166 14.865 12.778 1.00 0.00 H new ATOM 773 N ILE A 49 -6.319 11.338 6.535 1.00 0.00 N ATOM 774 CA ILE A 49 -5.202 10.447 6.258 1.00 0.00 C ATOM 775 C ILE A 49 -5.172 10.093 4.780 1.00 0.00 C ATOM 776 O ILE A 49 -6.207 10.106 4.111 1.00 0.00 O ATOM 777 CB ILE A 49 -5.254 9.149 7.094 1.00 0.00 C ATOM 778 CG1 ILE A 49 -6.529 8.353 6.793 1.00 0.00 C ATOM 779 CG2 ILE A 49 -5.156 9.478 8.577 1.00 0.00 C ATOM 780 CD1 ILE A 49 -6.562 6.993 7.456 1.00 0.00 C ATOM 0 H ILE A 49 -7.230 10.882 6.570 1.00 0.00 H new ATOM 0 HA ILE A 49 -4.295 10.982 6.538 1.00 0.00 H new ATOM 0 HB ILE A 49 -4.403 8.526 6.819 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -7.394 8.930 7.121 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -6.622 8.225 5.715 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -5.194 8.556 9.157 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -4.216 9.993 8.774 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -5.988 10.121 8.863 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -7.492 6.486 7.200 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -5.717 6.398 7.109 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -6.501 7.114 8.538 1.00 0.00 H new ATOM 792 N THR A 50 -3.992 9.786 4.276 1.00 0.00 N ATOM 793 CA THR A 50 -3.828 9.468 2.868 1.00 0.00 C ATOM 794 C THR A 50 -4.128 7.996 2.604 1.00 0.00 C ATOM 795 O THR A 50 -4.143 7.180 3.530 1.00 0.00 O ATOM 796 CB THR A 50 -2.398 9.788 2.391 1.00 0.00 C ATOM 797 OG1 THR A 50 -1.447 9.058 3.174 1.00 0.00 O ATOM 798 CG2 THR A 50 -2.108 11.279 2.496 1.00 0.00 C ATOM 0 H THR A 50 -3.130 9.750 4.821 1.00 0.00 H new ATOM 0 HA THR A 50 -4.535 10.084 2.312 1.00 0.00 H new ATOM 0 HB THR A 50 -2.315 9.492 1.345 1.00 0.00 H new ATOM 0 HG1 THR A 50 -1.442 9.406 4.090 1.00 0.00 H new ATOM 0 HG21 THR A 50 -1.092 11.477 2.153 1.00 0.00 H new ATOM 0 HG22 THR A 50 -2.814 11.832 1.877 1.00 0.00 H new ATOM 0 HG23 THR A 50 -2.209 11.597 3.534 1.00 0.00 H new ATOM 806 N VAL A 51 -4.365 7.658 1.339 1.00 0.00 N ATOM 807 CA VAL A 51 -4.585 6.270 0.943 1.00 0.00 C ATOM 808 C VAL A 51 -3.377 5.416 1.322 1.00 0.00 C ATOM 809 O VAL A 51 -3.520 4.260 1.707 1.00 0.00 O ATOM 810 CB VAL A 51 -4.852 6.153 -0.576 1.00 0.00 C ATOM 811 CG1 VAL A 51 -5.113 4.708 -0.980 1.00 0.00 C ATOM 812 CG2 VAL A 51 -6.022 7.036 -0.977 1.00 0.00 C ATOM 0 H VAL A 51 -4.410 8.327 0.570 1.00 0.00 H new ATOM 0 HA VAL A 51 -5.466 5.908 1.473 1.00 0.00 H new ATOM 0 HB VAL A 51 -3.960 6.492 -1.102 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -5.297 4.658 -2.053 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -4.244 4.098 -0.732 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -5.985 4.332 -0.444 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -6.198 6.943 -2.049 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -6.915 6.725 -0.435 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -5.794 8.074 -0.736 1.00 0.00 H new ATOM 822 N ARG A 52 -2.193 6.015 1.234 1.00 0.00 N ATOM 823 CA ARG A 52 -0.949 5.350 1.613 1.00 0.00 C ATOM 824 C ARG A 52 -1.034 4.839 3.052 1.00 0.00 C ATOM 825 O ARG A 52 -0.748 3.671 3.339 1.00 0.00 O ATOM 826 CB ARG A 52 0.221 6.332 1.493 1.00 0.00 C ATOM 827 CG ARG A 52 0.324 7.030 0.141 1.00 0.00 C ATOM 828 CD ARG A 52 1.365 6.388 -0.763 1.00 0.00 C ATOM 829 NE ARG A 52 1.030 5.013 -1.128 1.00 0.00 N ATOM 830 CZ ARG A 52 1.939 4.089 -1.438 1.00 0.00 C ATOM 831 NH1 ARG A 52 3.229 4.401 -1.442 1.00 0.00 N ATOM 832 NH2 ARG A 52 1.558 2.858 -1.758 1.00 0.00 N ATOM 0 H ARG A 52 -2.068 6.971 0.900 1.00 0.00 H new ATOM 0 HA ARG A 52 -0.790 4.504 0.944 1.00 0.00 H new ATOM 0 HB2 ARG A 52 0.125 7.088 2.272 1.00 0.00 H new ATOM 0 HB3 ARG A 52 1.151 5.795 1.682 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -0.647 7.005 -0.353 1.00 0.00 H new ATOM 0 HG3 ARG A 52 0.577 8.079 0.295 1.00 0.00 H new ATOM 0 HD2 ARG A 52 1.469 6.984 -1.670 1.00 0.00 H new ATOM 0 HD3 ARG A 52 2.332 6.400 -0.261 1.00 0.00 H new ATOM 0 HE ARG A 52 0.046 4.746 -1.147 1.00 0.00 H new ATOM 0 HH11 ARG A 52 3.525 5.348 -1.208 1.00 0.00 H new ATOM 0 HH12 ARG A 52 3.924 3.693 -1.679 1.00 0.00 H new ATOM 0 HH21 ARG A 52 0.567 2.617 -1.767 1.00 0.00 H new ATOM 0 HH22 ARG A 52 2.256 2.153 -1.995 1.00 0.00 H new ATOM 846 N GLU A 53 -1.451 5.723 3.948 1.00 0.00 N ATOM 847 CA GLU A 53 -1.543 5.408 5.367 1.00 0.00 C ATOM 848 C GLU A 53 -2.671 4.415 5.630 1.00 0.00 C ATOM 849 O GLU A 53 -2.572 3.569 6.521 1.00 0.00 O ATOM 850 CB GLU A 53 -1.766 6.692 6.161 1.00 0.00 C ATOM 851 CG GLU A 53 -0.683 7.729 5.919 1.00 0.00 C ATOM 852 CD GLU A 53 -1.013 9.076 6.521 1.00 0.00 C ATOM 853 OE1 GLU A 53 -1.794 9.831 5.899 1.00 0.00 O ATOM 854 OE2 GLU A 53 -0.482 9.390 7.607 1.00 0.00 O ATOM 0 H GLU A 53 -1.734 6.674 3.713 1.00 0.00 H new ATOM 0 HA GLU A 53 -0.609 4.946 5.687 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -2.734 7.115 5.894 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -1.804 6.454 7.224 1.00 0.00 H new ATOM 0 HG2 GLU A 53 0.257 7.370 6.338 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -0.530 7.844 4.846 1.00 0.00 H new ATOM 861 N PHE A 54 -3.737 4.520 4.846 1.00 0.00 N ATOM 862 CA PHE A 54 -4.859 3.597 4.953 1.00 0.00 C ATOM 863 C PHE A 54 -4.426 2.192 4.537 1.00 0.00 C ATOM 864 O PHE A 54 -4.844 1.198 5.134 1.00 0.00 O ATOM 865 CB PHE A 54 -6.027 4.075 4.087 1.00 0.00 C ATOM 866 CG PHE A 54 -7.291 3.286 4.284 1.00 0.00 C ATOM 867 CD1 PHE A 54 -7.996 3.374 5.474 1.00 0.00 C ATOM 868 CD2 PHE A 54 -7.775 2.460 3.282 1.00 0.00 C ATOM 869 CE1 PHE A 54 -9.161 2.654 5.660 1.00 0.00 C ATOM 870 CE2 PHE A 54 -8.941 1.739 3.463 1.00 0.00 C ATOM 871 CZ PHE A 54 -9.634 1.836 4.655 1.00 0.00 C ATOM 0 H PHE A 54 -3.848 5.236 4.128 1.00 0.00 H new ATOM 0 HA PHE A 54 -5.190 3.567 5.991 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -6.226 5.124 4.309 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -5.736 4.021 3.038 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -7.631 4.012 6.265 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -7.236 2.379 2.350 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -9.701 2.732 6.592 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -9.310 1.101 2.674 1.00 0.00 H new ATOM 0 HZ PHE A 54 -10.544 1.272 4.799 1.00 0.00 H new ATOM 881 N VAL A 55 -3.577 2.124 3.514 1.00 0.00 N ATOM 882 CA VAL A 55 -3.003 0.860 3.072 1.00 0.00 C ATOM 883 C VAL A 55 -2.255 0.178 4.216 1.00 0.00 C ATOM 884 O VAL A 55 -2.379 -1.031 4.412 1.00 0.00 O ATOM 885 CB VAL A 55 -2.052 1.061 1.865 1.00 0.00 C ATOM 886 CG1 VAL A 55 -1.279 -0.211 1.556 1.00 0.00 C ATOM 887 CG2 VAL A 55 -2.830 1.507 0.636 1.00 0.00 C ATOM 0 H VAL A 55 -3.272 2.934 2.975 1.00 0.00 H new ATOM 0 HA VAL A 55 -3.827 0.220 2.755 1.00 0.00 H new ATOM 0 HB VAL A 55 -1.339 1.840 2.134 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -0.620 -0.039 0.705 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -0.684 -0.495 2.424 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -1.978 -1.013 1.318 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -2.144 1.642 -0.200 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -3.570 0.749 0.379 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -3.335 2.450 0.847 1.00 0.00 H new ATOM 897 N ARG A 56 -1.495 0.963 4.980 1.00 0.00 N ATOM 898 CA ARG A 56 -0.772 0.435 6.134 1.00 0.00 C ATOM 899 C ARG A 56 -1.731 -0.244 7.096 1.00 0.00 C ATOM 900 O ARG A 56 -1.531 -1.395 7.482 1.00 0.00 O ATOM 901 CB ARG A 56 -0.037 1.549 6.881 1.00 0.00 C ATOM 902 CG ARG A 56 0.929 1.025 7.935 1.00 0.00 C ATOM 903 CD ARG A 56 1.639 2.150 8.673 1.00 0.00 C ATOM 904 NE ARG A 56 0.751 2.860 9.591 1.00 0.00 N ATOM 905 CZ ARG A 56 1.134 3.885 10.352 1.00 0.00 C ATOM 906 NH1 ARG A 56 2.386 4.324 10.306 1.00 0.00 N ATOM 907 NH2 ARG A 56 0.262 4.462 11.169 1.00 0.00 N ATOM 0 H ARG A 56 -1.365 1.962 4.821 1.00 0.00 H new ATOM 0 HA ARG A 56 -0.046 -0.287 5.761 1.00 0.00 H new ATOM 0 HB2 ARG A 56 0.513 2.158 6.163 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -0.768 2.201 7.359 1.00 0.00 H new ATOM 0 HG2 ARG A 56 0.384 0.410 8.651 1.00 0.00 H new ATOM 0 HG3 ARG A 56 1.669 0.381 7.459 1.00 0.00 H new ATOM 0 HD2 ARG A 56 2.482 1.741 9.230 1.00 0.00 H new ATOM 0 HD3 ARG A 56 2.048 2.855 7.949 1.00 0.00 H new ATOM 0 HE ARG A 56 -0.220 2.553 9.653 1.00 0.00 H new ATOM 0 HH11 ARG A 56 3.061 3.876 9.686 1.00 0.00 H new ATOM 0 HH12 ARG A 56 2.673 5.109 10.891 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -0.698 4.121 11.213 1.00 0.00 H new ATOM 0 HH22 ARG A 56 0.552 5.247 11.753 1.00 0.00 H new ATOM 921 N ALA A 57 -2.780 0.482 7.458 1.00 0.00 N ATOM 922 CA ALA A 57 -3.747 0.017 8.437 1.00 0.00 C ATOM 923 C ALA A 57 -4.399 -1.289 8.004 1.00 0.00 C ATOM 924 O ALA A 57 -4.537 -2.208 8.803 1.00 0.00 O ATOM 925 CB ALA A 57 -4.806 1.084 8.672 1.00 0.00 C ATOM 0 H ALA A 57 -2.982 1.408 7.081 1.00 0.00 H new ATOM 0 HA ALA A 57 -3.215 -0.173 9.369 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -5.526 0.726 9.407 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -4.331 1.993 9.042 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -5.320 1.299 7.735 1.00 0.00 H new ATOM 931 N VAL A 58 -4.785 -1.373 6.739 1.00 0.00 N ATOM 932 CA VAL A 58 -5.491 -2.547 6.236 1.00 0.00 C ATOM 933 C VAL A 58 -4.552 -3.743 6.085 1.00 0.00 C ATOM 934 O VAL A 58 -4.929 -4.876 6.383 1.00 0.00 O ATOM 935 CB VAL A 58 -6.177 -2.258 4.883 1.00 0.00 C ATOM 936 CG1 VAL A 58 -6.915 -3.488 4.374 1.00 0.00 C ATOM 937 CG2 VAL A 58 -7.129 -1.081 5.014 1.00 0.00 C ATOM 0 H VAL A 58 -4.623 -0.646 6.042 1.00 0.00 H new ATOM 0 HA VAL A 58 -6.256 -2.791 6.973 1.00 0.00 H new ATOM 0 HB VAL A 58 -5.405 -2.003 4.157 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -7.390 -3.259 3.420 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -6.208 -4.307 4.240 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -7.676 -3.781 5.097 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -7.605 -0.889 4.052 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -7.892 -1.311 5.757 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -6.574 -0.197 5.327 1.00 0.00 H new ATOM 947 N ALA A 59 -3.325 -3.487 5.647 1.00 0.00 N ATOM 948 CA ALA A 59 -2.363 -4.558 5.398 1.00 0.00 C ATOM 949 C ALA A 59 -1.980 -5.289 6.684 1.00 0.00 C ATOM 950 O ALA A 59 -1.751 -6.495 6.673 1.00 0.00 O ATOM 951 CB ALA A 59 -1.123 -4.005 4.709 1.00 0.00 C ATOM 0 H ALA A 59 -2.972 -2.549 5.457 1.00 0.00 H new ATOM 0 HA ALA A 59 -2.841 -5.284 4.740 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -0.415 -4.814 4.530 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -1.406 -3.553 3.758 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -0.659 -3.251 5.345 1.00 0.00 H new ATOM 957 N LYS A 60 -1.915 -4.558 7.791 1.00 0.00 N ATOM 958 CA LYS A 60 -1.540 -5.151 9.072 1.00 0.00 C ATOM 959 C LYS A 60 -2.719 -5.136 10.047 1.00 0.00 C ATOM 960 O LYS A 60 -2.536 -5.284 11.257 1.00 0.00 O ATOM 961 CB LYS A 60 -0.332 -4.418 9.673 1.00 0.00 C ATOM 962 CG LYS A 60 -0.577 -2.946 9.962 1.00 0.00 C ATOM 963 CD LYS A 60 0.663 -2.270 10.531 1.00 0.00 C ATOM 964 CE LYS A 60 1.800 -2.239 9.521 1.00 0.00 C ATOM 965 NZ LYS A 60 3.021 -1.603 10.080 1.00 0.00 N ATOM 0 H LYS A 60 -2.116 -3.559 7.829 1.00 0.00 H new ATOM 0 HA LYS A 60 -1.260 -6.190 8.896 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -0.043 -4.915 10.599 1.00 0.00 H new ATOM 0 HB3 LYS A 60 0.511 -4.507 8.987 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -0.879 -2.440 9.045 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -1.402 -2.846 10.667 1.00 0.00 H new ATOM 0 HD2 LYS A 60 0.416 -1.252 10.833 1.00 0.00 H new ATOM 0 HD3 LYS A 60 0.987 -2.799 11.427 1.00 0.00 H new ATOM 0 HE2 LYS A 60 2.033 -3.256 9.205 1.00 0.00 H new ATOM 0 HE3 LYS A 60 1.481 -1.694 8.632 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 3.761 -1.571 9.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 2.798 -0.636 10.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 3.360 -2.157 10.892 1.00 0.00 H new ATOM 979 N SER A 61 -3.922 -4.950 9.506 1.00 0.00 N ATOM 980 CA SER A 61 -5.139 -4.841 10.310 1.00 0.00 C ATOM 981 C SER A 61 -5.324 -6.054 11.219 1.00 0.00 C ATOM 982 O SER A 61 -5.192 -5.959 12.443 1.00 0.00 O ATOM 983 CB SER A 61 -6.354 -4.686 9.390 1.00 0.00 C ATOM 984 OG SER A 61 -6.399 -5.726 8.423 1.00 0.00 O ATOM 0 H SER A 61 -4.081 -4.871 8.502 1.00 0.00 H new ATOM 0 HA SER A 61 -5.045 -3.961 10.946 1.00 0.00 H new ATOM 0 HB2 SER A 61 -7.268 -4.698 9.984 1.00 0.00 H new ATOM 0 HB3 SER A 61 -6.313 -3.720 8.888 1.00 0.00 H new ATOM 0 HG SER A 61 -5.884 -5.460 7.633 1.00 0.00 H new ATOM 990 N GLU A 62 -5.635 -7.183 10.614 1.00 0.00 N ATOM 991 CA GLU A 62 -5.789 -8.425 11.338 1.00 0.00 C ATOM 992 C GLU A 62 -4.458 -9.169 11.334 1.00 0.00 C ATOM 993 O GLU A 62 -3.520 -8.745 10.656 1.00 0.00 O ATOM 994 CB GLU A 62 -6.897 -9.266 10.688 1.00 0.00 C ATOM 995 CG GLU A 62 -7.303 -10.490 11.493 1.00 0.00 C ATOM 996 CD GLU A 62 -7.819 -10.137 12.871 1.00 0.00 C ATOM 997 OE1 GLU A 62 -7.007 -9.741 13.726 1.00 0.00 O ATOM 998 OE2 GLU A 62 -9.038 -10.254 13.104 1.00 0.00 O ATOM 0 H GLU A 62 -5.787 -7.263 9.609 1.00 0.00 H new ATOM 0 HA GLU A 62 -6.076 -8.228 12.371 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -7.774 -8.637 10.537 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -6.562 -9.588 9.702 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -8.073 -11.038 10.950 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -6.446 -11.157 11.590 1.00 0.00 H new ATOM 1005 N LEU A 63 -4.367 -10.250 12.105 1.00 0.00 N ATOM 1006 CA LEU A 63 -3.169 -11.084 12.124 1.00 0.00 C ATOM 1007 C LEU A 63 -2.777 -11.487 10.708 1.00 0.00 C ATOM 1008 O LEU A 63 -3.451 -12.297 10.068 1.00 0.00 O ATOM 1009 CB LEU A 63 -3.378 -12.338 12.983 1.00 0.00 C ATOM 1010 CG LEU A 63 -3.273 -12.135 14.499 1.00 0.00 C ATOM 1011 CD1 LEU A 63 -4.445 -11.322 15.030 1.00 0.00 C ATOM 1012 CD2 LEU A 63 -3.203 -13.478 15.204 1.00 0.00 C ATOM 0 H LEU A 63 -5.111 -10.569 12.726 1.00 0.00 H new ATOM 0 HA LEU A 63 -2.364 -10.496 12.564 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -4.362 -12.749 12.758 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -2.644 -13.086 12.684 1.00 0.00 H new ATOM 0 HG LEU A 63 -2.358 -11.578 14.702 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -4.341 -11.195 16.108 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -4.457 -10.344 14.549 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -5.377 -11.844 14.814 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -3.129 -13.321 16.280 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -4.102 -14.052 14.983 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -2.328 -14.026 14.856 1.00 0.00 H new ATOM 1024 N TYR A 64 -1.688 -10.898 10.227 1.00 0.00 N ATOM 1025 CA TYR A 64 -1.223 -11.116 8.862 1.00 0.00 C ATOM 1026 C TYR A 64 -0.690 -12.531 8.655 1.00 0.00 C ATOM 1027 O TYR A 64 -0.511 -12.972 7.518 1.00 0.00 O ATOM 1028 CB TYR A 64 -0.157 -10.080 8.490 1.00 0.00 C ATOM 1029 CG TYR A 64 0.896 -9.866 9.556 1.00 0.00 C ATOM 1030 CD1 TYR A 64 2.006 -10.698 9.645 1.00 0.00 C ATOM 1031 CD2 TYR A 64 0.782 -8.822 10.467 1.00 0.00 C ATOM 1032 CE1 TYR A 64 2.970 -10.496 10.612 1.00 0.00 C ATOM 1033 CE2 TYR A 64 1.743 -8.615 11.438 1.00 0.00 C ATOM 1034 CZ TYR A 64 2.834 -9.454 11.507 1.00 0.00 C ATOM 1035 OH TYR A 64 3.799 -9.249 12.468 1.00 0.00 O ATOM 0 H TYR A 64 -1.105 -10.259 10.769 1.00 0.00 H new ATOM 0 HA TYR A 64 -2.082 -10.996 8.202 1.00 0.00 H new ATOM 0 HB2 TYR A 64 0.333 -10.394 7.568 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -0.647 -9.129 8.283 1.00 0.00 H new ATOM 0 HD1 TYR A 64 2.116 -11.515 8.947 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -0.071 -8.162 10.415 1.00 0.00 H new ATOM 0 HE1 TYR A 64 3.827 -11.151 10.668 1.00 0.00 H new ATOM 0 HE2 TYR A 64 1.640 -7.800 12.139 1.00 0.00 H new ATOM 0 HH TYR A 64 3.554 -8.475 13.017 1.00 0.00 H new ATOM 1045 N LYS A 65 -0.442 -13.249 9.744 1.00 0.00 N ATOM 1046 CA LYS A 65 -0.028 -14.636 9.634 1.00 0.00 C ATOM 1047 C LYS A 65 -1.256 -15.508 9.407 1.00 0.00 C ATOM 1048 O LYS A 65 -1.733 -16.201 10.309 1.00 0.00 O ATOM 1049 CB LYS A 65 0.744 -15.089 10.873 1.00 0.00 C ATOM 1050 CG LYS A 65 1.488 -16.396 10.660 1.00 0.00 C ATOM 1051 CD LYS A 65 2.354 -16.764 11.853 1.00 0.00 C ATOM 1052 CE LYS A 65 1.526 -17.256 13.027 1.00 0.00 C ATOM 1053 NZ LYS A 65 2.386 -17.671 14.165 1.00 0.00 N ATOM 0 H LYS A 65 -0.520 -12.898 10.698 1.00 0.00 H new ATOM 0 HA LYS A 65 0.648 -14.736 8.784 1.00 0.00 H new ATOM 0 HB2 LYS A 65 1.456 -14.313 11.155 1.00 0.00 H new ATOM 0 HB3 LYS A 65 0.050 -15.203 11.706 1.00 0.00 H new ATOM 0 HG2 LYS A 65 0.770 -17.195 10.474 1.00 0.00 H new ATOM 0 HG3 LYS A 65 2.113 -16.316 9.770 1.00 0.00 H new ATOM 0 HD2 LYS A 65 3.064 -17.538 11.561 1.00 0.00 H new ATOM 0 HD3 LYS A 65 2.937 -15.896 12.159 1.00 0.00 H new ATOM 0 HE2 LYS A 65 0.848 -16.467 13.351 1.00 0.00 H new ATOM 0 HE3 LYS A 65 0.909 -18.097 12.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 1.788 -18.001 14.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 3.016 -18.441 13.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 2.957 -16.862 14.482 1.00 0.00 H new ATOM 1185 N PHE A 73 5.564 -19.193 0.409 1.00 0.00 N ATOM 1186 CA PHE A 73 6.989 -18.914 0.324 1.00 0.00 C ATOM 1187 C PHE A 73 7.234 -17.426 0.511 1.00 0.00 C ATOM 1188 O PHE A 73 6.482 -16.608 -0.011 1.00 0.00 O ATOM 1189 CB PHE A 73 7.550 -19.373 -1.026 1.00 0.00 C ATOM 1190 CG PHE A 73 7.438 -20.854 -1.253 1.00 0.00 C ATOM 1191 CD1 PHE A 73 8.412 -21.715 -0.775 1.00 0.00 C ATOM 1192 CD2 PHE A 73 6.355 -21.384 -1.937 1.00 0.00 C ATOM 1193 CE1 PHE A 73 8.309 -23.078 -0.976 1.00 0.00 C ATOM 1194 CE2 PHE A 73 6.246 -22.746 -2.140 1.00 0.00 C ATOM 1195 CZ PHE A 73 7.225 -23.594 -1.659 1.00 0.00 C ATOM 0 HA PHE A 73 7.500 -19.465 1.114 1.00 0.00 H new ATOM 0 HB2 PHE A 73 7.024 -18.851 -1.825 1.00 0.00 H new ATOM 0 HB3 PHE A 73 8.598 -19.082 -1.092 1.00 0.00 H new ATOM 0 HD1 PHE A 73 9.261 -21.317 -0.239 1.00 0.00 H new ATOM 0 HD2 PHE A 73 5.588 -20.725 -2.315 1.00 0.00 H new ATOM 0 HE1 PHE A 73 9.075 -23.739 -0.599 1.00 0.00 H new ATOM 0 HE2 PHE A 73 5.397 -23.147 -2.674 1.00 0.00 H new ATOM 0 HZ PHE A 73 7.143 -24.659 -1.817 1.00 0.00 H new ATOM 1205 N GLN A 74 8.288 -17.085 1.241 1.00 0.00 N ATOM 1206 CA GLN A 74 8.598 -15.690 1.551 1.00 0.00 C ATOM 1207 C GLN A 74 8.746 -14.868 0.277 1.00 0.00 C ATOM 1208 O GLN A 74 8.252 -13.746 0.190 1.00 0.00 O ATOM 1209 CB GLN A 74 9.880 -15.599 2.383 1.00 0.00 C ATOM 1210 CG GLN A 74 9.748 -16.194 3.775 1.00 0.00 C ATOM 1211 CD GLN A 74 8.688 -15.500 4.608 1.00 0.00 C ATOM 1212 OE1 GLN A 74 8.427 -14.310 4.440 1.00 0.00 O ATOM 1213 NE2 GLN A 74 8.069 -16.239 5.511 1.00 0.00 N ATOM 0 H GLN A 74 8.948 -17.757 1.633 1.00 0.00 H new ATOM 0 HA GLN A 74 7.769 -15.283 2.130 1.00 0.00 H new ATOM 0 HB2 GLN A 74 10.683 -16.111 1.853 1.00 0.00 H new ATOM 0 HB3 GLN A 74 10.172 -14.553 2.471 1.00 0.00 H new ATOM 0 HG2 GLN A 74 9.504 -17.253 3.692 1.00 0.00 H new ATOM 0 HG3 GLN A 74 10.708 -16.128 4.287 1.00 0.00 H new ATOM 0 HE21 GLN A 74 8.314 -17.223 5.620 1.00 0.00 H new ATOM 0 HE22 GLN A 74 7.346 -15.826 6.099 1.00 0.00 H new ATOM 1222 N THR A 75 9.408 -15.449 -0.713 1.00 0.00 N ATOM 1223 CA THR A 75 9.595 -14.805 -2.003 1.00 0.00 C ATOM 1224 C THR A 75 8.251 -14.480 -2.647 1.00 0.00 C ATOM 1225 O THR A 75 8.043 -13.386 -3.177 1.00 0.00 O ATOM 1226 CB THR A 75 10.392 -15.727 -2.938 1.00 0.00 C ATOM 1227 OG1 THR A 75 9.825 -17.043 -2.895 1.00 0.00 O ATOM 1228 CG2 THR A 75 11.856 -15.784 -2.528 1.00 0.00 C ATOM 0 H THR A 75 9.828 -16.376 -0.645 1.00 0.00 H new ATOM 0 HA THR A 75 10.144 -13.877 -1.842 1.00 0.00 H new ATOM 0 HB THR A 75 10.339 -15.330 -3.952 1.00 0.00 H new ATOM 0 HG1 THR A 75 10.328 -17.636 -3.491 1.00 0.00 H new ATOM 0 HG21 THR A 75 12.398 -16.443 -3.206 1.00 0.00 H new ATOM 0 HG22 THR A 75 12.286 -14.783 -2.574 1.00 0.00 H new ATOM 0 HG23 THR A 75 11.934 -16.166 -1.510 1.00 0.00 H new ATOM 1236 N ARG A 76 7.337 -15.438 -2.569 1.00 0.00 N ATOM 1237 CA ARG A 76 6.018 -15.305 -3.160 1.00 0.00 C ATOM 1238 C ARG A 76 5.199 -14.269 -2.392 1.00 0.00 C ATOM 1239 O ARG A 76 4.489 -13.465 -2.991 1.00 0.00 O ATOM 1240 CB ARG A 76 5.310 -16.662 -3.143 1.00 0.00 C ATOM 1241 CG ARG A 76 4.163 -16.776 -4.131 1.00 0.00 C ATOM 1242 CD ARG A 76 4.677 -16.785 -5.559 1.00 0.00 C ATOM 1243 NE ARG A 76 3.603 -16.877 -6.542 1.00 0.00 N ATOM 1244 CZ ARG A 76 3.574 -16.160 -7.665 1.00 0.00 C ATOM 1245 NH1 ARG A 76 4.566 -15.323 -7.932 1.00 0.00 N ATOM 1246 NH2 ARG A 76 2.564 -16.283 -8.519 1.00 0.00 N ATOM 0 H ARG A 76 7.492 -16.327 -2.094 1.00 0.00 H new ATOM 0 HA ARG A 76 6.119 -14.969 -4.192 1.00 0.00 H new ATOM 0 HB2 ARG A 76 6.039 -17.443 -3.358 1.00 0.00 H new ATOM 0 HB3 ARG A 76 4.930 -16.849 -2.139 1.00 0.00 H new ATOM 0 HG2 ARG A 76 3.600 -17.689 -3.937 1.00 0.00 H new ATOM 0 HG3 ARG A 76 3.475 -15.942 -3.993 1.00 0.00 H new ATOM 0 HD2 ARG A 76 5.253 -15.877 -5.740 1.00 0.00 H new ATOM 0 HD3 ARG A 76 5.358 -17.626 -5.691 1.00 0.00 H new ATOM 0 HE ARG A 76 2.835 -17.523 -6.360 1.00 0.00 H new ATOM 0 HH11 ARG A 76 5.345 -15.231 -7.280 1.00 0.00 H new ATOM 0 HH12 ARG A 76 4.551 -14.771 -8.790 1.00 0.00 H new ATOM 0 HH21 ARG A 76 1.802 -16.930 -8.318 1.00 0.00 H new ATOM 0 HH22 ARG A 76 2.551 -15.730 -9.376 1.00 0.00 H new ATOM 1260 N VAL A 77 5.317 -14.292 -1.065 1.00 0.00 N ATOM 1261 CA VAL A 77 4.621 -13.336 -0.207 1.00 0.00 C ATOM 1262 C VAL A 77 5.035 -11.906 -0.541 1.00 0.00 C ATOM 1263 O VAL A 77 4.193 -11.014 -0.656 1.00 0.00 O ATOM 1264 CB VAL A 77 4.897 -13.614 1.289 1.00 0.00 C ATOM 1265 CG1 VAL A 77 4.197 -12.595 2.176 1.00 0.00 C ATOM 1266 CG2 VAL A 77 4.463 -15.022 1.660 1.00 0.00 C ATOM 0 H VAL A 77 5.891 -14.966 -0.559 1.00 0.00 H new ATOM 0 HA VAL A 77 3.554 -13.455 -0.393 1.00 0.00 H new ATOM 0 HB VAL A 77 5.971 -13.524 1.452 1.00 0.00 H new ATOM 0 HG11 VAL A 77 4.410 -12.816 3.222 1.00 0.00 H new ATOM 0 HG12 VAL A 77 4.558 -11.595 1.936 1.00 0.00 H new ATOM 0 HG13 VAL A 77 3.121 -12.643 2.006 1.00 0.00 H new ATOM 0 HG21 VAL A 77 4.665 -15.199 2.716 1.00 0.00 H new ATOM 0 HG22 VAL A 77 3.396 -15.135 1.471 1.00 0.00 H new ATOM 0 HG23 VAL A 77 5.016 -15.744 1.059 1.00 0.00 H new ATOM 1276 N ILE A 78 6.335 -11.698 -0.707 1.00 0.00 N ATOM 1277 CA ILE A 78 6.860 -10.386 -1.066 1.00 0.00 C ATOM 1278 C ILE A 78 6.299 -9.929 -2.407 1.00 0.00 C ATOM 1279 O ILE A 78 5.912 -8.772 -2.563 1.00 0.00 O ATOM 1280 CB ILE A 78 8.403 -10.390 -1.124 1.00 0.00 C ATOM 1281 CG1 ILE A 78 8.974 -10.725 0.254 1.00 0.00 C ATOM 1282 CG2 ILE A 78 8.932 -9.045 -1.614 1.00 0.00 C ATOM 1283 CD1 ILE A 78 10.475 -10.900 0.263 1.00 0.00 C ATOM 0 H ILE A 78 7.046 -12.421 -0.599 1.00 0.00 H new ATOM 0 HA ILE A 78 6.546 -9.689 -0.289 1.00 0.00 H new ATOM 0 HB ILE A 78 8.723 -11.153 -1.833 1.00 0.00 H new ATOM 0 HG12 ILE A 78 8.705 -9.932 0.952 1.00 0.00 H new ATOM 0 HG13 ILE A 78 8.508 -11.641 0.618 1.00 0.00 H new ATOM 0 HG21 ILE A 78 10.021 -9.072 -1.646 1.00 0.00 H new ATOM 0 HG22 ILE A 78 8.544 -8.843 -2.613 1.00 0.00 H new ATOM 0 HG23 ILE A 78 8.609 -8.257 -0.934 1.00 0.00 H new ATOM 0 HD11 ILE A 78 10.808 -11.136 1.274 1.00 0.00 H new ATOM 0 HD12 ILE A 78 10.751 -11.713 -0.409 1.00 0.00 H new ATOM 0 HD13 ILE A 78 10.951 -9.978 -0.070 1.00 0.00 H new ATOM 1295 N GLU A 79 6.241 -10.844 -3.371 1.00 0.00 N ATOM 1296 CA GLU A 79 5.694 -10.532 -4.679 1.00 0.00 C ATOM 1297 C GLU A 79 4.210 -10.185 -4.561 1.00 0.00 C ATOM 1298 O GLU A 79 3.718 -9.286 -5.244 1.00 0.00 O ATOM 1299 CB GLU A 79 5.905 -11.701 -5.645 1.00 0.00 C ATOM 1300 CG GLU A 79 5.579 -11.343 -7.083 1.00 0.00 C ATOM 1301 CD GLU A 79 5.927 -12.439 -8.069 1.00 0.00 C ATOM 1302 OE1 GLU A 79 7.059 -12.956 -8.015 1.00 0.00 O ATOM 1303 OE2 GLU A 79 5.066 -12.794 -8.903 1.00 0.00 O ATOM 0 H GLU A 79 6.567 -11.805 -3.267 1.00 0.00 H new ATOM 0 HA GLU A 79 6.220 -9.665 -5.079 1.00 0.00 H new ATOM 0 HB2 GLU A 79 6.941 -12.034 -5.584 1.00 0.00 H new ATOM 0 HB3 GLU A 79 5.282 -12.540 -5.334 1.00 0.00 H new ATOM 0 HG2 GLU A 79 4.515 -11.118 -7.162 1.00 0.00 H new ATOM 0 HG3 GLU A 79 6.118 -10.435 -7.355 1.00 0.00 H new ATOM 1310 N LEU A 80 3.509 -10.889 -3.676 1.00 0.00 N ATOM 1311 CA LEU A 80 2.105 -10.601 -3.406 1.00 0.00 C ATOM 1312 C LEU A 80 1.942 -9.175 -2.894 1.00 0.00 C ATOM 1313 O LEU A 80 1.122 -8.414 -3.407 1.00 0.00 O ATOM 1314 CB LEU A 80 1.527 -11.582 -2.379 1.00 0.00 C ATOM 1315 CG LEU A 80 1.466 -13.046 -2.819 1.00 0.00 C ATOM 1316 CD1 LEU A 80 0.930 -13.913 -1.689 1.00 0.00 C ATOM 1317 CD2 LEU A 80 0.607 -13.198 -4.068 1.00 0.00 C ATOM 0 H LEU A 80 3.892 -11.664 -3.134 1.00 0.00 H new ATOM 0 HA LEU A 80 1.559 -10.713 -4.342 1.00 0.00 H new ATOM 0 HB2 LEU A 80 2.124 -11.520 -1.469 1.00 0.00 H new ATOM 0 HB3 LEU A 80 0.519 -11.257 -2.121 1.00 0.00 H new ATOM 0 HG LEU A 80 2.476 -13.377 -3.061 1.00 0.00 H new ATOM 0 HD11 LEU A 80 0.891 -14.952 -2.015 1.00 0.00 H new ATOM 0 HD12 LEU A 80 1.586 -13.828 -0.823 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -0.072 -13.580 -1.419 1.00 0.00 H new ATOM 0 HD21 LEU A 80 0.577 -14.247 -4.364 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -0.405 -12.851 -3.858 1.00 0.00 H new ATOM 0 HD23 LEU A 80 1.033 -12.605 -4.877 1.00 0.00 H new ATOM 1329 N ASN A 81 2.734 -8.813 -1.888 1.00 0.00 N ATOM 1330 CA ASN A 81 2.682 -7.468 -1.323 1.00 0.00 C ATOM 1331 C ASN A 81 3.077 -6.436 -2.367 1.00 0.00 C ATOM 1332 O ASN A 81 2.434 -5.398 -2.500 1.00 0.00 O ATOM 1333 CB ASN A 81 3.601 -7.330 -0.104 1.00 0.00 C ATOM 1334 CG ASN A 81 3.170 -8.189 1.068 1.00 0.00 C ATOM 1335 OD1 ASN A 81 2.008 -8.577 1.172 1.00 0.00 O ATOM 1336 ND2 ASN A 81 4.092 -8.457 1.983 1.00 0.00 N ATOM 0 H ASN A 81 3.417 -9.430 -1.449 1.00 0.00 H new ATOM 0 HA ASN A 81 1.655 -7.293 -1.003 1.00 0.00 H new ATOM 0 HB2 ASN A 81 4.617 -7.601 -0.391 1.00 0.00 H new ATOM 0 HB3 ASN A 81 3.625 -6.286 0.208 1.00 0.00 H new ATOM 0 HD21 ASN A 81 3.847 -9.003 2.809 1.00 0.00 H new ATOM 0 HD22 ASN A 81 5.046 -8.117 1.861 1.00 0.00 H new ATOM 1343 N TYR A 82 4.126 -6.738 -3.118 1.00 0.00 N ATOM 1344 CA TYR A 82 4.627 -5.833 -4.142 1.00 0.00 C ATOM 1345 C TYR A 82 3.532 -5.516 -5.160 1.00 0.00 C ATOM 1346 O TYR A 82 3.265 -4.354 -5.459 1.00 0.00 O ATOM 1347 CB TYR A 82 5.835 -6.456 -4.848 1.00 0.00 C ATOM 1348 CG TYR A 82 6.943 -5.472 -5.168 1.00 0.00 C ATOM 1349 CD1 TYR A 82 7.947 -5.210 -4.244 1.00 0.00 C ATOM 1350 CD2 TYR A 82 6.993 -4.811 -6.391 1.00 0.00 C ATOM 1351 CE1 TYR A 82 8.964 -4.318 -4.526 1.00 0.00 C ATOM 1352 CE2 TYR A 82 8.008 -3.917 -6.681 1.00 0.00 C ATOM 1353 CZ TYR A 82 8.990 -3.675 -5.747 1.00 0.00 C ATOM 1354 OH TYR A 82 10.001 -2.786 -6.035 1.00 0.00 O ATOM 0 H TYR A 82 4.650 -7.609 -3.036 1.00 0.00 H new ATOM 0 HA TYR A 82 4.935 -4.904 -3.663 1.00 0.00 H new ATOM 0 HB2 TYR A 82 6.239 -7.250 -4.220 1.00 0.00 H new ATOM 0 HB3 TYR A 82 5.500 -6.922 -5.774 1.00 0.00 H new ATOM 0 HD1 TYR A 82 7.932 -5.713 -3.288 1.00 0.00 H new ATOM 0 HD2 TYR A 82 6.226 -4.999 -7.127 1.00 0.00 H new ATOM 0 HE1 TYR A 82 9.735 -4.125 -3.795 1.00 0.00 H new ATOM 0 HE2 TYR A 82 8.030 -3.412 -7.635 1.00 0.00 H new ATOM 0 HH TYR A 82 10.390 -3.005 -6.907 1.00 0.00 H new ATOM 1364 N LYS A 83 2.872 -6.555 -5.655 1.00 0.00 N ATOM 1365 CA LYS A 83 1.857 -6.395 -6.694 1.00 0.00 C ATOM 1366 C LYS A 83 0.537 -5.874 -6.132 1.00 0.00 C ATOM 1367 O LYS A 83 -0.296 -5.358 -6.873 1.00 0.00 O ATOM 1368 CB LYS A 83 1.615 -7.724 -7.410 1.00 0.00 C ATOM 1369 CG LYS A 83 2.862 -8.301 -8.054 1.00 0.00 C ATOM 1370 CD LYS A 83 2.574 -9.619 -8.750 1.00 0.00 C ATOM 1371 CE LYS A 83 1.644 -9.429 -9.934 1.00 0.00 C ATOM 1372 NZ LYS A 83 1.356 -10.714 -10.618 1.00 0.00 N ATOM 0 H LYS A 83 3.020 -7.519 -5.355 1.00 0.00 H new ATOM 0 HA LYS A 83 2.237 -5.657 -7.401 1.00 0.00 H new ATOM 0 HB2 LYS A 83 1.218 -8.445 -6.696 1.00 0.00 H new ATOM 0 HB3 LYS A 83 0.853 -7.581 -8.176 1.00 0.00 H new ATOM 0 HG2 LYS A 83 3.263 -7.588 -8.775 1.00 0.00 H new ATOM 0 HG3 LYS A 83 3.629 -8.450 -7.294 1.00 0.00 H new ATOM 0 HD2 LYS A 83 3.509 -10.065 -9.088 1.00 0.00 H new ATOM 0 HD3 LYS A 83 2.126 -10.316 -8.042 1.00 0.00 H new ATOM 0 HE2 LYS A 83 0.710 -8.980 -9.595 1.00 0.00 H new ATOM 0 HE3 LYS A 83 2.094 -8.733 -10.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 0.718 -10.544 -11.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 2.244 -11.130 -10.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 0.904 -11.370 -9.949 1.00 0.00 H new ATOM 1386 N HIS A 84 0.332 -6.022 -4.831 1.00 0.00 N ATOM 1387 CA HIS A 84 -0.924 -5.596 -4.220 1.00 0.00 C ATOM 1388 C HIS A 84 -0.814 -4.187 -3.644 1.00 0.00 C ATOM 1389 O HIS A 84 -1.804 -3.463 -3.574 1.00 0.00 O ATOM 1390 CB HIS A 84 -1.349 -6.571 -3.117 1.00 0.00 C ATOM 1391 CG HIS A 84 -2.811 -6.503 -2.784 1.00 0.00 C ATOM 1392 ND1 HIS A 84 -3.406 -5.417 -2.176 1.00 0.00 N ATOM 1393 CD2 HIS A 84 -3.806 -7.397 -2.998 1.00 0.00 C ATOM 1394 CE1 HIS A 84 -4.698 -5.649 -2.029 1.00 0.00 C ATOM 1395 NE2 HIS A 84 -4.970 -6.843 -2.522 1.00 0.00 N ATOM 0 H HIS A 84 1.008 -6.428 -4.183 1.00 0.00 H new ATOM 0 HA HIS A 84 -1.681 -5.590 -5.004 1.00 0.00 H new ATOM 0 HB2 HIS A 84 -1.103 -7.587 -3.427 1.00 0.00 H new ATOM 0 HB3 HIS A 84 -0.770 -6.363 -2.217 1.00 0.00 H new ATOM 0 HD1 HIS A 84 -2.923 -4.567 -1.885 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -3.703 -8.368 -3.459 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -5.412 -4.975 -1.580 1.00 0.00 H new ATOM 1404 N LEU A 85 0.375 -3.813 -3.198 1.00 0.00 N ATOM 1405 CA LEU A 85 0.568 -2.519 -2.557 1.00 0.00 C ATOM 1406 C LEU A 85 1.211 -1.510 -3.508 1.00 0.00 C ATOM 1407 O LEU A 85 1.018 -0.303 -3.359 1.00 0.00 O ATOM 1408 CB LEU A 85 1.411 -2.673 -1.289 1.00 0.00 C ATOM 1409 CG LEU A 85 0.872 -3.686 -0.274 1.00 0.00 C ATOM 1410 CD1 LEU A 85 1.751 -3.723 0.964 1.00 0.00 C ATOM 1411 CD2 LEU A 85 -0.565 -3.359 0.104 1.00 0.00 C ATOM 0 H LEU A 85 1.218 -4.383 -3.267 1.00 0.00 H new ATOM 0 HA LEU A 85 -0.414 -2.134 -2.283 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.420 -2.969 -1.575 1.00 0.00 H new ATOM 0 HB3 LEU A 85 1.490 -1.701 -0.803 1.00 0.00 H new ATOM 0 HG LEU A 85 0.888 -4.672 -0.738 1.00 0.00 H new ATOM 0 HD11 LEU A 85 1.351 -4.448 1.673 1.00 0.00 H new ATOM 0 HD12 LEU A 85 2.764 -4.011 0.683 1.00 0.00 H new ATOM 0 HD13 LEU A 85 1.770 -2.736 1.427 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -0.927 -4.091 0.826 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -0.608 -2.363 0.545 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -1.191 -3.388 -0.788 1.00 0.00 H new ATOM 1423 N LEU A 86 1.981 -2.002 -4.474 1.00 0.00 N ATOM 1424 CA LEU A 86 2.607 -1.129 -5.463 1.00 0.00 C ATOM 1425 C LEU A 86 2.007 -1.362 -6.844 1.00 0.00 C ATOM 1426 O LEU A 86 2.240 -0.592 -7.772 1.00 0.00 O ATOM 1427 CB LEU A 86 4.122 -1.352 -5.508 1.00 0.00 C ATOM 1428 CG LEU A 86 4.867 -1.022 -4.212 1.00 0.00 C ATOM 1429 CD1 LEU A 86 6.354 -1.291 -4.370 1.00 0.00 C ATOM 1430 CD2 LEU A 86 4.631 0.425 -3.807 1.00 0.00 C ATOM 0 H LEU A 86 2.186 -2.994 -4.593 1.00 0.00 H new ATOM 0 HA LEU A 86 2.416 -0.098 -5.166 1.00 0.00 H new ATOM 0 HB2 LEU A 86 4.312 -2.395 -5.763 1.00 0.00 H new ATOM 0 HB3 LEU A 86 4.539 -0.746 -6.313 1.00 0.00 H new ATOM 0 HG LEU A 86 4.479 -1.666 -3.423 1.00 0.00 H new ATOM 0 HD11 LEU A 86 6.868 -1.051 -3.439 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.510 -2.343 -4.610 1.00 0.00 H new ATOM 0 HD13 LEU A 86 6.752 -0.672 -5.174 1.00 0.00 H new ATOM 0 HD21 LEU A 86 5.170 0.637 -2.884 1.00 0.00 H new ATOM 0 HD22 LEU A 86 4.989 1.087 -4.596 1.00 0.00 H new ATOM 0 HD23 LEU A 86 3.565 0.590 -3.651 1.00 0.00 H new ATOM 1442 N GLY A 87 1.248 -2.442 -6.973 1.00 0.00 N ATOM 1443 CA GLY A 87 0.547 -2.721 -8.213 1.00 0.00 C ATOM 1444 C GLY A 87 1.456 -3.224 -9.318 1.00 0.00 C ATOM 1445 O GLY A 87 1.063 -3.257 -10.484 1.00 0.00 O ATOM 0 H GLY A 87 1.104 -3.134 -6.237 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -0.229 -3.463 -8.024 1.00 0.00 H new ATOM 0 HA3 GLY A 87 0.045 -1.814 -8.550 1.00 0.00 H new ATOM 1449 N ARG A 88 2.664 -3.631 -8.958 1.00 0.00 N ATOM 1450 CA ARG A 88 3.636 -4.090 -9.938 1.00 0.00 C ATOM 1451 C ARG A 88 4.495 -5.203 -9.346 1.00 0.00 C ATOM 1452 O ARG A 88 4.621 -5.309 -8.130 1.00 0.00 O ATOM 1453 CB ARG A 88 4.516 -2.915 -10.389 1.00 0.00 C ATOM 1454 CG ARG A 88 5.521 -3.275 -11.470 1.00 0.00 C ATOM 1455 CD ARG A 88 6.421 -2.102 -11.812 1.00 0.00 C ATOM 1456 NE ARG A 88 5.693 -0.999 -12.442 1.00 0.00 N ATOM 1457 CZ ARG A 88 6.134 0.261 -12.468 1.00 0.00 C ATOM 1458 NH1 ARG A 88 7.262 0.586 -11.848 1.00 0.00 N ATOM 1459 NH2 ARG A 88 5.449 1.201 -13.105 1.00 0.00 N ATOM 0 H ARG A 88 2.995 -3.653 -7.993 1.00 0.00 H new ATOM 0 HA ARG A 88 3.108 -4.486 -10.805 1.00 0.00 H new ATOM 0 HB2 ARG A 88 3.874 -2.114 -10.756 1.00 0.00 H new ATOM 0 HB3 ARG A 88 5.052 -2.523 -9.525 1.00 0.00 H new ATOM 0 HG2 ARG A 88 6.129 -4.115 -11.136 1.00 0.00 H new ATOM 0 HG3 ARG A 88 4.992 -3.601 -12.365 1.00 0.00 H new ATOM 0 HD2 ARG A 88 6.903 -1.742 -10.903 1.00 0.00 H new ATOM 0 HD3 ARG A 88 7.213 -2.439 -12.481 1.00 0.00 H new ATOM 0 HE ARG A 88 4.798 -1.205 -12.886 1.00 0.00 H new ATOM 0 HH11 ARG A 88 7.794 -0.128 -11.350 1.00 0.00 H new ATOM 0 HH12 ARG A 88 7.597 1.549 -11.870 1.00 0.00 H new ATOM 0 HH21 ARG A 88 4.578 0.964 -13.580 1.00 0.00 H new ATOM 0 HH22 ARG A 88 5.793 2.161 -13.120 1.00 0.00 H new ATOM 1473 N ALA A 89 5.065 -6.038 -10.204 1.00 0.00 N ATOM 1474 CA ALA A 89 5.940 -7.116 -9.762 1.00 0.00 C ATOM 1475 C ALA A 89 7.403 -6.668 -9.783 1.00 0.00 C ATOM 1476 O ALA A 89 7.760 -5.752 -10.531 1.00 0.00 O ATOM 1477 CB ALA A 89 5.742 -8.342 -10.643 1.00 0.00 C ATOM 0 H ALA A 89 4.936 -5.989 -11.215 1.00 0.00 H new ATOM 0 HA ALA A 89 5.682 -7.377 -8.736 1.00 0.00 H new ATOM 0 HB1 ALA A 89 6.400 -9.143 -10.305 1.00 0.00 H new ATOM 0 HB2 ALA A 89 4.705 -8.673 -10.579 1.00 0.00 H new ATOM 0 HB3 ALA A 89 5.979 -8.089 -11.677 1.00 0.00 H new ATOM 1483 N PRO A 90 8.264 -7.304 -8.959 1.00 0.00 N ATOM 1484 CA PRO A 90 9.698 -6.979 -8.893 1.00 0.00 C ATOM 1485 C PRO A 90 10.384 -7.059 -10.255 1.00 0.00 C ATOM 1486 O PRO A 90 9.920 -7.754 -11.165 1.00 0.00 O ATOM 1487 CB PRO A 90 10.266 -8.042 -7.949 1.00 0.00 C ATOM 1488 CG PRO A 90 9.107 -8.471 -7.121 1.00 0.00 C ATOM 1489 CD PRO A 90 7.906 -8.382 -8.019 1.00 0.00 C ATOM 0 HA PRO A 90 9.861 -5.956 -8.554 1.00 0.00 H new ATOM 0 HB2 PRO A 90 10.688 -8.880 -8.504 1.00 0.00 H new ATOM 0 HB3 PRO A 90 11.066 -7.635 -7.330 1.00 0.00 H new ATOM 0 HG2 PRO A 90 9.245 -9.487 -6.752 1.00 0.00 H new ATOM 0 HG3 PRO A 90 8.991 -7.828 -6.248 1.00 0.00 H new ATOM 0 HD2 PRO A 90 7.721 -9.323 -8.538 1.00 0.00 H new ATOM 0 HD3 PRO A 90 7.002 -8.143 -7.459 1.00 0.00 H new ATOM 1497 N TYR A 91 11.498 -6.356 -10.383 1.00 0.00 N ATOM 1498 CA TYR A 91 12.212 -6.267 -11.648 1.00 0.00 C ATOM 1499 C TYR A 91 13.368 -7.254 -11.650 1.00 0.00 C ATOM 1500 O TYR A 91 13.718 -7.826 -12.685 1.00 0.00 O ATOM 1501 CB TYR A 91 12.750 -4.846 -11.854 1.00 0.00 C ATOM 1502 CG TYR A 91 11.774 -3.762 -11.454 1.00 0.00 C ATOM 1503 CD1 TYR A 91 11.718 -3.314 -10.141 1.00 0.00 C ATOM 1504 CD2 TYR A 91 10.906 -3.196 -12.377 1.00 0.00 C ATOM 1505 CE1 TYR A 91 10.828 -2.335 -9.759 1.00 0.00 C ATOM 1506 CE2 TYR A 91 10.009 -2.215 -12.001 1.00 0.00 C ATOM 1507 CZ TYR A 91 9.975 -1.789 -10.690 1.00 0.00 C ATOM 1508 OH TYR A 91 9.077 -0.819 -10.306 1.00 0.00 O ATOM 0 H TYR A 91 11.930 -5.835 -9.620 1.00 0.00 H new ATOM 0 HA TYR A 91 11.525 -6.506 -12.460 1.00 0.00 H new ATOM 0 HB2 TYR A 91 13.667 -4.727 -11.277 1.00 0.00 H new ATOM 0 HB3 TYR A 91 13.014 -4.716 -12.903 1.00 0.00 H new ATOM 0 HD1 TYR A 91 12.384 -3.741 -9.406 1.00 0.00 H new ATOM 0 HD2 TYR A 91 10.932 -3.527 -13.405 1.00 0.00 H new ATOM 0 HE1 TYR A 91 10.800 -1.998 -8.733 1.00 0.00 H new ATOM 0 HE2 TYR A 91 9.338 -1.784 -12.730 1.00 0.00 H new ATOM 0 HH TYR A 91 9.283 -0.525 -9.394 1.00 0.00 H new ATOM 1518 N ASP A 92 13.961 -7.431 -10.481 1.00 0.00 N ATOM 1519 CA ASP A 92 15.072 -8.347 -10.302 1.00 0.00 C ATOM 1520 C ASP A 92 14.957 -9.041 -8.945 1.00 0.00 C ATOM 1521 O ASP A 92 14.141 -8.652 -8.107 1.00 0.00 O ATOM 1522 CB ASP A 92 16.402 -7.584 -10.413 1.00 0.00 C ATOM 1523 CG ASP A 92 17.614 -8.489 -10.321 1.00 0.00 C ATOM 1524 OD1 ASP A 92 17.911 -9.199 -11.309 1.00 0.00 O ATOM 1525 OD2 ASP A 92 18.270 -8.506 -9.259 1.00 0.00 O ATOM 0 H ASP A 92 13.684 -6.943 -9.629 1.00 0.00 H new ATOM 0 HA ASP A 92 15.045 -9.107 -11.083 1.00 0.00 H new ATOM 0 HB2 ASP A 92 16.428 -7.047 -11.361 1.00 0.00 H new ATOM 0 HB3 ASP A 92 16.453 -6.837 -9.621 1.00 0.00 H new ATOM 1530 N GLU A 93 15.763 -10.073 -8.744 1.00 0.00 N ATOM 1531 CA GLU A 93 15.809 -10.806 -7.484 1.00 0.00 C ATOM 1532 C GLU A 93 16.175 -9.874 -6.325 1.00 0.00 C ATOM 1533 O GLU A 93 15.787 -10.105 -5.179 1.00 0.00 O ATOM 1534 CB GLU A 93 16.846 -11.925 -7.603 1.00 0.00 C ATOM 1535 CG GLU A 93 16.949 -12.824 -6.385 1.00 0.00 C ATOM 1536 CD GLU A 93 18.085 -13.818 -6.503 1.00 0.00 C ATOM 1537 OE1 GLU A 93 17.927 -14.827 -7.225 1.00 0.00 O ATOM 1538 OE2 GLU A 93 19.147 -13.591 -5.886 1.00 0.00 O ATOM 0 H GLU A 93 16.406 -10.428 -9.451 1.00 0.00 H new ATOM 0 HA GLU A 93 14.825 -11.228 -7.278 1.00 0.00 H new ATOM 0 HB2 GLU A 93 16.602 -12.538 -8.471 1.00 0.00 H new ATOM 0 HB3 GLU A 93 17.822 -11.479 -7.792 1.00 0.00 H new ATOM 0 HG2 GLU A 93 17.095 -12.212 -5.495 1.00 0.00 H new ATOM 0 HG3 GLU A 93 16.010 -13.362 -6.252 1.00 0.00 H new ATOM 1545 N SER A 94 16.903 -8.811 -6.648 1.00 0.00 N ATOM 1546 CA SER A 94 17.433 -7.889 -5.651 1.00 0.00 C ATOM 1547 C SER A 94 16.344 -7.288 -4.760 1.00 0.00 C ATOM 1548 O SER A 94 16.534 -7.176 -3.546 1.00 0.00 O ATOM 1549 CB SER A 94 18.226 -6.787 -6.345 1.00 0.00 C ATOM 1550 OG SER A 94 19.292 -7.347 -7.093 1.00 0.00 O ATOM 0 H SER A 94 17.142 -8.564 -7.608 1.00 0.00 H new ATOM 0 HA SER A 94 18.089 -8.460 -4.993 1.00 0.00 H new ATOM 0 HB2 SER A 94 17.571 -6.217 -7.003 1.00 0.00 H new ATOM 0 HB3 SER A 94 18.619 -6.090 -5.605 1.00 0.00 H new ATOM 0 HG SER A 94 18.988 -7.536 -8.005 1.00 0.00 H new ATOM 1556 N GLU A 95 15.209 -6.909 -5.346 1.00 0.00 N ATOM 1557 CA GLU A 95 14.106 -6.354 -4.565 1.00 0.00 C ATOM 1558 C GLU A 95 13.604 -7.376 -3.554 1.00 0.00 C ATOM 1559 O GLU A 95 13.357 -7.048 -2.391 1.00 0.00 O ATOM 1560 CB GLU A 95 12.940 -5.905 -5.454 1.00 0.00 C ATOM 1561 CG GLU A 95 13.273 -4.757 -6.393 1.00 0.00 C ATOM 1562 CD GLU A 95 14.042 -5.209 -7.613 1.00 0.00 C ATOM 1563 OE1 GLU A 95 13.398 -5.662 -8.578 1.00 0.00 O ATOM 1564 OE2 GLU A 95 15.287 -5.116 -7.606 1.00 0.00 O ATOM 0 H GLU A 95 15.030 -6.975 -6.348 1.00 0.00 H new ATOM 0 HA GLU A 95 14.493 -5.478 -4.045 1.00 0.00 H new ATOM 0 HB2 GLU A 95 12.601 -6.756 -6.045 1.00 0.00 H new ATOM 0 HB3 GLU A 95 12.107 -5.608 -4.817 1.00 0.00 H new ATOM 0 HG2 GLU A 95 12.350 -4.272 -6.709 1.00 0.00 H new ATOM 0 HG3 GLU A 95 13.858 -4.011 -5.855 1.00 0.00 H new ATOM 1571 N VAL A 96 13.472 -8.618 -3.998 1.00 0.00 N ATOM 1572 CA VAL A 96 13.003 -9.688 -3.131 1.00 0.00 C ATOM 1573 C VAL A 96 14.004 -9.928 -2.008 1.00 0.00 C ATOM 1574 O VAL A 96 13.631 -10.017 -0.840 1.00 0.00 O ATOM 1575 CB VAL A 96 12.778 -11.000 -3.914 1.00 0.00 C ATOM 1576 CG1 VAL A 96 12.204 -12.081 -3.011 1.00 0.00 C ATOM 1577 CG2 VAL A 96 11.867 -10.760 -5.107 1.00 0.00 C ATOM 0 H VAL A 96 13.683 -8.909 -4.953 1.00 0.00 H new ATOM 0 HA VAL A 96 12.046 -9.376 -2.711 1.00 0.00 H new ATOM 0 HB VAL A 96 13.744 -11.345 -4.281 1.00 0.00 H new ATOM 0 HG11 VAL A 96 12.055 -12.995 -3.587 1.00 0.00 H new ATOM 0 HG12 VAL A 96 12.897 -12.277 -2.192 1.00 0.00 H new ATOM 0 HG13 VAL A 96 11.249 -11.747 -2.606 1.00 0.00 H new ATOM 0 HG21 VAL A 96 11.720 -11.696 -5.647 1.00 0.00 H new ATOM 0 HG22 VAL A 96 10.904 -10.386 -4.760 1.00 0.00 H new ATOM 0 HG23 VAL A 96 12.323 -10.026 -5.771 1.00 0.00 H new ATOM 1587 N ILE A 97 15.281 -9.996 -2.372 1.00 0.00 N ATOM 1588 CA ILE A 97 16.353 -10.214 -1.404 1.00 0.00 C ATOM 1589 C ILE A 97 16.402 -9.084 -0.377 1.00 0.00 C ATOM 1590 O ILE A 97 16.601 -9.325 0.816 1.00 0.00 O ATOM 1591 CB ILE A 97 17.725 -10.332 -2.106 1.00 0.00 C ATOM 1592 CG1 ILE A 97 17.709 -11.490 -3.109 1.00 0.00 C ATOM 1593 CG2 ILE A 97 18.846 -10.515 -1.091 1.00 0.00 C ATOM 1594 CD1 ILE A 97 17.329 -12.828 -2.506 1.00 0.00 C ATOM 0 H ILE A 97 15.601 -9.903 -3.336 1.00 0.00 H new ATOM 0 HA ILE A 97 16.139 -11.152 -0.891 1.00 0.00 H new ATOM 0 HB ILE A 97 17.913 -9.404 -2.646 1.00 0.00 H new ATOM 0 HG12 ILE A 97 17.009 -11.253 -3.910 1.00 0.00 H new ATOM 0 HG13 ILE A 97 18.696 -11.576 -3.564 1.00 0.00 H new ATOM 0 HG21 ILE A 97 19.800 -10.595 -1.613 1.00 0.00 H new ATOM 0 HG22 ILE A 97 18.871 -9.658 -0.418 1.00 0.00 H new ATOM 0 HG23 ILE A 97 18.670 -11.423 -0.515 1.00 0.00 H new ATOM 0 HD11 ILE A 97 17.342 -13.593 -3.282 1.00 0.00 H new ATOM 0 HD12 ILE A 97 18.043 -13.091 -1.725 1.00 0.00 H new ATOM 0 HD13 ILE A 97 16.329 -12.763 -2.077 1.00 0.00 H new ATOM 1606 N PHE A 98 16.207 -7.854 -0.846 1.00 0.00 N ATOM 1607 CA PHE A 98 16.187 -6.690 0.031 1.00 0.00 C ATOM 1608 C PHE A 98 15.070 -6.817 1.063 1.00 0.00 C ATOM 1609 O PHE A 98 15.272 -6.563 2.252 1.00 0.00 O ATOM 1610 CB PHE A 98 16.005 -5.410 -0.796 1.00 0.00 C ATOM 1611 CG PHE A 98 15.894 -4.158 0.031 1.00 0.00 C ATOM 1612 CD1 PHE A 98 17.018 -3.582 0.600 1.00 0.00 C ATOM 1613 CD2 PHE A 98 14.661 -3.558 0.234 1.00 0.00 C ATOM 1614 CE1 PHE A 98 16.914 -2.432 1.360 1.00 0.00 C ATOM 1615 CE2 PHE A 98 14.551 -2.408 0.993 1.00 0.00 C ATOM 1616 CZ PHE A 98 15.679 -1.843 1.555 1.00 0.00 C ATOM 0 H PHE A 98 16.060 -7.639 -1.832 1.00 0.00 H new ATOM 0 HA PHE A 98 17.139 -6.636 0.559 1.00 0.00 H new ATOM 0 HB2 PHE A 98 16.848 -5.308 -1.479 1.00 0.00 H new ATOM 0 HB3 PHE A 98 15.109 -5.510 -1.408 1.00 0.00 H new ATOM 0 HD1 PHE A 98 17.986 -4.036 0.448 1.00 0.00 H new ATOM 0 HD2 PHE A 98 13.776 -3.994 -0.206 1.00 0.00 H new ATOM 0 HE1 PHE A 98 17.797 -1.994 1.801 1.00 0.00 H new ATOM 0 HE2 PHE A 98 13.584 -1.952 1.146 1.00 0.00 H new ATOM 0 HZ PHE A 98 15.596 -0.943 2.146 1.00 0.00 H new ATOM 1626 N HIS A 99 13.897 -7.234 0.603 1.00 0.00 N ATOM 1627 CA HIS A 99 12.746 -7.383 1.484 1.00 0.00 C ATOM 1628 C HIS A 99 12.911 -8.592 2.399 1.00 0.00 C ATOM 1629 O HIS A 99 12.430 -8.586 3.528 1.00 0.00 O ATOM 1630 CB HIS A 99 11.451 -7.482 0.675 1.00 0.00 C ATOM 1631 CG HIS A 99 10.965 -6.155 0.165 1.00 0.00 C ATOM 1632 ND1 HIS A 99 9.850 -5.530 0.663 1.00 0.00 N ATOM 1633 CD2 HIS A 99 11.451 -5.332 -0.798 1.00 0.00 C ATOM 1634 CE1 HIS A 99 9.663 -4.387 0.036 1.00 0.00 C ATOM 1635 NE2 HIS A 99 10.621 -4.239 -0.857 1.00 0.00 N ATOM 0 H HIS A 99 13.718 -7.474 -0.372 1.00 0.00 H new ATOM 0 HA HIS A 99 12.685 -6.494 2.112 1.00 0.00 H new ATOM 0 HB2 HIS A 99 11.609 -8.152 -0.170 1.00 0.00 H new ATOM 0 HB3 HIS A 99 10.676 -7.930 1.297 1.00 0.00 H new ATOM 0 HD1 HIS A 99 9.255 -5.895 1.407 1.00 0.00 H new ATOM 0 HD2 HIS A 99 12.327 -5.504 -1.405 1.00 0.00 H new ATOM 0 HE1 HIS A 99 8.860 -3.689 0.222 1.00 0.00 H new ATOM 1644 N LEU A 100 13.606 -9.618 1.919 1.00 0.00 N ATOM 1645 CA LEU A 100 13.931 -10.775 2.749 1.00 0.00 C ATOM 1646 C LEU A 100 14.822 -10.359 3.912 1.00 0.00 C ATOM 1647 O LEU A 100 14.594 -10.751 5.054 1.00 0.00 O ATOM 1648 CB LEU A 100 14.625 -11.861 1.921 1.00 0.00 C ATOM 1649 CG LEU A 100 13.726 -12.599 0.925 1.00 0.00 C ATOM 1650 CD1 LEU A 100 14.545 -13.564 0.081 1.00 0.00 C ATOM 1651 CD2 LEU A 100 12.621 -13.345 1.658 1.00 0.00 C ATOM 0 H LEU A 100 13.955 -9.673 0.962 1.00 0.00 H new ATOM 0 HA LEU A 100 13.000 -11.182 3.143 1.00 0.00 H new ATOM 0 HB2 LEU A 100 15.449 -11.405 1.373 1.00 0.00 H new ATOM 0 HB3 LEU A 100 15.061 -12.592 2.603 1.00 0.00 H new ATOM 0 HG LEU A 100 13.269 -11.863 0.264 1.00 0.00 H new ATOM 0 HD11 LEU A 100 13.890 -14.080 -0.621 1.00 0.00 H new ATOM 0 HD12 LEU A 100 15.304 -13.010 -0.471 1.00 0.00 H new ATOM 0 HD13 LEU A 100 15.028 -14.295 0.730 1.00 0.00 H new ATOM 0 HD21 LEU A 100 11.991 -13.864 0.935 1.00 0.00 H new ATOM 0 HD22 LEU A 100 13.063 -14.070 2.341 1.00 0.00 H new ATOM 0 HD23 LEU A 100 12.016 -12.636 2.223 1.00 0.00 H new ATOM 1663 N ASP A 101 15.828 -9.546 3.611 1.00 0.00 N ATOM 1664 CA ASP A 101 16.740 -9.038 4.632 1.00 0.00 C ATOM 1665 C ASP A 101 15.974 -8.172 5.627 1.00 0.00 C ATOM 1666 O ASP A 101 16.186 -8.258 6.835 1.00 0.00 O ATOM 1667 CB ASP A 101 17.868 -8.234 3.978 1.00 0.00 C ATOM 1668 CG ASP A 101 19.008 -7.924 4.930 1.00 0.00 C ATOM 1669 OD1 ASP A 101 19.814 -8.836 5.214 1.00 0.00 O ATOM 1670 OD2 ASP A 101 19.121 -6.767 5.376 1.00 0.00 O ATOM 0 H ASP A 101 16.034 -9.223 2.666 1.00 0.00 H new ATOM 0 HA ASP A 101 17.181 -9.879 5.167 1.00 0.00 H new ATOM 0 HB2 ASP A 101 18.256 -8.791 3.125 1.00 0.00 H new ATOM 0 HB3 ASP A 101 17.462 -7.300 3.590 1.00 0.00 H new ATOM 1675 N LEU A 102 15.057 -7.364 5.104 1.00 0.00 N ATOM 1676 CA LEU A 102 14.206 -6.513 5.930 1.00 0.00 C ATOM 1677 C LEU A 102 13.295 -7.354 6.826 1.00 0.00 C ATOM 1678 O LEU A 102 13.081 -7.030 7.997 1.00 0.00 O ATOM 1679 CB LEU A 102 13.363 -5.600 5.035 1.00 0.00 C ATOM 1680 CG LEU A 102 12.418 -4.647 5.765 1.00 0.00 C ATOM 1681 CD1 LEU A 102 13.199 -3.656 6.609 1.00 0.00 C ATOM 1682 CD2 LEU A 102 11.537 -3.918 4.768 1.00 0.00 C ATOM 0 H LEU A 102 14.883 -7.280 4.102 1.00 0.00 H new ATOM 0 HA LEU A 102 14.845 -5.904 6.570 1.00 0.00 H new ATOM 0 HB2 LEU A 102 14.036 -5.010 4.413 1.00 0.00 H new ATOM 0 HB3 LEU A 102 12.773 -6.224 4.364 1.00 0.00 H new ATOM 0 HG LEU A 102 11.783 -5.232 6.430 1.00 0.00 H new ATOM 0 HD11 LEU A 102 12.506 -2.987 7.120 1.00 0.00 H new ATOM 0 HD12 LEU A 102 13.793 -4.195 7.347 1.00 0.00 H new ATOM 0 HD13 LEU A 102 13.859 -3.073 5.967 1.00 0.00 H new ATOM 0 HD21 LEU A 102 10.868 -3.242 5.300 1.00 0.00 H new ATOM 0 HD22 LEU A 102 12.161 -3.346 4.082 1.00 0.00 H new ATOM 0 HD23 LEU A 102 10.948 -4.642 4.205 1.00 0.00 H new ATOM 1694 N TYR A 103 12.762 -8.433 6.262 1.00 0.00 N ATOM 1695 CA TYR A 103 11.910 -9.358 7.000 1.00 0.00 C ATOM 1696 C TYR A 103 12.682 -10.013 8.144 1.00 0.00 C ATOM 1697 O TYR A 103 12.116 -10.338 9.189 1.00 0.00 O ATOM 1698 CB TYR A 103 11.348 -10.424 6.050 1.00 0.00 C ATOM 1699 CG TYR A 103 10.562 -11.518 6.741 1.00 0.00 C ATOM 1700 CD1 TYR A 103 9.290 -11.279 7.247 1.00 0.00 C ATOM 1701 CD2 TYR A 103 11.100 -12.789 6.890 1.00 0.00 C ATOM 1702 CE1 TYR A 103 8.577 -12.277 7.884 1.00 0.00 C ATOM 1703 CE2 TYR A 103 10.393 -13.791 7.524 1.00 0.00 C ATOM 1704 CZ TYR A 103 9.135 -13.531 8.020 1.00 0.00 C ATOM 1705 OH TYR A 103 8.434 -14.527 8.662 1.00 0.00 O ATOM 0 H TYR A 103 12.908 -8.690 5.286 1.00 0.00 H new ATOM 0 HA TYR A 103 11.081 -8.797 7.431 1.00 0.00 H new ATOM 0 HB2 TYR A 103 10.705 -9.938 5.316 1.00 0.00 H new ATOM 0 HB3 TYR A 103 12.173 -10.877 5.501 1.00 0.00 H new ATOM 0 HD1 TYR A 103 8.852 -10.298 7.141 1.00 0.00 H new ATOM 0 HD2 TYR A 103 12.087 -12.997 6.504 1.00 0.00 H new ATOM 0 HE1 TYR A 103 7.590 -12.076 8.273 1.00 0.00 H new ATOM 0 HE2 TYR A 103 10.825 -14.775 7.631 1.00 0.00 H new ATOM 0 HH TYR A 103 8.968 -15.349 8.671 1.00 0.00 H new ATOM 1715 N GLU A 104 13.974 -10.202 7.942 1.00 0.00 N ATOM 1716 CA GLU A 104 14.825 -10.773 8.970 1.00 0.00 C ATOM 1717 C GLU A 104 15.223 -9.718 9.996 1.00 0.00 C ATOM 1718 O GLU A 104 15.380 -10.015 11.179 1.00 0.00 O ATOM 1719 CB GLU A 104 16.064 -11.396 8.331 1.00 0.00 C ATOM 1720 CG GLU A 104 15.760 -12.641 7.515 1.00 0.00 C ATOM 1721 CD GLU A 104 15.272 -13.783 8.380 1.00 0.00 C ATOM 1722 OE1 GLU A 104 14.053 -13.891 8.604 1.00 0.00 O ATOM 1723 OE2 GLU A 104 16.118 -14.573 8.850 1.00 0.00 O ATOM 0 H GLU A 104 14.457 -9.968 7.075 1.00 0.00 H new ATOM 0 HA GLU A 104 14.267 -11.551 9.491 1.00 0.00 H new ATOM 0 HB2 GLU A 104 16.543 -10.657 7.688 1.00 0.00 H new ATOM 0 HB3 GLU A 104 16.779 -11.649 9.114 1.00 0.00 H new ATOM 0 HG2 GLU A 104 15.005 -12.407 6.765 1.00 0.00 H new ATOM 0 HG3 GLU A 104 16.657 -12.951 6.979 1.00 0.00 H new ATOM 1730 N ASN A 105 15.375 -8.480 9.543 1.00 0.00 N ATOM 1731 CA ASN A 105 15.761 -7.387 10.431 1.00 0.00 C ATOM 1732 C ASN A 105 14.608 -6.981 11.341 1.00 0.00 C ATOM 1733 O ASN A 105 14.744 -6.963 12.564 1.00 0.00 O ATOM 1734 CB ASN A 105 16.227 -6.158 9.645 1.00 0.00 C ATOM 1735 CG ASN A 105 17.488 -6.385 8.827 1.00 0.00 C ATOM 1736 OD1 ASN A 105 17.712 -5.703 7.830 1.00 0.00 O ATOM 1737 ND2 ASN A 105 18.310 -7.348 9.223 1.00 0.00 N ATOM 0 H ASN A 105 15.238 -8.207 8.570 1.00 0.00 H new ATOM 0 HA ASN A 105 16.589 -7.757 11.036 1.00 0.00 H new ATOM 0 HB2 ASN A 105 15.426 -5.842 8.977 1.00 0.00 H new ATOM 0 HB3 ASN A 105 16.402 -5.339 10.343 1.00 0.00 H new ATOM 0 HD21 ASN A 105 19.160 -7.542 8.694 1.00 0.00 H new ATOM 0 HD22 ASN A 105 18.092 -7.894 10.056 1.00 0.00 H new ATOM 1744 N GLU A 106 13.471 -6.649 10.747 1.00 0.00 N ATOM 1745 CA GLU A 106 12.352 -6.134 11.521 1.00 0.00 C ATOM 1746 C GLU A 106 11.120 -7.019 11.380 1.00 0.00 C ATOM 1747 O GLU A 106 10.389 -7.231 12.348 1.00 0.00 O ATOM 1748 CB GLU A 106 12.025 -4.709 11.082 1.00 0.00 C ATOM 1749 CG GLU A 106 13.209 -3.764 11.163 1.00 0.00 C ATOM 1750 CD GLU A 106 12.859 -2.350 10.761 1.00 0.00 C ATOM 1751 OE1 GLU A 106 12.826 -2.060 9.551 1.00 0.00 O ATOM 1752 OE2 GLU A 106 12.634 -1.510 11.658 1.00 0.00 O ATOM 0 H GLU A 106 13.300 -6.726 9.744 1.00 0.00 H new ATOM 0 HA GLU A 106 12.644 -6.132 12.571 1.00 0.00 H new ATOM 0 HB2 GLU A 106 11.656 -4.729 10.057 1.00 0.00 H new ATOM 0 HB3 GLU A 106 11.218 -4.322 11.704 1.00 0.00 H new ATOM 0 HG2 GLU A 106 13.597 -3.762 12.182 1.00 0.00 H new ATOM 0 HG3 GLU A 106 14.007 -4.133 10.519 1.00 0.00 H new ATOM 1759 N GLY A 107 10.896 -7.549 10.186 1.00 0.00 N ATOM 1760 CA GLY A 107 9.785 -8.457 9.994 1.00 0.00 C ATOM 1761 C GLY A 107 8.820 -8.011 8.915 1.00 0.00 C ATOM 1762 O GLY A 107 9.138 -7.147 8.096 1.00 0.00 O ATOM 0 H GLY A 107 11.458 -7.369 9.354 1.00 0.00 H new ATOM 0 HA2 GLY A 107 10.172 -9.444 9.739 1.00 0.00 H new ATOM 0 HA3 GLY A 107 9.244 -8.560 10.934 1.00 0.00 H new ATOM 1766 N PHE A 108 7.625 -8.592 8.947 1.00 0.00 N ATOM 1767 CA PHE A 108 6.607 -8.371 7.925 1.00 0.00 C ATOM 1768 C PHE A 108 5.967 -6.996 8.089 1.00 0.00 C ATOM 1769 O PHE A 108 5.580 -6.358 7.114 1.00 0.00 O ATOM 1770 CB PHE A 108 5.538 -9.468 8.031 1.00 0.00 C ATOM 1771 CG PHE A 108 4.517 -9.465 6.925 1.00 0.00 C ATOM 1772 CD1 PHE A 108 4.768 -10.135 5.739 1.00 0.00 C ATOM 1773 CD2 PHE A 108 3.300 -8.811 7.075 1.00 0.00 C ATOM 1774 CE1 PHE A 108 3.831 -10.152 4.725 1.00 0.00 C ATOM 1775 CE2 PHE A 108 2.362 -8.824 6.061 1.00 0.00 C ATOM 1776 CZ PHE A 108 2.626 -9.496 4.885 1.00 0.00 C ATOM 0 H PHE A 108 7.334 -9.232 9.686 1.00 0.00 H new ATOM 0 HA PHE A 108 7.076 -8.411 6.942 1.00 0.00 H new ATOM 0 HB2 PHE A 108 6.034 -10.439 8.046 1.00 0.00 H new ATOM 0 HB3 PHE A 108 5.020 -9.360 8.984 1.00 0.00 H new ATOM 0 HD1 PHE A 108 5.708 -10.650 5.606 1.00 0.00 H new ATOM 0 HD2 PHE A 108 3.085 -8.287 7.994 1.00 0.00 H new ATOM 0 HE1 PHE A 108 4.040 -10.679 3.806 1.00 0.00 H new ATOM 0 HE2 PHE A 108 1.422 -8.308 6.189 1.00 0.00 H new ATOM 0 HZ PHE A 108 1.893 -9.509 4.092 1.00 0.00 H new ATOM 1786 N ASP A 109 5.862 -6.552 9.334 1.00 0.00 N ATOM 1787 CA ASP A 109 5.265 -5.258 9.647 1.00 0.00 C ATOM 1788 C ASP A 109 6.046 -4.132 8.966 1.00 0.00 C ATOM 1789 O ASP A 109 5.470 -3.244 8.323 1.00 0.00 O ATOM 1790 CB ASP A 109 5.252 -5.055 11.164 1.00 0.00 C ATOM 1791 CG ASP A 109 4.266 -3.996 11.605 1.00 0.00 C ATOM 1792 OD1 ASP A 109 3.081 -4.330 11.796 1.00 0.00 O ATOM 1793 OD2 ASP A 109 4.664 -2.827 11.770 1.00 0.00 O ATOM 0 H ASP A 109 6.185 -7.072 10.150 1.00 0.00 H new ATOM 0 HA ASP A 109 4.241 -5.237 9.274 1.00 0.00 H new ATOM 0 HB2 ASP A 109 5.006 -5.999 11.650 1.00 0.00 H new ATOM 0 HB3 ASP A 109 6.252 -4.776 11.497 1.00 0.00 H new ATOM 1798 N ALA A 110 7.369 -4.204 9.083 1.00 0.00 N ATOM 1799 CA ALA A 110 8.252 -3.215 8.482 1.00 0.00 C ATOM 1800 C ALA A 110 8.276 -3.358 6.968 1.00 0.00 C ATOM 1801 O ALA A 110 8.443 -2.371 6.246 1.00 0.00 O ATOM 1802 CB ALA A 110 9.655 -3.342 9.048 1.00 0.00 C ATOM 0 H ALA A 110 7.853 -4.943 9.592 1.00 0.00 H new ATOM 0 HA ALA A 110 7.867 -2.225 8.724 1.00 0.00 H new ATOM 0 HB1 ALA A 110 10.302 -2.595 8.588 1.00 0.00 H new ATOM 0 HB2 ALA A 110 9.628 -3.184 10.126 1.00 0.00 H new ATOM 0 HB3 ALA A 110 10.044 -4.338 8.837 1.00 0.00 H new ATOM 1808 N ASP A 111 8.113 -4.590 6.489 1.00 0.00 N ATOM 1809 CA ASP A 111 8.018 -4.843 5.054 1.00 0.00 C ATOM 1810 C ASP A 111 6.911 -3.986 4.457 1.00 0.00 C ATOM 1811 O ASP A 111 7.121 -3.281 3.471 1.00 0.00 O ATOM 1812 CB ASP A 111 7.740 -6.326 4.774 1.00 0.00 C ATOM 1813 CG ASP A 111 7.626 -6.631 3.289 1.00 0.00 C ATOM 1814 OD1 ASP A 111 8.666 -6.628 2.604 1.00 0.00 O ATOM 1815 OD2 ASP A 111 6.498 -6.868 2.801 1.00 0.00 O ATOM 0 H ASP A 111 8.044 -5.425 7.071 1.00 0.00 H new ATOM 0 HA ASP A 111 8.971 -4.583 4.593 1.00 0.00 H new ATOM 0 HB2 ASP A 111 8.540 -6.929 5.204 1.00 0.00 H new ATOM 0 HB3 ASP A 111 6.816 -6.619 5.273 1.00 0.00 H new ATOM 1820 N ILE A 112 5.750 -4.017 5.105 1.00 0.00 N ATOM 1821 CA ILE A 112 4.585 -3.261 4.661 1.00 0.00 C ATOM 1822 C ILE A 112 4.872 -1.764 4.603 1.00 0.00 C ATOM 1823 O ILE A 112 4.593 -1.111 3.594 1.00 0.00 O ATOM 1824 CB ILE A 112 3.376 -3.500 5.591 1.00 0.00 C ATOM 1825 CG1 ILE A 112 3.011 -4.985 5.625 1.00 0.00 C ATOM 1826 CG2 ILE A 112 2.181 -2.666 5.147 1.00 0.00 C ATOM 1827 CD1 ILE A 112 1.905 -5.312 6.602 1.00 0.00 C ATOM 0 H ILE A 112 5.591 -4.565 5.950 1.00 0.00 H new ATOM 0 HA ILE A 112 4.349 -3.617 3.658 1.00 0.00 H new ATOM 0 HB ILE A 112 3.653 -3.190 6.598 1.00 0.00 H new ATOM 0 HG12 ILE A 112 2.707 -5.299 4.626 1.00 0.00 H new ATOM 0 HG13 ILE A 112 3.898 -5.563 5.885 1.00 0.00 H new ATOM 0 HG21 ILE A 112 1.340 -2.850 5.816 1.00 0.00 H new ATOM 0 HG22 ILE A 112 2.444 -1.609 5.177 1.00 0.00 H new ATOM 0 HG23 ILE A 112 1.902 -2.942 4.130 1.00 0.00 H new ATOM 0 HD11 ILE A 112 1.699 -6.382 6.573 1.00 0.00 H new ATOM 0 HD12 ILE A 112 2.213 -5.029 7.608 1.00 0.00 H new ATOM 0 HD13 ILE A 112 1.005 -4.761 6.330 1.00 0.00 H new ATOM 1839 N ASP A 113 5.431 -1.221 5.682 1.00 0.00 N ATOM 1840 CA ASP A 113 5.712 0.218 5.761 1.00 0.00 C ATOM 1841 C ASP A 113 6.630 0.689 4.635 1.00 0.00 C ATOM 1842 O ASP A 113 6.622 1.868 4.265 1.00 0.00 O ATOM 1843 CB ASP A 113 6.321 0.579 7.117 1.00 0.00 C ATOM 1844 CG ASP A 113 5.278 0.658 8.212 1.00 0.00 C ATOM 1845 OD1 ASP A 113 4.591 -0.352 8.457 1.00 0.00 O ATOM 1846 OD2 ASP A 113 5.140 1.732 8.836 1.00 0.00 O ATOM 0 H ASP A 113 5.699 -1.749 6.512 1.00 0.00 H new ATOM 0 HA ASP A 113 4.758 0.733 5.648 1.00 0.00 H new ATOM 0 HB2 ASP A 113 7.071 -0.165 7.386 1.00 0.00 H new ATOM 0 HB3 ASP A 113 6.836 1.537 7.038 1.00 0.00 H new ATOM 1851 N SER A 114 7.397 -0.235 4.076 1.00 0.00 N ATOM 1852 CA SER A 114 8.326 0.081 2.999 1.00 0.00 C ATOM 1853 C SER A 114 7.593 0.512 1.727 1.00 0.00 C ATOM 1854 O SER A 114 8.069 1.374 0.989 1.00 0.00 O ATOM 1855 CB SER A 114 9.199 -1.131 2.703 1.00 0.00 C ATOM 1856 OG SER A 114 9.788 -1.615 3.891 1.00 0.00 O ATOM 0 H SER A 114 7.395 -1.217 4.352 1.00 0.00 H new ATOM 0 HA SER A 114 8.946 0.916 3.326 1.00 0.00 H new ATOM 0 HB2 SER A 114 8.599 -1.915 2.241 1.00 0.00 H new ATOM 0 HB3 SER A 114 9.976 -0.861 1.988 1.00 0.00 H new ATOM 0 HG SER A 114 9.088 -1.948 4.491 1.00 0.00 H new ATOM 1862 N TYR A 115 6.423 -0.073 1.486 1.00 0.00 N ATOM 1863 CA TYR A 115 5.663 0.201 0.265 1.00 0.00 C ATOM 1864 C TYR A 115 4.958 1.549 0.356 1.00 0.00 C ATOM 1865 O TYR A 115 4.428 2.052 -0.634 1.00 0.00 O ATOM 1866 CB TYR A 115 4.624 -0.900 0.014 1.00 0.00 C ATOM 1867 CG TYR A 115 5.207 -2.295 -0.065 1.00 0.00 C ATOM 1868 CD1 TYR A 115 5.676 -2.812 -1.266 1.00 0.00 C ATOM 1869 CD2 TYR A 115 5.291 -3.094 1.065 1.00 0.00 C ATOM 1870 CE1 TYR A 115 6.212 -4.084 -1.335 1.00 0.00 C ATOM 1871 CE2 TYR A 115 5.823 -4.367 1.003 1.00 0.00 C ATOM 1872 CZ TYR A 115 6.282 -4.857 -0.195 1.00 0.00 C ATOM 1873 OH TYR A 115 6.829 -6.119 -0.250 1.00 0.00 O ATOM 0 H TYR A 115 5.979 -0.739 2.118 1.00 0.00 H new ATOM 0 HA TYR A 115 6.369 0.224 -0.565 1.00 0.00 H new ATOM 0 HB2 TYR A 115 3.882 -0.873 0.812 1.00 0.00 H new ATOM 0 HB3 TYR A 115 4.099 -0.684 -0.917 1.00 0.00 H new ATOM 0 HD1 TYR A 115 5.621 -2.210 -2.161 1.00 0.00 H new ATOM 0 HD2 TYR A 115 4.934 -2.714 2.011 1.00 0.00 H new ATOM 0 HE1 TYR A 115 6.574 -4.470 -2.276 1.00 0.00 H new ATOM 0 HE2 TYR A 115 5.878 -4.975 1.894 1.00 0.00 H new ATOM 0 HH TYR A 115 7.719 -6.108 0.160 1.00 0.00 H new ATOM 1883 N ILE A 116 4.964 2.130 1.546 1.00 0.00 N ATOM 1884 CA ILE A 116 4.235 3.365 1.806 1.00 0.00 C ATOM 1885 C ILE A 116 5.117 4.582 1.595 1.00 0.00 C ATOM 1886 O ILE A 116 4.810 5.453 0.783 1.00 0.00 O ATOM 1887 CB ILE A 116 3.715 3.403 3.249 1.00 0.00 C ATOM 1888 CG1 ILE A 116 3.005 2.098 3.591 1.00 0.00 C ATOM 1889 CG2 ILE A 116 2.785 4.593 3.449 1.00 0.00 C ATOM 1890 CD1 ILE A 116 2.664 1.987 5.051 1.00 0.00 C ATOM 0 H ILE A 116 5.469 1.764 2.353 1.00 0.00 H new ATOM 0 HA ILE A 116 3.400 3.388 1.105 1.00 0.00 H new ATOM 0 HB ILE A 116 4.564 3.518 3.923 1.00 0.00 H new ATOM 0 HG12 ILE A 116 2.091 2.022 3.002 1.00 0.00 H new ATOM 0 HG13 ILE A 116 3.639 1.259 3.306 1.00 0.00 H new ATOM 0 HG21 ILE A 116 2.425 4.605 4.478 1.00 0.00 H new ATOM 0 HG22 ILE A 116 3.326 5.516 3.243 1.00 0.00 H new ATOM 0 HG23 ILE A 116 1.937 4.510 2.769 1.00 0.00 H new ATOM 0 HD11 ILE A 116 2.160 1.038 5.236 1.00 0.00 H new ATOM 0 HD12 ILE A 116 3.578 2.034 5.643 1.00 0.00 H new ATOM 0 HD13 ILE A 116 2.006 2.808 5.334 1.00 0.00 H new ATOM 1902 N ASP A 117 6.220 4.624 2.330 1.00 0.00 N ATOM 1903 CA ASP A 117 7.086 5.797 2.356 1.00 0.00 C ATOM 1904 C ASP A 117 7.922 5.894 1.081 1.00 0.00 C ATOM 1905 O ASP A 117 8.587 6.902 0.843 1.00 0.00 O ATOM 1906 CB ASP A 117 7.990 5.746 3.594 1.00 0.00 C ATOM 1907 CG ASP A 117 8.863 6.976 3.748 1.00 0.00 C ATOM 1908 OD1 ASP A 117 8.356 8.023 4.206 1.00 0.00 O ATOM 1909 OD2 ASP A 117 10.067 6.897 3.431 1.00 0.00 O ATOM 0 H ASP A 117 6.538 3.855 2.920 1.00 0.00 H new ATOM 0 HA ASP A 117 6.461 6.688 2.408 1.00 0.00 H new ATOM 0 HB2 ASP A 117 7.370 5.635 4.484 1.00 0.00 H new ATOM 0 HB3 ASP A 117 8.626 4.862 3.535 1.00 0.00 H new ATOM 1914 N SER A 118 7.869 4.840 0.266 1.00 0.00 N ATOM 1915 CA SER A 118 8.573 4.801 -1.014 1.00 0.00 C ATOM 1916 C SER A 118 8.281 6.061 -1.837 1.00 0.00 C ATOM 1917 O SER A 118 7.164 6.251 -2.330 1.00 0.00 O ATOM 1918 CB SER A 118 8.158 3.550 -1.791 1.00 0.00 C ATOM 1919 OG SER A 118 8.888 3.422 -2.996 1.00 0.00 O ATOM 0 H SER A 118 7.339 3.994 0.474 1.00 0.00 H new ATOM 0 HA SER A 118 9.645 4.766 -0.822 1.00 0.00 H new ATOM 0 HB2 SER A 118 8.317 2.667 -1.172 1.00 0.00 H new ATOM 0 HB3 SER A 118 7.092 3.596 -2.013 1.00 0.00 H new ATOM 0 HG SER A 118 8.426 2.798 -3.594 1.00 0.00 H new ATOM 1925 N PRO A 119 9.287 6.937 -1.987 1.00 0.00 N ATOM 1926 CA PRO A 119 9.115 8.254 -2.610 1.00 0.00 C ATOM 1927 C PRO A 119 8.718 8.188 -4.085 1.00 0.00 C ATOM 1928 O PRO A 119 7.703 8.766 -4.486 1.00 0.00 O ATOM 1929 CB PRO A 119 10.489 8.912 -2.455 1.00 0.00 C ATOM 1930 CG PRO A 119 11.443 7.787 -2.258 1.00 0.00 C ATOM 1931 CD PRO A 119 10.675 6.710 -1.548 1.00 0.00 C ATOM 0 HA PRO A 119 8.302 8.805 -2.137 1.00 0.00 H new ATOM 0 HB2 PRO A 119 10.747 9.497 -3.338 1.00 0.00 H new ATOM 0 HB3 PRO A 119 10.505 9.594 -1.605 1.00 0.00 H new ATOM 0 HG2 PRO A 119 11.825 7.428 -3.214 1.00 0.00 H new ATOM 0 HG3 PRO A 119 12.304 8.104 -1.670 1.00 0.00 H new ATOM 0 HD2 PRO A 119 11.027 5.716 -1.825 1.00 0.00 H new ATOM 0 HD3 PRO A 119 10.773 6.793 -0.466 1.00 0.00 H new ATOM 1939 N GLU A 120 9.494 7.466 -4.887 1.00 0.00 N ATOM 1940 CA GLU A 120 9.294 7.472 -6.331 1.00 0.00 C ATOM 1941 C GLU A 120 8.007 6.748 -6.706 1.00 0.00 C ATOM 1942 O GLU A 120 7.312 7.146 -7.640 1.00 0.00 O ATOM 1943 CB GLU A 120 10.496 6.863 -7.076 1.00 0.00 C ATOM 1944 CG GLU A 120 10.821 5.420 -6.715 1.00 0.00 C ATOM 1945 CD GLU A 120 11.624 5.295 -5.438 1.00 0.00 C ATOM 1946 OE1 GLU A 120 11.017 5.240 -4.354 1.00 0.00 O ATOM 1947 OE2 GLU A 120 12.871 5.251 -5.518 1.00 0.00 O ATOM 0 H GLU A 120 10.260 6.875 -4.565 1.00 0.00 H new ATOM 0 HA GLU A 120 9.207 8.513 -6.641 1.00 0.00 H new ATOM 0 HB2 GLU A 120 10.304 6.918 -8.148 1.00 0.00 H new ATOM 0 HB3 GLU A 120 11.375 7.477 -6.878 1.00 0.00 H new ATOM 0 HG2 GLU A 120 9.892 4.860 -6.609 1.00 0.00 H new ATOM 0 HG3 GLU A 120 11.377 4.963 -7.533 1.00 0.00 H new ATOM 1954 N TYR A 121 7.674 5.703 -5.958 1.00 0.00 N ATOM 1955 CA TYR A 121 6.464 4.941 -6.226 1.00 0.00 C ATOM 1956 C TYR A 121 5.225 5.755 -5.876 1.00 0.00 C ATOM 1957 O TYR A 121 4.246 5.750 -6.617 1.00 0.00 O ATOM 1958 CB TYR A 121 6.470 3.613 -5.463 1.00 0.00 C ATOM 1959 CG TYR A 121 7.411 2.583 -6.053 1.00 0.00 C ATOM 1960 CD1 TYR A 121 8.785 2.705 -5.904 1.00 0.00 C ATOM 1961 CD2 TYR A 121 6.924 1.488 -6.756 1.00 0.00 C ATOM 1962 CE1 TYR A 121 9.649 1.771 -6.437 1.00 0.00 C ATOM 1963 CE2 TYR A 121 7.783 0.546 -7.293 1.00 0.00 C ATOM 1964 CZ TYR A 121 9.145 0.693 -7.129 1.00 0.00 C ATOM 1965 OH TYR A 121 10.004 -0.242 -7.660 1.00 0.00 O ATOM 0 H TYR A 121 8.222 5.367 -5.166 1.00 0.00 H new ATOM 0 HA TYR A 121 6.438 4.718 -7.293 1.00 0.00 H new ATOM 0 HB2 TYR A 121 6.751 3.800 -4.427 1.00 0.00 H new ATOM 0 HB3 TYR A 121 5.459 3.205 -5.450 1.00 0.00 H new ATOM 0 HD1 TYR A 121 9.186 3.548 -5.360 1.00 0.00 H new ATOM 0 HD2 TYR A 121 5.858 1.370 -6.885 1.00 0.00 H new ATOM 0 HE1 TYR A 121 10.716 1.885 -6.312 1.00 0.00 H new ATOM 0 HE2 TYR A 121 7.390 -0.300 -7.838 1.00 0.00 H new ATOM 0 HH TYR A 121 9.970 -1.060 -7.122 1.00 0.00 H new ATOM 1975 N THR A 122 5.278 6.473 -4.762 1.00 0.00 N ATOM 1976 CA THR A 122 4.154 7.294 -4.340 1.00 0.00 C ATOM 1977 C THR A 122 3.846 8.382 -5.372 1.00 0.00 C ATOM 1978 O THR A 122 2.715 8.507 -5.835 1.00 0.00 O ATOM 1979 CB THR A 122 4.420 7.938 -2.964 1.00 0.00 C ATOM 1980 OG1 THR A 122 4.598 6.914 -1.974 1.00 0.00 O ATOM 1981 CG2 THR A 122 3.273 8.850 -2.549 1.00 0.00 C ATOM 0 H THR A 122 6.084 6.503 -4.138 1.00 0.00 H new ATOM 0 HA THR A 122 3.288 6.638 -4.256 1.00 0.00 H new ATOM 0 HB THR A 122 5.326 8.539 -3.043 1.00 0.00 H new ATOM 0 HG1 THR A 122 5.555 6.752 -1.839 1.00 0.00 H new ATOM 0 HG21 THR A 122 3.491 9.288 -1.575 1.00 0.00 H new ATOM 0 HG22 THR A 122 3.155 9.644 -3.286 1.00 0.00 H new ATOM 0 HG23 THR A 122 2.351 8.271 -2.488 1.00 0.00 H new ATOM 1989 N ASN A 123 4.863 9.144 -5.758 1.00 0.00 N ATOM 1990 CA ASN A 123 4.663 10.272 -6.663 1.00 0.00 C ATOM 1991 C ASN A 123 4.290 9.809 -8.066 1.00 0.00 C ATOM 1992 O ASN A 123 3.375 10.360 -8.680 1.00 0.00 O ATOM 1993 CB ASN A 123 5.910 11.160 -6.726 1.00 0.00 C ATOM 1994 CG ASN A 123 6.128 11.962 -5.459 1.00 0.00 C ATOM 1995 OD1 ASN A 123 5.611 13.071 -5.313 1.00 0.00 O ATOM 1996 ND2 ASN A 123 6.909 11.416 -4.541 1.00 0.00 N ATOM 0 H ASN A 123 5.829 9.004 -5.461 1.00 0.00 H new ATOM 0 HA ASN A 123 3.834 10.855 -6.262 1.00 0.00 H new ATOM 0 HB2 ASN A 123 6.785 10.536 -6.910 1.00 0.00 H new ATOM 0 HB3 ASN A 123 5.821 11.843 -7.571 1.00 0.00 H new ATOM 0 HD21 ASN A 123 7.102 11.916 -3.673 1.00 0.00 H new ATOM 0 HD22 ASN A 123 7.318 10.495 -4.701 1.00 0.00 H new ATOM 2003 N SER A 124 4.981 8.793 -8.567 1.00 0.00 N ATOM 2004 CA SER A 124 4.782 8.354 -9.941 1.00 0.00 C ATOM 2005 C SER A 124 3.547 7.460 -10.082 1.00 0.00 C ATOM 2006 O SER A 124 2.722 7.677 -10.971 1.00 0.00 O ATOM 2007 CB SER A 124 6.026 7.619 -10.456 1.00 0.00 C ATOM 2008 OG SER A 124 5.924 7.351 -11.844 1.00 0.00 O ATOM 0 H SER A 124 5.679 8.261 -8.047 1.00 0.00 H new ATOM 0 HA SER A 124 4.617 9.246 -10.545 1.00 0.00 H new ATOM 0 HB2 SER A 124 6.914 8.222 -10.263 1.00 0.00 H new ATOM 0 HB3 SER A 124 6.151 6.684 -9.910 1.00 0.00 H new ATOM 0 HG SER A 124 6.730 6.883 -12.147 1.00 0.00 H new ATOM 2014 N PHE A 125 3.406 6.469 -9.208 1.00 0.00 N ATOM 2015 CA PHE A 125 2.347 5.478 -9.364 1.00 0.00 C ATOM 2016 C PHE A 125 1.021 5.963 -8.779 1.00 0.00 C ATOM 2017 O PHE A 125 -0.037 5.733 -9.368 1.00 0.00 O ATOM 2018 CB PHE A 125 2.759 4.144 -8.729 1.00 0.00 C ATOM 2019 CG PHE A 125 1.681 3.097 -8.762 1.00 0.00 C ATOM 2020 CD1 PHE A 125 1.342 2.464 -9.948 1.00 0.00 C ATOM 2021 CD2 PHE A 125 1.003 2.752 -7.605 1.00 0.00 C ATOM 2022 CE1 PHE A 125 0.346 1.508 -9.978 1.00 0.00 C ATOM 2023 CE2 PHE A 125 0.008 1.798 -7.629 1.00 0.00 C ATOM 2024 CZ PHE A 125 -0.322 1.174 -8.817 1.00 0.00 C ATOM 0 H PHE A 125 4.004 6.331 -8.393 1.00 0.00 H new ATOM 0 HA PHE A 125 2.197 5.328 -10.433 1.00 0.00 H new ATOM 0 HB2 PHE A 125 3.639 3.762 -9.247 1.00 0.00 H new ATOM 0 HB3 PHE A 125 3.050 4.320 -7.693 1.00 0.00 H new ATOM 0 HD1 PHE A 125 1.863 2.721 -10.858 1.00 0.00 H new ATOM 0 HD2 PHE A 125 1.257 3.236 -6.673 1.00 0.00 H new ATOM 0 HE1 PHE A 125 0.090 1.022 -10.908 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -0.513 1.538 -6.720 1.00 0.00 H new ATOM 0 HZ PHE A 125 -1.101 0.426 -8.837 1.00 0.00 H new ATOM 2034 N GLY A 126 1.067 6.645 -7.641 1.00 0.00 N ATOM 2035 CA GLY A 126 -0.162 7.132 -7.047 1.00 0.00 C ATOM 2036 C GLY A 126 -0.038 7.434 -5.567 1.00 0.00 C ATOM 2037 O GLY A 126 0.412 6.598 -4.785 1.00 0.00 O ATOM 0 H GLY A 126 1.919 6.867 -7.126 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -0.476 8.036 -7.569 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -0.947 6.390 -7.194 1.00 0.00 H new ATOM 2041 N ASP A 127 -0.439 8.641 -5.195 1.00 0.00 N ATOM 2042 CA ASP A 127 -0.426 9.073 -3.801 1.00 0.00 C ATOM 2043 C ASP A 127 -1.798 8.858 -3.163 1.00 0.00 C ATOM 2044 O ASP A 127 -1.915 8.255 -2.093 1.00 0.00 O ATOM 2045 CB ASP A 127 -0.007 10.548 -3.701 1.00 0.00 C ATOM 2046 CG ASP A 127 -0.523 11.387 -4.858 1.00 0.00 C ATOM 2047 OD1 ASP A 127 -1.754 11.518 -5.012 1.00 0.00 O ATOM 2048 OD2 ASP A 127 0.304 11.908 -5.637 1.00 0.00 O ATOM 0 H ASP A 127 -0.782 9.347 -5.846 1.00 0.00 H new ATOM 0 HA ASP A 127 0.303 8.472 -3.258 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -0.377 10.963 -2.764 1.00 0.00 H new ATOM 0 HB3 ASP A 127 1.081 10.611 -3.670 1.00 0.00 H new ATOM 2053 N TRP A 128 -2.832 9.353 -3.827 1.00 0.00 N ATOM 2054 CA TRP A 128 -4.208 9.113 -3.409 1.00 0.00 C ATOM 2055 C TRP A 128 -4.843 8.044 -4.292 1.00 0.00 C ATOM 2056 O TRP A 128 -6.068 7.916 -4.355 1.00 0.00 O ATOM 2057 CB TRP A 128 -5.030 10.402 -3.487 1.00 0.00 C ATOM 2058 CG TRP A 128 -4.657 11.428 -2.461 1.00 0.00 C ATOM 2059 CD1 TRP A 128 -3.749 12.437 -2.603 1.00 0.00 C ATOM 2060 CD2 TRP A 128 -5.188 11.548 -1.134 1.00 0.00 C ATOM 2061 NE1 TRP A 128 -3.688 13.182 -1.451 1.00 0.00 N ATOM 2062 CE2 TRP A 128 -4.561 12.656 -0.534 1.00 0.00 C ATOM 2063 CE3 TRP A 128 -6.133 10.830 -0.397 1.00 0.00 C ATOM 2064 CZ2 TRP A 128 -4.849 13.062 0.767 1.00 0.00 C ATOM 2065 CZ3 TRP A 128 -6.419 11.234 0.894 1.00 0.00 C ATOM 2066 CH2 TRP A 128 -5.779 12.341 1.464 1.00 0.00 C ATOM 0 H TRP A 128 -2.744 9.928 -4.665 1.00 0.00 H new ATOM 0 HA TRP A 128 -4.197 8.768 -2.375 1.00 0.00 H new ATOM 0 HB2 TRP A 128 -4.911 10.836 -4.480 1.00 0.00 H new ATOM 0 HB3 TRP A 128 -6.085 10.155 -3.371 1.00 0.00 H new ATOM 0 HD1 TRP A 128 -3.164 12.622 -3.492 1.00 0.00 H new ATOM 0 HE1 TRP A 128 -3.090 13.995 -1.302 1.00 0.00 H new ATOM 0 HE3 TRP A 128 -6.631 9.974 -0.828 1.00 0.00 H new ATOM 0 HZ2 TRP A 128 -4.356 13.915 1.209 1.00 0.00 H new ATOM 0 HZ3 TRP A 128 -7.148 10.686 1.472 1.00 0.00 H new ATOM 0 HH2 TRP A 128 -6.025 12.632 2.475 1.00 0.00 H new ATOM 2077 N VAL A 129 -4.002 7.274 -4.965 1.00 0.00 N ATOM 2078 CA VAL A 129 -4.468 6.246 -5.882 1.00 0.00 C ATOM 2079 C VAL A 129 -4.348 4.864 -5.244 1.00 0.00 C ATOM 2080 O VAL A 129 -3.367 4.568 -4.557 1.00 0.00 O ATOM 2081 CB VAL A 129 -3.675 6.280 -7.211 1.00 0.00 C ATOM 2082 CG1 VAL A 129 -4.167 5.209 -8.177 1.00 0.00 C ATOM 2083 CG2 VAL A 129 -3.768 7.659 -7.850 1.00 0.00 C ATOM 0 H VAL A 129 -2.987 7.343 -4.892 1.00 0.00 H new ATOM 0 HA VAL A 129 -5.516 6.449 -6.100 1.00 0.00 H new ATOM 0 HB VAL A 129 -2.630 6.069 -6.984 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -3.590 5.259 -9.100 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -4.042 4.225 -7.724 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -5.221 5.375 -8.398 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -3.205 7.666 -8.783 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -4.812 7.896 -8.054 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -3.353 8.404 -7.171 1.00 0.00 H new ATOM 2093 N VAL A 130 -5.359 4.036 -5.459 1.00 0.00 N ATOM 2094 CA VAL A 130 -5.357 2.672 -4.964 1.00 0.00 C ATOM 2095 C VAL A 130 -4.625 1.771 -5.955 1.00 0.00 C ATOM 2096 O VAL A 130 -4.959 1.750 -7.142 1.00 0.00 O ATOM 2097 CB VAL A 130 -6.796 2.151 -4.751 1.00 0.00 C ATOM 2098 CG1 VAL A 130 -6.790 0.728 -4.213 1.00 0.00 C ATOM 2099 CG2 VAL A 130 -7.569 3.073 -3.818 1.00 0.00 C ATOM 0 H VAL A 130 -6.199 4.291 -5.979 1.00 0.00 H new ATOM 0 HA VAL A 130 -4.846 2.658 -4.002 1.00 0.00 H new ATOM 0 HB VAL A 130 -7.296 2.142 -5.720 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -7.816 0.388 -4.073 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -6.284 0.073 -4.922 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -6.266 0.702 -3.258 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -8.580 2.688 -3.681 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -7.065 3.120 -2.853 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -7.617 4.072 -4.251 1.00 0.00 H new ATOM 2109 N PRO A 131 -3.606 1.037 -5.476 1.00 0.00 N ATOM 2110 CA PRO A 131 -2.761 0.174 -6.310 1.00 0.00 C ATOM 2111 C PRO A 131 -3.550 -0.759 -7.227 1.00 0.00 C ATOM 2112 O PRO A 131 -4.224 -1.692 -6.776 1.00 0.00 O ATOM 2113 CB PRO A 131 -1.943 -0.638 -5.294 1.00 0.00 C ATOM 2114 CG PRO A 131 -2.549 -0.350 -3.958 1.00 0.00 C ATOM 2115 CD PRO A 131 -3.184 1.001 -4.074 1.00 0.00 C ATOM 0 HA PRO A 131 -2.155 0.771 -6.991 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -1.985 -1.703 -5.521 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -0.892 -0.348 -5.317 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -3.288 -1.107 -3.694 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -1.790 -0.358 -3.176 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -4.028 1.112 -3.394 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -2.481 1.801 -3.842 1.00 0.00 H new ATOM 2123 N TYR A 132 -3.470 -0.483 -8.518 1.00 0.00 N ATOM 2124 CA TYR A 132 -4.085 -1.327 -9.526 1.00 0.00 C ATOM 2125 C TYR A 132 -3.007 -2.116 -10.255 1.00 0.00 C ATOM 2126 O TYR A 132 -1.822 -1.820 -10.113 1.00 0.00 O ATOM 2127 CB TYR A 132 -4.894 -0.478 -10.520 1.00 0.00 C ATOM 2128 CG TYR A 132 -4.066 0.515 -11.318 1.00 0.00 C ATOM 2129 CD1 TYR A 132 -3.810 1.792 -10.832 1.00 0.00 C ATOM 2130 CD2 TYR A 132 -3.546 0.173 -12.561 1.00 0.00 C ATOM 2131 CE1 TYR A 132 -3.059 2.696 -11.562 1.00 0.00 C ATOM 2132 CE2 TYR A 132 -2.795 1.071 -13.296 1.00 0.00 C ATOM 2133 CZ TYR A 132 -2.553 2.331 -12.793 1.00 0.00 C ATOM 2134 OH TYR A 132 -1.809 3.229 -13.528 1.00 0.00 O ATOM 0 H TYR A 132 -2.979 0.328 -8.894 1.00 0.00 H new ATOM 0 HA TYR A 132 -4.769 -2.022 -9.039 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -5.408 -1.144 -11.213 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -5.663 0.067 -9.972 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -4.204 2.083 -9.869 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -3.732 -0.813 -12.960 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -2.869 3.684 -11.170 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -2.400 0.787 -14.260 1.00 0.00 H new ATOM 0 HH TYR A 132 -1.337 3.837 -12.921 1.00 0.00 H new ATOM 2144 N TYR A 133 -3.412 -3.120 -11.020 1.00 0.00 N ATOM 2145 CA TYR A 133 -2.469 -3.904 -11.805 1.00 0.00 C ATOM 2146 C TYR A 133 -1.831 -3.042 -12.888 1.00 0.00 C ATOM 2147 O TYR A 133 -2.442 -2.759 -13.921 1.00 0.00 O ATOM 2148 CB TYR A 133 -3.164 -5.124 -12.421 1.00 0.00 C ATOM 2149 CG TYR A 133 -2.328 -5.869 -13.444 1.00 0.00 C ATOM 2150 CD1 TYR A 133 -1.196 -6.583 -13.069 1.00 0.00 C ATOM 2151 CD2 TYR A 133 -2.679 -5.858 -14.787 1.00 0.00 C ATOM 2152 CE1 TYR A 133 -0.439 -7.263 -14.007 1.00 0.00 C ATOM 2153 CE2 TYR A 133 -1.930 -6.533 -15.728 1.00 0.00 C ATOM 2154 CZ TYR A 133 -0.812 -7.234 -15.335 1.00 0.00 C ATOM 2155 OH TYR A 133 -0.067 -7.911 -16.277 1.00 0.00 O ATOM 0 H TYR A 133 -4.385 -3.410 -11.114 1.00 0.00 H new ATOM 0 HA TYR A 133 -1.680 -4.260 -11.142 1.00 0.00 H new ATOM 0 HB2 TYR A 133 -3.438 -5.813 -11.622 1.00 0.00 H new ATOM 0 HB3 TYR A 133 -4.091 -4.799 -12.894 1.00 0.00 H new ATOM 0 HD1 TYR A 133 -0.903 -6.608 -12.030 1.00 0.00 H new ATOM 0 HD2 TYR A 133 -3.555 -5.310 -15.101 1.00 0.00 H new ATOM 0 HE1 TYR A 133 0.439 -7.813 -13.701 1.00 0.00 H new ATOM 0 HE2 TYR A 133 -2.219 -6.512 -16.768 1.00 0.00 H new ATOM 0 HH TYR A 133 -0.469 -7.787 -17.162 1.00 0.00 H new ATOM 2165 N ARG A 134 -0.613 -2.601 -12.629 1.00 0.00 N ATOM 2166 CA ARG A 134 0.123 -1.806 -13.590 1.00 0.00 C ATOM 2167 C ARG A 134 1.080 -2.695 -14.371 1.00 0.00 C ATOM 2168 O ARG A 134 2.219 -2.921 -13.956 1.00 0.00 O ATOM 2169 CB ARG A 134 0.891 -0.674 -12.894 1.00 0.00 C ATOM 2170 CG ARG A 134 1.636 0.232 -13.860 1.00 0.00 C ATOM 2171 CD ARG A 134 0.679 0.961 -14.787 1.00 0.00 C ATOM 2172 NE ARG A 134 1.373 1.568 -15.920 1.00 0.00 N ATOM 2173 CZ ARG A 134 1.018 2.722 -16.482 1.00 0.00 C ATOM 2174 NH1 ARG A 134 0.000 3.424 -15.993 1.00 0.00 N ATOM 2175 NH2 ARG A 134 1.688 3.176 -17.535 1.00 0.00 N ATOM 0 H ARG A 134 -0.113 -2.782 -11.758 1.00 0.00 H new ATOM 0 HA ARG A 134 -0.588 -1.353 -14.281 1.00 0.00 H new ATOM 0 HB2 ARG A 134 0.191 -0.075 -12.312 1.00 0.00 H new ATOM 0 HB3 ARG A 134 1.603 -1.106 -12.191 1.00 0.00 H new ATOM 0 HG2 ARG A 134 2.225 0.958 -13.299 1.00 0.00 H new ATOM 0 HG3 ARG A 134 2.336 -0.360 -14.450 1.00 0.00 H new ATOM 0 HD2 ARG A 134 -0.073 0.263 -15.154 1.00 0.00 H new ATOM 0 HD3 ARG A 134 0.151 1.734 -14.229 1.00 0.00 H new ATOM 0 HE ARG A 134 2.180 1.077 -16.305 1.00 0.00 H new ATOM 0 HH11 ARG A 134 -0.514 3.079 -15.182 1.00 0.00 H new ATOM 0 HH12 ARG A 134 -0.266 4.307 -16.428 1.00 0.00 H new ATOM 0 HH21 ARG A 134 2.471 2.641 -17.910 1.00 0.00 H new ATOM 0 HH22 ARG A 134 1.419 4.059 -17.968 1.00 0.00 H new