USER MOD reduce.3.24.130724 H: found=0, std=0, add=1053, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1068 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 27 TYR OH : rot 69:sc= 0.463 USER MOD Set 1.2: A 131 SER OG : rot -160:sc= -3.27 USER MOD Set 1.3: A 140 GLN :FLIP amide:sc= 0.616 F(o=-5.4,f=-2.2) USER MOD Set 2.1: A 59 SER OG : rot 180:sc= 0.0104 USER MOD Set 2.2: A 71 TYR OH : rot 32:sc= 0.00874 USER MOD Single : A 7 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 8 THR OG1 : rot 78:sc= 1.18 USER MOD Single : A 9 THR OG1 : rot -57:sc= 1.17 USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=-0.056) USER MOD Single : A 17 THR OG1 : rot 80:sc= 1.11 USER MOD Single : A 19 GLN : amide:sc= -1.42 K(o=-1.4,f=-4.3!) USER MOD Single : A 23 HIS : no HD1:sc= -1.78 X(o=-1.8,f=-1.5) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN : amide:sc= 0 X(o=0,f=-0.0082) USER MOD Single : A 68 HIS : no HD1:sc= -3.11! C(o=-3.1!,f=-5.8!) USER MOD Single : A 73 MET CE :methyl 166:sc= -0.0681 (180deg=-0.466) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot -133:sc= -0.142 USER MOD Single : A 101 ASN : amide:sc= -0.367 K(o=-0.37,f=-2.5) USER MOD Single : A 103 HIS : no HD1:sc= -0.834 X(o=-0.83,f=-0.46) USER MOD Single : A 109 THR OG1 : rot 180:sc=-0.000532 USER MOD Single : A 113 THR OG1 : rot 180:sc= -0.997 USER MOD Single : A 117 ASN : amide:sc= -0.202 X(o=-0.2,f=0) USER MOD Single : A 119 ASN : amide:sc= 0 X(o=0,f=-0.0076) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 134 TYR OH : rot 73:sc= 0.0211 USER MOD Single : A 138 THR OG1 : rot 180:sc= 0 USER MOD Single : A 141 MET CE :methyl -115:sc= -0.265 (180deg=-1.48!) USER MOD Single : A 142 THR OG1 : rot 180:sc= -1.15 USER MOD Single : A 143 TYR OH : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 TYR OH : rot 180:sc= 0 USER MOD Single : A 149 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 150 ASN : amide:sc= -0.057 X(o=-0.057,f=-0.47) USER MOD Single : A 152 ASN : amide:sc= -0.565 X(o=-0.56,f=-0.32) USER MOD Single : A 154 TYR OH : rot 180:sc= 0 USER MOD Single : A 158 MET CE :methyl -172:sc= 0 (180deg=-0.084) USER MOD Single : A 161 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 34 N ALA A 3 -26.207 0.617 20.369 1.00 0.00 N ATOM 35 CA ALA A 3 -24.942 1.079 20.928 1.00 0.00 C ATOM 36 C ALA A 3 -24.546 0.263 22.156 1.00 0.00 C ATOM 37 O ALA A 3 -23.374 0.220 22.531 1.00 0.00 O ATOM 38 CB ALA A 3 -25.032 2.555 21.281 1.00 0.00 C ATOM 0 HA ALA A 3 -24.169 0.941 20.172 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -24.081 2.888 21.697 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -25.257 3.131 20.383 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -25.823 2.706 22.016 1.00 0.00 H new ATOM 44 N ASP A 4 -25.528 -0.384 22.778 1.00 0.00 N ATOM 45 CA ASP A 4 -25.275 -1.197 23.962 1.00 0.00 C ATOM 46 C ASP A 4 -24.652 -2.533 23.574 1.00 0.00 C ATOM 47 O ASP A 4 -23.566 -2.881 24.035 1.00 0.00 O ATOM 48 CB ASP A 4 -26.575 -1.431 24.733 1.00 0.00 C ATOM 49 CG ASP A 4 -26.341 -1.618 26.219 1.00 0.00 C ATOM 50 OD1 ASP A 4 -27.231 -1.247 27.013 1.00 0.00 O ATOM 51 OD2 ASP A 4 -25.265 -2.135 26.590 1.00 0.00 O ATOM 0 H ASP A 4 -26.504 -0.361 22.482 1.00 0.00 H new ATOM 0 HA ASP A 4 -24.575 -0.660 24.602 1.00 0.00 H new ATOM 0 HB2 ASP A 4 -27.244 -0.585 24.577 1.00 0.00 H new ATOM 0 HB3 ASP A 4 -27.077 -2.312 24.334 1.00 0.00 H new ATOM 57 N GLU A 5 -25.346 -3.275 22.718 1.00 0.00 N ATOM 58 CA GLU A 5 -24.860 -4.570 22.261 1.00 0.00 C ATOM 59 C GLU A 5 -23.660 -4.400 21.334 1.00 0.00 C ATOM 60 O GLU A 5 -22.822 -5.295 21.215 1.00 0.00 O ATOM 61 CB GLU A 5 -25.973 -5.332 21.539 1.00 0.00 C ATOM 62 CG GLU A 5 -27.065 -5.837 22.469 1.00 0.00 C ATOM 63 CD GLU A 5 -28.402 -5.165 22.219 1.00 0.00 C ATOM 64 OE1 GLU A 5 -28.501 -3.940 22.441 1.00 0.00 O ATOM 65 OE2 GLU A 5 -29.348 -5.864 21.800 1.00 0.00 O ATOM 0 H GLU A 5 -26.247 -3.001 22.327 1.00 0.00 H new ATOM 0 HA GLU A 5 -24.547 -5.143 23.134 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -26.419 -4.681 20.787 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -25.538 -6.179 21.009 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -27.175 -6.914 22.343 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -26.764 -5.666 23.503 1.00 0.00 H new ATOM 73 N TRP A 6 -23.583 -3.245 20.678 1.00 0.00 N ATOM 74 CA TRP A 6 -22.485 -2.959 19.762 1.00 0.00 C ATOM 75 C TRP A 6 -21.180 -2.756 20.524 1.00 0.00 C ATOM 76 O TRP A 6 -20.131 -3.262 20.125 1.00 0.00 O ATOM 77 CB TRP A 6 -22.801 -1.718 18.927 1.00 0.00 C ATOM 78 CG TRP A 6 -21.887 -1.542 17.753 1.00 0.00 C ATOM 79 CD1 TRP A 6 -21.848 -2.309 16.624 1.00 0.00 C ATOM 80 CD2 TRP A 6 -20.880 -0.536 17.591 1.00 0.00 C ATOM 81 NE1 TRP A 6 -20.877 -1.841 15.770 1.00 0.00 N ATOM 82 CE2 TRP A 6 -20.270 -0.754 16.342 1.00 0.00 C ATOM 83 CE3 TRP A 6 -20.435 0.527 18.382 1.00 0.00 C ATOM 84 CZ2 TRP A 6 -19.238 0.053 15.867 1.00 0.00 C ATOM 85 CZ3 TRP A 6 -19.412 1.327 17.910 1.00 0.00 C ATOM 86 CH2 TRP A 6 -18.825 1.086 16.662 1.00 0.00 C ATOM 0 H TRP A 6 -24.267 -2.494 20.764 1.00 0.00 H new ATOM 0 HA TRP A 6 -22.366 -3.815 19.097 1.00 0.00 H new ATOM 0 HB2 TRP A 6 -23.829 -1.781 18.571 1.00 0.00 H new ATOM 0 HB3 TRP A 6 -22.737 -0.835 19.563 1.00 0.00 H new ATOM 0 HD1 TRP A 6 -22.486 -3.159 16.430 1.00 0.00 H new ATOM 0 HE1 TRP A 6 -20.646 -2.238 14.859 1.00 0.00 H new ATOM 0 HE3 TRP A 6 -20.883 0.720 19.346 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 -18.781 -0.131 14.906 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 -19.060 2.151 18.513 1.00 0.00 H new ATOM 0 HH2 TRP A 6 -18.029 1.730 16.320 1.00 0.00 H new ATOM 97 N MET A 7 -21.251 -2.012 21.623 1.00 0.00 N ATOM 98 CA MET A 7 -20.075 -1.741 22.441 1.00 0.00 C ATOM 99 C MET A 7 -19.596 -3.010 23.142 1.00 0.00 C ATOM 100 O MET A 7 -18.395 -3.230 23.295 1.00 0.00 O ATOM 101 CB MET A 7 -20.386 -0.655 23.475 1.00 0.00 C ATOM 102 CG MET A 7 -19.665 0.658 23.212 1.00 0.00 C ATOM 103 SD MET A 7 -18.115 0.792 24.123 1.00 0.00 S ATOM 104 CE MET A 7 -18.071 2.550 24.460 1.00 0.00 C ATOM 0 H MET A 7 -22.111 -1.586 21.968 1.00 0.00 H new ATOM 0 HA MET A 7 -19.279 -1.389 21.785 1.00 0.00 H new ATOM 0 HB2 MET A 7 -21.461 -0.474 23.488 1.00 0.00 H new ATOM 0 HB3 MET A 7 -20.112 -1.019 24.465 1.00 0.00 H new ATOM 0 HG2 MET A 7 -19.464 0.750 22.145 1.00 0.00 H new ATOM 0 HG3 MET A 7 -20.317 1.487 23.487 1.00 0.00 H new ATOM 0 HE1 MET A 7 -17.167 2.791 25.020 1.00 0.00 H new ATOM 0 HE2 MET A 7 -18.073 3.101 23.519 1.00 0.00 H new ATOM 0 HE3 MET A 7 -18.946 2.830 25.046 1.00 0.00 H new ATOM 114 N THR A 8 -20.543 -3.838 23.567 1.00 0.00 N ATOM 115 CA THR A 8 -20.218 -5.085 24.252 1.00 0.00 C ATOM 116 C THR A 8 -19.366 -5.988 23.366 1.00 0.00 C ATOM 117 O THR A 8 -18.434 -6.638 23.840 1.00 0.00 O ATOM 118 CB THR A 8 -21.498 -5.815 24.663 1.00 0.00 C ATOM 119 OG1 THR A 8 -22.365 -4.946 25.370 1.00 0.00 O ATOM 120 CG2 THR A 8 -21.243 -7.023 25.537 1.00 0.00 C ATOM 0 H THR A 8 -21.542 -3.669 23.450 1.00 0.00 H new ATOM 0 HA THR A 8 -19.645 -4.839 25.146 1.00 0.00 H new ATOM 0 HB THR A 8 -21.952 -6.152 23.731 1.00 0.00 H new ATOM 0 HG1 THR A 8 -22.822 -4.354 24.737 1.00 0.00 H new ATOM 0 HG21 THR A 8 -22.192 -7.494 25.792 1.00 0.00 H new ATOM 0 HG22 THR A 8 -20.617 -7.735 24.999 1.00 0.00 H new ATOM 0 HG23 THR A 8 -20.736 -6.711 26.450 1.00 0.00 H new ATOM 128 N THR A 9 -19.691 -6.022 22.078 1.00 0.00 N ATOM 129 CA THR A 9 -18.955 -6.846 21.125 1.00 0.00 C ATOM 130 C THR A 9 -17.553 -6.291 20.896 1.00 0.00 C ATOM 131 O THR A 9 -16.614 -7.041 20.630 1.00 0.00 O ATOM 132 CB THR A 9 -19.710 -6.922 19.798 1.00 0.00 C ATOM 133 OG1 THR A 9 -19.791 -5.644 19.193 1.00 0.00 O ATOM 134 CG2 THR A 9 -21.120 -7.452 19.940 1.00 0.00 C ATOM 0 H THR A 9 -20.459 -5.489 21.670 1.00 0.00 H new ATOM 0 HA THR A 9 -18.865 -7.849 21.542 1.00 0.00 H new ATOM 0 HB THR A 9 -19.139 -7.616 19.181 1.00 0.00 H new ATOM 0 HG1 THR A 9 -20.220 -5.016 19.811 1.00 0.00 H new ATOM 0 HG21 THR A 9 -21.599 -7.480 18.961 1.00 0.00 H new ATOM 0 HG22 THR A 9 -21.090 -8.458 20.358 1.00 0.00 H new ATOM 0 HG23 THR A 9 -21.689 -6.800 20.603 1.00 0.00 H new ATOM 142 N PHE A 10 -17.418 -4.973 21.000 1.00 0.00 N ATOM 143 CA PHE A 10 -16.129 -4.318 20.803 1.00 0.00 C ATOM 144 C PHE A 10 -15.121 -4.776 21.852 1.00 0.00 C ATOM 145 O PHE A 10 -13.939 -4.954 21.553 1.00 0.00 O ATOM 146 CB PHE A 10 -16.292 -2.798 20.863 1.00 0.00 C ATOM 147 CG PHE A 10 -15.242 -2.052 20.091 1.00 0.00 C ATOM 148 CD1 PHE A 10 -14.933 -2.414 18.790 1.00 0.00 C ATOM 149 CD2 PHE A 10 -14.565 -0.988 20.665 1.00 0.00 C ATOM 150 CE1 PHE A 10 -13.967 -1.730 18.076 1.00 0.00 C ATOM 151 CE2 PHE A 10 -13.599 -0.300 19.957 1.00 0.00 C ATOM 152 CZ PHE A 10 -13.300 -0.671 18.660 1.00 0.00 C ATOM 0 H PHE A 10 -18.185 -4.337 21.219 1.00 0.00 H new ATOM 0 HA PHE A 10 -15.753 -4.597 19.819 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -17.275 -2.530 20.476 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -16.262 -2.478 21.905 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -15.453 -3.240 18.328 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -14.795 -0.693 21.678 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -13.734 -2.023 17.063 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -13.078 0.527 20.417 1.00 0.00 H new ATOM 0 HZ PHE A 10 -12.546 -0.134 18.104 1.00 0.00 H new ATOM 162 N ARG A 11 -15.593 -4.963 23.080 1.00 0.00 N ATOM 163 CA ARG A 11 -14.731 -5.400 24.171 1.00 0.00 C ATOM 164 C ARG A 11 -14.106 -6.757 23.862 1.00 0.00 C ATOM 165 O ARG A 11 -12.911 -6.963 24.069 1.00 0.00 O ATOM 166 CB ARG A 11 -15.524 -5.475 25.477 1.00 0.00 C ATOM 167 CG ARG A 11 -15.486 -4.189 26.287 1.00 0.00 C ATOM 168 CD ARG A 11 -15.396 -4.468 27.780 1.00 0.00 C ATOM 169 NE ARG A 11 -16.629 -4.113 28.479 1.00 0.00 N ATOM 170 CZ ARG A 11 -17.712 -4.887 28.510 1.00 0.00 C ATOM 171 NH1 ARG A 11 -17.722 -6.055 27.881 1.00 0.00 N ATOM 172 NH2 ARG A 11 -18.791 -4.488 29.171 1.00 0.00 N ATOM 0 H ARG A 11 -16.568 -4.819 23.344 1.00 0.00 H new ATOM 0 HA ARG A 11 -13.930 -4.669 24.282 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -16.561 -5.720 25.249 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -15.130 -6.289 26.085 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -14.631 -3.588 25.977 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -16.380 -3.601 26.080 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -15.181 -5.525 27.939 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -14.564 -3.906 28.204 1.00 0.00 H new ATOM 0 HE ARG A 11 -16.662 -3.221 28.972 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -16.896 -6.366 27.369 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -18.555 -6.642 27.909 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -18.790 -3.590 29.654 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -19.622 -5.080 29.196 1.00 0.00 H new ATOM 186 N GLU A 12 -14.924 -7.680 23.365 1.00 0.00 N ATOM 187 CA GLU A 12 -14.452 -9.017 23.028 1.00 0.00 C ATOM 188 C GLU A 12 -13.559 -8.983 21.792 1.00 0.00 C ATOM 189 O GLU A 12 -12.639 -9.790 21.655 1.00 0.00 O ATOM 190 CB GLU A 12 -15.636 -9.955 22.790 1.00 0.00 C ATOM 191 CG GLU A 12 -15.395 -11.376 23.271 1.00 0.00 C ATOM 192 CD GLU A 12 -16.526 -12.316 22.904 1.00 0.00 C ATOM 193 OE1 GLU A 12 -17.452 -12.479 23.726 1.00 0.00 O ATOM 194 OE2 GLU A 12 -16.485 -12.890 21.795 1.00 0.00 O ATOM 0 H GLU A 12 -15.916 -7.526 23.187 1.00 0.00 H new ATOM 0 HA GLU A 12 -13.866 -9.390 23.868 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -16.514 -9.553 23.296 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -15.864 -9.975 21.724 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -14.465 -11.748 22.842 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -15.267 -11.372 24.354 1.00 0.00 H new ATOM 202 N ASN A 13 -13.837 -8.045 20.892 1.00 0.00 N ATOM 203 CA ASN A 13 -13.059 -7.906 19.667 1.00 0.00 C ATOM 204 C ASN A 13 -11.601 -7.585 19.980 1.00 0.00 C ATOM 205 O ASN A 13 -10.693 -8.306 19.567 1.00 0.00 O ATOM 206 CB ASN A 13 -13.656 -6.811 18.780 1.00 0.00 C ATOM 207 CG ASN A 13 -13.053 -6.801 17.389 1.00 0.00 C ATOM 208 OD1 ASN A 13 -12.248 -5.933 17.054 1.00 0.00 O ATOM 209 ND2 ASN A 13 -13.444 -7.770 16.568 1.00 0.00 N ATOM 0 H ASN A 13 -14.596 -7.370 20.989 1.00 0.00 H new ATOM 0 HA ASN A 13 -13.096 -8.856 19.134 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -14.734 -6.956 18.705 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -13.497 -5.840 19.249 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -13.074 -7.814 15.618 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -14.114 -8.470 16.887 1.00 0.00 H new ATOM 216 N ILE A 14 -11.385 -6.497 20.714 1.00 0.00 N ATOM 217 CA ILE A 14 -10.038 -6.080 21.083 1.00 0.00 C ATOM 218 C ILE A 14 -9.428 -7.034 22.105 1.00 0.00 C ATOM 219 O ILE A 14 -8.222 -7.277 22.098 1.00 0.00 O ATOM 220 CB ILE A 14 -10.030 -4.652 21.662 1.00 0.00 C ATOM 221 CG1 ILE A 14 -10.938 -4.571 22.890 1.00 0.00 C ATOM 222 CG2 ILE A 14 -10.468 -3.650 20.605 1.00 0.00 C ATOM 223 CD1 ILE A 14 -10.879 -3.235 23.597 1.00 0.00 C ATOM 0 H ILE A 14 -12.126 -5.889 21.064 1.00 0.00 H new ATOM 0 HA ILE A 14 -9.441 -6.097 20.171 1.00 0.00 H new ATOM 0 HB ILE A 14 -9.014 -4.406 21.969 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -11.966 -4.767 22.585 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -10.658 -5.357 23.591 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -10.457 -2.646 21.029 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -9.784 -3.693 19.757 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -11.477 -3.892 20.270 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -11.547 -3.249 24.458 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -9.859 -3.046 23.932 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -11.188 -2.446 22.911 1.00 0.00 H new ATOM 235 N ALA A 15 -10.270 -7.571 22.982 1.00 0.00 N ATOM 236 CA ALA A 15 -9.813 -8.498 24.010 1.00 0.00 C ATOM 237 C ALA A 15 -9.196 -9.747 23.389 1.00 0.00 C ATOM 238 O ALA A 15 -8.181 -10.253 23.867 1.00 0.00 O ATOM 239 CB ALA A 15 -10.965 -8.878 24.928 1.00 0.00 C ATOM 0 H ALA A 15 -11.272 -7.380 23.001 1.00 0.00 H new ATOM 0 HA ALA A 15 -9.043 -7.998 24.598 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -10.609 -9.571 25.691 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -11.359 -7.982 25.407 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -11.753 -9.354 24.345 1.00 0.00 H new ATOM 245 N GLN A 16 -9.815 -10.239 22.321 1.00 0.00 N ATOM 246 CA GLN A 16 -9.327 -11.428 21.635 1.00 0.00 C ATOM 247 C GLN A 16 -8.103 -11.101 20.784 1.00 0.00 C ATOM 248 O GLN A 16 -7.204 -11.928 20.630 1.00 0.00 O ATOM 249 CB GLN A 16 -10.431 -12.027 20.760 1.00 0.00 C ATOM 250 CG GLN A 16 -10.732 -13.483 21.073 1.00 0.00 C ATOM 251 CD GLN A 16 -11.093 -14.283 19.837 1.00 0.00 C ATOM 252 OE1 GLN A 16 -11.837 -13.815 18.975 1.00 0.00 O ATOM 253 NE2 GLN A 16 -10.565 -15.499 19.744 1.00 0.00 N ATOM 0 H GLN A 16 -10.656 -9.832 21.912 1.00 0.00 H new ATOM 0 HA GLN A 16 -9.036 -12.160 22.389 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -11.341 -11.441 20.886 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -10.140 -11.942 19.713 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -9.864 -13.935 21.553 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -11.554 -13.535 21.787 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -9.953 -15.847 20.482 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -10.772 -16.084 18.934 1.00 0.00 H new ATOM 262 N THR A 17 -8.076 -9.892 20.235 1.00 0.00 N ATOM 263 CA THR A 17 -6.963 -9.456 19.401 1.00 0.00 C ATOM 264 C THR A 17 -5.660 -9.442 20.195 1.00 0.00 C ATOM 265 O THR A 17 -4.633 -9.934 19.730 1.00 0.00 O ATOM 266 CB THR A 17 -7.240 -8.064 18.830 1.00 0.00 C ATOM 267 OG1 THR A 17 -8.551 -7.991 18.300 1.00 0.00 O ATOM 268 CG2 THR A 17 -6.277 -7.663 17.733 1.00 0.00 C ATOM 0 H THR A 17 -8.813 -9.196 20.353 1.00 0.00 H new ATOM 0 HA THR A 17 -6.859 -10.164 18.579 1.00 0.00 H new ATOM 0 HB THR A 17 -7.115 -7.379 19.668 1.00 0.00 H new ATOM 0 HG1 THR A 17 -9.191 -7.851 19.029 1.00 0.00 H new ATOM 0 HG21 THR A 17 -6.530 -6.666 17.373 1.00 0.00 H new ATOM 0 HG22 THR A 17 -5.260 -7.660 18.125 1.00 0.00 H new ATOM 0 HG23 THR A 17 -6.346 -8.374 16.910 1.00 0.00 H new ATOM 276 N TRP A 18 -5.712 -8.875 21.396 1.00 0.00 N ATOM 277 CA TRP A 18 -4.538 -8.797 22.256 1.00 0.00 C ATOM 278 C TRP A 18 -4.210 -10.161 22.857 1.00 0.00 C ATOM 279 O TRP A 18 -3.052 -10.461 23.143 1.00 0.00 O ATOM 280 CB TRP A 18 -4.764 -7.775 23.371 1.00 0.00 C ATOM 281 CG TRP A 18 -5.202 -6.434 22.866 1.00 0.00 C ATOM 282 CD1 TRP A 18 -6.287 -5.717 23.280 1.00 0.00 C ATOM 283 CD2 TRP A 18 -4.564 -5.650 21.852 1.00 0.00 C ATOM 284 NE1 TRP A 18 -6.364 -4.534 22.584 1.00 0.00 N ATOM 285 CE2 TRP A 18 -5.316 -4.470 21.701 1.00 0.00 C ATOM 286 CE3 TRP A 18 -3.430 -5.831 21.055 1.00 0.00 C ATOM 287 CZ2 TRP A 18 -4.971 -3.478 20.788 1.00 0.00 C ATOM 288 CZ3 TRP A 18 -3.087 -4.844 20.149 1.00 0.00 C ATOM 289 CH2 TRP A 18 -3.856 -3.681 20.022 1.00 0.00 C ATOM 0 H TRP A 18 -6.555 -8.463 21.795 1.00 0.00 H new ATOM 0 HA TRP A 18 -3.693 -8.478 21.646 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -5.516 -8.160 24.060 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -3.841 -7.658 23.939 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -6.983 -6.033 24.043 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -7.083 -3.820 22.704 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -2.832 -6.726 21.145 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -5.562 -2.580 20.688 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -2.212 -4.972 19.529 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -3.563 -2.929 19.305 1.00 0.00 H new ATOM 300 N GLN A 19 -5.237 -10.983 23.044 1.00 0.00 N ATOM 301 CA GLN A 19 -5.057 -12.315 23.609 1.00 0.00 C ATOM 302 C GLN A 19 -4.145 -13.161 22.726 1.00 0.00 C ATOM 303 O GLN A 19 -3.094 -13.625 23.167 1.00 0.00 O ATOM 304 CB GLN A 19 -6.411 -13.008 23.778 1.00 0.00 C ATOM 305 CG GLN A 19 -6.542 -13.777 25.082 1.00 0.00 C ATOM 306 CD GLN A 19 -5.418 -14.773 25.287 1.00 0.00 C ATOM 307 OE1 GLN A 19 -4.840 -15.282 24.327 1.00 0.00 O ATOM 308 NE2 GLN A 19 -5.101 -15.058 26.546 1.00 0.00 N ATOM 0 H GLN A 19 -6.203 -10.750 22.813 1.00 0.00 H new ATOM 0 HA GLN A 19 -4.588 -12.208 24.587 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -7.202 -12.260 23.726 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -6.566 -13.693 22.945 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -6.555 -13.074 25.915 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -7.496 -14.304 25.094 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -5.606 -14.613 27.312 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -4.353 -15.722 26.746 1.00 0.00 H new ATOM 334 N PRO A 21 -2.336 -12.531 19.371 1.00 0.00 N ATOM 335 CA PRO A 21 -1.892 -11.690 18.254 1.00 0.00 C ATOM 336 C PRO A 21 -1.738 -12.480 16.959 1.00 0.00 C ATOM 337 O PRO A 21 -1.462 -13.680 16.982 1.00 0.00 O ATOM 338 CB PRO A 21 -0.534 -11.163 18.723 1.00 0.00 C ATOM 339 CG PRO A 21 -0.601 -11.209 20.209 1.00 0.00 C ATOM 340 CD PRO A 21 -1.457 -12.397 20.548 1.00 0.00 C ATOM 0 HA PRO A 21 -2.613 -10.905 18.024 1.00 0.00 H new ATOM 0 HB2 PRO A 21 0.282 -11.779 18.345 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -0.359 -10.148 18.366 1.00 0.00 H new ATOM 0 HG2 PRO A 21 0.394 -11.309 20.642 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -1.032 -10.291 20.609 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -0.857 -13.293 20.705 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -2.030 -12.232 21.461 1.00 0.00 H new ATOM 348 N GLU A 22 -1.917 -11.801 15.833 1.00 0.00 N ATOM 349 CA GLU A 22 -1.798 -12.439 14.527 1.00 0.00 C ATOM 350 C GLU A 22 -0.390 -12.266 13.964 1.00 0.00 C ATOM 351 O GLU A 22 0.369 -13.229 13.857 1.00 0.00 O ATOM 352 CB GLU A 22 -2.823 -11.853 13.553 1.00 0.00 C ATOM 353 CG GLU A 22 -4.265 -12.100 13.968 1.00 0.00 C ATOM 354 CD GLU A 22 -5.243 -11.202 13.236 1.00 0.00 C ATOM 355 OE1 GLU A 22 -6.405 -11.619 13.046 1.00 0.00 O ATOM 356 OE2 GLU A 22 -4.847 -10.080 12.853 1.00 0.00 O ATOM 0 H GLU A 22 -2.145 -10.808 15.797 1.00 0.00 H new ATOM 0 HA GLU A 22 -1.993 -13.504 14.652 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -2.657 -10.779 13.466 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -2.659 -12.282 12.564 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -4.521 -13.142 13.777 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -4.363 -11.939 15.042 1.00 0.00 H new ATOM 364 N HIS A 23 -0.049 -11.032 13.606 1.00 0.00 N ATOM 365 CA HIS A 23 1.267 -10.733 13.056 1.00 0.00 C ATOM 366 C HIS A 23 1.597 -9.251 13.211 1.00 0.00 C ATOM 367 O HIS A 23 0.739 -8.450 13.579 1.00 0.00 O ATOM 368 CB HIS A 23 1.326 -11.128 11.579 1.00 0.00 C ATOM 369 CG HIS A 23 1.398 -12.607 11.357 1.00 0.00 C ATOM 370 ND1 HIS A 23 0.457 -13.306 10.631 1.00 0.00 N ATOM 371 CD2 HIS A 23 2.307 -13.522 11.771 1.00 0.00 C ATOM 372 CE1 HIS A 23 0.782 -14.586 10.609 1.00 0.00 C ATOM 373 NE2 HIS A 23 1.901 -14.744 11.293 1.00 0.00 N ATOM 0 H HIS A 23 -0.666 -10.224 13.687 1.00 0.00 H new ATOM 0 HA HIS A 23 2.006 -11.312 13.610 1.00 0.00 H new ATOM 0 HB2 HIS A 23 0.445 -10.735 11.071 1.00 0.00 H new ATOM 0 HB3 HIS A 23 2.195 -10.657 11.120 1.00 0.00 H new ATOM 0 HD2 HIS A 23 3.187 -13.327 12.366 1.00 0.00 H new ATOM 0 HE1 HIS A 23 0.227 -15.370 10.116 1.00 0.00 H new ATOM 0 HE2 HIS A 23 2.385 -15.629 11.442 1.00 0.00 H new ATOM 382 N TYR A 24 2.845 -8.896 12.927 1.00 0.00 N ATOM 383 CA TYR A 24 3.289 -7.510 13.036 1.00 0.00 C ATOM 384 C TYR A 24 3.672 -6.953 11.668 1.00 0.00 C ATOM 385 O TYR A 24 4.267 -7.651 10.847 1.00 0.00 O ATOM 386 CB TYR A 24 4.477 -7.407 13.992 1.00 0.00 C ATOM 387 CG TYR A 24 4.080 -7.351 15.450 1.00 0.00 C ATOM 388 CD1 TYR A 24 3.302 -6.307 15.937 1.00 0.00 C ATOM 389 CD2 TYR A 24 4.481 -8.340 16.338 1.00 0.00 C ATOM 390 CE1 TYR A 24 2.935 -6.252 17.269 1.00 0.00 C ATOM 391 CE2 TYR A 24 4.119 -8.293 17.671 1.00 0.00 C ATOM 392 CZ TYR A 24 3.347 -7.247 18.131 1.00 0.00 C ATOM 393 OH TYR A 24 2.984 -7.196 19.457 1.00 0.00 O ATOM 0 H TYR A 24 3.567 -9.548 12.620 1.00 0.00 H new ATOM 0 HA TYR A 24 2.462 -6.919 13.431 1.00 0.00 H new ATOM 0 HB2 TYR A 24 5.133 -8.263 13.836 1.00 0.00 H new ATOM 0 HB3 TYR A 24 5.053 -6.515 13.747 1.00 0.00 H new ATOM 0 HD1 TYR A 24 2.979 -5.526 15.264 1.00 0.00 H new ATOM 0 HD2 TYR A 24 5.086 -9.160 15.981 1.00 0.00 H new ATOM 0 HE1 TYR A 24 2.329 -5.435 17.632 1.00 0.00 H new ATOM 0 HE2 TYR A 24 4.439 -9.071 18.348 1.00 0.00 H new ATOM 0 HH TYR A 24 3.354 -7.972 19.928 1.00 0.00 H new ATOM 403 N ASP A 25 3.326 -5.692 11.431 1.00 0.00 N ATOM 404 CA ASP A 25 3.634 -5.041 10.163 1.00 0.00 C ATOM 405 C ASP A 25 4.047 -3.590 10.382 1.00 0.00 C ATOM 406 O ASP A 25 3.313 -2.809 10.989 1.00 0.00 O ATOM 407 CB ASP A 25 2.424 -5.103 9.228 1.00 0.00 C ATOM 408 CG ASP A 25 2.826 -5.214 7.770 1.00 0.00 C ATOM 409 OD1 ASP A 25 2.481 -6.233 7.135 1.00 0.00 O ATOM 410 OD2 ASP A 25 3.485 -4.283 7.262 1.00 0.00 O ATOM 0 H ASP A 25 2.832 -5.101 12.100 1.00 0.00 H new ATOM 0 HA ASP A 25 4.468 -5.572 9.704 1.00 0.00 H new ATOM 0 HB2 ASP A 25 1.804 -5.958 9.497 1.00 0.00 H new ATOM 0 HB3 ASP A 25 1.814 -4.210 9.367 1.00 0.00 H new ATOM 416 N LEU A 26 5.227 -3.234 9.885 1.00 0.00 N ATOM 417 CA LEU A 26 5.737 -1.875 10.027 1.00 0.00 C ATOM 418 C LEU A 26 5.564 -1.092 8.731 1.00 0.00 C ATOM 419 O LEU A 26 5.646 -1.653 7.638 1.00 0.00 O ATOM 420 CB LEU A 26 7.215 -1.903 10.425 1.00 0.00 C ATOM 421 CG LEU A 26 7.514 -2.600 11.753 1.00 0.00 C ATOM 422 CD1 LEU A 26 7.673 -4.097 11.545 1.00 0.00 C ATOM 423 CD2 LEU A 26 8.763 -2.013 12.392 1.00 0.00 C ATOM 0 H LEU A 26 5.848 -3.867 9.381 1.00 0.00 H new ATOM 0 HA LEU A 26 5.165 -1.378 10.810 1.00 0.00 H new ATOM 0 HB2 LEU A 26 7.779 -2.401 9.636 1.00 0.00 H new ATOM 0 HB3 LEU A 26 7.580 -0.878 10.480 1.00 0.00 H new ATOM 0 HG LEU A 26 6.673 -2.435 12.427 1.00 0.00 H new ATOM 0 HD11 LEU A 26 7.885 -4.577 12.501 1.00 0.00 H new ATOM 0 HD12 LEU A 26 6.752 -4.507 11.130 1.00 0.00 H new ATOM 0 HD13 LEU A 26 8.496 -4.283 10.855 1.00 0.00 H new ATOM 0 HD21 LEU A 26 8.961 -2.520 13.336 1.00 0.00 H new ATOM 0 HD22 LEU A 26 9.612 -2.148 11.722 1.00 0.00 H new ATOM 0 HD23 LEU A 26 8.612 -0.949 12.576 1.00 0.00 H new ATOM 435 N TYR A 27 5.322 0.209 8.859 1.00 0.00 N ATOM 436 CA TYR A 27 5.136 1.071 7.696 1.00 0.00 C ATOM 437 C TYR A 27 6.128 2.230 7.714 1.00 0.00 C ATOM 438 O TYR A 27 6.204 2.981 8.685 1.00 0.00 O ATOM 439 CB TYR A 27 3.703 1.608 7.659 1.00 0.00 C ATOM 440 CG TYR A 27 3.044 1.483 6.305 1.00 0.00 C ATOM 441 CD1 TYR A 27 3.556 2.148 5.197 1.00 0.00 C ATOM 442 CD2 TYR A 27 1.910 0.698 6.133 1.00 0.00 C ATOM 443 CE1 TYR A 27 2.956 2.036 3.957 1.00 0.00 C ATOM 444 CE2 TYR A 27 1.305 0.581 4.896 1.00 0.00 C ATOM 445 CZ TYR A 27 1.832 1.251 3.812 1.00 0.00 C ATOM 446 OH TYR A 27 1.232 1.137 2.579 1.00 0.00 O ATOM 0 H TYR A 27 5.250 0.690 9.756 1.00 0.00 H new ATOM 0 HA TYR A 27 5.317 0.477 6.800 1.00 0.00 H new ATOM 0 HB2 TYR A 27 3.104 1.073 8.396 1.00 0.00 H new ATOM 0 HB3 TYR A 27 3.709 2.657 7.955 1.00 0.00 H new ATOM 0 HD1 TYR A 27 4.437 2.762 5.307 1.00 0.00 H new ATOM 0 HD2 TYR A 27 1.495 0.171 6.979 1.00 0.00 H new ATOM 0 HE1 TYR A 27 3.365 2.561 3.106 1.00 0.00 H new ATOM 0 HE2 TYR A 27 0.424 -0.032 4.779 1.00 0.00 H new ATOM 0 HH TYR A 27 1.815 0.629 1.977 1.00 0.00 H new ATOM 456 N ILE A 28 6.886 2.367 6.630 1.00 0.00 N ATOM 457 CA ILE A 28 7.873 3.434 6.520 1.00 0.00 C ATOM 458 C ILE A 28 7.968 3.950 5.087 1.00 0.00 C ATOM 459 O ILE A 28 7.746 3.203 4.133 1.00 0.00 O ATOM 460 CB ILE A 28 9.267 2.961 6.975 1.00 0.00 C ATOM 461 CG1 ILE A 28 9.712 1.750 6.152 1.00 0.00 C ATOM 462 CG2 ILE A 28 9.254 2.623 8.458 1.00 0.00 C ATOM 463 CD1 ILE A 28 11.187 1.758 5.816 1.00 0.00 C ATOM 0 H ILE A 28 6.835 1.753 5.817 1.00 0.00 H new ATOM 0 HA ILE A 28 7.540 4.240 7.174 1.00 0.00 H new ATOM 0 HB ILE A 28 9.980 3.770 6.813 1.00 0.00 H new ATOM 0 HG12 ILE A 28 9.478 0.840 6.704 1.00 0.00 H new ATOM 0 HG13 ILE A 28 9.137 1.718 5.227 1.00 0.00 H new ATOM 0 HG21 ILE A 28 10.246 2.290 8.764 1.00 0.00 H new ATOM 0 HG22 ILE A 28 8.975 3.508 9.030 1.00 0.00 H new ATOM 0 HG23 ILE A 28 8.532 1.828 8.644 1.00 0.00 H new ATOM 0 HD11 ILE A 28 11.432 0.871 5.232 1.00 0.00 H new ATOM 0 HD12 ILE A 28 11.423 2.651 5.237 1.00 0.00 H new ATOM 0 HD13 ILE A 28 11.770 1.758 6.737 1.00 0.00 H new ATOM 475 N PRO A 29 8.300 5.242 4.914 1.00 0.00 N ATOM 476 CA PRO A 29 8.423 5.855 3.588 1.00 0.00 C ATOM 477 C PRO A 29 9.646 5.353 2.829 1.00 0.00 C ATOM 478 O PRO A 29 10.429 4.557 3.349 1.00 0.00 O ATOM 479 CB PRO A 29 8.559 7.346 3.897 1.00 0.00 C ATOM 480 CG PRO A 29 9.137 7.396 5.269 1.00 0.00 C ATOM 481 CD PRO A 29 8.581 6.203 5.997 1.00 0.00 C ATOM 0 HA PRO A 29 7.574 5.615 2.948 1.00 0.00 H new ATOM 0 HB2 PRO A 29 9.208 7.842 3.175 1.00 0.00 H new ATOM 0 HB3 PRO A 29 7.593 7.849 3.856 1.00 0.00 H new ATOM 0 HG2 PRO A 29 10.226 7.360 5.235 1.00 0.00 H new ATOM 0 HG3 PRO A 29 8.864 8.323 5.774 1.00 0.00 H new ATOM 0 HD2 PRO A 29 9.296 5.801 6.715 1.00 0.00 H new ATOM 0 HD3 PRO A 29 7.679 6.456 6.553 1.00 0.00 H new ATOM 489 N ALA A 30 9.806 5.823 1.596 1.00 0.00 N ATOM 490 CA ALA A 30 10.935 5.423 0.765 1.00 0.00 C ATOM 491 C ALA A 30 11.789 6.627 0.383 1.00 0.00 C ATOM 492 O ALA A 30 13.018 6.557 0.393 1.00 0.00 O ATOM 493 CB ALA A 30 10.442 4.706 -0.483 1.00 0.00 C ATOM 0 H ALA A 30 9.167 6.482 1.150 1.00 0.00 H new ATOM 0 HA ALA A 30 11.556 4.739 1.343 1.00 0.00 H new ATOM 0 HB1 ALA A 30 11.295 4.413 -1.095 1.00 0.00 H new ATOM 0 HB2 ALA A 30 9.880 3.818 -0.194 1.00 0.00 H new ATOM 0 HB3 ALA A 30 9.797 5.373 -1.055 1.00 0.00 H new ATOM 872 N TRP A 52 9.348 12.912 14.873 1.00 0.00 N ATOM 873 CA TRP A 52 9.237 11.467 15.029 1.00 0.00 C ATOM 874 C TRP A 52 8.027 10.928 14.274 1.00 0.00 C ATOM 875 O TRP A 52 6.899 11.374 14.488 1.00 0.00 O ATOM 876 CB TRP A 52 9.135 11.099 16.510 1.00 0.00 C ATOM 877 CG TRP A 52 10.366 11.439 17.292 1.00 0.00 C ATOM 878 CD1 TRP A 52 10.538 12.503 18.131 1.00 0.00 C ATOM 879 CD2 TRP A 52 11.600 10.712 17.308 1.00 0.00 C ATOM 880 NE1 TRP A 52 11.803 12.481 18.667 1.00 0.00 N ATOM 881 CE2 TRP A 52 12.474 11.392 18.178 1.00 0.00 C ATOM 882 CE3 TRP A 52 12.052 9.551 16.672 1.00 0.00 C ATOM 883 CZ2 TRP A 52 13.771 10.949 18.426 1.00 0.00 C ATOM 884 CZ3 TRP A 52 13.339 9.114 16.920 1.00 0.00 C ATOM 885 CH2 TRP A 52 14.185 9.811 17.790 1.00 0.00 C ATOM 0 HA TRP A 52 10.135 11.012 14.610 1.00 0.00 H new ATOM 0 HB2 TRP A 52 8.281 11.616 16.948 1.00 0.00 H new ATOM 0 HB3 TRP A 52 8.940 10.030 16.599 1.00 0.00 H new ATOM 0 HD1 TRP A 52 9.789 13.252 18.342 1.00 0.00 H new ATOM 0 HE1 TRP A 52 12.181 13.165 19.323 1.00 0.00 H new ATOM 0 HE3 TRP A 52 11.407 9.006 15.999 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 14.426 11.485 19.097 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 13.698 8.219 16.434 1.00 0.00 H new ATOM 0 HH2 TRP A 52 15.185 9.443 17.963 1.00 0.00 H new ATOM 896 N GLY A 53 8.268 9.966 13.390 1.00 0.00 N ATOM 897 CA GLY A 53 7.188 9.380 12.616 1.00 0.00 C ATOM 898 C GLY A 53 7.332 7.879 12.464 1.00 0.00 C ATOM 899 O GLY A 53 8.347 7.303 12.855 1.00 0.00 O ATOM 0 H GLY A 53 9.192 9.581 13.195 1.00 0.00 H new ATOM 0 HA2 GLY A 53 6.237 9.604 13.098 1.00 0.00 H new ATOM 0 HA3 GLY A 53 7.161 9.841 11.629 1.00 0.00 H new ATOM 903 N GLY A 54 6.314 7.243 11.895 1.00 0.00 N ATOM 904 CA GLY A 54 6.352 5.804 11.703 1.00 0.00 C ATOM 905 C GLY A 54 4.971 5.204 11.539 1.00 0.00 C ATOM 906 O GLY A 54 3.964 5.858 11.815 1.00 0.00 O ATOM 0 H GLY A 54 5.463 7.697 11.563 1.00 0.00 H new ATOM 0 HA2 GLY A 54 6.951 5.574 10.822 1.00 0.00 H new ATOM 0 HA3 GLY A 54 6.847 5.340 12.556 1.00 0.00 H new ATOM 910 N GLY A 55 4.920 3.955 11.089 1.00 0.00 N ATOM 911 CA GLY A 55 3.646 3.286 10.896 1.00 0.00 C ATOM 912 C GLY A 55 3.634 1.886 11.478 1.00 0.00 C ATOM 913 O GLY A 55 4.628 1.164 11.400 1.00 0.00 O ATOM 0 H GLY A 55 5.738 3.393 10.854 1.00 0.00 H new ATOM 0 HA2 GLY A 55 2.855 3.876 11.359 1.00 0.00 H new ATOM 0 HA3 GLY A 55 3.423 3.235 9.830 1.00 0.00 H new ATOM 917 N PHE A 56 2.504 1.501 12.063 1.00 0.00 N ATOM 918 CA PHE A 56 2.365 0.179 12.661 1.00 0.00 C ATOM 919 C PHE A 56 0.929 -0.322 12.544 1.00 0.00 C ATOM 920 O PHE A 56 -0.011 0.469 12.467 1.00 0.00 O ATOM 921 CB PHE A 56 2.787 0.214 14.132 1.00 0.00 C ATOM 922 CG PHE A 56 4.230 -0.141 14.349 1.00 0.00 C ATOM 923 CD1 PHE A 56 4.614 -1.461 14.524 1.00 0.00 C ATOM 924 CD2 PHE A 56 5.203 0.845 14.380 1.00 0.00 C ATOM 925 CE1 PHE A 56 5.941 -1.791 14.724 1.00 0.00 C ATOM 926 CE2 PHE A 56 6.532 0.522 14.580 1.00 0.00 C ATOM 927 CZ PHE A 56 6.901 -0.798 14.753 1.00 0.00 C ATOM 0 H PHE A 56 1.672 2.086 12.135 1.00 0.00 H new ATOM 0 HA PHE A 56 3.016 -0.508 12.120 1.00 0.00 H new ATOM 0 HB2 PHE A 56 2.602 1.211 14.531 1.00 0.00 H new ATOM 0 HB3 PHE A 56 2.162 -0.477 14.698 1.00 0.00 H new ATOM 0 HD1 PHE A 56 3.867 -2.241 14.504 1.00 0.00 H new ATOM 0 HD2 PHE A 56 4.920 1.879 14.246 1.00 0.00 H new ATOM 0 HE1 PHE A 56 6.227 -2.824 14.857 1.00 0.00 H new ATOM 0 HE2 PHE A 56 7.281 1.300 14.601 1.00 0.00 H new ATOM 0 HZ PHE A 56 7.938 -1.053 14.911 1.00 0.00 H new ATOM 937 N GLY A 57 0.767 -1.641 12.533 1.00 0.00 N ATOM 938 CA GLY A 57 -0.558 -2.223 12.425 1.00 0.00 C ATOM 939 C GLY A 57 -0.518 -3.730 12.257 1.00 0.00 C ATOM 940 O GLY A 57 0.519 -4.357 12.468 1.00 0.00 O ATOM 0 H GLY A 57 1.529 -2.317 12.597 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -1.134 -1.975 13.317 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -1.078 -1.780 11.576 1.00 0.00 H new ATOM 944 N LEU A 58 -1.652 -4.310 11.876 1.00 0.00 N ATOM 945 CA LEU A 58 -1.743 -5.753 11.680 1.00 0.00 C ATOM 946 C LEU A 58 -2.484 -6.081 10.389 1.00 0.00 C ATOM 947 O LEU A 58 -2.973 -5.188 9.697 1.00 0.00 O ATOM 948 CB LEU A 58 -2.451 -6.405 12.869 1.00 0.00 C ATOM 949 CG LEU A 58 -1.633 -6.460 14.160 1.00 0.00 C ATOM 950 CD1 LEU A 58 -1.662 -5.113 14.868 1.00 0.00 C ATOM 951 CD2 LEU A 58 -2.156 -7.556 15.076 1.00 0.00 C ATOM 0 H LEU A 58 -2.519 -3.804 11.697 1.00 0.00 H new ATOM 0 HA LEU A 58 -0.731 -6.150 11.606 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -3.375 -5.860 13.065 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -2.733 -7.421 12.592 1.00 0.00 H new ATOM 0 HG LEU A 58 -0.599 -6.691 13.903 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -1.075 -5.171 15.784 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -1.240 -4.349 14.215 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -2.692 -4.853 15.113 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -1.562 -7.581 15.990 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -3.198 -7.355 15.326 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -2.083 -8.519 14.570 1.00 0.00 H new ATOM 963 N SER A 59 -2.565 -7.369 10.070 1.00 0.00 N ATOM 964 CA SER A 59 -3.247 -7.816 8.862 1.00 0.00 C ATOM 965 C SER A 59 -4.114 -9.039 9.148 1.00 0.00 C ATOM 966 O SER A 59 -3.738 -9.909 9.934 1.00 0.00 O ATOM 967 CB SER A 59 -2.229 -8.144 7.768 1.00 0.00 C ATOM 968 OG SER A 59 -1.005 -7.466 7.990 1.00 0.00 O ATOM 0 H SER A 59 -2.166 -8.121 10.632 1.00 0.00 H new ATOM 0 HA SER A 59 -3.892 -7.007 8.518 1.00 0.00 H new ATOM 0 HB2 SER A 59 -2.053 -9.219 7.741 1.00 0.00 H new ATOM 0 HB3 SER A 59 -2.633 -7.863 6.795 1.00 0.00 H new ATOM 0 HG SER A 59 -0.371 -7.694 7.278 1.00 0.00 H new ATOM 974 N ARG A 60 -5.277 -9.096 8.507 1.00 0.00 N ATOM 975 CA ARG A 60 -6.197 -10.212 8.692 1.00 0.00 C ATOM 976 C ARG A 60 -6.209 -11.118 7.465 1.00 0.00 C ATOM 977 O ARG A 60 -6.134 -10.644 6.331 1.00 0.00 O ATOM 978 CB ARG A 60 -7.609 -9.694 8.973 1.00 0.00 C ATOM 979 CG ARG A 60 -8.513 -10.722 9.634 1.00 0.00 C ATOM 980 CD ARG A 60 -9.709 -10.064 10.302 1.00 0.00 C ATOM 981 NE ARG A 60 -9.312 -9.205 11.415 1.00 0.00 N ATOM 982 CZ ARG A 60 -10.169 -8.672 12.282 1.00 0.00 C ATOM 983 NH1 ARG A 60 -11.471 -8.905 12.169 1.00 0.00 N ATOM 984 NH2 ARG A 60 -9.724 -7.902 13.266 1.00 0.00 N ATOM 0 H ARG A 60 -5.604 -8.383 7.855 1.00 0.00 H new ATOM 0 HA ARG A 60 -5.854 -10.795 9.547 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -7.544 -8.814 9.613 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -8.063 -9.373 8.035 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -8.859 -11.437 8.888 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -7.945 -11.285 10.375 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -10.256 -9.474 9.566 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -10.391 -10.834 10.664 1.00 0.00 H new ATOM 0 HE ARG A 60 -8.320 -9.002 11.534 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -11.820 -9.496 11.414 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -12.123 -8.493 12.837 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -8.725 -7.718 13.358 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -10.381 -7.493 13.931 1.00 0.00 H new ATOM 998 N TRP A 61 -6.304 -12.423 7.699 1.00 0.00 N ATOM 999 CA TRP A 61 -6.326 -13.394 6.611 1.00 0.00 C ATOM 1000 C TRP A 61 -7.716 -14.001 6.450 1.00 0.00 C ATOM 1001 O TRP A 61 -8.366 -14.358 7.433 1.00 0.00 O ATOM 1002 CB TRP A 61 -5.301 -14.500 6.867 1.00 0.00 C ATOM 1003 CG TRP A 61 -5.578 -15.296 8.106 1.00 0.00 C ATOM 1004 CD1 TRP A 61 -5.375 -14.898 9.397 1.00 0.00 C ATOM 1005 CD2 TRP A 61 -6.107 -16.625 8.173 1.00 0.00 C ATOM 1006 NE1 TRP A 61 -5.747 -15.899 10.262 1.00 0.00 N ATOM 1007 CE2 TRP A 61 -6.200 -16.969 9.535 1.00 0.00 C ATOM 1008 CE3 TRP A 61 -6.513 -17.556 7.213 1.00 0.00 C ATOM 1009 CZ2 TRP A 61 -6.681 -18.205 9.959 1.00 0.00 C ATOM 1010 CZ3 TRP A 61 -6.991 -18.783 7.635 1.00 0.00 C ATOM 1011 CH2 TRP A 61 -7.071 -19.098 8.998 1.00 0.00 C ATOM 0 H TRP A 61 -6.367 -12.832 8.631 1.00 0.00 H new ATOM 0 HA TRP A 61 -6.068 -12.874 5.688 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -5.282 -15.172 6.009 1.00 0.00 H new ATOM 0 HB3 TRP A 61 -4.309 -14.055 6.945 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -4.980 -13.938 9.694 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -5.695 -15.853 11.280 1.00 0.00 H new ATOM 0 HE3 TRP A 61 -6.454 -17.321 6.160 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 -6.744 -18.450 11.009 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 -7.308 -19.510 6.902 1.00 0.00 H new ATOM 0 HH2 TRP A 61 -7.448 -20.065 9.296 1.00 0.00 H new ATOM 1022 N ASP A 62 -8.167 -14.113 5.205 1.00 0.00 N ATOM 1023 CA ASP A 62 -9.481 -14.676 4.915 1.00 0.00 C ATOM 1024 C ASP A 62 -9.354 -16.036 4.239 1.00 0.00 C ATOM 1025 O ASP A 62 -8.607 -16.194 3.272 1.00 0.00 O ATOM 1026 CB ASP A 62 -10.280 -13.723 4.024 1.00 0.00 C ATOM 1027 CG ASP A 62 -11.757 -13.713 4.369 1.00 0.00 C ATOM 1028 OD1 ASP A 62 -12.580 -13.540 3.446 1.00 0.00 O ATOM 1029 OD2 ASP A 62 -12.090 -13.877 5.562 1.00 0.00 O ATOM 0 H ASP A 62 -7.642 -13.821 4.381 1.00 0.00 H new ATOM 0 HA ASP A 62 -10.008 -14.809 5.860 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -9.879 -12.714 4.124 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -10.155 -14.014 2.981 1.00 0.00 H new ATOM 1035 N GLU A 63 -10.088 -17.017 4.755 1.00 0.00 N ATOM 1036 CA GLU A 63 -10.060 -18.369 4.207 1.00 0.00 C ATOM 1037 C GLU A 63 -10.604 -18.406 2.779 1.00 0.00 C ATOM 1038 O GLU A 63 -10.413 -19.387 2.062 1.00 0.00 O ATOM 1039 CB GLU A 63 -10.871 -19.315 5.094 1.00 0.00 C ATOM 1040 CG GLU A 63 -10.268 -20.705 5.212 1.00 0.00 C ATOM 1041 CD GLU A 63 -11.310 -21.802 5.116 1.00 0.00 C ATOM 1042 OE1 GLU A 63 -10.932 -22.956 4.821 1.00 0.00 O ATOM 1043 OE2 GLU A 63 -12.504 -21.509 5.335 1.00 0.00 O ATOM 0 H GLU A 63 -10.711 -16.900 5.554 1.00 0.00 H new ATOM 0 HA GLU A 63 -9.020 -18.695 4.183 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -10.959 -18.880 6.090 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -11.881 -19.399 4.693 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -9.526 -20.843 4.425 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -9.743 -20.790 6.163 1.00 0.00 H new ATOM 1051 N LYS A 64 -11.282 -17.336 2.369 1.00 0.00 N ATOM 1052 CA LYS A 64 -11.848 -17.262 1.027 1.00 0.00 C ATOM 1053 C LYS A 64 -10.883 -16.587 0.054 1.00 0.00 C ATOM 1054 O LYS A 64 -11.302 -16.010 -0.949 1.00 0.00 O ATOM 1055 CB LYS A 64 -13.176 -16.503 1.052 1.00 0.00 C ATOM 1056 CG LYS A 64 -14.003 -16.680 -0.212 1.00 0.00 C ATOM 1057 CD LYS A 64 -15.079 -17.738 -0.030 1.00 0.00 C ATOM 1058 CE LYS A 64 -16.380 -17.331 -0.706 1.00 0.00 C ATOM 1059 NZ LYS A 64 -17.301 -16.636 0.235 1.00 0.00 N ATOM 0 H LYS A 64 -11.452 -16.512 2.946 1.00 0.00 H new ATOM 0 HA LYS A 64 -12.022 -18.281 0.683 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -13.761 -16.839 1.908 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -12.976 -15.442 1.199 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -14.466 -15.731 -0.481 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -13.351 -16.962 -1.039 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -14.733 -18.685 -0.444 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -15.255 -17.900 1.033 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -16.161 -16.676 -1.550 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -16.872 -18.216 -1.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -18.175 -16.375 -0.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -17.530 -17.269 1.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -16.841 -15.777 0.600 1.00 0.00 H new ATOM 1073 N GLY A 65 -9.589 -16.664 0.354 1.00 0.00 N ATOM 1074 CA GLY A 65 -8.592 -16.058 -0.509 1.00 0.00 C ATOM 1075 C GLY A 65 -8.599 -14.544 -0.436 1.00 0.00 C ATOM 1076 O GLY A 65 -8.599 -13.867 -1.465 1.00 0.00 O ATOM 0 H GLY A 65 -9.215 -17.134 1.178 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -7.605 -16.427 -0.231 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -8.771 -16.369 -1.538 1.00 0.00 H new ATOM 1080 N ASN A 66 -8.603 -14.010 0.780 1.00 0.00 N ATOM 1081 CA ASN A 66 -8.608 -12.564 0.978 1.00 0.00 C ATOM 1082 C ASN A 66 -7.553 -12.151 2.000 1.00 0.00 C ATOM 1083 O ASN A 66 -7.173 -12.939 2.868 1.00 0.00 O ATOM 1084 CB ASN A 66 -9.993 -12.094 1.432 1.00 0.00 C ATOM 1085 CG ASN A 66 -10.547 -10.994 0.548 1.00 0.00 C ATOM 1086 OD1 ASN A 66 -10.733 -11.182 -0.655 1.00 0.00 O ATOM 1087 ND2 ASN A 66 -10.814 -9.836 1.141 1.00 0.00 N ATOM 0 H ASN A 66 -8.603 -14.555 1.642 1.00 0.00 H new ATOM 0 HA ASN A 66 -8.368 -12.090 0.026 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -10.680 -12.940 1.429 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -9.934 -11.736 2.460 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -11.188 -9.059 0.597 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -10.645 -9.724 2.141 1.00 0.00 H new ATOM 1094 N TRP A 67 -7.084 -10.913 1.892 1.00 0.00 N ATOM 1095 CA TRP A 67 -6.072 -10.396 2.806 1.00 0.00 C ATOM 1096 C TRP A 67 -6.371 -8.950 3.188 1.00 0.00 C ATOM 1097 O TRP A 67 -6.133 -8.030 2.406 1.00 0.00 O ATOM 1098 CB TRP A 67 -4.683 -10.494 2.170 1.00 0.00 C ATOM 1099 CG TRP A 67 -3.859 -11.622 2.712 1.00 0.00 C ATOM 1100 CD1 TRP A 67 -2.923 -11.550 3.703 1.00 0.00 C ATOM 1101 CD2 TRP A 67 -3.897 -12.991 2.293 1.00 0.00 C ATOM 1102 NE1 TRP A 67 -2.377 -12.790 3.927 1.00 0.00 N ATOM 1103 CE2 TRP A 67 -2.958 -13.692 3.074 1.00 0.00 C ATOM 1104 CE3 TRP A 67 -4.634 -13.692 1.335 1.00 0.00 C ATOM 1105 CZ2 TRP A 67 -2.737 -15.059 2.924 1.00 0.00 C ATOM 1106 CZ3 TRP A 67 -4.414 -15.050 1.188 1.00 0.00 C ATOM 1107 CH2 TRP A 67 -3.473 -15.720 1.979 1.00 0.00 C ATOM 0 H TRP A 67 -7.388 -10.249 1.180 1.00 0.00 H new ATOM 0 HA TRP A 67 -6.092 -11.002 3.712 1.00 0.00 H new ATOM 0 HB2 TRP A 67 -4.793 -10.619 1.093 1.00 0.00 H new ATOM 0 HB3 TRP A 67 -4.151 -9.556 2.330 1.00 0.00 H new ATOM 0 HD1 TRP A 67 -2.651 -10.649 4.233 1.00 0.00 H new ATOM 0 HE1 TRP A 67 -1.656 -13.005 4.616 1.00 0.00 H new ATOM 0 HE3 TRP A 67 -5.362 -13.183 0.721 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -2.011 -15.578 3.532 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 -4.978 -15.602 0.451 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -3.325 -16.781 1.840 1.00 0.00 H new ATOM 1118 N HIS A 68 -6.894 -8.758 4.395 1.00 0.00 N ATOM 1119 CA HIS A 68 -7.226 -7.424 4.880 1.00 0.00 C ATOM 1120 C HIS A 68 -5.985 -6.719 5.418 1.00 0.00 C ATOM 1121 O HIS A 68 -5.283 -7.249 6.280 1.00 0.00 O ATOM 1122 CB HIS A 68 -8.294 -7.505 5.972 1.00 0.00 C ATOM 1123 CG HIS A 68 -9.262 -6.364 5.948 1.00 0.00 C ATOM 1124 ND1 HIS A 68 -8.910 -5.086 5.563 1.00 0.00 N ATOM 1125 CD2 HIS A 68 -10.577 -6.310 6.266 1.00 0.00 C ATOM 1126 CE1 HIS A 68 -9.967 -4.297 5.646 1.00 0.00 C ATOM 1127 NE2 HIS A 68 -10.991 -5.015 6.068 1.00 0.00 N ATOM 0 H HIS A 68 -7.097 -9.509 5.054 1.00 0.00 H new ATOM 0 HA HIS A 68 -7.618 -6.847 4.042 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -8.844 -8.440 5.862 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -7.805 -7.535 6.946 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -11.187 -7.132 6.611 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -9.989 -3.244 5.409 1.00 0.00 H new ATOM 0 HE2 HIS A 68 -11.937 -4.665 6.222 1.00 0.00 H new ATOM 1136 N GLY A 69 -5.719 -5.523 4.905 1.00 0.00 N ATOM 1137 CA GLY A 69 -4.562 -4.765 5.345 1.00 0.00 C ATOM 1138 C GLY A 69 -4.943 -3.515 6.112 1.00 0.00 C ATOM 1139 O GLY A 69 -5.465 -2.560 5.536 1.00 0.00 O ATOM 0 H GLY A 69 -6.285 -5.064 4.191 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -3.936 -5.397 5.975 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -3.963 -4.487 4.478 1.00 0.00 H new ATOM 1143 N LEU A 70 -4.682 -3.518 7.415 1.00 0.00 N ATOM 1144 CA LEU A 70 -4.999 -2.375 8.264 1.00 0.00 C ATOM 1145 C LEU A 70 -3.755 -1.875 8.988 1.00 0.00 C ATOM 1146 O LEU A 70 -3.024 -2.655 9.599 1.00 0.00 O ATOM 1147 CB LEU A 70 -6.078 -2.752 9.281 1.00 0.00 C ATOM 1148 CG LEU A 70 -7.515 -2.674 8.760 1.00 0.00 C ATOM 1149 CD1 LEU A 70 -7.930 -3.998 8.138 1.00 0.00 C ATOM 1150 CD2 LEU A 70 -8.467 -2.289 9.882 1.00 0.00 C ATOM 0 H LEU A 70 -4.251 -4.301 7.907 1.00 0.00 H new ATOM 0 HA LEU A 70 -5.374 -1.574 7.627 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -5.889 -3.767 9.629 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -5.985 -2.096 10.146 1.00 0.00 H new ATOM 0 HG LEU A 70 -7.561 -1.904 7.990 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -8.954 -3.923 7.773 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -7.265 -4.234 7.307 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -7.868 -4.787 8.887 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -9.484 -2.238 9.494 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -8.417 -3.036 10.674 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -8.182 -1.316 10.283 1.00 0.00 H new ATOM 1162 N TYR A 71 -3.518 -0.569 8.915 1.00 0.00 N ATOM 1163 CA TYR A 71 -2.358 0.034 9.564 1.00 0.00 C ATOM 1164 C TYR A 71 -2.659 1.463 10.002 1.00 0.00 C ATOM 1165 O TYR A 71 -3.551 2.115 9.459 1.00 0.00 O ATOM 1166 CB TYR A 71 -1.155 0.020 8.620 1.00 0.00 C ATOM 1167 CG TYR A 71 -0.960 -1.297 7.903 1.00 0.00 C ATOM 1168 CD1 TYR A 71 -0.486 -2.414 8.578 1.00 0.00 C ATOM 1169 CD2 TYR A 71 -1.251 -1.423 6.550 1.00 0.00 C ATOM 1170 CE1 TYR A 71 -0.307 -3.620 7.926 1.00 0.00 C ATOM 1171 CE2 TYR A 71 -1.075 -2.624 5.890 1.00 0.00 C ATOM 1172 CZ TYR A 71 -0.603 -3.720 6.583 1.00 0.00 C ATOM 1173 OH TYR A 71 -0.425 -4.918 5.930 1.00 0.00 O ATOM 0 H TYR A 71 -4.112 0.091 8.414 1.00 0.00 H new ATOM 0 HA TYR A 71 -2.123 -0.555 10.450 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -1.275 0.812 7.881 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -0.255 0.250 9.190 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -0.253 -2.340 9.630 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -1.621 -0.567 6.005 1.00 0.00 H new ATOM 0 HE1 TYR A 71 0.063 -4.479 8.466 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -1.305 -2.705 4.838 1.00 0.00 H new ATOM 0 HH TYR A 71 -0.583 -5.657 6.554 1.00 0.00 H new ATOM 1183 N ALA A 72 -1.908 1.943 10.987 1.00 0.00 N ATOM 1184 CA ALA A 72 -2.091 3.295 11.500 1.00 0.00 C ATOM 1185 C ALA A 72 -0.748 3.953 11.798 1.00 0.00 C ATOM 1186 O ALA A 72 -0.022 3.526 12.696 1.00 0.00 O ATOM 1187 CB ALA A 72 -2.959 3.274 12.748 1.00 0.00 C ATOM 0 H ALA A 72 -1.166 1.415 11.446 1.00 0.00 H new ATOM 0 HA ALA A 72 -2.594 3.884 10.733 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -3.087 4.291 13.120 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -3.934 2.851 12.506 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -2.479 2.665 13.515 1.00 0.00 H new ATOM 1193 N MET A 73 -0.423 4.994 11.038 1.00 0.00 N ATOM 1194 CA MET A 73 0.835 5.711 11.221 1.00 0.00 C ATOM 1195 C MET A 73 0.588 7.115 11.761 1.00 0.00 C ATOM 1196 O MET A 73 -0.479 7.692 11.553 1.00 0.00 O ATOM 1197 CB MET A 73 1.599 5.787 9.898 1.00 0.00 C ATOM 1198 CG MET A 73 0.866 6.563 8.816 1.00 0.00 C ATOM 1199 SD MET A 73 1.143 5.888 7.168 1.00 0.00 S ATOM 1200 CE MET A 73 0.023 6.896 6.198 1.00 0.00 C ATOM 0 H MET A 73 -1.012 5.360 10.290 1.00 0.00 H new ATOM 0 HA MET A 73 1.434 5.163 11.948 1.00 0.00 H new ATOM 0 HB2 MET A 73 2.568 6.253 10.074 1.00 0.00 H new ATOM 0 HB3 MET A 73 1.792 4.775 9.541 1.00 0.00 H new ATOM 0 HG2 MET A 73 -0.202 6.558 9.031 1.00 0.00 H new ATOM 0 HG3 MET A 73 1.191 7.603 8.837 1.00 0.00 H new ATOM 0 HE1 MET A 73 0.253 6.779 5.139 1.00 0.00 H new ATOM 0 HE2 MET A 73 -1.004 6.581 6.384 1.00 0.00 H new ATOM 0 HE3 MET A 73 0.138 7.942 6.480 1.00 0.00 H new ATOM 1210 N ALA A 74 1.582 7.659 12.454 1.00 0.00 N ATOM 1211 CA ALA A 74 1.475 8.996 13.024 1.00 0.00 C ATOM 1212 C ALA A 74 2.712 9.830 12.704 1.00 0.00 C ATOM 1213 O ALA A 74 3.802 9.292 12.517 1.00 0.00 O ATOM 1214 CB ALA A 74 1.266 8.914 14.528 1.00 0.00 C ATOM 0 H ALA A 74 2.472 7.194 12.635 1.00 0.00 H new ATOM 0 HA ALA A 74 0.612 9.487 12.575 1.00 0.00 H new ATOM 0 HB1 ALA A 74 1.188 9.920 14.940 1.00 0.00 H new ATOM 0 HB2 ALA A 74 0.349 8.364 14.738 1.00 0.00 H new ATOM 0 HB3 ALA A 74 2.111 8.399 14.985 1.00 0.00 H new ATOM 1220 N PHE A 75 2.533 11.146 12.645 1.00 0.00 N ATOM 1221 CA PHE A 75 3.635 12.054 12.348 1.00 0.00 C ATOM 1222 C PHE A 75 3.582 13.287 13.244 1.00 0.00 C ATOM 1223 O PHE A 75 2.520 13.657 13.744 1.00 0.00 O ATOM 1224 CB PHE A 75 3.595 12.474 10.878 1.00 0.00 C ATOM 1225 CG PHE A 75 4.043 11.397 9.932 1.00 0.00 C ATOM 1226 CD1 PHE A 75 3.172 10.391 9.545 1.00 0.00 C ATOM 1227 CD2 PHE A 75 5.335 11.391 9.431 1.00 0.00 C ATOM 1228 CE1 PHE A 75 3.582 9.398 8.675 1.00 0.00 C ATOM 1229 CE2 PHE A 75 5.750 10.400 8.561 1.00 0.00 C ATOM 1230 CZ PHE A 75 4.872 9.403 8.182 1.00 0.00 C ATOM 0 H PHE A 75 1.636 11.607 12.799 1.00 0.00 H new ATOM 0 HA PHE A 75 4.569 11.527 12.543 1.00 0.00 H new ATOM 0 HB2 PHE A 75 2.578 12.771 10.621 1.00 0.00 H new ATOM 0 HB3 PHE A 75 4.227 13.351 10.742 1.00 0.00 H new ATOM 0 HD1 PHE A 75 2.162 10.383 9.927 1.00 0.00 H new ATOM 0 HD2 PHE A 75 6.025 12.169 9.723 1.00 0.00 H new ATOM 0 HE1 PHE A 75 2.894 8.619 8.381 1.00 0.00 H new ATOM 0 HE2 PHE A 75 6.760 10.405 8.178 1.00 0.00 H new ATOM 0 HZ PHE A 75 5.194 8.629 7.501 1.00 0.00 H new ATOM 1240 N LYS A 76 4.733 13.920 13.440 1.00 0.00 N ATOM 1241 CA LYS A 76 4.817 15.113 14.275 1.00 0.00 C ATOM 1242 C LYS A 76 4.423 16.357 13.484 1.00 0.00 C ATOM 1243 O LYS A 76 5.241 16.931 12.764 1.00 0.00 O ATOM 1244 CB LYS A 76 6.232 15.270 14.834 1.00 0.00 C ATOM 1245 CG LYS A 76 6.355 14.879 16.297 1.00 0.00 C ATOM 1246 CD LYS A 76 6.264 16.091 17.209 1.00 0.00 C ATOM 1247 CE LYS A 76 6.486 15.712 18.665 1.00 0.00 C ATOM 1248 NZ LYS A 76 7.221 16.773 19.409 1.00 0.00 N ATOM 0 H LYS A 76 5.621 13.627 13.032 1.00 0.00 H new ATOM 0 HA LYS A 76 4.120 14.999 15.105 1.00 0.00 H new ATOM 0 HB2 LYS A 76 6.916 14.660 14.245 1.00 0.00 H new ATOM 0 HB3 LYS A 76 6.547 16.307 14.716 1.00 0.00 H new ATOM 0 HG2 LYS A 76 5.567 14.171 16.552 1.00 0.00 H new ATOM 0 HG3 LYS A 76 7.305 14.371 16.460 1.00 0.00 H new ATOM 0 HD2 LYS A 76 7.006 16.831 16.908 1.00 0.00 H new ATOM 0 HD3 LYS A 76 5.285 16.558 17.099 1.00 0.00 H new ATOM 0 HE2 LYS A 76 5.524 15.533 19.144 1.00 0.00 H new ATOM 0 HE3 LYS A 76 7.046 14.778 18.716 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 7.352 16.477 20.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 8.150 16.927 18.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 6.675 17.657 19.383 1.00 0.00 H new ATOM 1262 N ASP A 77 3.168 16.768 13.624 1.00 0.00 N ATOM 1263 CA ASP A 77 2.666 17.944 12.922 1.00 0.00 C ATOM 1264 C ASP A 77 3.290 19.219 13.481 1.00 0.00 C ATOM 1265 O ASP A 77 4.194 19.166 14.314 1.00 0.00 O ATOM 1266 CB ASP A 77 1.141 18.017 13.033 1.00 0.00 C ATOM 1267 CG ASP A 77 0.491 18.505 11.754 1.00 0.00 C ATOM 1268 OD1 ASP A 77 0.572 17.786 10.735 1.00 0.00 O ATOM 1269 OD2 ASP A 77 -0.097 19.607 11.770 1.00 0.00 O ATOM 0 H ASP A 77 2.479 16.305 14.217 1.00 0.00 H new ATOM 0 HA ASP A 77 2.943 17.856 11.872 1.00 0.00 H new ATOM 0 HB2 ASP A 77 0.750 17.031 13.283 1.00 0.00 H new ATOM 0 HB3 ASP A 77 0.871 18.684 13.852 1.00 0.00 H new ATOM 1275 N SER A 78 2.801 20.363 13.015 1.00 0.00 N ATOM 1276 CA SER A 78 3.310 21.654 13.468 1.00 0.00 C ATOM 1277 C SER A 78 2.685 22.064 14.801 1.00 0.00 C ATOM 1278 O SER A 78 3.036 23.100 15.364 1.00 0.00 O ATOM 1279 CB SER A 78 3.036 22.728 12.414 1.00 0.00 C ATOM 1280 OG SER A 78 3.800 22.500 11.242 1.00 0.00 O ATOM 0 H SER A 78 2.053 20.424 12.324 1.00 0.00 H new ATOM 0 HA SER A 78 4.386 21.555 13.614 1.00 0.00 H new ATOM 0 HB2 SER A 78 1.975 22.735 12.165 1.00 0.00 H new ATOM 0 HB3 SER A 78 3.274 23.711 12.821 1.00 0.00 H new ATOM 0 HG SER A 78 3.605 23.199 10.583 1.00 0.00 H new ATOM 1286 N TRP A 79 1.759 21.250 15.304 1.00 0.00 N ATOM 1287 CA TRP A 79 1.095 21.540 16.570 1.00 0.00 C ATOM 1288 C TRP A 79 1.781 20.824 17.732 1.00 0.00 C ATOM 1289 O TRP A 79 1.184 20.628 18.790 1.00 0.00 O ATOM 1290 CB TRP A 79 -0.378 21.131 16.500 1.00 0.00 C ATOM 1291 CG TRP A 79 -1.319 22.222 16.912 1.00 0.00 C ATOM 1292 CD1 TRP A 79 -2.559 22.472 16.397 1.00 0.00 C ATOM 1293 CD2 TRP A 79 -1.097 23.209 17.924 1.00 0.00 C ATOM 1294 NE1 TRP A 79 -3.121 23.556 17.028 1.00 0.00 N ATOM 1295 CE2 TRP A 79 -2.243 24.026 17.970 1.00 0.00 C ATOM 1296 CE3 TRP A 79 -0.041 23.484 18.799 1.00 0.00 C ATOM 1297 CZ2 TRP A 79 -2.361 25.096 18.853 1.00 0.00 C ATOM 1298 CZ3 TRP A 79 -0.160 24.546 19.675 1.00 0.00 C ATOM 1299 CH2 TRP A 79 -1.313 25.340 19.697 1.00 0.00 C ATOM 0 H TRP A 79 1.453 20.387 14.855 1.00 0.00 H new ATOM 0 HA TRP A 79 1.162 22.614 16.746 1.00 0.00 H new ATOM 0 HB2 TRP A 79 -0.614 20.823 15.481 1.00 0.00 H new ATOM 0 HB3 TRP A 79 -0.537 20.263 17.140 1.00 0.00 H new ATOM 0 HD1 TRP A 79 -3.029 21.902 15.609 1.00 0.00 H new ATOM 0 HE1 TRP A 79 -4.042 23.947 16.828 1.00 0.00 H new ATOM 0 HE3 TRP A 79 0.852 22.877 18.790 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 -3.248 25.711 18.871 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 0.650 24.767 20.354 1.00 0.00 H new ATOM 0 HH2 TRP A 79 -1.376 26.162 20.395 1.00 0.00 H new ATOM 1310 N ASN A 80 3.039 20.435 17.530 1.00 0.00 N ATOM 1311 CA ASN A 80 3.802 19.743 18.564 1.00 0.00 C ATOM 1312 C ASN A 80 3.056 18.508 19.063 1.00 0.00 C ATOM 1313 O ASN A 80 3.189 18.118 20.224 1.00 0.00 O ATOM 1314 CB ASN A 80 4.087 20.688 19.733 1.00 0.00 C ATOM 1315 CG ASN A 80 4.644 22.021 19.276 1.00 0.00 C ATOM 1316 OD1 ASN A 80 4.039 23.069 19.501 1.00 0.00 O ATOM 1317 ND2 ASN A 80 5.804 21.989 18.630 1.00 0.00 N ATOM 0 H ASN A 80 3.550 20.588 16.660 1.00 0.00 H new ATOM 0 HA ASN A 80 4.746 19.419 18.126 1.00 0.00 H new ATOM 0 HB2 ASN A 80 3.168 20.855 20.294 1.00 0.00 H new ATOM 0 HB3 ASN A 80 4.795 20.216 20.414 1.00 0.00 H new ATOM 0 HD21 ASN A 80 6.227 22.856 18.299 1.00 0.00 H new ATOM 0 HD22 ASN A 80 6.271 21.098 18.465 1.00 0.00 H new ATOM 1324 N LYS A 81 2.272 17.899 18.181 1.00 0.00 N ATOM 1325 CA LYS A 81 1.506 16.709 18.533 1.00 0.00 C ATOM 1326 C LYS A 81 1.573 15.669 17.420 1.00 0.00 C ATOM 1327 O LYS A 81 1.849 15.996 16.267 1.00 0.00 O ATOM 1328 CB LYS A 81 0.048 17.081 18.812 1.00 0.00 C ATOM 1329 CG LYS A 81 -0.143 17.876 20.095 1.00 0.00 C ATOM 1330 CD LYS A 81 -0.849 17.056 21.162 1.00 0.00 C ATOM 1331 CE LYS A 81 -2.329 17.395 21.236 1.00 0.00 C ATOM 1332 NZ LYS A 81 -2.616 18.405 22.292 1.00 0.00 N ATOM 0 H LYS A 81 2.150 18.209 17.217 1.00 0.00 H new ATOM 0 HA LYS A 81 1.944 16.279 19.434 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -0.337 17.662 17.974 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -0.547 16.169 18.868 1.00 0.00 H new ATOM 0 HG2 LYS A 81 0.827 18.203 20.469 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -0.722 18.775 19.884 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -0.728 15.994 20.946 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -0.384 17.239 22.131 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -2.663 17.775 20.270 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -2.899 16.488 21.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -3.636 18.608 22.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -2.321 18.033 23.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -2.092 19.280 22.087 1.00 0.00 H new ATOM 1346 N TRP A 82 1.318 14.413 17.776 1.00 0.00 N ATOM 1347 CA TRP A 82 1.348 13.324 16.806 1.00 0.00 C ATOM 1348 C TRP A 82 -0.007 13.165 16.124 1.00 0.00 C ATOM 1349 O TRP A 82 -0.992 12.790 16.760 1.00 0.00 O ATOM 1350 CB TRP A 82 1.744 12.015 17.492 1.00 0.00 C ATOM 1351 CG TRP A 82 3.205 11.931 17.812 1.00 0.00 C ATOM 1352 CD1 TRP A 82 4.238 11.894 16.920 1.00 0.00 C ATOM 1353 CD2 TRP A 82 3.795 11.871 19.115 1.00 0.00 C ATOM 1354 NE1 TRP A 82 5.436 11.816 17.590 1.00 0.00 N ATOM 1355 CE2 TRP A 82 5.190 11.800 18.937 1.00 0.00 C ATOM 1356 CE3 TRP A 82 3.281 11.872 20.415 1.00 0.00 C ATOM 1357 CZ2 TRP A 82 6.075 11.730 20.011 1.00 0.00 C ATOM 1358 CZ3 TRP A 82 4.160 11.802 21.479 1.00 0.00 C ATOM 1359 CH2 TRP A 82 5.543 11.733 21.272 1.00 0.00 C ATOM 0 H TRP A 82 1.089 14.125 18.727 1.00 0.00 H new ATOM 0 HA TRP A 82 2.090 13.567 16.046 1.00 0.00 H new ATOM 0 HB2 TRP A 82 1.171 11.908 18.413 1.00 0.00 H new ATOM 0 HB3 TRP A 82 1.472 11.179 16.848 1.00 0.00 H new ATOM 0 HD1 TRP A 82 4.130 11.922 15.846 1.00 0.00 H new ATOM 0 HE1 TRP A 82 6.358 11.776 17.155 1.00 0.00 H new ATOM 0 HE3 TRP A 82 2.216 11.927 20.585 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 7.142 11.675 19.854 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 3.774 11.800 22.487 1.00 0.00 H new ATOM 0 HH2 TRP A 82 6.204 11.681 22.125 1.00 0.00 H new ATOM 1370 N GLU A 83 -0.048 13.452 14.828 1.00 0.00 N ATOM 1371 CA GLU A 83 -1.282 13.341 14.060 1.00 0.00 C ATOM 1372 C GLU A 83 -1.575 11.882 13.709 1.00 0.00 C ATOM 1373 O GLU A 83 -0.737 11.200 13.119 1.00 0.00 O ATOM 1374 CB GLU A 83 -1.186 14.175 12.780 1.00 0.00 C ATOM 1375 CG GLU A 83 -2.497 14.833 12.384 1.00 0.00 C ATOM 1376 CD GLU A 83 -3.305 13.989 11.419 1.00 0.00 C ATOM 1377 OE1 GLU A 83 -4.103 13.150 11.887 1.00 0.00 O ATOM 1378 OE2 GLU A 83 -3.140 14.167 10.193 1.00 0.00 O ATOM 0 H GLU A 83 0.759 13.763 14.287 1.00 0.00 H new ATOM 0 HA GLU A 83 -2.099 13.720 14.674 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -0.428 14.946 12.915 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -0.849 13.536 11.964 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -3.089 15.022 13.279 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -2.290 15.801 11.928 1.00 0.00 H new ATOM 1386 N PRO A 84 -2.771 11.380 14.069 1.00 0.00 N ATOM 1387 CA PRO A 84 -3.160 9.997 13.788 1.00 0.00 C ATOM 1388 C PRO A 84 -3.593 9.798 12.340 1.00 0.00 C ATOM 1389 O PRO A 84 -4.222 10.673 11.742 1.00 0.00 O ATOM 1390 CB PRO A 84 -4.338 9.774 14.733 1.00 0.00 C ATOM 1391 CG PRO A 84 -4.961 11.119 14.875 1.00 0.00 C ATOM 1392 CD PRO A 84 -3.835 12.116 14.780 1.00 0.00 C ATOM 0 HA PRO A 84 -2.335 9.299 13.933 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -5.044 9.051 14.324 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -4.006 9.386 15.696 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -5.700 11.290 14.092 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -5.481 11.209 15.829 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -4.137 13.009 14.233 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -3.505 12.442 15.766 1.00 0.00 H new ATOM 1400 N ILE A 85 -3.253 8.642 11.779 1.00 0.00 N ATOM 1401 CA ILE A 85 -3.610 8.326 10.401 1.00 0.00 C ATOM 1402 C ILE A 85 -4.155 6.908 10.288 1.00 0.00 C ATOM 1403 O ILE A 85 -3.449 5.937 10.564 1.00 0.00 O ATOM 1404 CB ILE A 85 -2.399 8.476 9.460 1.00 0.00 C ATOM 1405 CG1 ILE A 85 -1.703 9.817 9.698 1.00 0.00 C ATOM 1406 CG2 ILE A 85 -2.838 8.351 8.009 1.00 0.00 C ATOM 1407 CD1 ILE A 85 -0.309 9.887 9.113 1.00 0.00 C ATOM 0 H ILE A 85 -2.731 7.908 12.258 1.00 0.00 H new ATOM 0 HA ILE A 85 -4.383 9.034 10.102 1.00 0.00 H new ATOM 0 HB ILE A 85 -1.689 7.677 9.675 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -2.310 10.613 9.267 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -1.648 10.003 10.771 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -1.972 8.459 7.356 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -3.293 7.373 7.849 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -3.564 9.131 7.780 1.00 0.00 H new ATOM 0 HD11 ILE A 85 0.124 10.866 9.320 1.00 0.00 H new ATOM 0 HD12 ILE A 85 0.313 9.113 9.562 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -0.359 9.733 8.035 1.00 0.00 H new ATOM 1419 N ALA A 86 -5.416 6.794 9.883 1.00 0.00 N ATOM 1420 CA ALA A 86 -6.057 5.493 9.737 1.00 0.00 C ATOM 1421 C ALA A 86 -5.996 5.008 8.292 1.00 0.00 C ATOM 1422 O ALA A 86 -6.171 5.789 7.357 1.00 0.00 O ATOM 1423 CB ALA A 86 -7.499 5.559 10.213 1.00 0.00 C ATOM 0 H ALA A 86 -6.014 7.587 9.650 1.00 0.00 H new ATOM 0 HA ALA A 86 -5.514 4.778 10.355 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -7.965 4.580 10.098 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -7.523 5.851 11.263 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -8.045 6.293 9.620 1.00 0.00 H new ATOM 1429 N GLY A 87 -5.747 3.715 8.118 1.00 0.00 N ATOM 1430 CA GLY A 87 -5.669 3.148 6.785 1.00 0.00 C ATOM 1431 C GLY A 87 -6.122 1.701 6.743 1.00 0.00 C ATOM 1432 O GLY A 87 -5.759 0.905 7.608 1.00 0.00 O ATOM 0 H GLY A 87 -5.598 3.049 8.876 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -6.284 3.738 6.106 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -4.643 3.215 6.424 1.00 0.00 H new ATOM 1436 N TYR A 88 -6.917 1.362 5.734 1.00 0.00 N ATOM 1437 CA TYR A 88 -7.421 0.002 5.582 1.00 0.00 C ATOM 1438 C TYR A 88 -7.807 -0.277 4.134 1.00 0.00 C ATOM 1439 O TYR A 88 -8.210 0.627 3.402 1.00 0.00 O ATOM 1440 CB TYR A 88 -8.628 -0.222 6.496 1.00 0.00 C ATOM 1441 CG TYR A 88 -9.802 0.676 6.180 1.00 0.00 C ATOM 1442 CD1 TYR A 88 -9.864 1.973 6.674 1.00 0.00 C ATOM 1443 CD2 TYR A 88 -10.851 0.225 5.387 1.00 0.00 C ATOM 1444 CE1 TYR A 88 -10.936 2.796 6.386 1.00 0.00 C ATOM 1445 CE2 TYR A 88 -11.927 1.043 5.094 1.00 0.00 C ATOM 1446 CZ TYR A 88 -11.964 2.326 5.597 1.00 0.00 C ATOM 1447 OH TYR A 88 -13.034 3.143 5.309 1.00 0.00 O ATOM 0 H TYR A 88 -7.226 2.010 5.009 1.00 0.00 H new ATOM 0 HA TYR A 88 -6.626 -0.687 5.866 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -8.945 -1.262 6.417 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -8.325 -0.059 7.530 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -9.061 2.344 7.293 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -10.825 -0.780 4.993 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -10.968 3.802 6.777 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -12.733 0.679 4.475 1.00 0.00 H new ATOM 0 HH TYR A 88 -13.670 2.661 4.741 1.00 0.00 H new ATOM 1457 N GLY A 89 -7.682 -1.536 3.726 1.00 0.00 N ATOM 1458 CA GLY A 89 -8.022 -1.912 2.366 1.00 0.00 C ATOM 1459 C GLY A 89 -8.011 -3.414 2.160 1.00 0.00 C ATOM 1460 O GLY A 89 -7.745 -4.174 3.090 1.00 0.00 O ATOM 0 H GLY A 89 -7.351 -2.302 4.313 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -9.010 -1.522 2.121 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -7.316 -1.449 1.677 1.00 0.00 H new ATOM 1464 N TRP A 90 -8.302 -3.842 0.935 1.00 0.00 N ATOM 1465 CA TRP A 90 -8.325 -5.263 0.607 1.00 0.00 C ATOM 1466 C TRP A 90 -7.367 -5.573 -0.539 1.00 0.00 C ATOM 1467 O TRP A 90 -7.189 -4.761 -1.447 1.00 0.00 O ATOM 1468 CB TRP A 90 -9.743 -5.698 0.235 1.00 0.00 C ATOM 1469 CG TRP A 90 -10.784 -5.217 1.199 1.00 0.00 C ATOM 1470 CD1 TRP A 90 -10.891 -5.543 2.520 1.00 0.00 C ATOM 1471 CD2 TRP A 90 -11.866 -4.323 0.916 1.00 0.00 C ATOM 1472 NE1 TRP A 90 -11.974 -4.907 3.077 1.00 0.00 N ATOM 1473 CE2 TRP A 90 -12.589 -4.151 2.113 1.00 0.00 C ATOM 1474 CE3 TRP A 90 -12.295 -3.649 -0.231 1.00 0.00 C ATOM 1475 CZ2 TRP A 90 -13.715 -3.335 2.193 1.00 0.00 C ATOM 1476 CZ3 TRP A 90 -13.412 -2.839 -0.149 1.00 0.00 C ATOM 1477 CH2 TRP A 90 -14.111 -2.688 1.056 1.00 0.00 C ATOM 0 H TRP A 90 -8.525 -3.225 0.154 1.00 0.00 H new ATOM 0 HA TRP A 90 -8.001 -5.819 1.487 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -9.980 -5.324 -0.761 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -9.780 -6.786 0.185 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -10.222 -6.204 3.050 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -12.272 -4.985 4.049 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -11.763 -3.759 -1.165 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -14.256 -3.218 3.120 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -13.752 -2.313 -1.029 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -14.980 -2.048 1.087 1.00 0.00 H new ATOM 1488 N GLU A 91 -6.755 -6.751 -0.490 1.00 0.00 N ATOM 1489 CA GLU A 91 -5.815 -7.167 -1.526 1.00 0.00 C ATOM 1490 C GLU A 91 -5.733 -8.687 -1.607 1.00 0.00 C ATOM 1491 O GLU A 91 -5.973 -9.386 -0.622 1.00 0.00 O ATOM 1492 CB GLU A 91 -4.429 -6.583 -1.248 1.00 0.00 C ATOM 1493 CG GLU A 91 -3.888 -6.928 0.130 1.00 0.00 C ATOM 1494 CD GLU A 91 -2.439 -7.372 0.096 1.00 0.00 C ATOM 1495 OE1 GLU A 91 -1.701 -7.065 1.056 1.00 0.00 O ATOM 1496 OE2 GLU A 91 -2.042 -8.026 -0.892 1.00 0.00 O ATOM 0 H GLU A 91 -6.892 -7.434 0.255 1.00 0.00 H new ATOM 0 HA GLU A 91 -6.176 -6.790 -2.483 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -3.733 -6.946 -2.004 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -4.474 -5.499 -1.351 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -3.982 -6.059 0.781 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -4.496 -7.720 0.567 1.00 0.00 H new ATOM 1504 N SER A 92 -5.392 -9.194 -2.788 1.00 0.00 N ATOM 1505 CA SER A 92 -5.276 -10.633 -2.999 1.00 0.00 C ATOM 1506 C SER A 92 -3.828 -11.028 -3.266 1.00 0.00 C ATOM 1507 O SER A 92 -3.167 -10.455 -4.133 1.00 0.00 O ATOM 1508 CB SER A 92 -6.160 -11.069 -4.168 1.00 0.00 C ATOM 1509 OG SER A 92 -6.372 -12.470 -4.151 1.00 0.00 O ATOM 0 H SER A 92 -5.191 -8.630 -3.613 1.00 0.00 H new ATOM 0 HA SER A 92 -5.609 -11.137 -2.092 1.00 0.00 H new ATOM 0 HB2 SER A 92 -7.118 -10.552 -4.116 1.00 0.00 H new ATOM 0 HB3 SER A 92 -5.693 -10.780 -5.109 1.00 0.00 H new ATOM 0 HG SER A 92 -6.941 -12.724 -4.907 1.00 0.00 H new ATOM 1515 N THR A 93 -3.339 -12.011 -2.516 1.00 0.00 N ATOM 1516 CA THR A 93 -1.969 -12.483 -2.672 1.00 0.00 C ATOM 1517 C THR A 93 -1.938 -13.860 -3.327 1.00 0.00 C ATOM 1518 O THR A 93 -2.725 -14.740 -2.982 1.00 0.00 O ATOM 1519 CB THR A 93 -1.268 -12.536 -1.313 1.00 0.00 C ATOM 1520 OG1 THR A 93 -2.196 -12.825 -0.282 1.00 0.00 O ATOM 1521 CG2 THR A 93 -0.565 -11.246 -0.951 1.00 0.00 C ATOM 0 H THR A 93 -3.872 -12.496 -1.794 1.00 0.00 H new ATOM 0 HA THR A 93 -1.442 -11.782 -3.319 1.00 0.00 H new ATOM 0 HB THR A 93 -0.520 -13.324 -1.404 1.00 0.00 H new ATOM 0 HG1 THR A 93 -2.055 -12.209 0.467 1.00 0.00 H new ATOM 0 HG21 THR A 93 -0.089 -11.352 0.024 1.00 0.00 H new ATOM 0 HG22 THR A 93 0.192 -11.021 -1.702 1.00 0.00 H new ATOM 0 HG23 THR A 93 -1.291 -10.434 -0.914 1.00 0.00 H new ATOM 1529 N TRP A 94 -1.022 -14.038 -4.274 1.00 0.00 N ATOM 1530 CA TRP A 94 -0.888 -15.307 -4.979 1.00 0.00 C ATOM 1531 C TRP A 94 0.561 -15.554 -5.385 1.00 0.00 C ATOM 1532 O TRP A 94 1.359 -14.619 -5.473 1.00 0.00 O ATOM 1533 CB TRP A 94 -1.787 -15.327 -6.216 1.00 0.00 C ATOM 1534 CG TRP A 94 -1.542 -14.179 -7.147 1.00 0.00 C ATOM 1535 CD1 TRP A 94 -0.360 -13.846 -7.744 1.00 0.00 C ATOM 1536 CD2 TRP A 94 -2.501 -13.210 -7.587 1.00 0.00 C ATOM 1537 NE1 TRP A 94 -0.525 -12.731 -8.528 1.00 0.00 N ATOM 1538 CE2 TRP A 94 -1.831 -12.322 -8.449 1.00 0.00 C ATOM 1539 CE3 TRP A 94 -3.862 -13.010 -7.337 1.00 0.00 C ATOM 1540 CZ2 TRP A 94 -2.475 -11.249 -9.060 1.00 0.00 C ATOM 1541 CZ3 TRP A 94 -4.500 -11.944 -7.945 1.00 0.00 C ATOM 1542 CH2 TRP A 94 -3.807 -11.076 -8.798 1.00 0.00 C ATOM 0 H TRP A 94 -0.362 -13.319 -4.570 1.00 0.00 H new ATOM 0 HA TRP A 94 -1.198 -16.103 -4.302 1.00 0.00 H new ATOM 0 HB2 TRP A 94 -1.631 -16.262 -6.755 1.00 0.00 H new ATOM 0 HB3 TRP A 94 -2.830 -15.312 -5.899 1.00 0.00 H new ATOM 0 HD1 TRP A 94 0.569 -14.382 -7.618 1.00 0.00 H new ATOM 0 HE1 TRP A 94 0.205 -12.280 -9.079 1.00 0.00 H new ATOM 0 HE3 TRP A 94 -4.405 -13.675 -6.682 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 -1.942 -10.577 -9.717 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 -5.551 -11.778 -7.759 1.00 0.00 H new ATOM 0 HH2 TRP A 94 -4.334 -10.254 -9.258 1.00 0.00 H new ATOM 1553 N ARG A 95 0.896 -16.815 -5.633 1.00 0.00 N ATOM 1554 CA ARG A 95 2.250 -17.183 -6.030 1.00 0.00 C ATOM 1555 C ARG A 95 2.231 -18.079 -7.267 1.00 0.00 C ATOM 1556 O ARG A 95 1.299 -18.859 -7.463 1.00 0.00 O ATOM 1557 CB ARG A 95 2.964 -17.897 -4.881 1.00 0.00 C ATOM 1558 CG ARG A 95 2.238 -19.139 -4.390 1.00 0.00 C ATOM 1559 CD ARG A 95 2.333 -19.281 -2.879 1.00 0.00 C ATOM 1560 NE ARG A 95 1.486 -20.359 -2.377 1.00 0.00 N ATOM 1561 CZ ARG A 95 0.156 -20.308 -2.354 1.00 0.00 C ATOM 1562 NH1 ARG A 95 -0.482 -19.234 -2.805 1.00 0.00 N ATOM 1563 NH2 ARG A 95 -0.540 -21.333 -1.881 1.00 0.00 N ATOM 0 H ARG A 95 0.248 -17.600 -5.566 1.00 0.00 H new ATOM 0 HA ARG A 95 2.791 -16.269 -6.274 1.00 0.00 H new ATOM 0 HB2 ARG A 95 3.966 -18.177 -5.205 1.00 0.00 H new ATOM 0 HB3 ARG A 95 3.081 -17.202 -4.049 1.00 0.00 H new ATOM 0 HG2 ARG A 95 1.190 -19.090 -4.686 1.00 0.00 H new ATOM 0 HG3 ARG A 95 2.663 -20.022 -4.867 1.00 0.00 H new ATOM 0 HD2 ARG A 95 3.368 -19.472 -2.597 1.00 0.00 H new ATOM 0 HD3 ARG A 95 2.043 -18.342 -2.408 1.00 0.00 H new ATOM 0 HE ARG A 95 1.940 -21.201 -2.023 1.00 0.00 H new ATOM 0 HH11 ARG A 95 0.047 -18.443 -3.171 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -1.501 -19.200 -2.785 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -0.056 -22.161 -1.534 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -1.559 -21.293 -1.864 1.00 0.00 H new ATOM 1577 N PRO A 96 3.264 -17.979 -8.121 1.00 0.00 N ATOM 1578 CA PRO A 96 3.360 -18.785 -9.342 1.00 0.00 C ATOM 1579 C PRO A 96 3.225 -20.278 -9.062 1.00 0.00 C ATOM 1580 O PRO A 96 2.919 -20.684 -7.941 1.00 0.00 O ATOM 1581 CB PRO A 96 4.761 -18.466 -9.874 1.00 0.00 C ATOM 1582 CG PRO A 96 5.088 -17.129 -9.308 1.00 0.00 C ATOM 1583 CD PRO A 96 4.420 -17.074 -7.963 1.00 0.00 C ATOM 0 HA PRO A 96 2.561 -18.553 -10.046 1.00 0.00 H new ATOM 0 HB2 PRO A 96 5.485 -19.217 -9.558 1.00 0.00 H new ATOM 0 HB3 PRO A 96 4.776 -18.448 -10.964 1.00 0.00 H new ATOM 0 HG2 PRO A 96 6.166 -16.998 -9.214 1.00 0.00 H new ATOM 0 HG3 PRO A 96 4.726 -16.331 -9.957 1.00 0.00 H new ATOM 0 HD2 PRO A 96 5.087 -17.408 -7.169 1.00 0.00 H new ATOM 0 HD3 PRO A 96 4.106 -16.061 -7.711 1.00 0.00 H new ATOM 1591 N LEU A 97 3.457 -21.091 -10.088 1.00 0.00 N ATOM 1592 CA LEU A 97 3.361 -22.539 -9.951 1.00 0.00 C ATOM 1593 C LEU A 97 4.747 -23.169 -9.855 1.00 0.00 C ATOM 1594 O LEU A 97 4.960 -24.297 -10.301 1.00 0.00 O ATOM 1595 CB LEU A 97 2.599 -23.135 -11.136 1.00 0.00 C ATOM 1596 CG LEU A 97 1.692 -24.320 -10.795 1.00 0.00 C ATOM 1597 CD1 LEU A 97 0.338 -23.831 -10.308 1.00 0.00 C ATOM 1598 CD2 LEU A 97 1.531 -25.230 -12.002 1.00 0.00 C ATOM 0 H LEU A 97 3.713 -20.771 -11.022 1.00 0.00 H new ATOM 0 HA LEU A 97 2.817 -22.757 -9.032 1.00 0.00 H new ATOM 0 HB2 LEU A 97 1.992 -22.351 -11.589 1.00 0.00 H new ATOM 0 HB3 LEU A 97 3.320 -23.454 -11.888 1.00 0.00 H new ATOM 0 HG LEU A 97 2.158 -24.893 -9.993 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -0.294 -24.687 -10.070 1.00 0.00 H new ATOM 0 HD12 LEU A 97 0.471 -23.219 -9.416 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -0.136 -23.236 -11.088 1.00 0.00 H new ATOM 0 HD21 LEU A 97 0.883 -26.067 -11.742 1.00 0.00 H new ATOM 0 HD22 LEU A 97 1.087 -24.669 -12.824 1.00 0.00 H new ATOM 0 HD23 LEU A 97 2.507 -25.607 -12.306 1.00 0.00 H new ATOM 1610 N ALA A 98 5.686 -22.433 -9.270 1.00 0.00 N ATOM 1611 CA ALA A 98 7.052 -22.919 -9.115 1.00 0.00 C ATOM 1612 C ALA A 98 7.374 -23.192 -7.650 1.00 0.00 C ATOM 1613 O ALA A 98 7.612 -24.336 -7.259 1.00 0.00 O ATOM 1614 CB ALA A 98 8.037 -21.917 -9.696 1.00 0.00 C ATOM 0 H ALA A 98 5.526 -21.498 -8.895 1.00 0.00 H new ATOM 0 HA ALA A 98 7.142 -23.858 -9.661 1.00 0.00 H new ATOM 0 HB1 ALA A 98 9.053 -22.293 -9.573 1.00 0.00 H new ATOM 0 HB2 ALA A 98 7.828 -21.774 -10.756 1.00 0.00 H new ATOM 0 HB3 ALA A 98 7.937 -20.965 -9.175 1.00 0.00 H new ATOM 1620 N ASP A 99 7.381 -22.136 -6.844 1.00 0.00 N ATOM 1621 CA ASP A 99 7.675 -22.262 -5.421 1.00 0.00 C ATOM 1622 C ASP A 99 6.902 -21.226 -4.612 1.00 0.00 C ATOM 1623 O ASP A 99 6.282 -20.322 -5.173 1.00 0.00 O ATOM 1624 CB ASP A 99 9.176 -22.104 -5.173 1.00 0.00 C ATOM 1625 CG ASP A 99 9.928 -23.410 -5.330 1.00 0.00 C ATOM 1626 OD1 ASP A 99 10.800 -23.490 -6.221 1.00 0.00 O ATOM 1627 OD2 ASP A 99 9.646 -24.354 -4.561 1.00 0.00 O ATOM 0 H ASP A 99 7.186 -21.183 -7.152 1.00 0.00 H new ATOM 0 HA ASP A 99 7.363 -23.255 -5.098 1.00 0.00 H new ATOM 0 HB2 ASP A 99 9.581 -21.369 -5.868 1.00 0.00 H new ATOM 0 HB3 ASP A 99 9.336 -21.714 -4.168 1.00 0.00 H new ATOM 1633 N GLU A 100 6.942 -21.364 -3.291 1.00 0.00 N ATOM 1634 CA GLU A 100 6.245 -20.439 -2.404 1.00 0.00 C ATOM 1635 C GLU A 100 7.237 -19.567 -1.639 1.00 0.00 C ATOM 1636 O GLU A 100 7.213 -19.513 -0.408 1.00 0.00 O ATOM 1637 CB GLU A 100 5.360 -21.211 -1.424 1.00 0.00 C ATOM 1638 CG GLU A 100 4.436 -22.212 -2.098 1.00 0.00 C ATOM 1639 CD GLU A 100 3.659 -23.050 -1.102 1.00 0.00 C ATOM 1640 OE1 GLU A 100 2.411 -23.044 -1.166 1.00 0.00 O ATOM 1641 OE2 GLU A 100 4.297 -23.713 -0.257 1.00 0.00 O ATOM 0 H GLU A 100 7.449 -22.107 -2.811 1.00 0.00 H new ATOM 0 HA GLU A 100 5.617 -19.790 -3.015 1.00 0.00 H new ATOM 0 HB2 GLU A 100 5.995 -21.738 -0.711 1.00 0.00 H new ATOM 0 HB3 GLU A 100 4.760 -20.502 -0.853 1.00 0.00 H new ATOM 0 HG2 GLU A 100 3.737 -21.679 -2.742 1.00 0.00 H new ATOM 0 HG3 GLU A 100 5.024 -22.869 -2.740 1.00 0.00 H new ATOM 1649 N ASN A 101 8.108 -18.886 -2.375 1.00 0.00 N ATOM 1650 CA ASN A 101 9.108 -18.016 -1.767 1.00 0.00 C ATOM 1651 C ASN A 101 8.698 -16.551 -1.883 1.00 0.00 C ATOM 1652 O ASN A 101 8.719 -15.811 -0.899 1.00 0.00 O ATOM 1653 CB ASN A 101 10.471 -18.230 -2.428 1.00 0.00 C ATOM 1654 CG ASN A 101 11.053 -19.596 -2.120 1.00 0.00 C ATOM 1655 OD1 ASN A 101 10.417 -20.622 -2.357 1.00 0.00 O ATOM 1656 ND2 ASN A 101 12.271 -19.614 -1.590 1.00 0.00 N ATOM 0 H ASN A 101 8.142 -18.920 -3.394 1.00 0.00 H new ATOM 0 HA ASN A 101 9.181 -18.272 -0.710 1.00 0.00 H new ATOM 0 HB2 ASN A 101 10.371 -18.115 -3.507 1.00 0.00 H new ATOM 0 HB3 ASN A 101 11.162 -17.458 -2.088 1.00 0.00 H new ATOM 0 HD21 ASN A 101 12.715 -20.504 -1.363 1.00 0.00 H new ATOM 0 HD22 ASN A 101 12.762 -18.738 -1.410 1.00 0.00 H new ATOM 1663 N PHE A 102 8.326 -16.140 -3.090 1.00 0.00 N ATOM 1664 CA PHE A 102 7.910 -14.763 -3.336 1.00 0.00 C ATOM 1665 C PHE A 102 6.421 -14.693 -3.656 1.00 0.00 C ATOM 1666 O PHE A 102 5.901 -15.506 -4.422 1.00 0.00 O ATOM 1667 CB PHE A 102 8.720 -14.161 -4.485 1.00 0.00 C ATOM 1668 CG PHE A 102 8.579 -14.913 -5.777 1.00 0.00 C ATOM 1669 CD1 PHE A 102 7.520 -14.656 -6.632 1.00 0.00 C ATOM 1670 CD2 PHE A 102 9.507 -15.878 -6.137 1.00 0.00 C ATOM 1671 CE1 PHE A 102 7.387 -15.346 -7.822 1.00 0.00 C ATOM 1672 CE2 PHE A 102 9.380 -16.572 -7.325 1.00 0.00 C ATOM 1673 CZ PHE A 102 8.319 -16.305 -8.169 1.00 0.00 C ATOM 0 H PHE A 102 8.304 -16.740 -3.914 1.00 0.00 H new ATOM 0 HA PHE A 102 8.095 -14.187 -2.430 1.00 0.00 H new ATOM 0 HB2 PHE A 102 8.405 -13.129 -4.639 1.00 0.00 H new ATOM 0 HB3 PHE A 102 9.772 -14.135 -4.202 1.00 0.00 H new ATOM 0 HD1 PHE A 102 6.789 -13.907 -6.365 1.00 0.00 H new ATOM 0 HD2 PHE A 102 10.339 -16.090 -5.481 1.00 0.00 H new ATOM 0 HE1 PHE A 102 6.556 -15.136 -8.479 1.00 0.00 H new ATOM 0 HE2 PHE A 102 10.109 -17.322 -7.594 1.00 0.00 H new ATOM 0 HZ PHE A 102 8.218 -16.845 -9.099 1.00 0.00 H new ATOM 1683 N HIS A 103 5.739 -13.719 -3.064 1.00 0.00 N ATOM 1684 CA HIS A 103 4.307 -13.542 -3.286 1.00 0.00 C ATOM 1685 C HIS A 103 4.022 -12.205 -3.961 1.00 0.00 C ATOM 1686 O HIS A 103 4.859 -11.304 -3.955 1.00 0.00 O ATOM 1687 CB HIS A 103 3.550 -13.629 -1.959 1.00 0.00 C ATOM 1688 CG HIS A 103 3.551 -15.000 -1.358 1.00 0.00 C ATOM 1689 ND1 HIS A 103 2.880 -15.313 -0.194 1.00 0.00 N ATOM 1690 CD2 HIS A 103 4.146 -16.146 -1.766 1.00 0.00 C ATOM 1691 CE1 HIS A 103 3.063 -16.590 0.088 1.00 0.00 C ATOM 1692 NE2 HIS A 103 3.827 -17.118 -0.850 1.00 0.00 N ATOM 0 H HIS A 103 6.154 -13.039 -2.426 1.00 0.00 H new ATOM 0 HA HIS A 103 3.965 -14.340 -3.945 1.00 0.00 H new ATOM 0 HB2 HIS A 103 3.994 -12.930 -1.250 1.00 0.00 H new ATOM 0 HB3 HIS A 103 2.519 -13.311 -2.117 1.00 0.00 H new ATOM 0 HD2 HIS A 103 4.757 -16.272 -2.647 1.00 0.00 H new ATOM 0 HE1 HIS A 103 2.657 -17.113 0.941 1.00 0.00 H new ATOM 0 HE2 HIS A 103 4.131 -18.091 -0.888 1.00 0.00 H new ATOM 1701 N LEU A 104 2.832 -12.084 -4.541 1.00 0.00 N ATOM 1702 CA LEU A 104 2.435 -10.856 -5.221 1.00 0.00 C ATOM 1703 C LEU A 104 1.035 -10.429 -4.797 1.00 0.00 C ATOM 1704 O LEU A 104 0.080 -11.198 -4.906 1.00 0.00 O ATOM 1705 CB LEU A 104 2.485 -11.049 -6.738 1.00 0.00 C ATOM 1706 CG LEU A 104 3.785 -11.652 -7.272 1.00 0.00 C ATOM 1707 CD1 LEU A 104 3.701 -13.170 -7.292 1.00 0.00 C ATOM 1708 CD2 LEU A 104 4.089 -11.114 -8.663 1.00 0.00 C ATOM 0 H LEU A 104 2.126 -12.821 -4.554 1.00 0.00 H new ATOM 0 HA LEU A 104 3.136 -10.071 -4.939 1.00 0.00 H new ATOM 0 HB2 LEU A 104 1.656 -11.691 -7.035 1.00 0.00 H new ATOM 0 HB3 LEU A 104 2.327 -10.083 -7.217 1.00 0.00 H new ATOM 0 HG LEU A 104 4.598 -11.363 -6.606 1.00 0.00 H new ATOM 0 HD11 LEU A 104 4.635 -13.581 -7.675 1.00 0.00 H new ATOM 0 HD12 LEU A 104 3.530 -13.538 -6.280 1.00 0.00 H new ATOM 0 HD13 LEU A 104 2.877 -13.480 -7.935 1.00 0.00 H new ATOM 0 HD21 LEU A 104 5.017 -11.553 -9.028 1.00 0.00 H new ATOM 0 HD22 LEU A 104 3.274 -11.373 -9.339 1.00 0.00 H new ATOM 0 HD23 LEU A 104 4.193 -10.030 -8.619 1.00 0.00 H new ATOM 1720 N GLY A 105 0.919 -9.196 -4.311 1.00 0.00 N ATOM 1721 CA GLY A 105 -0.369 -8.687 -3.877 1.00 0.00 C ATOM 1722 C GLY A 105 -0.843 -7.518 -4.717 1.00 0.00 C ATOM 1723 O GLY A 105 -0.035 -6.730 -5.209 1.00 0.00 O ATOM 0 H GLY A 105 1.694 -8.541 -4.210 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -1.107 -9.487 -3.924 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -0.301 -8.377 -2.834 1.00 0.00 H new ATOM 1727 N LEU A 106 -2.157 -7.403 -4.882 1.00 0.00 N ATOM 1728 CA LEU A 106 -2.737 -6.321 -5.668 1.00 0.00 C ATOM 1729 C LEU A 106 -4.156 -6.010 -5.202 1.00 0.00 C ATOM 1730 O LEU A 106 -5.004 -6.899 -5.124 1.00 0.00 O ATOM 1731 CB LEU A 106 -2.746 -6.690 -7.153 1.00 0.00 C ATOM 1732 CG LEU A 106 -2.979 -5.519 -8.109 1.00 0.00 C ATOM 1733 CD1 LEU A 106 -2.407 -5.832 -9.484 1.00 0.00 C ATOM 1734 CD2 LEU A 106 -4.463 -5.201 -8.207 1.00 0.00 C ATOM 0 H LEU A 106 -2.840 -8.046 -4.482 1.00 0.00 H new ATOM 0 HA LEU A 106 -2.123 -5.432 -5.524 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -1.793 -7.158 -7.401 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -3.522 -7.437 -7.322 1.00 0.00 H new ATOM 0 HG LEU A 106 -2.464 -4.643 -7.715 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -2.582 -4.988 -10.151 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -1.335 -6.012 -9.400 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.894 -6.720 -9.887 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.612 -4.366 -8.891 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -4.998 -6.074 -8.579 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -4.844 -4.935 -7.221 1.00 0.00 H new ATOM 1746 N GLY A 107 -4.407 -4.742 -4.893 1.00 0.00 N ATOM 1747 CA GLY A 107 -5.725 -4.337 -4.438 1.00 0.00 C ATOM 1748 C GLY A 107 -5.829 -2.841 -4.218 1.00 0.00 C ATOM 1749 O GLY A 107 -5.027 -2.072 -4.748 1.00 0.00 O ATOM 0 H GLY A 107 -3.722 -3.988 -4.949 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -6.470 -4.646 -5.172 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -5.960 -4.855 -3.508 1.00 0.00 H new ATOM 1753 N PHE A 108 -6.819 -2.428 -3.434 1.00 0.00 N ATOM 1754 CA PHE A 108 -7.027 -1.013 -3.145 1.00 0.00 C ATOM 1755 C PHE A 108 -6.852 -0.731 -1.656 1.00 0.00 C ATOM 1756 O PHE A 108 -7.131 -1.586 -0.816 1.00 0.00 O ATOM 1757 CB PHE A 108 -8.422 -0.578 -3.598 1.00 0.00 C ATOM 1758 CG PHE A 108 -8.558 -0.457 -5.089 1.00 0.00 C ATOM 1759 CD1 PHE A 108 -8.306 -1.543 -5.911 1.00 0.00 C ATOM 1760 CD2 PHE A 108 -8.937 0.743 -5.667 1.00 0.00 C ATOM 1761 CE1 PHE A 108 -8.431 -1.435 -7.284 1.00 0.00 C ATOM 1762 CE2 PHE A 108 -9.063 0.858 -7.039 1.00 0.00 C ATOM 1763 CZ PHE A 108 -8.810 -0.232 -7.848 1.00 0.00 C ATOM 0 H PHE A 108 -7.490 -3.053 -2.987 1.00 0.00 H new ATOM 0 HA PHE A 108 -6.280 -0.441 -3.695 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -9.155 -1.297 -3.232 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -8.661 0.382 -3.140 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -8.008 -2.485 -5.475 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -9.136 1.599 -5.039 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -8.233 -2.289 -7.914 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -9.359 1.800 -7.478 1.00 0.00 H new ATOM 0 HZ PHE A 108 -8.908 -0.144 -8.920 1.00 0.00 H new ATOM 1773 N THR A 109 -6.388 0.473 -1.338 1.00 0.00 N ATOM 1774 CA THR A 109 -6.176 0.868 0.049 1.00 0.00 C ATOM 1775 C THR A 109 -6.765 2.249 0.319 1.00 0.00 C ATOM 1776 O THR A 109 -6.336 3.243 -0.267 1.00 0.00 O ATOM 1777 CB THR A 109 -4.682 0.865 0.379 1.00 0.00 C ATOM 1778 OG1 THR A 109 -4.015 -0.169 -0.323 1.00 0.00 O ATOM 1779 CG2 THR A 109 -4.396 0.678 1.854 1.00 0.00 C ATOM 0 H THR A 109 -6.152 1.192 -2.022 1.00 0.00 H new ATOM 0 HA THR A 109 -6.684 0.145 0.688 1.00 0.00 H new ATOM 0 HB THR A 109 -4.317 1.846 0.076 1.00 0.00 H new ATOM 0 HG1 THR A 109 -3.061 -0.153 -0.100 1.00 0.00 H new ATOM 0 HG21 THR A 109 -3.319 0.685 2.020 1.00 0.00 H new ATOM 0 HG22 THR A 109 -4.856 1.489 2.419 1.00 0.00 H new ATOM 0 HG23 THR A 109 -4.808 -0.275 2.186 1.00 0.00 H new ATOM 1787 N ALA A 110 -7.750 2.303 1.209 1.00 0.00 N ATOM 1788 CA ALA A 110 -8.398 3.562 1.556 1.00 0.00 C ATOM 1789 C ALA A 110 -7.998 4.019 2.955 1.00 0.00 C ATOM 1790 O ALA A 110 -7.903 3.212 3.879 1.00 0.00 O ATOM 1791 CB ALA A 110 -9.910 3.421 1.457 1.00 0.00 C ATOM 0 H ALA A 110 -8.117 1.490 1.703 1.00 0.00 H new ATOM 0 HA ALA A 110 -8.067 4.320 0.847 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -10.382 4.368 1.719 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -10.184 3.149 0.438 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -10.249 2.645 2.144 1.00 0.00 H new ATOM 1797 N GLY A 111 -7.763 5.319 3.102 1.00 0.00 N ATOM 1798 CA GLY A 111 -7.377 5.862 4.391 1.00 0.00 C ATOM 1799 C GLY A 111 -8.031 7.201 4.674 1.00 0.00 C ATOM 1800 O GLY A 111 -8.742 7.742 3.828 1.00 0.00 O ATOM 0 H GLY A 111 -7.833 6.006 2.351 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -7.648 5.155 5.176 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -6.293 5.976 4.425 1.00 0.00 H new ATOM 1804 N VAL A 112 -7.790 7.735 5.867 1.00 0.00 N ATOM 1805 CA VAL A 112 -8.362 9.017 6.259 1.00 0.00 C ATOM 1806 C VAL A 112 -7.431 9.774 7.198 1.00 0.00 C ATOM 1807 O VAL A 112 -6.845 9.190 8.111 1.00 0.00 O ATOM 1808 CB VAL A 112 -9.729 8.837 6.947 1.00 0.00 C ATOM 1809 CG1 VAL A 112 -10.399 10.184 7.166 1.00 0.00 C ATOM 1810 CG2 VAL A 112 -10.620 7.915 6.130 1.00 0.00 C ATOM 0 H VAL A 112 -7.203 7.300 6.578 1.00 0.00 H new ATOM 0 HA VAL A 112 -8.496 9.593 5.343 1.00 0.00 H new ATOM 0 HB VAL A 112 -9.567 8.377 7.922 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -11.363 10.036 7.653 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -9.765 10.807 7.797 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -10.550 10.676 6.205 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -11.581 7.800 6.631 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -10.776 8.343 5.140 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -10.142 6.940 6.032 1.00 0.00 H new ATOM 1820 N THR A 113 -7.298 11.077 6.968 1.00 0.00 N ATOM 1821 CA THR A 113 -6.437 11.916 7.795 1.00 0.00 C ATOM 1822 C THR A 113 -7.231 13.062 8.416 1.00 0.00 C ATOM 1823 O THR A 113 -8.059 13.687 7.752 1.00 0.00 O ATOM 1824 CB THR A 113 -5.281 12.473 6.963 1.00 0.00 C ATOM 1825 OG1 THR A 113 -5.671 12.644 5.613 1.00 0.00 O ATOM 1826 CG2 THR A 113 -4.053 11.588 6.979 1.00 0.00 C ATOM 0 H THR A 113 -7.775 11.574 6.216 1.00 0.00 H new ATOM 0 HA THR A 113 -6.033 11.300 8.598 1.00 0.00 H new ATOM 0 HB THR A 113 -5.027 13.428 7.423 1.00 0.00 H new ATOM 0 HG1 THR A 113 -4.918 13.002 5.098 1.00 0.00 H new ATOM 0 HG21 THR A 113 -3.270 12.040 6.370 1.00 0.00 H new ATOM 0 HG22 THR A 113 -3.697 11.478 8.003 1.00 0.00 H new ATOM 0 HG23 THR A 113 -4.306 10.608 6.575 1.00 0.00 H new ATOM 1834 N ALA A 114 -6.974 13.331 9.691 1.00 0.00 N ATOM 1835 CA ALA A 114 -7.666 14.402 10.401 1.00 0.00 C ATOM 1836 C ALA A 114 -6.675 15.344 11.075 1.00 0.00 C ATOM 1837 O ALA A 114 -5.850 14.918 11.884 1.00 0.00 O ATOM 1838 CB ALA A 114 -8.625 13.819 11.427 1.00 0.00 C ATOM 0 H ALA A 114 -6.292 12.823 10.254 1.00 0.00 H new ATOM 0 HA ALA A 114 -8.236 14.979 9.673 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -9.135 14.628 11.950 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -9.361 13.193 10.923 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -8.068 13.218 12.145 1.00 0.00 H new ATOM 1844 N ARG A 115 -6.761 16.626 10.738 1.00 0.00 N ATOM 1845 CA ARG A 115 -5.872 17.629 11.313 1.00 0.00 C ATOM 1846 C ARG A 115 -6.340 19.038 10.959 1.00 0.00 C ATOM 1847 O ARG A 115 -6.379 19.414 9.787 1.00 0.00 O ATOM 1848 CB ARG A 115 -4.441 17.416 10.817 1.00 0.00 C ATOM 1849 CG ARG A 115 -4.342 17.189 9.318 1.00 0.00 C ATOM 1850 CD ARG A 115 -2.926 17.413 8.812 1.00 0.00 C ATOM 1851 NE ARG A 115 -2.077 16.243 9.025 1.00 0.00 N ATOM 1852 CZ ARG A 115 -0.931 16.032 8.383 1.00 0.00 C ATOM 1853 NH1 ARG A 115 -0.492 16.910 7.489 1.00 0.00 N ATOM 1854 NH2 ARG A 115 -0.220 14.942 8.636 1.00 0.00 N ATOM 0 H ARG A 115 -7.437 16.995 10.070 1.00 0.00 H new ATOM 0 HA ARG A 115 -5.894 17.519 12.397 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -3.840 18.285 11.084 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -4.010 16.559 11.335 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -4.657 16.173 9.081 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -5.025 17.863 8.801 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -2.954 17.652 7.749 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -2.491 18.274 9.320 1.00 0.00 H new ATOM 0 HE ARG A 115 -2.381 15.547 9.706 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -1.034 17.751 7.292 1.00 0.00 H new ATOM 0 HH12 ARG A 115 0.387 16.743 7.000 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -0.552 14.265 9.323 1.00 0.00 H new ATOM 0 HH22 ARG A 115 0.659 14.780 8.144 1.00 0.00 H new ATOM 1868 N ASP A 116 -6.697 19.812 11.979 1.00 0.00 N ATOM 1869 CA ASP A 116 -7.163 21.178 11.775 1.00 0.00 C ATOM 1870 C ASP A 116 -7.214 21.940 13.095 1.00 0.00 C ATOM 1871 O ASP A 116 -7.046 21.358 14.166 1.00 0.00 O ATOM 1872 CB ASP A 116 -8.548 21.174 11.122 1.00 0.00 C ATOM 1873 CG ASP A 116 -8.817 22.437 10.328 1.00 0.00 C ATOM 1874 OD1 ASP A 116 -8.035 22.731 9.399 1.00 0.00 O ATOM 1875 OD2 ASP A 116 -9.809 23.131 10.635 1.00 0.00 O ATOM 0 H ASP A 116 -6.672 19.516 12.955 1.00 0.00 H new ATOM 0 HA ASP A 116 -6.457 21.681 11.114 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -8.634 20.309 10.464 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -9.310 21.064 11.894 1.00 0.00 H new ATOM 1881 N ASN A 117 -7.446 23.247 13.009 1.00 0.00 N ATOM 1882 CA ASN A 117 -7.519 24.089 14.197 1.00 0.00 C ATOM 1883 C ASN A 117 -8.966 24.439 14.526 1.00 0.00 C ATOM 1884 O ASN A 117 -9.514 23.979 15.529 1.00 0.00 O ATOM 1885 CB ASN A 117 -6.706 25.368 13.991 1.00 0.00 C ATOM 1886 CG ASN A 117 -5.273 25.224 14.462 1.00 0.00 C ATOM 1887 OD1 ASN A 117 -4.447 24.600 13.796 1.00 0.00 O ATOM 1888 ND2 ASN A 117 -4.968 25.801 15.619 1.00 0.00 N ATOM 0 H ASN A 117 -7.586 23.745 12.130 1.00 0.00 H new ATOM 0 HA ASN A 117 -7.100 23.532 15.035 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -6.713 25.633 12.934 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -7.182 26.188 14.529 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -4.019 25.736 15.987 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -5.683 26.309 16.140 1.00 0.00 H new ATOM 1895 N TRP A 118 -9.582 25.253 13.676 1.00 0.00 N ATOM 1896 CA TRP A 118 -10.968 25.663 13.877 1.00 0.00 C ATOM 1897 C TRP A 118 -11.926 24.542 13.487 1.00 0.00 C ATOM 1898 O TRP A 118 -12.601 23.965 14.339 1.00 0.00 O ATOM 1899 CB TRP A 118 -11.275 26.919 13.059 1.00 0.00 C ATOM 1900 CG TRP A 118 -10.367 28.068 13.372 1.00 0.00 C ATOM 1901 CD1 TRP A 118 -9.076 28.230 12.959 1.00 0.00 C ATOM 1902 CD2 TRP A 118 -10.681 29.218 14.165 1.00 0.00 C ATOM 1903 NE1 TRP A 118 -8.568 29.410 13.447 1.00 0.00 N ATOM 1904 CE2 TRP A 118 -9.535 30.034 14.190 1.00 0.00 C ATOM 1905 CE3 TRP A 118 -11.822 29.638 14.857 1.00 0.00 C ATOM 1906 CZ2 TRP A 118 -9.496 31.244 14.880 1.00 0.00 C ATOM 1907 CZ3 TRP A 118 -11.781 30.838 15.540 1.00 0.00 C ATOM 1908 CH2 TRP A 118 -10.626 31.629 15.547 1.00 0.00 C ATOM 0 H TRP A 118 -9.144 25.642 12.841 1.00 0.00 H new ATOM 0 HA TRP A 118 -11.106 25.885 14.935 1.00 0.00 H new ATOM 0 HB2 TRP A 118 -11.196 26.681 11.998 1.00 0.00 H new ATOM 0 HB3 TRP A 118 -12.306 27.220 13.242 1.00 0.00 H new ATOM 0 HD1 TRP A 118 -8.533 27.532 12.339 1.00 0.00 H new ATOM 0 HE1 TRP A 118 -7.625 29.763 13.283 1.00 0.00 H new ATOM 0 HE3 TRP A 118 -12.718 29.035 14.857 1.00 0.00 H new ATOM 0 HZ2 TRP A 118 -8.606 31.855 14.888 1.00 0.00 H new ATOM 0 HZ3 TRP A 118 -12.656 31.172 16.078 1.00 0.00 H new ATOM 0 HH2 TRP A 118 -10.627 32.562 16.090 1.00 0.00 H new ATOM 1919 N ASN A 119 -11.979 24.241 12.194 1.00 0.00 N ATOM 1920 CA ASN A 119 -12.853 23.189 11.688 1.00 0.00 C ATOM 1921 C ASN A 119 -12.603 22.943 10.204 1.00 0.00 C ATOM 1922 O ASN A 119 -12.357 23.878 9.443 1.00 0.00 O ATOM 1923 CB ASN A 119 -14.320 23.561 11.915 1.00 0.00 C ATOM 1924 CG ASN A 119 -15.265 22.430 11.560 1.00 0.00 C ATOM 1925 OD1 ASN A 119 -15.714 22.314 10.420 1.00 0.00 O ATOM 1926 ND2 ASN A 119 -15.572 21.586 12.540 1.00 0.00 N ATOM 0 H ASN A 119 -11.427 24.711 11.477 1.00 0.00 H new ATOM 0 HA ASN A 119 -12.630 22.272 12.234 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -14.464 23.837 12.960 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -14.566 24.438 11.316 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -16.203 20.805 12.361 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -15.177 21.720 13.471 1.00 0.00 H new ATOM 1933 N TYR A 120 -12.666 21.679 9.799 1.00 0.00 N ATOM 1934 CA TYR A 120 -12.444 21.313 8.405 1.00 0.00 C ATOM 1935 C TYR A 120 -12.782 19.845 8.166 1.00 0.00 C ATOM 1936 O TYR A 120 -13.000 19.084 9.109 1.00 0.00 O ATOM 1937 CB TYR A 120 -10.991 21.583 8.014 1.00 0.00 C ATOM 1938 CG TYR A 120 -10.804 21.893 6.545 1.00 0.00 C ATOM 1939 CD1 TYR A 120 -11.091 23.155 6.040 1.00 0.00 C ATOM 1940 CD2 TYR A 120 -10.340 20.924 5.665 1.00 0.00 C ATOM 1941 CE1 TYR A 120 -10.922 23.441 4.699 1.00 0.00 C ATOM 1942 CE2 TYR A 120 -10.167 21.203 4.323 1.00 0.00 C ATOM 1943 CZ TYR A 120 -10.460 22.462 3.845 1.00 0.00 C ATOM 1944 OH TYR A 120 -10.289 22.744 2.509 1.00 0.00 O ATOM 0 H TYR A 120 -12.869 20.892 10.415 1.00 0.00 H new ATOM 0 HA TYR A 120 -13.101 21.923 7.785 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -10.615 22.419 8.603 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -10.387 20.713 8.273 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -11.452 23.925 6.706 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -10.111 19.936 6.036 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -11.151 24.427 4.321 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -9.804 20.439 3.652 1.00 0.00 H new ATOM 0 HH TYR A 120 -9.956 21.947 2.046 1.00 0.00 H new ATOM 1954 N ILE A 121 -12.824 19.454 6.897 1.00 0.00 N ATOM 1955 CA ILE A 121 -13.133 18.078 6.529 1.00 0.00 C ATOM 1956 C ILE A 121 -11.854 17.257 6.363 1.00 0.00 C ATOM 1957 O ILE A 121 -10.895 17.712 5.741 1.00 0.00 O ATOM 1958 CB ILE A 121 -13.950 18.021 5.220 1.00 0.00 C ATOM 1959 CG1 ILE A 121 -14.372 16.583 4.910 1.00 0.00 C ATOM 1960 CG2 ILE A 121 -13.148 18.604 4.065 1.00 0.00 C ATOM 1961 CD1 ILE A 121 -15.727 16.215 5.474 1.00 0.00 C ATOM 0 H ILE A 121 -12.648 20.072 6.105 1.00 0.00 H new ATOM 0 HA ILE A 121 -13.729 17.653 7.337 1.00 0.00 H new ATOM 0 HB ILE A 121 -14.851 18.621 5.351 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -14.387 16.443 3.829 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -13.623 15.899 5.310 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -13.739 18.556 3.151 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -12.900 19.643 4.282 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -12.230 18.031 3.934 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -15.960 15.182 5.215 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -15.711 16.323 6.559 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -16.487 16.875 5.055 1.00 0.00 H new ATOM 1973 N PRO A 122 -11.822 16.030 6.916 1.00 0.00 N ATOM 1974 CA PRO A 122 -10.652 15.151 6.821 1.00 0.00 C ATOM 1975 C PRO A 122 -10.188 14.968 5.380 1.00 0.00 C ATOM 1976 O PRO A 122 -10.894 15.329 4.439 1.00 0.00 O ATOM 1977 CB PRO A 122 -11.141 13.816 7.405 1.00 0.00 C ATOM 1978 CG PRO A 122 -12.627 13.937 7.492 1.00 0.00 C ATOM 1979 CD PRO A 122 -12.912 15.398 7.672 1.00 0.00 C ATOM 0 HA PRO A 122 -9.793 15.563 7.350 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -10.852 12.980 6.768 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -10.704 13.634 8.387 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -13.103 13.555 6.589 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -13.018 13.357 8.328 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -13.891 15.672 7.278 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -12.898 15.688 8.723 1.00 0.00 H new ATOM 1987 N LEU A 123 -8.995 14.407 5.214 1.00 0.00 N ATOM 1988 CA LEU A 123 -8.437 14.178 3.887 1.00 0.00 C ATOM 1989 C LEU A 123 -8.423 12.690 3.546 1.00 0.00 C ATOM 1990 O LEU A 123 -7.440 11.995 3.800 1.00 0.00 O ATOM 1991 CB LEU A 123 -7.018 14.745 3.805 1.00 0.00 C ATOM 1992 CG LEU A 123 -6.934 16.225 3.428 1.00 0.00 C ATOM 1993 CD1 LEU A 123 -7.083 17.099 4.664 1.00 0.00 C ATOM 1994 CD2 LEU A 123 -5.621 16.519 2.719 1.00 0.00 C ATOM 0 H LEU A 123 -8.396 14.103 5.982 1.00 0.00 H new ATOM 0 HA LEU A 123 -9.070 14.690 3.162 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -6.530 14.603 4.769 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -6.453 14.167 3.074 1.00 0.00 H new ATOM 0 HG LEU A 123 -7.752 16.455 2.745 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -7.021 18.149 4.377 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -8.049 16.907 5.131 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -6.286 16.868 5.371 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -5.577 17.576 2.458 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -4.789 16.274 3.378 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -5.555 15.918 1.812 1.00 0.00 H new ATOM 2006 N PRO A 124 -9.521 12.180 2.960 1.00 0.00 N ATOM 2007 CA PRO A 124 -9.631 10.770 2.582 1.00 0.00 C ATOM 2008 C PRO A 124 -8.880 10.459 1.291 1.00 0.00 C ATOM 2009 O PRO A 124 -9.030 11.161 0.291 1.00 0.00 O ATOM 2010 CB PRO A 124 -11.134 10.584 2.384 1.00 0.00 C ATOM 2011 CG PRO A 124 -11.619 11.921 1.938 1.00 0.00 C ATOM 2012 CD PRO A 124 -10.742 12.939 2.620 1.00 0.00 C ATOM 0 HA PRO A 124 -9.197 10.106 3.330 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -11.344 9.817 1.639 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -11.621 10.273 3.308 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -11.554 12.016 0.854 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -12.665 12.065 2.209 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -10.520 13.780 1.963 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -11.220 13.347 3.510 1.00 0.00 H new ATOM 2020 N VAL A 125 -8.072 9.404 1.320 1.00 0.00 N ATOM 2021 CA VAL A 125 -7.298 9.006 0.150 1.00 0.00 C ATOM 2022 C VAL A 125 -7.379 7.500 -0.077 1.00 0.00 C ATOM 2023 O VAL A 125 -7.013 6.710 0.794 1.00 0.00 O ATOM 2024 CB VAL A 125 -5.820 9.413 0.289 1.00 0.00 C ATOM 2025 CG1 VAL A 125 -5.073 9.171 -1.014 1.00 0.00 C ATOM 2026 CG2 VAL A 125 -5.705 10.870 0.715 1.00 0.00 C ATOM 0 H VAL A 125 -7.936 8.811 2.139 1.00 0.00 H new ATOM 0 HA VAL A 125 -7.731 9.524 -0.706 1.00 0.00 H new ATOM 0 HB VAL A 125 -5.364 8.795 1.062 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -4.030 9.465 -0.895 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -5.125 8.113 -1.272 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -5.528 9.761 -1.809 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -4.653 11.140 0.808 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -6.178 11.506 -0.033 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -6.202 11.009 1.675 1.00 0.00 H new ATOM 2036 N LEU A 126 -7.859 7.108 -1.252 1.00 0.00 N ATOM 2037 CA LEU A 126 -7.986 5.697 -1.595 1.00 0.00 C ATOM 2038 C LEU A 126 -7.589 5.452 -3.047 1.00 0.00 C ATOM 2039 O LEU A 126 -8.205 5.987 -3.969 1.00 0.00 O ATOM 2040 CB LEU A 126 -9.420 5.221 -1.359 1.00 0.00 C ATOM 2041 CG LEU A 126 -10.504 6.077 -2.018 1.00 0.00 C ATOM 2042 CD1 LEU A 126 -11.680 5.213 -2.447 1.00 0.00 C ATOM 2043 CD2 LEU A 126 -10.965 7.173 -1.068 1.00 0.00 C ATOM 0 H LEU A 126 -8.167 7.749 -1.984 1.00 0.00 H new ATOM 0 HA LEU A 126 -7.312 5.130 -0.953 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -9.512 4.199 -1.726 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -9.605 5.192 -0.285 1.00 0.00 H new ATOM 0 HG LEU A 126 -10.081 6.545 -2.907 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -12.441 5.839 -2.913 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -11.339 4.463 -3.161 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -12.104 4.716 -1.574 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -11.736 7.773 -1.551 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -11.371 6.722 -0.162 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -10.119 7.810 -0.809 1.00 0.00 H new ATOM 2055 N LEU A 127 -6.554 4.641 -3.244 1.00 0.00 N ATOM 2056 CA LEU A 127 -6.075 4.327 -4.586 1.00 0.00 C ATOM 2057 C LEU A 127 -5.507 2.910 -4.644 1.00 0.00 C ATOM 2058 O LEU A 127 -5.086 2.359 -3.626 1.00 0.00 O ATOM 2059 CB LEU A 127 -5.009 5.335 -5.018 1.00 0.00 C ATOM 2060 CG LEU A 127 -5.551 6.637 -5.610 1.00 0.00 C ATOM 2061 CD1 LEU A 127 -4.476 7.711 -5.608 1.00 0.00 C ATOM 2062 CD2 LEU A 127 -6.071 6.403 -7.021 1.00 0.00 C ATOM 0 H LEU A 127 -6.032 4.190 -2.493 1.00 0.00 H new ATOM 0 HA LEU A 127 -6.921 4.388 -5.271 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -4.388 5.577 -4.155 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -4.360 4.861 -5.755 1.00 0.00 H new ATOM 0 HG LEU A 127 -6.379 6.980 -4.990 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -4.879 8.630 -6.033 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -4.149 7.897 -4.585 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -3.627 7.377 -6.205 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -6.453 7.339 -7.428 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -5.261 6.037 -7.651 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -6.872 5.665 -6.996 1.00 0.00 H new ATOM 2074 N PRO A 128 -5.487 2.301 -5.841 1.00 0.00 N ATOM 2075 CA PRO A 128 -4.966 0.942 -6.028 1.00 0.00 C ATOM 2076 C PRO A 128 -3.462 0.861 -5.797 1.00 0.00 C ATOM 2077 O PRO A 128 -2.695 1.662 -6.333 1.00 0.00 O ATOM 2078 CB PRO A 128 -5.301 0.625 -7.488 1.00 0.00 C ATOM 2079 CG PRO A 128 -5.423 1.954 -8.149 1.00 0.00 C ATOM 2080 CD PRO A 128 -5.969 2.887 -7.105 1.00 0.00 C ATOM 0 HA PRO A 128 -5.402 0.240 -5.317 1.00 0.00 H new ATOM 0 HB2 PRO A 128 -4.519 0.023 -7.951 1.00 0.00 H new ATOM 0 HB3 PRO A 128 -6.228 0.058 -7.567 1.00 0.00 H new ATOM 0 HG2 PRO A 128 -4.455 2.299 -8.513 1.00 0.00 H new ATOM 0 HG3 PRO A 128 -6.088 1.901 -9.011 1.00 0.00 H new ATOM 0 HD2 PRO A 128 -5.602 3.904 -7.243 1.00 0.00 H new ATOM 0 HD3 PRO A 128 -7.058 2.934 -7.137 1.00 0.00 H new ATOM 2088 N LEU A 129 -3.044 -0.111 -4.992 1.00 0.00 N ATOM 2089 CA LEU A 129 -1.631 -0.299 -4.686 1.00 0.00 C ATOM 2090 C LEU A 129 -1.170 -1.700 -5.074 1.00 0.00 C ATOM 2091 O LEU A 129 -1.983 -2.561 -5.413 1.00 0.00 O ATOM 2092 CB LEU A 129 -1.374 -0.062 -3.196 1.00 0.00 C ATOM 2093 CG LEU A 129 -1.168 1.401 -2.799 1.00 0.00 C ATOM 2094 CD1 LEU A 129 -2.506 2.112 -2.671 1.00 0.00 C ATOM 2095 CD2 LEU A 129 -0.387 1.494 -1.498 1.00 0.00 C ATOM 0 H LEU A 129 -3.665 -0.781 -4.539 1.00 0.00 H new ATOM 0 HA LEU A 129 -1.061 0.426 -5.267 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -2.216 -0.461 -2.630 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -0.492 -0.630 -2.900 1.00 0.00 H new ATOM 0 HG LEU A 129 -0.591 1.893 -3.582 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -2.340 3.151 -2.388 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -3.030 2.075 -3.626 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -3.108 1.620 -1.907 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -0.249 2.542 -1.230 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -0.938 0.986 -0.706 1.00 0.00 H new ATOM 0 HD23 LEU A 129 0.587 1.021 -1.624 1.00 0.00 H new ATOM 2107 N ALA A 130 0.139 -1.921 -5.022 1.00 0.00 N ATOM 2108 CA ALA A 130 0.712 -3.217 -5.367 1.00 0.00 C ATOM 2109 C ALA A 130 2.012 -3.459 -4.607 1.00 0.00 C ATOM 2110 O ALA A 130 2.942 -2.657 -4.675 1.00 0.00 O ATOM 2111 CB ALA A 130 0.950 -3.306 -6.867 1.00 0.00 C ATOM 0 H ALA A 130 0.824 -1.218 -4.744 1.00 0.00 H new ATOM 0 HA ALA A 130 0.002 -3.991 -5.077 1.00 0.00 H new ATOM 0 HB1 ALA A 130 1.378 -4.278 -7.110 1.00 0.00 H new ATOM 0 HB2 ALA A 130 0.003 -3.184 -7.393 1.00 0.00 H new ATOM 0 HB3 ALA A 130 1.639 -2.519 -7.173 1.00 0.00 H new ATOM 2117 N SER A 131 2.068 -4.571 -3.880 1.00 0.00 N ATOM 2118 CA SER A 131 3.254 -4.917 -3.105 1.00 0.00 C ATOM 2119 C SER A 131 3.785 -6.291 -3.504 1.00 0.00 C ATOM 2120 O SER A 131 3.074 -7.089 -4.114 1.00 0.00 O ATOM 2121 CB SER A 131 2.935 -4.896 -1.609 1.00 0.00 C ATOM 2122 OG SER A 131 3.025 -3.582 -1.087 1.00 0.00 O ATOM 0 H SER A 131 1.307 -5.247 -3.812 1.00 0.00 H new ATOM 0 HA SER A 131 4.024 -4.175 -3.316 1.00 0.00 H new ATOM 0 HB2 SER A 131 1.932 -5.289 -1.442 1.00 0.00 H new ATOM 0 HB3 SER A 131 3.626 -5.550 -1.077 1.00 0.00 H new ATOM 0 HG SER A 131 3.134 -3.623 -0.114 1.00 0.00 H new ATOM 2128 N VAL A 132 5.038 -6.559 -3.154 1.00 0.00 N ATOM 2129 CA VAL A 132 5.665 -7.835 -3.472 1.00 0.00 C ATOM 2130 C VAL A 132 6.350 -8.431 -2.248 1.00 0.00 C ATOM 2131 O VAL A 132 7.038 -7.729 -1.507 1.00 0.00 O ATOM 2132 CB VAL A 132 6.700 -7.685 -4.604 1.00 0.00 C ATOM 2133 CG1 VAL A 132 6.018 -7.278 -5.901 1.00 0.00 C ATOM 2134 CG2 VAL A 132 7.773 -6.679 -4.217 1.00 0.00 C ATOM 0 H VAL A 132 5.640 -5.908 -2.649 1.00 0.00 H new ATOM 0 HA VAL A 132 4.871 -8.504 -3.802 1.00 0.00 H new ATOM 0 HB VAL A 132 7.181 -8.650 -4.762 1.00 0.00 H new ATOM 0 HG11 VAL A 132 6.765 -7.177 -6.689 1.00 0.00 H new ATOM 0 HG12 VAL A 132 5.292 -8.040 -6.185 1.00 0.00 H new ATOM 0 HG13 VAL A 132 5.508 -6.325 -5.760 1.00 0.00 H new ATOM 0 HG21 VAL A 132 8.495 -6.587 -5.029 1.00 0.00 H new ATOM 0 HG22 VAL A 132 7.312 -5.709 -4.029 1.00 0.00 H new ATOM 0 HG23 VAL A 132 8.282 -7.019 -3.315 1.00 0.00 H new ATOM 2144 N GLY A 133 6.157 -9.729 -2.041 1.00 0.00 N ATOM 2145 CA GLY A 133 6.763 -10.397 -0.904 1.00 0.00 C ATOM 2146 C GLY A 133 8.092 -11.040 -1.247 1.00 0.00 C ATOM 2147 O GLY A 133 8.145 -11.996 -2.019 1.00 0.00 O ATOM 0 H GLY A 133 5.592 -10.331 -2.640 1.00 0.00 H new ATOM 0 HA2 GLY A 133 6.909 -9.676 -0.099 1.00 0.00 H new ATOM 0 HA3 GLY A 133 6.080 -11.160 -0.529 1.00 0.00 H new ATOM 2151 N TYR A 134 9.167 -10.514 -0.670 1.00 0.00 N ATOM 2152 CA TYR A 134 10.504 -11.043 -0.917 1.00 0.00 C ATOM 2153 C TYR A 134 11.343 -11.007 0.356 1.00 0.00 C ATOM 2154 O TYR A 134 11.653 -9.937 0.878 1.00 0.00 O ATOM 2155 CB TYR A 134 11.194 -10.244 -2.025 1.00 0.00 C ATOM 2156 CG TYR A 134 11.334 -11.006 -3.324 1.00 0.00 C ATOM 2157 CD1 TYR A 134 12.034 -12.205 -3.376 1.00 0.00 C ATOM 2158 CD2 TYR A 134 10.766 -10.526 -4.498 1.00 0.00 C ATOM 2159 CE1 TYR A 134 12.164 -12.904 -4.561 1.00 0.00 C ATOM 2160 CE2 TYR A 134 10.892 -11.220 -5.686 1.00 0.00 C ATOM 2161 CZ TYR A 134 11.591 -12.407 -5.712 1.00 0.00 C ATOM 2162 OH TYR A 134 11.719 -13.101 -6.894 1.00 0.00 O ATOM 0 H TYR A 134 9.139 -9.722 -0.028 1.00 0.00 H new ATOM 0 HA TYR A 134 10.407 -12.081 -1.237 1.00 0.00 H new ATOM 0 HB2 TYR A 134 10.629 -9.330 -2.209 1.00 0.00 H new ATOM 0 HB3 TYR A 134 12.184 -9.943 -1.682 1.00 0.00 H new ATOM 0 HD1 TYR A 134 12.484 -12.597 -2.476 1.00 0.00 H new ATOM 0 HD2 TYR A 134 10.217 -9.596 -4.481 1.00 0.00 H new ATOM 0 HE1 TYR A 134 12.712 -13.835 -4.585 1.00 0.00 H new ATOM 0 HE2 TYR A 134 10.445 -10.834 -6.590 1.00 0.00 H new ATOM 0 HH TYR A 134 11.155 -13.902 -6.866 1.00 0.00 H new ATOM 2172 N GLY A 135 11.710 -12.185 0.851 1.00 0.00 N ATOM 2173 CA GLY A 135 12.509 -12.264 2.058 1.00 0.00 C ATOM 2174 C GLY A 135 11.818 -11.632 3.253 1.00 0.00 C ATOM 2175 O GLY A 135 10.589 -11.625 3.326 1.00 0.00 O ATOM 0 H GLY A 135 11.468 -13.085 0.437 1.00 0.00 H new ATOM 0 HA2 GLY A 135 12.726 -13.309 2.279 1.00 0.00 H new ATOM 0 HA3 GLY A 135 13.465 -11.768 1.891 1.00 0.00 H new ATOM 2179 N PRO A 136 12.586 -11.090 4.211 1.00 0.00 N ATOM 2180 CA PRO A 136 12.025 -10.454 5.407 1.00 0.00 C ATOM 2181 C PRO A 136 11.440 -9.072 5.123 1.00 0.00 C ATOM 2182 O PRO A 136 10.865 -8.440 6.008 1.00 0.00 O ATOM 2183 CB PRO A 136 13.232 -10.340 6.337 1.00 0.00 C ATOM 2184 CG PRO A 136 14.401 -10.230 5.420 1.00 0.00 C ATOM 2185 CD PRO A 136 14.062 -11.055 4.206 1.00 0.00 C ATOM 0 HA PRO A 136 11.195 -11.027 5.820 1.00 0.00 H new ATOM 0 HB2 PRO A 136 13.153 -9.467 6.985 1.00 0.00 H new ATOM 0 HB3 PRO A 136 13.317 -11.212 6.986 1.00 0.00 H new ATOM 0 HG2 PRO A 136 14.584 -9.191 5.146 1.00 0.00 H new ATOM 0 HG3 PRO A 136 15.308 -10.598 5.900 1.00 0.00 H new ATOM 0 HD2 PRO A 136 14.449 -10.603 3.293 1.00 0.00 H new ATOM 0 HD3 PRO A 136 14.487 -12.057 4.271 1.00 0.00 H new ATOM 2193 N VAL A 137 11.589 -8.605 3.885 1.00 0.00 N ATOM 2194 CA VAL A 137 11.073 -7.297 3.497 1.00 0.00 C ATOM 2195 C VAL A 137 9.959 -7.427 2.463 1.00 0.00 C ATOM 2196 O VAL A 137 9.891 -8.412 1.730 1.00 0.00 O ATOM 2197 CB VAL A 137 12.188 -6.403 2.922 1.00 0.00 C ATOM 2198 CG1 VAL A 137 13.213 -6.070 3.994 1.00 0.00 C ATOM 2199 CG2 VAL A 137 12.851 -7.076 1.730 1.00 0.00 C ATOM 0 H VAL A 137 12.061 -9.112 3.137 1.00 0.00 H new ATOM 0 HA VAL A 137 10.674 -6.835 4.400 1.00 0.00 H new ATOM 0 HB VAL A 137 11.740 -5.470 2.580 1.00 0.00 H new ATOM 0 HG11 VAL A 137 13.992 -5.438 3.568 1.00 0.00 H new ATOM 0 HG12 VAL A 137 12.725 -5.542 4.813 1.00 0.00 H new ATOM 0 HG13 VAL A 137 13.658 -6.991 4.370 1.00 0.00 H new ATOM 0 HG21 VAL A 137 13.636 -6.430 1.337 1.00 0.00 H new ATOM 0 HG22 VAL A 137 13.286 -8.025 2.043 1.00 0.00 H new ATOM 0 HG23 VAL A 137 12.107 -7.256 0.954 1.00 0.00 H new ATOM 2209 N THR A 138 9.088 -6.424 2.412 1.00 0.00 N ATOM 2210 CA THR A 138 7.977 -6.424 1.468 1.00 0.00 C ATOM 2211 C THR A 138 7.854 -5.071 0.775 1.00 0.00 C ATOM 2212 O THR A 138 7.446 -4.084 1.387 1.00 0.00 O ATOM 2213 CB THR A 138 6.670 -6.765 2.186 1.00 0.00 C ATOM 2214 OG1 THR A 138 6.768 -8.017 2.841 1.00 0.00 O ATOM 2215 CG2 THR A 138 5.475 -6.823 1.259 1.00 0.00 C ATOM 0 H THR A 138 9.130 -5.601 3.013 1.00 0.00 H new ATOM 0 HA THR A 138 8.175 -7.183 0.711 1.00 0.00 H new ATOM 0 HB THR A 138 6.515 -5.957 2.901 1.00 0.00 H new ATOM 0 HG1 THR A 138 5.923 -8.216 3.295 1.00 0.00 H new ATOM 0 HG21 THR A 138 4.581 -7.069 1.832 1.00 0.00 H new ATOM 0 HG22 THR A 138 5.341 -5.855 0.777 1.00 0.00 H new ATOM 0 HG23 THR A 138 5.641 -7.587 0.499 1.00 0.00 H new ATOM 2223 N PHE A 139 8.211 -5.032 -0.504 1.00 0.00 N ATOM 2224 CA PHE A 139 8.142 -3.799 -1.281 1.00 0.00 C ATOM 2225 C PHE A 139 6.694 -3.412 -1.561 1.00 0.00 C ATOM 2226 O PHE A 139 5.834 -4.273 -1.742 1.00 0.00 O ATOM 2227 CB PHE A 139 8.905 -3.958 -2.597 1.00 0.00 C ATOM 2228 CG PHE A 139 9.681 -2.734 -2.992 1.00 0.00 C ATOM 2229 CD1 PHE A 139 9.026 -1.595 -3.431 1.00 0.00 C ATOM 2230 CD2 PHE A 139 11.064 -2.723 -2.923 1.00 0.00 C ATOM 2231 CE1 PHE A 139 9.736 -0.467 -3.795 1.00 0.00 C ATOM 2232 CE2 PHE A 139 11.781 -1.597 -3.286 1.00 0.00 C ATOM 2233 CZ PHE A 139 11.116 -0.469 -3.722 1.00 0.00 C ATOM 0 H PHE A 139 8.551 -5.840 -1.025 1.00 0.00 H new ATOM 0 HA PHE A 139 8.604 -3.004 -0.696 1.00 0.00 H new ATOM 0 HB2 PHE A 139 9.591 -4.801 -2.511 1.00 0.00 H new ATOM 0 HB3 PHE A 139 8.198 -4.202 -3.390 1.00 0.00 H new ATOM 0 HD1 PHE A 139 7.948 -1.589 -3.489 1.00 0.00 H new ATOM 0 HD2 PHE A 139 11.589 -3.603 -2.582 1.00 0.00 H new ATOM 0 HE1 PHE A 139 9.214 0.415 -4.136 1.00 0.00 H new ATOM 0 HE2 PHE A 139 12.859 -1.601 -3.228 1.00 0.00 H new ATOM 0 HZ PHE A 139 11.674 0.411 -4.006 1.00 0.00 H new ATOM 2243 N GLN A 140 6.434 -2.109 -1.598 1.00 0.00 N ATOM 2244 CA GLN A 140 5.090 -1.604 -1.859 1.00 0.00 C ATOM 2245 C GLN A 140 5.130 -0.441 -2.844 1.00 0.00 C ATOM 2246 O GLN A 140 6.169 0.192 -3.030 1.00 0.00 O ATOM 2247 CB GLN A 140 4.428 -1.161 -0.553 1.00 0.00 C ATOM 2248 CG GLN A 140 2.945 -0.853 -0.696 1.00 0.00 C ATOM 2249 CD GLN A 140 2.155 -1.201 0.549 1.00 0.00 C ATOM 2250 OE1 GLN A 140 2.717 -0.893 1.712 1.00 0.00 O flip ATOM 2251 NE2 GLN A 140 1.052 -1.742 0.467 1.00 0.00 N flip ATOM 0 H GLN A 140 7.136 -1.384 -1.451 1.00 0.00 H new ATOM 0 HA GLN A 140 4.503 -2.410 -2.300 1.00 0.00 H new ATOM 0 HB2 GLN A 140 4.558 -1.944 0.194 1.00 0.00 H new ATOM 0 HB3 GLN A 140 4.940 -0.275 -0.178 1.00 0.00 H new ATOM 0 HG2 GLN A 140 2.818 0.206 -0.918 1.00 0.00 H new ATOM 0 HG3 GLN A 140 2.543 -1.407 -1.544 1.00 0.00 H new ATOM 0 HE21 GLN A 140 0.658 -1.961 -0.448 1.00 0.00 H new ATOM 0 HE22 GLN A 140 0.532 -1.971 1.314 1.00 0.00 H new ATOM 2260 N MET A 141 3.992 -0.163 -3.473 1.00 0.00 N ATOM 2261 CA MET A 141 3.900 0.925 -4.439 1.00 0.00 C ATOM 2262 C MET A 141 2.444 1.290 -4.715 1.00 0.00 C ATOM 2263 O MET A 141 1.539 0.488 -4.487 1.00 0.00 O ATOM 2264 CB MET A 141 4.600 0.535 -5.744 1.00 0.00 C ATOM 2265 CG MET A 141 5.783 1.426 -6.089 1.00 0.00 C ATOM 2266 SD MET A 141 5.378 2.666 -7.335 1.00 0.00 S ATOM 2267 CE MET A 141 7.016 3.217 -7.806 1.00 0.00 C ATOM 0 H MET A 141 3.122 -0.676 -3.331 1.00 0.00 H new ATOM 0 HA MET A 141 4.397 1.798 -4.015 1.00 0.00 H new ATOM 0 HB2 MET A 141 4.943 -0.497 -5.669 1.00 0.00 H new ATOM 0 HB3 MET A 141 3.878 0.572 -6.559 1.00 0.00 H new ATOM 0 HG2 MET A 141 6.133 1.925 -5.185 1.00 0.00 H new ATOM 0 HG3 MET A 141 6.605 0.808 -6.450 1.00 0.00 H new ATOM 0 HE1 MET A 141 7.144 4.262 -7.524 1.00 0.00 H new ATOM 0 HE2 MET A 141 7.765 2.610 -7.297 1.00 0.00 H new ATOM 0 HE3 MET A 141 7.138 3.115 -8.884 1.00 0.00 H new ATOM 2277 N THR A 142 2.228 2.506 -5.205 1.00 0.00 N ATOM 2278 CA THR A 142 0.883 2.979 -5.514 1.00 0.00 C ATOM 2279 C THR A 142 0.835 3.609 -6.901 1.00 0.00 C ATOM 2280 O THR A 142 1.613 4.511 -7.211 1.00 0.00 O ATOM 2281 CB THR A 142 0.423 3.992 -4.464 1.00 0.00 C ATOM 2282 OG1 THR A 142 0.824 3.588 -3.168 1.00 0.00 O ATOM 2283 CG2 THR A 142 -1.077 4.190 -4.441 1.00 0.00 C ATOM 0 H THR A 142 2.967 3.182 -5.397 1.00 0.00 H new ATOM 0 HA THR A 142 0.210 2.122 -5.500 1.00 0.00 H new ATOM 0 HB THR A 142 0.893 4.934 -4.746 1.00 0.00 H new ATOM 0 HG1 THR A 142 0.522 4.250 -2.511 1.00 0.00 H new ATOM 0 HG21 THR A 142 -1.336 4.920 -3.674 1.00 0.00 H new ATOM 0 HG22 THR A 142 -1.411 4.551 -5.414 1.00 0.00 H new ATOM 0 HG23 THR A 142 -1.566 3.242 -4.218 1.00 0.00 H new ATOM 2291 N TYR A 143 -0.082 3.129 -7.734 1.00 0.00 N ATOM 2292 CA TYR A 143 -0.228 3.647 -9.090 1.00 0.00 C ATOM 2293 C TYR A 143 -1.681 3.574 -9.548 1.00 0.00 C ATOM 2294 O TYR A 143 -2.385 2.606 -9.263 1.00 0.00 O ATOM 2295 CB TYR A 143 0.664 2.866 -10.055 1.00 0.00 C ATOM 2296 CG TYR A 143 0.286 1.408 -10.187 1.00 0.00 C ATOM 2297 CD1 TYR A 143 -0.683 1.002 -11.096 1.00 0.00 C ATOM 2298 CD2 TYR A 143 0.896 0.439 -9.400 1.00 0.00 C ATOM 2299 CE1 TYR A 143 -1.032 -0.330 -11.218 1.00 0.00 C ATOM 2300 CE2 TYR A 143 0.553 -0.895 -9.517 1.00 0.00 C ATOM 2301 CZ TYR A 143 -0.412 -1.273 -10.427 1.00 0.00 C ATOM 2302 OH TYR A 143 -0.757 -2.600 -10.546 1.00 0.00 O ATOM 0 H TYR A 143 -0.735 2.383 -7.495 1.00 0.00 H new ATOM 0 HA TYR A 143 0.080 4.693 -9.088 1.00 0.00 H new ATOM 0 HB2 TYR A 143 0.618 3.335 -11.038 1.00 0.00 H new ATOM 0 HB3 TYR A 143 1.698 2.935 -9.717 1.00 0.00 H new ATOM 0 HD1 TYR A 143 -1.171 1.738 -11.717 1.00 0.00 H new ATOM 0 HD2 TYR A 143 1.650 0.733 -8.685 1.00 0.00 H new ATOM 0 HE1 TYR A 143 -1.787 -0.630 -11.930 1.00 0.00 H new ATOM 0 HE2 TYR A 143 1.038 -1.637 -8.900 1.00 0.00 H new ATOM 0 HH TYR A 143 -0.226 -3.134 -9.918 1.00 0.00 H new ATOM 2312 N ILE A 144 -2.123 4.604 -10.262 1.00 0.00 N ATOM 2313 CA ILE A 144 -3.492 4.658 -10.762 1.00 0.00 C ATOM 2314 C ILE A 144 -3.585 4.083 -12.175 1.00 0.00 C ATOM 2315 O ILE A 144 -3.079 4.680 -13.127 1.00 0.00 O ATOM 2316 CB ILE A 144 -4.029 6.102 -10.773 1.00 0.00 C ATOM 2317 CG1 ILE A 144 -3.757 6.781 -9.429 1.00 0.00 C ATOM 2318 CG2 ILE A 144 -5.517 6.111 -11.087 1.00 0.00 C ATOM 2319 CD1 ILE A 144 -2.490 7.608 -9.415 1.00 0.00 C ATOM 0 H ILE A 144 -1.553 5.413 -10.508 1.00 0.00 H new ATOM 0 HA ILE A 144 -4.100 4.056 -10.086 1.00 0.00 H new ATOM 0 HB ILE A 144 -3.510 6.661 -11.552 1.00 0.00 H new ATOM 0 HG12 ILE A 144 -4.602 7.422 -9.177 1.00 0.00 H new ATOM 0 HG13 ILE A 144 -3.692 6.019 -8.653 1.00 0.00 H new ATOM 0 HG21 ILE A 144 -5.882 7.138 -11.091 1.00 0.00 H new ATOM 0 HG22 ILE A 144 -5.685 5.662 -12.066 1.00 0.00 H new ATOM 0 HG23 ILE A 144 -6.052 5.539 -10.329 1.00 0.00 H new ATOM 0 HD11 ILE A 144 -2.361 8.060 -8.431 1.00 0.00 H new ATOM 0 HD12 ILE A 144 -1.635 6.968 -9.635 1.00 0.00 H new ATOM 0 HD13 ILE A 144 -2.559 8.393 -10.168 1.00 0.00 H new ATOM 2331 N PRO A 145 -4.233 2.914 -12.337 1.00 0.00 N ATOM 2332 CA PRO A 145 -4.384 2.272 -13.647 1.00 0.00 C ATOM 2333 C PRO A 145 -4.934 3.226 -14.701 1.00 0.00 C ATOM 2334 O PRO A 145 -5.558 4.236 -14.374 1.00 0.00 O ATOM 2335 CB PRO A 145 -5.379 1.142 -13.377 1.00 0.00 C ATOM 2336 CG PRO A 145 -5.210 0.827 -11.932 1.00 0.00 C ATOM 2337 CD PRO A 145 -4.869 2.129 -11.261 1.00 0.00 C ATOM 0 HA PRO A 145 -3.428 1.930 -14.045 1.00 0.00 H new ATOM 0 HB2 PRO A 145 -6.400 1.452 -13.598 1.00 0.00 H new ATOM 0 HB3 PRO A 145 -5.169 0.272 -13.999 1.00 0.00 H new ATOM 0 HG2 PRO A 145 -6.123 0.401 -11.516 1.00 0.00 H new ATOM 0 HG3 PRO A 145 -4.419 0.092 -11.783 1.00 0.00 H new ATOM 0 HD2 PRO A 145 -5.758 2.626 -10.873 1.00 0.00 H new ATOM 0 HD3 PRO A 145 -4.193 1.982 -10.418 1.00 0.00 H new ATOM 2345 N GLY A 146 -4.697 2.901 -15.968 1.00 0.00 N ATOM 2346 CA GLY A 146 -5.175 3.740 -17.051 1.00 0.00 C ATOM 2347 C GLY A 146 -4.077 4.598 -17.648 1.00 0.00 C ATOM 2348 O GLY A 146 -2.897 4.263 -17.551 1.00 0.00 O ATOM 0 H GLY A 146 -4.182 2.071 -16.264 1.00 0.00 H new ATOM 0 HA2 GLY A 146 -5.605 3.111 -17.831 1.00 0.00 H new ATOM 0 HA3 GLY A 146 -5.974 4.383 -16.683 1.00 0.00 H new ATOM 2352 N THR A 147 -4.467 5.707 -18.268 1.00 0.00 N ATOM 2353 CA THR A 147 -3.506 6.616 -18.884 1.00 0.00 C ATOM 2354 C THR A 147 -4.207 7.844 -19.454 1.00 0.00 C ATOM 2355 O THR A 147 -5.343 7.763 -19.920 1.00 0.00 O ATOM 2356 CB THR A 147 -2.729 5.899 -19.989 1.00 0.00 C ATOM 2357 OG1 THR A 147 -1.735 6.747 -20.534 1.00 0.00 O ATOM 2358 CG2 THR A 147 -3.607 5.428 -21.129 1.00 0.00 C ATOM 0 H THR A 147 -5.441 5.998 -18.357 1.00 0.00 H new ATOM 0 HA THR A 147 -2.808 6.943 -18.113 1.00 0.00 H new ATOM 0 HB THR A 147 -2.284 5.027 -19.510 1.00 0.00 H new ATOM 0 HG1 THR A 147 -1.248 6.270 -21.238 1.00 0.00 H new ATOM 0 HG21 THR A 147 -2.993 4.928 -21.878 1.00 0.00 H new ATOM 0 HG22 THR A 147 -4.355 4.732 -20.749 1.00 0.00 H new ATOM 0 HG23 THR A 147 -4.106 6.285 -21.582 1.00 0.00 H new ATOM 2366 N TYR A 148 -3.521 8.982 -19.415 1.00 0.00 N ATOM 2367 CA TYR A 148 -4.076 10.228 -19.929 1.00 0.00 C ATOM 2368 C TYR A 148 -3.008 11.043 -20.651 1.00 0.00 C ATOM 2369 O TYR A 148 -3.230 11.534 -21.758 1.00 0.00 O ATOM 2370 CB TYR A 148 -4.679 11.050 -18.788 1.00 0.00 C ATOM 2371 CG TYR A 148 -5.972 11.743 -19.158 1.00 0.00 C ATOM 2372 CD1 TYR A 148 -7.113 11.010 -19.455 1.00 0.00 C ATOM 2373 CD2 TYR A 148 -6.049 13.129 -19.209 1.00 0.00 C ATOM 2374 CE1 TYR A 148 -8.297 11.639 -19.793 1.00 0.00 C ATOM 2375 CE2 TYR A 148 -7.229 13.765 -19.544 1.00 0.00 C ATOM 2376 CZ TYR A 148 -8.349 13.016 -19.836 1.00 0.00 C ATOM 2377 OH TYR A 148 -9.526 13.646 -20.172 1.00 0.00 O ATOM 0 H TYR A 148 -2.579 9.066 -19.032 1.00 0.00 H new ATOM 0 HA TYR A 148 -4.861 9.980 -20.643 1.00 0.00 H new ATOM 0 HB2 TYR A 148 -4.859 10.395 -17.935 1.00 0.00 H new ATOM 0 HB3 TYR A 148 -3.954 11.798 -18.468 1.00 0.00 H new ATOM 0 HD1 TYR A 148 -7.075 9.931 -19.421 1.00 0.00 H new ATOM 0 HD2 TYR A 148 -5.173 13.719 -18.983 1.00 0.00 H new ATOM 0 HE1 TYR A 148 -9.176 11.055 -20.022 1.00 0.00 H new ATOM 0 HE2 TYR A 148 -7.274 14.844 -19.577 1.00 0.00 H new ATOM 0 HH TYR A 148 -9.394 14.617 -20.155 1.00 0.00 H new ATOM 2387 N ASN A 149 -1.849 11.183 -20.017 1.00 0.00 N ATOM 2388 CA ASN A 149 -0.745 11.938 -20.598 1.00 0.00 C ATOM 2389 C ASN A 149 0.570 11.605 -19.900 1.00 0.00 C ATOM 2390 O ASN A 149 1.480 11.039 -20.506 1.00 0.00 O ATOM 2391 CB ASN A 149 -1.020 13.440 -20.502 1.00 0.00 C ATOM 2392 CG ASN A 149 -0.486 14.203 -21.699 1.00 0.00 C ATOM 2393 OD1 ASN A 149 -1.030 14.114 -22.799 1.00 0.00 O ATOM 2394 ND2 ASN A 149 0.586 14.958 -21.488 1.00 0.00 N ATOM 0 H ASN A 149 -1.650 10.783 -19.100 1.00 0.00 H new ATOM 0 HA ASN A 149 -0.659 11.657 -21.648 1.00 0.00 H new ATOM 0 HB2 ASN A 149 -2.094 13.605 -20.419 1.00 0.00 H new ATOM 0 HB3 ASN A 149 -0.566 13.832 -19.592 1.00 0.00 H new ATOM 0 HD21 ASN A 149 0.991 15.494 -22.255 1.00 0.00 H new ATOM 0 HD22 ASN A 149 1.004 15.002 -20.559 1.00 0.00 H new ATOM 2401 N ASN A 150 0.662 11.960 -18.622 1.00 0.00 N ATOM 2402 CA ASN A 150 1.866 11.698 -17.841 1.00 0.00 C ATOM 2403 C ASN A 150 1.684 10.465 -16.962 1.00 0.00 C ATOM 2404 O ASN A 150 2.627 9.704 -16.739 1.00 0.00 O ATOM 2405 CB ASN A 150 2.211 12.910 -16.976 1.00 0.00 C ATOM 2406 CG ASN A 150 3.136 13.881 -17.684 1.00 0.00 C ATOM 2407 OD1 ASN A 150 4.125 13.478 -18.299 1.00 0.00 O ATOM 2408 ND2 ASN A 150 2.822 15.168 -17.600 1.00 0.00 N ATOM 0 H ASN A 150 -0.082 12.429 -18.106 1.00 0.00 H new ATOM 0 HA ASN A 150 2.687 11.511 -18.534 1.00 0.00 H new ATOM 0 HB2 ASN A 150 1.293 13.426 -16.696 1.00 0.00 H new ATOM 0 HB3 ASN A 150 2.681 12.572 -16.053 1.00 0.00 H new ATOM 0 HD21 ASN A 150 3.409 15.867 -18.055 1.00 0.00 H new ATOM 0 HD22 ASN A 150 1.994 15.458 -17.080 1.00 0.00 H new ATOM 2415 N GLY A 151 0.468 10.275 -16.462 1.00 0.00 N ATOM 2416 CA GLY A 151 0.185 9.133 -15.611 1.00 0.00 C ATOM 2417 C GLY A 151 0.433 9.426 -14.144 1.00 0.00 C ATOM 2418 O GLY A 151 0.702 8.515 -13.361 1.00 0.00 O ATOM 0 H GLY A 151 -0.327 10.891 -16.631 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -0.853 8.831 -15.747 1.00 0.00 H new ATOM 0 HA3 GLY A 151 0.805 8.291 -15.920 1.00 0.00 H new ATOM 2422 N ASN A 152 0.342 10.698 -13.771 1.00 0.00 N ATOM 2423 CA ASN A 152 0.558 11.106 -12.387 1.00 0.00 C ATOM 2424 C ASN A 152 1.949 10.702 -11.909 1.00 0.00 C ATOM 2425 O ASN A 152 2.790 10.277 -12.702 1.00 0.00 O ATOM 2426 CB ASN A 152 -0.507 10.488 -11.479 1.00 0.00 C ATOM 2427 CG ASN A 152 -0.980 11.449 -10.406 1.00 0.00 C ATOM 2428 OD1 ASN A 152 -0.989 11.119 -9.220 1.00 0.00 O ATOM 2429 ND2 ASN A 152 -1.377 12.647 -10.818 1.00 0.00 N ATOM 0 H ASN A 152 0.120 11.464 -14.407 1.00 0.00 H new ATOM 0 HA ASN A 152 0.480 12.192 -12.339 1.00 0.00 H new ATOM 0 HB2 ASN A 152 -1.358 10.175 -12.083 1.00 0.00 H new ATOM 0 HB3 ASN A 152 -0.103 9.592 -11.008 1.00 0.00 H new ATOM 0 HD21 ASN A 152 -1.706 13.336 -10.141 1.00 0.00 H new ATOM 0 HD22 ASN A 152 -1.353 12.879 -11.811 1.00 0.00 H new ATOM 2436 N VAL A 153 2.185 10.835 -10.608 1.00 0.00 N ATOM 2437 CA VAL A 153 3.474 10.484 -10.025 1.00 0.00 C ATOM 2438 C VAL A 153 3.380 9.189 -9.224 1.00 0.00 C ATOM 2439 O VAL A 153 2.490 9.027 -8.389 1.00 0.00 O ATOM 2440 CB VAL A 153 4.000 11.602 -9.107 1.00 0.00 C ATOM 2441 CG1 VAL A 153 4.407 12.819 -9.925 1.00 0.00 C ATOM 2442 CG2 VAL A 153 2.955 11.975 -8.066 1.00 0.00 C ATOM 0 H VAL A 153 1.500 11.183 -9.937 1.00 0.00 H new ATOM 0 HA VAL A 153 4.168 10.348 -10.854 1.00 0.00 H new ATOM 0 HB VAL A 153 4.883 11.232 -8.585 1.00 0.00 H new ATOM 0 HG11 VAL A 153 4.776 13.599 -9.259 1.00 0.00 H new ATOM 0 HG12 VAL A 153 5.193 12.539 -10.627 1.00 0.00 H new ATOM 0 HG13 VAL A 153 3.544 13.192 -10.476 1.00 0.00 H new ATOM 0 HG21 VAL A 153 3.345 12.767 -7.426 1.00 0.00 H new ATOM 0 HG22 VAL A 153 2.052 12.324 -8.566 1.00 0.00 H new ATOM 0 HG23 VAL A 153 2.719 11.101 -7.459 1.00 0.00 H new ATOM 2452 N TYR A 154 4.303 8.269 -9.485 1.00 0.00 N ATOM 2453 CA TYR A 154 4.323 6.989 -8.789 1.00 0.00 C ATOM 2454 C TYR A 154 4.808 7.159 -7.353 1.00 0.00 C ATOM 2455 O TYR A 154 5.775 7.876 -7.094 1.00 0.00 O ATOM 2456 CB TYR A 154 5.222 5.995 -9.529 1.00 0.00 C ATOM 2457 CG TYR A 154 4.602 5.445 -10.793 1.00 0.00 C ATOM 2458 CD1 TYR A 154 4.534 6.214 -11.947 1.00 0.00 C ATOM 2459 CD2 TYR A 154 4.084 4.157 -10.832 1.00 0.00 C ATOM 2460 CE1 TYR A 154 3.968 5.716 -13.105 1.00 0.00 C ATOM 2461 CE2 TYR A 154 3.517 3.650 -11.986 1.00 0.00 C ATOM 2462 CZ TYR A 154 3.461 4.433 -13.119 1.00 0.00 C ATOM 2463 OH TYR A 154 2.897 3.933 -14.269 1.00 0.00 O ATOM 0 H TYR A 154 5.046 8.387 -10.173 1.00 0.00 H new ATOM 0 HA TYR A 154 3.305 6.600 -8.767 1.00 0.00 H new ATOM 0 HB2 TYR A 154 6.163 6.485 -9.779 1.00 0.00 H new ATOM 0 HB3 TYR A 154 5.461 5.167 -8.861 1.00 0.00 H new ATOM 0 HD1 TYR A 154 4.930 7.219 -11.939 1.00 0.00 H new ATOM 0 HD2 TYR A 154 4.125 3.541 -9.946 1.00 0.00 H new ATOM 0 HE1 TYR A 154 3.923 6.328 -13.994 1.00 0.00 H new ATOM 0 HE2 TYR A 154 3.120 2.646 -12.000 1.00 0.00 H new ATOM 0 HH TYR A 154 2.590 3.016 -14.111 1.00 0.00 H new ATOM 2473 N PHE A 155 4.129 6.497 -6.421 1.00 0.00 N ATOM 2474 CA PHE A 155 4.491 6.577 -5.011 1.00 0.00 C ATOM 2475 C PHE A 155 5.188 5.299 -4.554 1.00 0.00 C ATOM 2476 O PHE A 155 4.777 4.194 -4.911 1.00 0.00 O ATOM 2477 CB PHE A 155 3.246 6.827 -4.157 1.00 0.00 C ATOM 2478 CG PHE A 155 2.701 8.220 -4.285 1.00 0.00 C ATOM 2479 CD1 PHE A 155 3.217 9.252 -3.517 1.00 0.00 C ATOM 2480 CD2 PHE A 155 1.673 8.499 -5.171 1.00 0.00 C ATOM 2481 CE1 PHE A 155 2.717 10.536 -3.631 1.00 0.00 C ATOM 2482 CE2 PHE A 155 1.170 9.780 -5.289 1.00 0.00 C ATOM 2483 CZ PHE A 155 1.692 10.800 -4.519 1.00 0.00 C ATOM 0 H PHE A 155 3.326 5.900 -6.617 1.00 0.00 H new ATOM 0 HA PHE A 155 5.182 7.410 -4.886 1.00 0.00 H new ATOM 0 HB2 PHE A 155 2.471 6.115 -4.441 1.00 0.00 H new ATOM 0 HB3 PHE A 155 3.488 6.635 -3.112 1.00 0.00 H new ATOM 0 HD1 PHE A 155 4.019 9.051 -2.822 1.00 0.00 H new ATOM 0 HD2 PHE A 155 1.260 7.706 -5.776 1.00 0.00 H new ATOM 0 HE1 PHE A 155 3.127 11.332 -3.027 1.00 0.00 H new ATOM 0 HE2 PHE A 155 0.368 9.984 -5.984 1.00 0.00 H new ATOM 0 HZ PHE A 155 1.300 11.802 -4.611 1.00 0.00 H new ATOM 2493 N ALA A 156 6.242 5.458 -3.760 1.00 0.00 N ATOM 2494 CA ALA A 156 6.995 4.318 -3.253 1.00 0.00 C ATOM 2495 C ALA A 156 6.760 4.127 -1.759 1.00 0.00 C ATOM 2496 O ALA A 156 6.812 5.082 -0.984 1.00 0.00 O ATOM 2497 CB ALA A 156 8.479 4.498 -3.536 1.00 0.00 C ATOM 0 H ALA A 156 6.593 6.365 -3.454 1.00 0.00 H new ATOM 0 HA ALA A 156 6.644 3.424 -3.768 1.00 0.00 H new ATOM 0 HB1 ALA A 156 9.029 3.639 -3.152 1.00 0.00 H new ATOM 0 HB2 ALA A 156 8.637 4.579 -4.611 1.00 0.00 H new ATOM 0 HB3 ALA A 156 8.835 5.405 -3.048 1.00 0.00 H new ATOM 2503 N TRP A 157 6.504 2.885 -1.359 1.00 0.00 N ATOM 2504 CA TRP A 157 6.261 2.569 0.044 1.00 0.00 C ATOM 2505 C TRP A 157 6.963 1.273 0.438 1.00 0.00 C ATOM 2506 O TRP A 157 7.263 0.435 -0.412 1.00 0.00 O ATOM 2507 CB TRP A 157 4.759 2.452 0.310 1.00 0.00 C ATOM 2508 CG TRP A 157 4.047 3.771 0.286 1.00 0.00 C ATOM 2509 CD1 TRP A 157 3.350 4.306 -0.758 1.00 0.00 C ATOM 2510 CD2 TRP A 157 3.969 4.723 1.353 1.00 0.00 C ATOM 2511 NE1 TRP A 157 2.839 5.532 -0.405 1.00 0.00 N ATOM 2512 CE2 TRP A 157 3.205 5.810 0.886 1.00 0.00 C ATOM 2513 CE3 TRP A 157 4.466 4.760 2.658 1.00 0.00 C ATOM 2514 CZ2 TRP A 157 2.930 6.921 1.679 1.00 0.00 C ATOM 2515 CZ3 TRP A 157 4.192 5.864 3.444 1.00 0.00 C ATOM 2516 CH2 TRP A 157 3.430 6.931 2.952 1.00 0.00 C ATOM 0 H TRP A 157 6.460 2.082 -1.986 1.00 0.00 H new ATOM 0 HA TRP A 157 6.667 3.380 0.649 1.00 0.00 H new ATOM 0 HB2 TRP A 157 4.315 1.794 -0.437 1.00 0.00 H new ATOM 0 HB3 TRP A 157 4.605 1.982 1.281 1.00 0.00 H new ATOM 0 HD1 TRP A 157 3.219 3.835 -1.721 1.00 0.00 H new ATOM 0 HE1 TRP A 157 2.279 6.136 -1.006 1.00 0.00 H new ATOM 0 HE3 TRP A 157 5.054 3.941 3.046 1.00 0.00 H new ATOM 0 HZ2 TRP A 157 2.343 7.745 1.302 1.00 0.00 H new ATOM 0 HZ3 TRP A 157 4.572 5.904 4.454 1.00 0.00 H new ATOM 0 HH2 TRP A 157 3.233 7.779 3.591 1.00 0.00 H new ATOM 2527 N MET A 158 7.222 1.117 1.732 1.00 0.00 N ATOM 2528 CA MET A 158 7.890 -0.076 2.238 1.00 0.00 C ATOM 2529 C MET A 158 7.181 -0.615 3.478 1.00 0.00 C ATOM 2530 O MET A 158 6.582 0.143 4.241 1.00 0.00 O ATOM 2531 CB MET A 158 9.352 0.234 2.567 1.00 0.00 C ATOM 2532 CG MET A 158 10.311 -0.880 2.182 1.00 0.00 C ATOM 2533 SD MET A 158 11.986 -0.592 2.784 1.00 0.00 S ATOM 2534 CE MET A 158 12.498 0.762 1.729 1.00 0.00 C ATOM 0 H MET A 158 6.980 1.801 2.449 1.00 0.00 H new ATOM 0 HA MET A 158 7.853 -0.839 1.461 1.00 0.00 H new ATOM 0 HB2 MET A 158 9.646 1.149 2.052 1.00 0.00 H new ATOM 0 HB3 MET A 158 9.442 0.427 3.636 1.00 0.00 H new ATOM 0 HG2 MET A 158 9.943 -1.825 2.581 1.00 0.00 H new ATOM 0 HG3 MET A 158 10.331 -0.978 1.097 1.00 0.00 H new ATOM 0 HE1 MET A 158 13.559 0.960 1.881 1.00 0.00 H new ATOM 0 HE2 MET A 158 12.324 0.497 0.686 1.00 0.00 H new ATOM 0 HE3 MET A 158 11.923 1.654 1.977 1.00 0.00 H new ATOM 2544 N ARG A 159 7.253 -1.928 3.670 1.00 0.00 N ATOM 2545 CA ARG A 159 6.619 -2.569 4.816 1.00 0.00 C ATOM 2546 C ARG A 159 7.363 -3.844 5.206 1.00 0.00 C ATOM 2547 O ARG A 159 7.613 -4.709 4.367 1.00 0.00 O ATOM 2548 CB ARG A 159 5.157 -2.894 4.502 1.00 0.00 C ATOM 2549 CG ARG A 159 4.948 -3.485 3.118 1.00 0.00 C ATOM 2550 CD ARG A 159 3.654 -4.282 3.041 1.00 0.00 C ATOM 2551 NE ARG A 159 3.740 -5.536 3.785 1.00 0.00 N ATOM 2552 CZ ARG A 159 2.920 -6.567 3.597 1.00 0.00 C ATOM 2553 NH1 ARG A 159 1.951 -6.498 2.692 1.00 0.00 N ATOM 2554 NH2 ARG A 159 3.069 -7.671 4.315 1.00 0.00 N ATOM 0 H ARG A 159 7.744 -2.569 3.047 1.00 0.00 H new ATOM 0 HA ARG A 159 6.657 -1.875 5.656 1.00 0.00 H new ATOM 0 HB2 ARG A 159 4.781 -3.595 5.248 1.00 0.00 H new ATOM 0 HB3 ARG A 159 4.564 -1.984 4.593 1.00 0.00 H new ATOM 0 HG2 ARG A 159 4.928 -2.684 2.379 1.00 0.00 H new ATOM 0 HG3 ARG A 159 5.789 -4.130 2.866 1.00 0.00 H new ATOM 0 HD2 ARG A 159 2.834 -3.682 3.435 1.00 0.00 H new ATOM 0 HD3 ARG A 159 3.420 -4.494 1.998 1.00 0.00 H new ATOM 0 HE ARG A 159 4.472 -5.627 4.490 1.00 0.00 H new ATOM 0 HH11 ARG A 159 1.832 -5.651 2.136 1.00 0.00 H new ATOM 0 HH12 ARG A 159 1.326 -7.292 2.553 1.00 0.00 H new ATOM 0 HH21 ARG A 159 3.812 -7.730 5.011 1.00 0.00 H new ATOM 0 HH22 ARG A 159 2.441 -8.462 4.171 1.00 0.00 H new ATOM 2568 N PHE A 160 7.714 -3.950 6.483 1.00 0.00 N ATOM 2569 CA PHE A 160 8.430 -5.118 6.983 1.00 0.00 C ATOM 2570 C PHE A 160 7.482 -6.074 7.700 1.00 0.00 C ATOM 2571 O PHE A 160 6.512 -5.649 8.327 1.00 0.00 O ATOM 2572 CB PHE A 160 9.551 -4.688 7.931 1.00 0.00 C ATOM 2573 CG PHE A 160 10.603 -3.840 7.273 1.00 0.00 C ATOM 2574 CD1 PHE A 160 10.478 -2.461 7.239 1.00 0.00 C ATOM 2575 CD2 PHE A 160 11.714 -4.425 6.687 1.00 0.00 C ATOM 2576 CE1 PHE A 160 11.444 -1.679 6.635 1.00 0.00 C ATOM 2577 CE2 PHE A 160 12.684 -3.647 6.081 1.00 0.00 C ATOM 2578 CZ PHE A 160 12.548 -2.273 6.055 1.00 0.00 C ATOM 0 H PHE A 160 7.515 -3.242 7.190 1.00 0.00 H new ATOM 0 HA PHE A 160 8.864 -5.638 6.129 1.00 0.00 H new ATOM 0 HB2 PHE A 160 9.118 -4.134 8.764 1.00 0.00 H new ATOM 0 HB3 PHE A 160 10.022 -5.577 8.350 1.00 0.00 H new ATOM 0 HD1 PHE A 160 9.616 -1.992 7.690 1.00 0.00 H new ATOM 0 HD2 PHE A 160 11.824 -5.499 6.704 1.00 0.00 H new ATOM 0 HE1 PHE A 160 11.336 -0.605 6.616 1.00 0.00 H new ATOM 0 HE2 PHE A 160 13.547 -4.114 5.629 1.00 0.00 H new ATOM 0 HZ PHE A 160 13.304 -1.664 5.582 1.00 0.00 H new ATOM 2588 N GLN A 161 7.769 -7.368 7.602 1.00 0.00 N ATOM 2589 CA GLN A 161 6.943 -8.386 8.241 1.00 0.00 C ATOM 2590 C GLN A 161 7.688 -9.042 9.399 1.00 0.00 C ATOM 2591 O GLN A 161 8.832 -9.474 9.250 1.00 0.00 O ATOM 2592 CB GLN A 161 6.524 -9.447 7.222 1.00 0.00 C ATOM 2593 CG GLN A 161 5.221 -9.125 6.511 1.00 0.00 C ATOM 2594 CD GLN A 161 4.340 -10.346 6.327 1.00 0.00 C ATOM 2595 OE1 GLN A 161 3.511 -10.662 7.181 1.00 0.00 O ATOM 2596 NE2 GLN A 161 4.517 -11.041 5.209 1.00 0.00 N ATOM 0 H GLN A 161 8.568 -7.737 7.086 1.00 0.00 H new ATOM 0 HA GLN A 161 6.051 -7.900 8.635 1.00 0.00 H new ATOM 0 HB2 GLN A 161 7.315 -9.559 6.480 1.00 0.00 H new ATOM 0 HB3 GLN A 161 6.424 -10.407 7.729 1.00 0.00 H new ATOM 0 HG2 GLN A 161 4.677 -8.372 7.081 1.00 0.00 H new ATOM 0 HG3 GLN A 161 5.441 -8.690 5.536 1.00 0.00 H new ATOM 0 HE21 GLN A 161 5.216 -10.743 4.528 1.00 0.00 H new ATOM 0 HE22 GLN A 161 3.954 -11.873 5.031 1.00 0.00 H new ATOM 2605 N PHE A 162 7.033 -9.116 10.553 1.00 0.00 N ATOM 2606 CA PHE A 162 7.635 -9.720 11.737 1.00 0.00 C ATOM 2607 C PHE A 162 6.756 -10.842 12.281 1.00 0.00 C ATOM 2608 O PHE A 162 5.533 -10.716 12.334 1.00 0.00 O ATOM 2609 CB PHE A 162 7.858 -8.661 12.818 1.00 0.00 C ATOM 2610 CG PHE A 162 9.133 -8.851 13.589 1.00 0.00 C ATOM 2611 CD1 PHE A 162 10.358 -8.547 13.015 1.00 0.00 C ATOM 2612 CD2 PHE A 162 9.108 -9.333 14.888 1.00 0.00 C ATOM 2613 CE1 PHE A 162 11.532 -8.721 13.722 1.00 0.00 C ATOM 2614 CE2 PHE A 162 10.279 -9.509 15.600 1.00 0.00 C ATOM 2615 CZ PHE A 162 11.493 -9.203 15.016 1.00 0.00 C ATOM 0 H PHE A 162 6.086 -8.765 10.694 1.00 0.00 H new ATOM 0 HA PHE A 162 8.597 -10.143 11.449 1.00 0.00 H new ATOM 0 HB2 PHE A 162 7.867 -7.675 12.353 1.00 0.00 H new ATOM 0 HB3 PHE A 162 7.017 -8.679 13.512 1.00 0.00 H new ATOM 0 HD1 PHE A 162 10.395 -8.170 12.004 1.00 0.00 H new ATOM 0 HD2 PHE A 162 8.162 -9.574 15.349 1.00 0.00 H new ATOM 0 HE1 PHE A 162 12.480 -8.480 13.263 1.00 0.00 H new ATOM 0 HE2 PHE A 162 10.245 -9.885 16.612 1.00 0.00 H new ATOM 0 HZ PHE A 162 12.410 -9.340 15.570 1.00 0.00 H new ATOM 2625 N LEU A 163 7.389 -11.939 12.686 1.00 0.00 N ATOM 2626 CA LEU A 163 6.665 -13.083 13.227 1.00 0.00 C ATOM 2627 C LEU A 163 7.523 -13.845 14.231 1.00 0.00 C ATOM 2628 O LEU A 163 8.729 -13.615 14.332 1.00 0.00 O ATOM 2629 CB LEU A 163 6.229 -14.018 12.097 1.00 0.00 C ATOM 2630 CG LEU A 163 7.373 -14.637 11.291 1.00 0.00 C ATOM 2631 CD1 LEU A 163 6.960 -15.991 10.733 1.00 0.00 C ATOM 2632 CD2 LEU A 163 7.800 -13.704 10.170 1.00 0.00 C ATOM 0 H LEU A 163 8.401 -12.059 12.650 1.00 0.00 H new ATOM 0 HA LEU A 163 5.780 -12.710 13.743 1.00 0.00 H new ATOM 0 HB2 LEU A 163 5.628 -14.822 12.522 1.00 0.00 H new ATOM 0 HB3 LEU A 163 5.583 -13.464 11.416 1.00 0.00 H new ATOM 0 HG LEU A 163 8.223 -14.785 11.957 1.00 0.00 H new ATOM 0 HD11 LEU A 163 7.786 -16.417 10.163 1.00 0.00 H new ATOM 0 HD12 LEU A 163 6.703 -16.660 11.554 1.00 0.00 H new ATOM 0 HD13 LEU A 163 6.095 -15.868 10.082 1.00 0.00 H new ATOM 0 HD21 LEU A 163 8.614 -14.160 9.607 1.00 0.00 H new ATOM 0 HD22 LEU A 163 6.955 -13.524 9.505 1.00 0.00 H new ATOM 0 HD23 LEU A 163 8.137 -12.758 10.593 1.00 0.00 H new