USER MOD reduce.3.24.130724 H: found=0, std=0, add=1162, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1163 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 114 TYR OH : rot -130:sc= -0.844 USER MOD Set 1.2: A 166 SER OG : rot 84:sc= 0.0219 USER MOD Set 2.1: A 95 LYS NZ :NH3+ -165:sc= 0 (180deg=0) USER MOD Set 2.2: A 105 LYS NZ :NH3+ -162:sc= 0 (180deg=0) USER MOD Set 3.1: A 31 GLN : amide:sc= -3.72 K(o=-4.8,f=-6.6!) USER MOD Set 3.2: A 35 SER OG : rot -160:sc= 0.197 USER MOD Set 3.3: A 154 HIS : no HE2:sc= -1.23 K(o=-4.8,f=-11!) USER MOD Set 4.1: A 24 SER OG : rot 23:sc= 0.846 USER MOD Set 4.2: A 117 LYS NZ :NH3+ -157:sc= -2.74! (180deg=-3.25!) USER MOD Single : A 6 GLN : amide:sc= -0.38 X(o=-0.38,f=-0.023) USER MOD Single : A 9 LYS NZ :NH3+ -147:sc= -0.0349 (180deg=-0.975) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 ASN : amide:sc= -1.69 X(o=-1.7,f=-1.9) USER MOD Single : A 17 TYR OH : rot -130:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot -46:sc= -0.631 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 180:sc= 0.176 USER MOD Single : A 39 GLN :FLIP amide:sc=-0.00549 F(o=-0.8,f=-0.0055) USER MOD Single : A 40 GLN :FLIP amide:sc= -0.319 F(o=-1.3,f=-0.32) USER MOD Single : A 42 ASN :FLIP amide:sc= -0.743 F(o=-3.7!,f=-0.74) USER MOD Single : A 44 ASN :FLIP amide:sc= 1.11 F(o=-0.85,f=1.1) USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 GLN :FLIP amide:sc= 0 F(o=-0.85,f=0) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= 0.302 X(o=0.3,f=0) USER MOD Single : A 76 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.211) USER MOD Single : A 78 THR OG1 : rot -54:sc= 0.896 USER MOD Single : A 83 GLN :FLIP amide:sc= -0.0946 F(o=-0.8,f=-0.095) USER MOD Single : A 85 MET CE :methyl -121:sc= -0.243 (180deg=-3.99!) USER MOD Single : A 86 ASN : amide:sc= -0.28 X(o=-0.28,f=-0.031) USER MOD Single : A 87 LYS NZ :NH3+ -173:sc= 1.82 (180deg=1.66) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 GLN : amide:sc=-0.00078 X(o=-0.00078,f=-0.02) USER MOD Single : A 97 GLN :FLIP amide:sc= 0 F(o=-0.59,f=0) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 LYS NZ :NH3+ -179:sc= -1.2! (180deg=-1.24!) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 GLN : amide:sc= -0.116 X(o=-0.12,f=-0.12) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 121 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 151 MET CE :methyl 150:sc= -0.18 (180deg=-0.852) USER MOD Single : A 153 THR OG1 : rot 89:sc= 0.959 USER MOD Single : A 157 SER OG : rot 180:sc= 0 USER MOD Single : A 160 THR OG1 : rot 58:sc= 0.922 USER MOD Single : A 161 GLN : amide:sc= -2.77 K(o=-2.8,f=-6.1!) USER MOD Single : A 165 HIS : no HE2:sc= -2.74 K(o=-2.7,f=-9.8!) USER MOD Single : A 168 GLN : amide:sc= -0.16 K(o=-0.16,f=-2.2!) USER MOD Single : A 169 MET CE :methyl 159:sc= -2.56 (180deg=-3.84!) USER MOD Single : A 172 SER OG : rot -72:sc= 0.315 USER MOD Single : A 175 GLN : amide:sc= -0.151 X(o=-0.15,f=-0.0015) USER MOD ----------------------------------------------------------------- ATOM 70 N GLN A 6 6.664 -9.653 -1.989 1.00 42.43 N ATOM 71 CA GLN A 6 5.931 -10.348 -0.938 1.00 62.10 C ATOM 72 C GLN A 6 4.825 -11.216 -1.529 1.00 21.23 C ATOM 73 O GLN A 6 4.414 -12.208 -0.927 1.00 74.31 O ATOM 74 CB GLN A 6 5.335 -9.342 0.048 1.00 33.31 C ATOM 75 CG GLN A 6 6.309 -8.255 0.472 1.00 12.00 C ATOM 76 CD GLN A 6 7.470 -8.796 1.282 1.00 3.44 C ATOM 77 OE1 GLN A 6 7.532 -8.614 2.499 1.00 55.13 O ATOM 78 NE2 GLN A 6 8.400 -9.465 0.611 1.00 21.00 N ATOM 0 HA GLN A 6 6.631 -10.994 -0.408 1.00 62.10 H new ATOM 0 HB2 GLN A 6 4.459 -8.877 -0.405 1.00 33.31 H new ATOM 0 HB3 GLN A 6 4.990 -9.875 0.934 1.00 33.31 H new ATOM 0 HG2 GLN A 6 6.693 -7.751 -0.415 1.00 12.00 H new ATOM 0 HG3 GLN A 6 5.778 -7.506 1.060 1.00 12.00 H new ATOM 0 HE21 GLN A 6 8.309 -9.592 -0.397 1.00 21.00 H new ATOM 0 HE22 GLN A 6 9.205 -9.852 1.103 1.00 21.00 H new ATOM 87 N TRP A 7 4.348 -10.836 -2.708 1.00 62.14 N ATOM 88 CA TRP A 7 3.289 -11.580 -3.380 1.00 72.41 C ATOM 89 C TRP A 7 3.744 -12.998 -3.710 1.00 0.33 C ATOM 90 O TRP A 7 2.935 -13.925 -3.755 1.00 50.41 O ATOM 91 CB TRP A 7 2.862 -10.858 -4.659 1.00 70.10 C ATOM 92 CG TRP A 7 3.802 -11.076 -5.806 1.00 11.30 C ATOM 93 CD1 TRP A 7 3.876 -12.180 -6.607 1.00 3.35 C ATOM 94 CD2 TRP A 7 4.802 -10.167 -6.278 1.00 42.15 C ATOM 95 NE1 TRP A 7 4.863 -12.012 -7.548 1.00 53.23 N ATOM 96 CE2 TRP A 7 5.445 -10.785 -7.369 1.00 10.01 C ATOM 97 CE3 TRP A 7 5.216 -8.891 -5.888 1.00 40.51 C ATOM 98 CZ2 TRP A 7 6.478 -10.169 -8.070 1.00 24.31 C ATOM 99 CZ3 TRP A 7 6.242 -8.281 -6.585 1.00 1.13 C ATOM 100 CH2 TRP A 7 6.863 -8.920 -7.666 1.00 4.20 C ATOM 0 H TRP A 7 4.678 -10.017 -3.219 1.00 62.14 H new ATOM 0 HA TRP A 7 2.437 -11.640 -2.703 1.00 72.41 H new ATOM 0 HB2 TRP A 7 1.867 -11.198 -4.945 1.00 70.10 H new ATOM 0 HB3 TRP A 7 2.788 -9.789 -4.457 1.00 70.10 H new ATOM 0 HD1 TRP A 7 3.251 -13.056 -6.514 1.00 3.35 H new ATOM 0 HE1 TRP A 7 5.121 -12.691 -8.264 1.00 53.23 H new ATOM 0 HE3 TRP A 7 4.743 -8.390 -5.057 1.00 40.51 H new ATOM 0 HZ2 TRP A 7 6.959 -10.660 -8.903 1.00 24.31 H new ATOM 0 HZ3 TRP A 7 6.570 -7.295 -6.291 1.00 1.13 H new ATOM 0 HH2 TRP A 7 7.661 -8.417 -8.191 1.00 4.20 H new ATOM 111 N ASP A 8 5.043 -13.159 -3.939 1.00 35.13 N ATOM 112 CA ASP A 8 5.605 -14.465 -4.263 1.00 3.21 C ATOM 113 C ASP A 8 5.631 -15.366 -3.032 1.00 62.14 C ATOM 114 O ASP A 8 5.322 -16.555 -3.114 1.00 31.15 O ATOM 115 CB ASP A 8 7.019 -14.309 -4.826 1.00 73.13 C ATOM 116 CG ASP A 8 7.036 -13.570 -6.150 1.00 22.11 C ATOM 117 OD1 ASP A 8 6.560 -14.140 -7.154 1.00 53.42 O ATOM 118 OD2 ASP A 8 7.526 -12.422 -6.181 1.00 54.22 O ATOM 0 H ASP A 8 5.726 -12.402 -3.906 1.00 35.13 H new ATOM 0 HA ASP A 8 4.970 -14.930 -5.018 1.00 3.21 H new ATOM 0 HB2 ASP A 8 7.637 -13.773 -4.106 1.00 73.13 H new ATOM 0 HB3 ASP A 8 7.466 -15.295 -4.957 1.00 73.13 H new ATOM 123 N LYS A 9 6.003 -14.793 -1.893 1.00 42.31 N ATOM 124 CA LYS A 9 6.070 -15.543 -0.645 1.00 11.35 C ATOM 125 C LYS A 9 4.685 -16.026 -0.225 1.00 42.13 C ATOM 126 O LYS A 9 4.465 -17.222 -0.037 1.00 73.43 O ATOM 127 CB LYS A 9 6.677 -14.677 0.462 1.00 35.44 C ATOM 128 CG LYS A 9 6.409 -15.204 1.862 1.00 72.03 C ATOM 129 CD LYS A 9 6.880 -16.640 2.017 1.00 73.44 C ATOM 130 CE LYS A 9 8.377 -16.765 1.778 1.00 13.11 C ATOM 131 NZ LYS A 9 8.681 -17.607 0.588 1.00 33.33 N ATOM 0 H LYS A 9 6.263 -13.810 -1.808 1.00 42.31 H new ATOM 0 HA LYS A 9 6.705 -16.414 -0.807 1.00 11.35 H new ATOM 0 HB2 LYS A 9 7.754 -14.608 0.309 1.00 35.44 H new ATOM 0 HB3 LYS A 9 6.278 -13.666 0.381 1.00 35.44 H new ATOM 0 HG2 LYS A 9 6.916 -14.573 2.592 1.00 72.03 H new ATOM 0 HG3 LYS A 9 5.342 -15.145 2.076 1.00 72.03 H new ATOM 0 HD2 LYS A 9 6.639 -16.997 3.018 1.00 73.44 H new ATOM 0 HD3 LYS A 9 6.344 -17.278 1.314 1.00 73.44 H new ATOM 0 HE2 LYS A 9 8.807 -15.773 1.640 1.00 13.11 H new ATOM 0 HE3 LYS A 9 8.850 -17.198 2.659 1.00 13.11 H new ATOM 0 HZ1 LYS A 9 9.570 -18.123 0.746 1.00 33.33 H new ATOM 0 HZ2 LYS A 9 7.908 -18.286 0.437 1.00 33.33 H new ATOM 0 HZ3 LYS A 9 8.778 -17.000 -0.251 1.00 33.33 H new ATOM 145 N VAL A 10 3.754 -15.088 -0.082 1.00 3.22 N ATOM 146 CA VAL A 10 2.390 -15.418 0.312 1.00 21.44 C ATOM 147 C VAL A 10 1.750 -16.383 -0.680 1.00 11.04 C ATOM 148 O VAL A 10 0.897 -17.192 -0.314 1.00 54.30 O ATOM 149 CB VAL A 10 1.515 -14.155 0.421 1.00 65.31 C ATOM 150 CG1 VAL A 10 1.957 -13.300 1.599 1.00 53.45 C ATOM 151 CG2 VAL A 10 1.566 -13.360 -0.875 1.00 32.10 C ATOM 0 H VAL A 10 3.920 -14.093 -0.233 1.00 3.22 H new ATOM 0 HA VAL A 10 2.450 -15.894 1.291 1.00 21.44 H new ATOM 0 HB VAL A 10 0.483 -14.461 0.593 1.00 65.31 H new ATOM 0 HG11 VAL A 10 1.328 -12.412 1.661 1.00 53.45 H new ATOM 0 HG12 VAL A 10 1.865 -13.875 2.521 1.00 53.45 H new ATOM 0 HG13 VAL A 10 2.996 -13.000 1.461 1.00 53.45 H new ATOM 0 HG21 VAL A 10 0.942 -12.471 -0.781 1.00 32.10 H new ATOM 0 HG22 VAL A 10 2.594 -13.062 -1.079 1.00 32.10 H new ATOM 0 HG23 VAL A 10 1.198 -13.977 -1.695 1.00 32.10 H new ATOM 161 N LYS A 11 2.168 -16.293 -1.938 1.00 14.33 N ATOM 162 CA LYS A 11 1.637 -17.158 -2.984 1.00 62.24 C ATOM 163 C LYS A 11 2.158 -18.583 -2.828 1.00 22.30 C ATOM 164 O LYS A 11 1.531 -19.537 -3.289 1.00 23.44 O ATOM 165 CB LYS A 11 2.015 -16.614 -4.364 1.00 73.42 C ATOM 166 CG LYS A 11 1.726 -17.582 -5.499 1.00 54.30 C ATOM 167 CD LYS A 11 1.952 -16.934 -6.855 1.00 23.31 C ATOM 168 CE LYS A 11 3.397 -16.490 -7.026 1.00 31.02 C ATOM 169 NZ LYS A 11 3.676 -16.033 -8.415 1.00 51.23 N ATOM 0 H LYS A 11 2.873 -15.629 -2.258 1.00 14.33 H new ATOM 0 HA LYS A 11 0.551 -17.175 -2.891 1.00 62.24 H new ATOM 0 HB2 LYS A 11 1.471 -15.686 -4.541 1.00 73.42 H new ATOM 0 HB3 LYS A 11 3.077 -16.367 -4.370 1.00 73.42 H new ATOM 0 HG2 LYS A 11 2.366 -18.459 -5.402 1.00 54.30 H new ATOM 0 HG3 LYS A 11 0.696 -17.930 -5.428 1.00 54.30 H new ATOM 0 HD2 LYS A 11 1.691 -17.639 -7.644 1.00 23.31 H new ATOM 0 HD3 LYS A 11 1.291 -16.074 -6.964 1.00 23.31 H new ATOM 0 HE2 LYS A 11 3.614 -15.682 -6.327 1.00 31.02 H new ATOM 0 HE3 LYS A 11 4.063 -17.316 -6.775 1.00 31.02 H new ATOM 0 HZ1 LYS A 11 4.671 -15.739 -8.490 1.00 51.23 H new ATOM 0 HZ2 LYS A 11 3.494 -16.812 -9.080 1.00 51.23 H new ATOM 0 HZ3 LYS A 11 3.059 -15.229 -8.646 1.00 51.23 H new ATOM 183 N ASP A 12 3.307 -18.720 -2.175 1.00 12.13 N ATOM 184 CA ASP A 12 3.910 -20.029 -1.955 1.00 65.13 C ATOM 185 C ASP A 12 3.061 -20.866 -1.004 1.00 25.42 C ATOM 186 O ASP A 12 2.500 -21.890 -1.394 1.00 33.21 O ATOM 187 CB ASP A 12 5.325 -19.875 -1.395 1.00 1.43 C ATOM 188 CG ASP A 12 6.108 -21.172 -1.433 1.00 32.44 C ATOM 189 OD1 ASP A 12 6.260 -21.742 -2.534 1.00 4.32 O ATOM 190 OD2 ASP A 12 6.569 -21.618 -0.361 1.00 74.42 O ATOM 0 H ASP A 12 3.839 -17.940 -1.789 1.00 12.13 H new ATOM 0 HA ASP A 12 3.962 -20.543 -2.915 1.00 65.13 H new ATOM 0 HB2 ASP A 12 5.858 -19.116 -1.967 1.00 1.43 H new ATOM 0 HB3 ASP A 12 5.269 -19.518 -0.367 1.00 1.43 H new ATOM 195 N PHE A 13 2.973 -20.425 0.247 1.00 44.04 N ATOM 196 CA PHE A 13 2.195 -21.135 1.255 1.00 52.42 C ATOM 197 C PHE A 13 0.748 -21.310 0.801 1.00 4.32 C ATOM 198 O PHE A 13 0.081 -22.272 1.178 1.00 72.40 O ATOM 199 CB PHE A 13 2.236 -20.381 2.586 1.00 40.34 C ATOM 200 CG PHE A 13 1.170 -19.330 2.713 1.00 43.15 C ATOM 201 CD1 PHE A 13 -0.102 -19.664 3.148 1.00 71.03 C ATOM 202 CD2 PHE A 13 1.441 -18.008 2.397 1.00 31.23 C ATOM 203 CE1 PHE A 13 -1.085 -18.699 3.265 1.00 63.24 C ATOM 204 CE2 PHE A 13 0.462 -17.039 2.513 1.00 43.24 C ATOM 205 CZ PHE A 13 -0.802 -17.385 2.948 1.00 41.21 C ATOM 0 H PHE A 13 3.431 -19.579 0.586 1.00 44.04 H new ATOM 0 HA PHE A 13 2.637 -22.122 1.391 1.00 52.42 H new ATOM 0 HB2 PHE A 13 2.130 -21.095 3.402 1.00 40.34 H new ATOM 0 HB3 PHE A 13 3.213 -19.911 2.698 1.00 40.34 H new ATOM 0 HD1 PHE A 13 -0.328 -20.690 3.399 1.00 71.03 H new ATOM 0 HD2 PHE A 13 2.428 -17.732 2.056 1.00 31.23 H new ATOM 0 HE1 PHE A 13 -2.073 -18.972 3.604 1.00 63.24 H new ATOM 0 HE2 PHE A 13 0.686 -16.012 2.264 1.00 43.24 H new ATOM 0 HZ PHE A 13 -1.568 -16.629 3.040 1.00 41.21 H new ATOM 215 N ALA A 14 0.271 -20.371 -0.010 1.00 22.31 N ATOM 216 CA ALA A 14 -1.095 -20.422 -0.516 1.00 44.34 C ATOM 217 C ALA A 14 -1.398 -21.779 -1.142 1.00 52.44 C ATOM 218 O ALA A 14 -2.405 -22.409 -0.822 1.00 61.01 O ATOM 219 CB ALA A 14 -1.324 -19.308 -1.528 1.00 22.41 C ATOM 0 H ALA A 14 0.810 -19.567 -0.330 1.00 22.31 H new ATOM 0 HA ALA A 14 -1.774 -20.280 0.325 1.00 44.34 H new ATOM 0 HB1 ALA A 14 -2.348 -19.357 -1.898 1.00 22.41 H new ATOM 0 HB2 ALA A 14 -1.157 -18.343 -1.050 1.00 22.41 H new ATOM 0 HB3 ALA A 14 -0.631 -19.425 -2.361 1.00 22.41 H new ATOM 225 N ASN A 15 -0.521 -22.222 -2.037 1.00 51.12 N ATOM 226 CA ASN A 15 -0.697 -23.504 -2.709 1.00 63.24 C ATOM 227 C ASN A 15 -0.270 -24.656 -1.804 1.00 54.20 C ATOM 228 O ASN A 15 -0.708 -25.793 -1.980 1.00 41.01 O ATOM 229 CB ASN A 15 0.110 -23.537 -4.009 1.00 51.01 C ATOM 230 CG ASN A 15 1.594 -23.729 -3.764 1.00 30.52 C ATOM 231 OD1 ASN A 15 2.367 -22.772 -3.786 1.00 44.01 O ATOM 232 ND2 ASN A 15 1.998 -24.972 -3.528 1.00 63.35 N ATOM 0 H ASN A 15 0.318 -21.712 -2.313 1.00 51.12 H new ATOM 0 HA ASN A 15 -1.755 -23.621 -2.942 1.00 63.24 H new ATOM 0 HB2 ASN A 15 -0.258 -24.345 -4.642 1.00 51.01 H new ATOM 0 HB3 ASN A 15 -0.048 -22.607 -4.555 1.00 51.01 H new ATOM 0 HD21 ASN A 15 2.985 -25.163 -3.355 1.00 63.35 H new ATOM 0 HD22 ASN A 15 1.321 -25.735 -3.519 1.00 63.35 H new ATOM 239 N VAL A 16 0.586 -24.353 -0.834 1.00 2.23 N ATOM 240 CA VAL A 16 1.071 -25.361 0.101 1.00 72.41 C ATOM 241 C VAL A 16 -0.081 -25.989 0.878 1.00 1.01 C ATOM 242 O VAL A 16 -0.349 -27.184 0.754 1.00 21.31 O ATOM 243 CB VAL A 16 2.082 -24.764 1.097 1.00 44.11 C ATOM 244 CG1 VAL A 16 2.365 -25.745 2.225 1.00 53.33 C ATOM 245 CG2 VAL A 16 3.368 -24.376 0.382 1.00 70.41 C ATOM 0 H VAL A 16 0.958 -23.417 -0.675 1.00 2.23 H new ATOM 0 HA VAL A 16 1.568 -26.129 -0.492 1.00 72.41 H new ATOM 0 HB VAL A 16 1.648 -23.863 1.532 1.00 44.11 H new ATOM 0 HG11 VAL A 16 3.082 -25.305 2.919 1.00 53.33 H new ATOM 0 HG12 VAL A 16 1.438 -25.969 2.754 1.00 53.33 H new ATOM 0 HG13 VAL A 16 2.778 -26.665 1.812 1.00 53.33 H new ATOM 0 HG21 VAL A 16 4.071 -23.956 1.101 1.00 70.41 H new ATOM 0 HG22 VAL A 16 3.807 -25.259 -0.082 1.00 70.41 H new ATOM 0 HG23 VAL A 16 3.148 -23.635 -0.386 1.00 70.41 H new ATOM 255 N TYR A 17 -0.759 -25.175 1.679 1.00 35.10 N ATOM 256 CA TYR A 17 -1.882 -25.651 2.479 1.00 52.43 C ATOM 257 C TYR A 17 -2.963 -26.262 1.592 1.00 44.33 C ATOM 258 O TYR A 17 -3.743 -27.105 2.035 1.00 43.14 O ATOM 259 CB TYR A 17 -2.471 -24.504 3.302 1.00 0.20 C ATOM 260 CG TYR A 17 -3.539 -23.721 2.573 1.00 53.04 C ATOM 261 CD1 TYR A 17 -4.848 -24.185 2.510 1.00 25.24 C ATOM 262 CD2 TYR A 17 -3.241 -22.518 1.945 1.00 24.01 C ATOM 263 CE1 TYR A 17 -5.827 -23.474 1.845 1.00 41.25 C ATOM 264 CE2 TYR A 17 -4.214 -21.799 1.278 1.00 23.33 C ATOM 265 CZ TYR A 17 -5.505 -22.281 1.231 1.00 72.34 C ATOM 266 OH TYR A 17 -6.477 -21.569 0.566 1.00 12.02 O ATOM 0 H TYR A 17 -0.551 -24.183 1.792 1.00 35.10 H new ATOM 0 HA TYR A 17 -1.513 -26.423 3.155 1.00 52.43 H new ATOM 0 HB2 TYR A 17 -2.893 -24.908 4.222 1.00 0.20 H new ATOM 0 HB3 TYR A 17 -1.668 -23.825 3.590 1.00 0.20 H new ATOM 0 HD1 TYR A 17 -5.104 -25.118 2.990 1.00 25.24 H new ATOM 0 HD2 TYR A 17 -2.231 -22.138 1.979 1.00 24.01 H new ATOM 0 HE1 TYR A 17 -6.839 -23.849 1.806 1.00 41.25 H new ATOM 0 HE2 TYR A 17 -3.965 -20.865 0.796 1.00 23.33 H new ATOM 0 HH TYR A 17 -6.154 -21.332 -0.328 1.00 12.02 H new ATOM 276 N VAL A 18 -3.001 -25.830 0.335 1.00 75.10 N ATOM 277 CA VAL A 18 -3.984 -26.335 -0.617 1.00 11.24 C ATOM 278 C VAL A 18 -3.595 -27.718 -1.127 1.00 11.22 C ATOM 279 O VAL A 18 -4.449 -28.586 -1.309 1.00 64.05 O ATOM 280 CB VAL A 18 -4.143 -25.383 -1.817 1.00 13.10 C ATOM 281 CG1 VAL A 18 -5.047 -26.001 -2.873 1.00 22.21 C ATOM 282 CG2 VAL A 18 -4.686 -24.037 -1.361 1.00 32.02 C ATOM 0 H VAL A 18 -2.363 -25.132 -0.047 1.00 75.10 H new ATOM 0 HA VAL A 18 -4.934 -26.401 -0.087 1.00 11.24 H new ATOM 0 HB VAL A 18 -3.161 -25.221 -2.262 1.00 13.10 H new ATOM 0 HG11 VAL A 18 -5.148 -25.314 -3.713 1.00 22.21 H new ATOM 0 HG12 VAL A 18 -4.612 -26.938 -3.221 1.00 22.21 H new ATOM 0 HG13 VAL A 18 -6.030 -26.194 -2.443 1.00 22.21 H new ATOM 0 HG21 VAL A 18 -4.792 -23.377 -2.222 1.00 32.02 H new ATOM 0 HG22 VAL A 18 -5.659 -24.178 -0.890 1.00 32.02 H new ATOM 0 HG23 VAL A 18 -3.997 -23.591 -0.644 1.00 32.02 H new ATOM 292 N ASP A 19 -2.301 -27.916 -1.355 1.00 15.23 N ATOM 293 CA ASP A 19 -1.798 -29.195 -1.843 1.00 10.53 C ATOM 294 C ASP A 19 -2.132 -30.318 -0.867 1.00 33.33 C ATOM 295 O ASP A 19 -2.395 -31.450 -1.274 1.00 4.43 O ATOM 296 CB ASP A 19 -0.286 -29.123 -2.058 1.00 44.44 C ATOM 297 CG ASP A 19 0.116 -29.493 -3.473 1.00 32.14 C ATOM 298 OD1 ASP A 19 -0.129 -30.650 -3.876 1.00 11.34 O ATOM 299 OD2 ASP A 19 0.674 -28.626 -4.177 1.00 20.22 O ATOM 0 H ASP A 19 -1.582 -27.207 -1.210 1.00 15.23 H new ATOM 0 HA ASP A 19 -2.283 -29.409 -2.795 1.00 10.53 H new ATOM 0 HB2 ASP A 19 0.062 -28.114 -1.837 1.00 44.44 H new ATOM 0 HB3 ASP A 19 0.210 -29.793 -1.356 1.00 44.44 H new ATOM 304 N ALA A 20 -2.120 -29.998 0.423 1.00 24.21 N ATOM 305 CA ALA A 20 -2.422 -30.980 1.457 1.00 72.21 C ATOM 306 C ALA A 20 -3.916 -31.283 1.506 1.00 62.53 C ATOM 307 O ALA A 20 -4.336 -32.420 1.288 1.00 13.12 O ATOM 308 CB ALA A 20 -1.937 -30.486 2.812 1.00 73.50 C ATOM 0 H ALA A 20 -1.904 -29.066 0.777 1.00 24.21 H new ATOM 0 HA ALA A 20 -1.898 -31.904 1.211 1.00 72.21 H new ATOM 0 HB1 ALA A 20 -2.169 -31.229 3.575 1.00 73.50 H new ATOM 0 HB2 ALA A 20 -0.859 -30.327 2.777 1.00 73.50 H new ATOM 0 HB3 ALA A 20 -2.435 -29.548 3.057 1.00 73.50 H new ATOM 314 N VAL A 21 -4.714 -30.260 1.793 1.00 2.04 N ATOM 315 CA VAL A 21 -6.161 -30.417 1.870 1.00 32.24 C ATOM 316 C VAL A 21 -6.713 -31.052 0.599 1.00 35.22 C ATOM 317 O VAL A 21 -7.665 -31.832 0.644 1.00 71.10 O ATOM 318 CB VAL A 21 -6.861 -29.065 2.102 1.00 52.25 C ATOM 319 CG1 VAL A 21 -6.494 -28.500 3.465 1.00 13.42 C ATOM 320 CG2 VAL A 21 -6.503 -28.084 0.995 1.00 72.20 C ATOM 0 H VAL A 21 -4.382 -29.313 1.976 1.00 2.04 H new ATOM 0 HA VAL A 21 -6.364 -31.072 2.717 1.00 32.24 H new ATOM 0 HB VAL A 21 -7.939 -29.225 2.081 1.00 52.25 H new ATOM 0 HG11 VAL A 21 -6.998 -27.545 3.611 1.00 13.42 H new ATOM 0 HG12 VAL A 21 -6.805 -29.197 4.243 1.00 13.42 H new ATOM 0 HG13 VAL A 21 -5.415 -28.353 3.519 1.00 13.42 H new ATOM 0 HG21 VAL A 21 -7.006 -27.134 1.174 1.00 72.20 H new ATOM 0 HG22 VAL A 21 -5.424 -27.927 0.983 1.00 72.20 H new ATOM 0 HG23 VAL A 21 -6.822 -28.488 0.034 1.00 72.20 H new ATOM 330 N LYS A 22 -6.110 -30.714 -0.535 1.00 41.50 N ATOM 331 CA LYS A 22 -6.539 -31.251 -1.821 1.00 22.23 C ATOM 332 C LYS A 22 -6.184 -32.730 -1.938 1.00 21.03 C ATOM 333 O LYS A 22 -6.947 -33.519 -2.496 1.00 44.22 O ATOM 334 CB LYS A 22 -5.892 -30.468 -2.966 1.00 21.45 C ATOM 335 CG LYS A 22 -6.099 -31.103 -4.330 1.00 22.43 C ATOM 336 CD LYS A 22 -4.888 -31.916 -4.756 1.00 21.42 C ATOM 337 CE LYS A 22 -5.264 -32.990 -5.766 1.00 14.43 C ATOM 338 NZ LYS A 22 -4.869 -32.611 -7.151 1.00 30.13 N ATOM 0 H LYS A 22 -5.321 -30.070 -0.590 1.00 41.50 H new ATOM 0 HA LYS A 22 -7.622 -31.149 -1.886 1.00 22.23 H new ATOM 0 HB2 LYS A 22 -6.299 -29.457 -2.980 1.00 21.45 H new ATOM 0 HB3 LYS A 22 -4.823 -30.378 -2.775 1.00 21.45 H new ATOM 0 HG2 LYS A 22 -6.979 -31.746 -4.303 1.00 22.43 H new ATOM 0 HG3 LYS A 22 -6.295 -30.325 -5.068 1.00 22.43 H new ATOM 0 HD2 LYS A 22 -4.138 -31.254 -5.189 1.00 21.42 H new ATOM 0 HD3 LYS A 22 -4.435 -32.381 -3.881 1.00 21.42 H new ATOM 0 HE2 LYS A 22 -4.781 -33.929 -5.495 1.00 14.43 H new ATOM 0 HE3 LYS A 22 -6.340 -33.162 -5.729 1.00 14.43 H new ATOM 0 HZ1 LYS A 22 -5.142 -33.368 -7.809 1.00 30.13 H new ATOM 0 HZ2 LYS A 22 -5.349 -31.729 -7.420 1.00 30.13 H new ATOM 0 HZ3 LYS A 22 -3.839 -32.471 -7.192 1.00 30.13 H new ATOM 352 N ASP A 23 -5.024 -33.099 -1.407 1.00 5.03 N ATOM 353 CA ASP A 23 -4.569 -34.484 -1.449 1.00 50.05 C ATOM 354 C ASP A 23 -5.443 -35.370 -0.567 1.00 24.11 C ATOM 355 O ASP A 23 -5.651 -36.546 -0.864 1.00 75.14 O ATOM 356 CB ASP A 23 -3.109 -34.578 -1.002 1.00 74.22 C ATOM 357 CG ASP A 23 -2.568 -35.992 -1.088 1.00 43.52 C ATOM 358 OD1 ASP A 23 -3.202 -36.830 -1.762 1.00 62.52 O ATOM 359 OD2 ASP A 23 -1.509 -36.259 -0.482 1.00 51.53 O ATOM 0 H ASP A 23 -4.381 -32.458 -0.942 1.00 5.03 H new ATOM 0 HA ASP A 23 -4.648 -34.836 -2.478 1.00 50.05 H new ATOM 0 HB2 ASP A 23 -2.499 -33.920 -1.621 1.00 74.22 H new ATOM 0 HB3 ASP A 23 -3.022 -34.220 0.024 1.00 74.22 H new ATOM 364 N SER A 24 -5.950 -34.798 0.520 1.00 4.53 N ATOM 365 CA SER A 24 -6.797 -35.537 1.449 1.00 4.41 C ATOM 366 C SER A 24 -8.184 -35.763 0.856 1.00 31.14 C ATOM 367 O SER A 24 -8.847 -36.754 1.160 1.00 63.34 O ATOM 368 CB SER A 24 -6.913 -34.784 2.776 1.00 41.22 C ATOM 369 OG SER A 24 -7.054 -33.390 2.561 1.00 63.23 O ATOM 0 H SER A 24 -5.789 -33.825 0.779 1.00 4.53 H new ATOM 0 HA SER A 24 -6.336 -36.508 1.630 1.00 4.41 H new ATOM 0 HB2 SER A 24 -7.771 -35.157 3.336 1.00 41.22 H new ATOM 0 HB3 SER A 24 -6.028 -34.974 3.384 1.00 41.22 H new ATOM 0 HG SER A 24 -7.406 -33.232 1.660 1.00 63.23 H new ATOM 375 N GLY A 25 -8.617 -34.835 0.008 1.00 14.05 N ATOM 376 CA GLY A 25 -9.923 -34.950 -0.614 1.00 33.52 C ATOM 377 C GLY A 25 -9.987 -36.081 -1.621 1.00 75.14 C ATOM 378 O GLY A 25 -10.979 -36.808 -1.686 1.00 62.31 O ATOM 0 H GLY A 25 -8.087 -34.006 -0.259 1.00 14.05 H new ATOM 0 HA2 GLY A 25 -10.676 -35.111 0.157 1.00 33.52 H new ATOM 0 HA3 GLY A 25 -10.170 -34.011 -1.110 1.00 33.52 H new ATOM 382 N ARG A 26 -8.929 -36.229 -2.411 1.00 4.11 N ATOM 383 CA ARG A 26 -8.870 -37.277 -3.422 1.00 71.33 C ATOM 384 C ARG A 26 -8.858 -38.658 -2.774 1.00 23.44 C ATOM 385 O ARG A 26 -9.442 -39.607 -3.298 1.00 41.20 O ATOM 386 CB ARG A 26 -7.628 -37.102 -4.298 1.00 20.12 C ATOM 387 CG ARG A 26 -7.373 -38.272 -5.234 1.00 42.11 C ATOM 388 CD ARG A 26 -8.576 -38.548 -6.122 1.00 52.50 C ATOM 389 NE ARG A 26 -8.252 -39.460 -7.216 1.00 11.44 N ATOM 390 CZ ARG A 26 -9.148 -39.910 -8.087 1.00 20.34 C ATOM 391 NH1 ARG A 26 -10.416 -39.535 -7.993 1.00 11.14 N ATOM 392 NH2 ARG A 26 -8.776 -40.738 -9.055 1.00 22.03 N ATOM 0 H ARG A 26 -8.100 -35.636 -2.370 1.00 4.11 H new ATOM 0 HA ARG A 26 -9.760 -37.195 -4.046 1.00 71.33 H new ATOM 0 HB2 ARG A 26 -7.736 -36.192 -4.888 1.00 20.12 H new ATOM 0 HB3 ARG A 26 -6.758 -36.965 -3.656 1.00 20.12 H new ATOM 0 HG2 ARG A 26 -6.502 -38.060 -5.855 1.00 42.11 H new ATOM 0 HG3 ARG A 26 -7.139 -39.162 -4.650 1.00 42.11 H new ATOM 0 HD2 ARG A 26 -9.380 -38.974 -5.521 1.00 52.50 H new ATOM 0 HD3 ARG A 26 -8.947 -37.609 -6.531 1.00 52.50 H new ATOM 0 HE ARG A 26 -7.285 -39.768 -7.317 1.00 11.44 H new ATOM 0 HH11 ARG A 26 -10.706 -38.899 -7.250 1.00 11.14 H new ATOM 0 HH12 ARG A 26 -11.102 -39.882 -8.664 1.00 11.14 H new ATOM 0 HH21 ARG A 26 -7.801 -41.029 -9.130 1.00 22.03 H new ATOM 0 HH22 ARG A 26 -9.465 -41.083 -9.724 1.00 22.03 H new ATOM 406 N ASP A 27 -8.188 -38.764 -1.631 1.00 40.42 N ATOM 407 CA ASP A 27 -8.100 -40.028 -0.910 1.00 64.34 C ATOM 408 C ASP A 27 -9.350 -40.263 -0.069 1.00 53.30 C ATOM 409 O ASP A 27 -9.775 -41.402 0.126 1.00 2.23 O ATOM 410 CB ASP A 27 -6.858 -40.045 -0.017 1.00 53.10 C ATOM 411 CG ASP A 27 -5.891 -41.151 -0.391 1.00 3.42 C ATOM 412 OD1 ASP A 27 -5.227 -41.028 -1.441 1.00 40.42 O ATOM 413 OD2 ASP A 27 -5.798 -42.139 0.367 1.00 61.54 O ATOM 0 H ASP A 27 -7.698 -37.989 -1.184 1.00 40.42 H new ATOM 0 HA ASP A 27 -8.022 -40.831 -1.643 1.00 64.34 H new ATOM 0 HB2 ASP A 27 -6.350 -39.083 -0.088 1.00 53.10 H new ATOM 0 HB3 ASP A 27 -7.163 -40.169 1.022 1.00 53.10 H new ATOM 418 N TYR A 28 -9.935 -39.178 0.427 1.00 22.24 N ATOM 419 CA TYR A 28 -11.135 -39.266 1.251 1.00 42.20 C ATOM 420 C TYR A 28 -12.342 -39.676 0.413 1.00 22.31 C ATOM 421 O TYR A 28 -13.249 -40.353 0.899 1.00 44.33 O ATOM 422 CB TYR A 28 -11.408 -37.926 1.936 1.00 5.31 C ATOM 423 CG TYR A 28 -12.802 -37.811 2.509 1.00 72.14 C ATOM 424 CD1 TYR A 28 -13.255 -38.704 3.471 1.00 30.55 C ATOM 425 CD2 TYR A 28 -13.667 -36.808 2.087 1.00 20.32 C ATOM 426 CE1 TYR A 28 -14.529 -38.604 3.997 1.00 42.25 C ATOM 427 CE2 TYR A 28 -14.942 -36.699 2.608 1.00 61.22 C ATOM 428 CZ TYR A 28 -15.368 -37.599 3.562 1.00 73.52 C ATOM 429 OH TYR A 28 -16.637 -37.495 4.083 1.00 14.05 O ATOM 0 H TYR A 28 -9.598 -38.228 0.273 1.00 22.24 H new ATOM 0 HA TYR A 28 -10.967 -40.028 2.012 1.00 42.20 H new ATOM 0 HB2 TYR A 28 -10.682 -37.782 2.737 1.00 5.31 H new ATOM 0 HB3 TYR A 28 -11.253 -37.122 1.217 1.00 5.31 H new ATOM 0 HD1 TYR A 28 -12.600 -39.491 3.814 1.00 30.55 H new ATOM 0 HD2 TYR A 28 -13.337 -36.102 1.339 1.00 20.32 H new ATOM 0 HE1 TYR A 28 -14.866 -39.308 4.744 1.00 42.25 H new ATOM 0 HE2 TYR A 28 -15.601 -35.913 2.270 1.00 61.22 H new ATOM 0 HH TYR A 28 -17.056 -38.381 4.104 1.00 14.05 H new ATOM 439 N VAL A 29 -12.346 -39.262 -0.850 1.00 65.11 N ATOM 440 CA VAL A 29 -13.439 -39.587 -1.758 1.00 71.20 C ATOM 441 C VAL A 29 -13.294 -41.001 -2.309 1.00 61.12 C ATOM 442 O VAL A 29 -14.285 -41.661 -2.622 1.00 64.21 O ATOM 443 CB VAL A 29 -13.507 -38.594 -2.933 1.00 64.25 C ATOM 444 CG1 VAL A 29 -12.278 -38.732 -3.820 1.00 53.31 C ATOM 445 CG2 VAL A 29 -14.781 -38.806 -3.737 1.00 63.30 C ATOM 0 H VAL A 29 -11.604 -38.700 -1.268 1.00 65.11 H new ATOM 0 HA VAL A 29 -14.361 -39.518 -1.181 1.00 71.20 H new ATOM 0 HB VAL A 29 -13.524 -37.581 -2.530 1.00 64.25 H new ATOM 0 HG11 VAL A 29 -12.343 -38.023 -4.645 1.00 53.31 H new ATOM 0 HG12 VAL A 29 -11.382 -38.526 -3.235 1.00 53.31 H new ATOM 0 HG13 VAL A 29 -12.227 -39.746 -4.217 1.00 53.31 H new ATOM 0 HG21 VAL A 29 -14.812 -38.096 -4.563 1.00 63.30 H new ATOM 0 HG22 VAL A 29 -14.798 -39.822 -4.131 1.00 63.30 H new ATOM 0 HG23 VAL A 29 -15.647 -38.652 -3.093 1.00 63.30 H new ATOM 455 N SER A 30 -12.052 -41.461 -2.425 1.00 10.40 N ATOM 456 CA SER A 30 -11.776 -42.796 -2.942 1.00 32.03 C ATOM 457 C SER A 30 -12.263 -43.866 -1.969 1.00 62.12 C ATOM 458 O SER A 30 -12.894 -44.843 -2.371 1.00 22.31 O ATOM 459 CB SER A 30 -10.278 -42.967 -3.198 1.00 64.20 C ATOM 460 OG SER A 30 -10.043 -43.642 -4.422 1.00 34.33 O ATOM 0 H SER A 30 -11.221 -40.928 -2.168 1.00 10.40 H new ATOM 0 HA SER A 30 -12.313 -42.913 -3.883 1.00 32.03 H new ATOM 0 HB2 SER A 30 -9.796 -41.990 -3.220 1.00 64.20 H new ATOM 0 HB3 SER A 30 -9.827 -43.527 -2.378 1.00 64.20 H new ATOM 0 HG SER A 30 -9.078 -43.737 -4.563 1.00 34.33 H new ATOM 466 N GLN A 31 -11.964 -43.673 -0.689 1.00 11.24 N ATOM 467 CA GLN A 31 -12.370 -44.621 0.342 1.00 72.44 C ATOM 468 C GLN A 31 -13.889 -44.664 0.474 1.00 70.53 C ATOM 469 O GLN A 31 -14.504 -45.723 0.341 1.00 52.42 O ATOM 470 CB GLN A 31 -11.740 -44.249 1.685 1.00 51.33 C ATOM 471 CG GLN A 31 -11.929 -45.307 2.760 1.00 42.23 C ATOM 472 CD GLN A 31 -13.321 -45.288 3.359 1.00 11.01 C ATOM 473 OE1 GLN A 31 -13.661 -44.399 4.141 1.00 60.41 O ATOM 474 NE2 GLN A 31 -14.136 -46.271 2.995 1.00 71.11 N ATOM 0 H GLN A 31 -11.442 -42.869 -0.341 1.00 11.24 H new ATOM 0 HA GLN A 31 -12.021 -45.611 0.047 1.00 72.44 H new ATOM 0 HB2 GLN A 31 -10.674 -44.076 1.541 1.00 51.33 H new ATOM 0 HB3 GLN A 31 -12.171 -43.310 2.031 1.00 51.33 H new ATOM 0 HG2 GLN A 31 -11.734 -46.291 2.334 1.00 42.23 H new ATOM 0 HG3 GLN A 31 -11.195 -45.151 3.551 1.00 42.23 H new ATOM 0 HE21 GLN A 31 -13.813 -46.987 2.344 1.00 71.11 H new ATOM 0 HE22 GLN A 31 -15.085 -46.310 3.366 1.00 71.11 H new ATOM 483 N PHE A 32 -14.488 -43.508 0.736 1.00 12.23 N ATOM 484 CA PHE A 32 -15.936 -43.414 0.888 1.00 45.42 C ATOM 485 C PHE A 32 -16.649 -44.010 -0.322 1.00 20.42 C ATOM 486 O PHE A 32 -17.497 -44.891 -0.182 1.00 51.14 O ATOM 487 CB PHE A 32 -16.356 -41.954 1.074 1.00 73.35 C ATOM 488 CG PHE A 32 -17.417 -41.765 2.120 1.00 54.24 C ATOM 489 CD1 PHE A 32 -18.630 -42.427 2.023 1.00 74.43 C ATOM 490 CD2 PHE A 32 -17.202 -40.925 3.200 1.00 44.41 C ATOM 491 CE1 PHE A 32 -19.609 -42.254 2.983 1.00 23.15 C ATOM 492 CE2 PHE A 32 -18.176 -40.748 4.164 1.00 11.41 C ATOM 493 CZ PHE A 32 -19.381 -41.414 4.056 1.00 22.21 C ATOM 0 H PHE A 32 -13.994 -42.623 0.848 1.00 12.23 H new ATOM 0 HA PHE A 32 -16.222 -43.983 1.773 1.00 45.42 H new ATOM 0 HB2 PHE A 32 -15.480 -41.364 1.345 1.00 73.35 H new ATOM 0 HB3 PHE A 32 -16.721 -41.565 0.123 1.00 73.35 H new ATOM 0 HD1 PHE A 32 -18.813 -43.086 1.187 1.00 74.43 H new ATOM 0 HD2 PHE A 32 -16.261 -40.402 3.290 1.00 44.41 H new ATOM 0 HE1 PHE A 32 -20.551 -42.775 2.895 1.00 23.15 H new ATOM 0 HE2 PHE A 32 -17.995 -40.090 5.001 1.00 11.41 H new ATOM 0 HZ PHE A 32 -20.144 -41.278 4.809 1.00 22.21 H new ATOM 503 N GLU A 33 -16.298 -43.523 -1.508 1.00 35.20 N ATOM 504 CA GLU A 33 -16.906 -44.007 -2.742 1.00 34.42 C ATOM 505 C GLU A 33 -16.662 -45.503 -2.918 1.00 61.32 C ATOM 506 O GLU A 33 -17.468 -46.207 -3.527 1.00 23.33 O ATOM 507 CB GLU A 33 -16.350 -43.243 -3.945 1.00 23.11 C ATOM 508 CG GLU A 33 -16.933 -43.692 -5.274 1.00 62.31 C ATOM 509 CD GLU A 33 -16.396 -42.894 -6.446 1.00 52.22 C ATOM 510 OE1 GLU A 33 -15.261 -43.175 -6.885 1.00 32.31 O ATOM 511 OE2 GLU A 33 -17.110 -41.988 -6.924 1.00 72.04 O ATOM 0 H GLU A 33 -15.597 -42.794 -1.640 1.00 35.20 H new ATOM 0 HA GLU A 33 -17.981 -43.837 -2.678 1.00 34.42 H new ATOM 0 HB2 GLU A 33 -16.548 -42.179 -3.812 1.00 23.11 H new ATOM 0 HB3 GLU A 33 -15.267 -43.365 -3.973 1.00 23.11 H new ATOM 0 HG2 GLU A 33 -16.710 -44.748 -5.426 1.00 62.31 H new ATOM 0 HG3 GLU A 33 -18.018 -43.597 -5.241 1.00 62.31 H new ATOM 518 N SER A 34 -15.544 -45.981 -2.382 1.00 23.52 N ATOM 519 CA SER A 34 -15.190 -47.392 -2.483 1.00 62.52 C ATOM 520 C SER A 34 -15.987 -48.226 -1.484 1.00 41.41 C ATOM 521 O SER A 34 -16.209 -49.419 -1.691 1.00 42.52 O ATOM 522 CB SER A 34 -13.691 -47.583 -2.242 1.00 50.31 C ATOM 523 OG SER A 34 -13.351 -48.958 -2.206 1.00 1.11 O ATOM 0 H SER A 34 -14.867 -45.412 -1.873 1.00 23.52 H new ATOM 0 HA SER A 34 -15.435 -47.730 -3.490 1.00 62.52 H new ATOM 0 HB2 SER A 34 -13.127 -47.086 -3.031 1.00 50.31 H new ATOM 0 HB3 SER A 34 -13.408 -47.110 -1.302 1.00 50.31 H new ATOM 0 HG SER A 34 -12.388 -49.053 -2.052 1.00 1.11 H new ATOM 529 N SER A 35 -16.415 -47.588 -0.399 1.00 40.55 N ATOM 530 CA SER A 35 -17.184 -48.269 0.635 1.00 73.32 C ATOM 531 C SER A 35 -18.539 -48.719 0.097 1.00 54.45 C ATOM 532 O SER A 35 -18.915 -49.884 0.225 1.00 52.24 O ATOM 533 CB SER A 35 -17.382 -47.351 1.842 1.00 4.13 C ATOM 534 OG SER A 35 -16.489 -47.687 2.890 1.00 23.11 O ATOM 0 H SER A 35 -16.242 -46.600 -0.214 1.00 40.55 H new ATOM 0 HA SER A 35 -16.625 -49.151 0.946 1.00 73.32 H new ATOM 0 HB2 SER A 35 -17.225 -46.314 1.544 1.00 4.13 H new ATOM 0 HB3 SER A 35 -18.410 -47.428 2.197 1.00 4.13 H new ATOM 0 HG SER A 35 -16.827 -47.326 3.736 1.00 23.11 H new ATOM 540 N SER A 36 -19.269 -47.785 -0.506 1.00 63.13 N ATOM 541 CA SER A 36 -20.584 -48.083 -1.061 1.00 40.42 C ATOM 542 C SER A 36 -20.487 -49.154 -2.143 1.00 54.44 C ATOM 543 O SER A 36 -21.037 -50.247 -2.002 1.00 54.25 O ATOM 544 CB SER A 36 -21.216 -46.814 -1.638 1.00 33.42 C ATOM 545 OG SER A 36 -20.365 -45.695 -1.463 1.00 62.22 O ATOM 0 H SER A 36 -18.972 -46.816 -0.622 1.00 63.13 H new ATOM 0 HA SER A 36 -21.214 -48.461 -0.256 1.00 40.42 H new ATOM 0 HB2 SER A 36 -21.421 -46.956 -2.699 1.00 33.42 H new ATOM 0 HB3 SER A 36 -22.173 -46.627 -1.151 1.00 33.42 H new ATOM 0 HG SER A 36 -20.791 -44.898 -1.841 1.00 62.22 H new ATOM 551 N LEU A 37 -19.785 -48.832 -3.224 1.00 23.01 N ATOM 552 CA LEU A 37 -19.615 -49.766 -4.332 1.00 3.41 C ATOM 553 C LEU A 37 -18.980 -51.068 -3.854 1.00 55.02 C ATOM 554 O LEU A 37 -19.232 -52.134 -4.414 1.00 23.54 O ATOM 555 CB LEU A 37 -18.752 -49.136 -5.427 1.00 62.40 C ATOM 556 CG LEU A 37 -19.294 -49.242 -6.853 1.00 30.52 C ATOM 557 CD1 LEU A 37 -18.614 -48.228 -7.759 1.00 61.43 C ATOM 558 CD2 LEU A 37 -19.105 -50.653 -7.392 1.00 35.15 C ATOM 0 H LEU A 37 -19.324 -47.932 -3.357 1.00 23.01 H new ATOM 0 HA LEU A 37 -20.600 -49.992 -4.739 1.00 3.41 H new ATOM 0 HB2 LEU A 37 -18.613 -48.081 -5.190 1.00 62.40 H new ATOM 0 HB3 LEU A 37 -17.767 -49.602 -5.399 1.00 62.40 H new ATOM 0 HG LEU A 37 -20.361 -49.022 -6.833 1.00 30.52 H new ATOM 0 HD11 LEU A 37 -19.012 -48.318 -8.770 1.00 61.43 H new ATOM 0 HD12 LEU A 37 -18.801 -47.222 -7.384 1.00 61.43 H new ATOM 0 HD13 LEU A 37 -17.540 -48.416 -7.774 1.00 61.43 H new ATOM 0 HD21 LEU A 37 -19.496 -50.710 -8.408 1.00 35.15 H new ATOM 0 HD22 LEU A 37 -18.044 -50.901 -7.398 1.00 35.15 H new ATOM 0 HD23 LEU A 37 -19.639 -51.360 -6.757 1.00 35.15 H new ATOM 570 N GLY A 38 -18.158 -50.973 -2.814 1.00 22.12 N ATOM 571 CA GLY A 38 -17.502 -52.151 -2.277 1.00 30.12 C ATOM 572 C GLY A 38 -18.445 -53.023 -1.471 1.00 43.30 C ATOM 573 O GLY A 38 -18.219 -54.224 -1.329 1.00 75.21 O ATOM 0 H GLY A 38 -17.934 -50.101 -2.334 1.00 22.12 H new ATOM 0 HA2 GLY A 38 -17.083 -52.735 -3.096 1.00 30.12 H new ATOM 0 HA3 GLY A 38 -16.668 -51.843 -1.646 1.00 30.12 H new ATOM 577 N GLN A 39 -19.502 -52.416 -0.941 1.00 42.01 N ATOM 578 CA GLN A 39 -20.480 -53.145 -0.143 1.00 72.41 C ATOM 579 C GLN A 39 -21.284 -54.107 -1.012 1.00 41.25 C ATOM 580 O GLN A 39 -21.352 -55.303 -0.731 1.00 10.21 O ATOM 581 CB GLN A 39 -21.422 -52.170 0.564 1.00 13.51 C ATOM 582 CG GLN A 39 -22.494 -52.854 1.397 1.00 72.13 C ATOM 583 CD GLN A 39 -21.983 -53.303 2.752 1.00 41.35 C ATOM 584 OE1 GLN A 39 -21.160 -54.345 2.759 1.00 51.40 O flip ATOM 585 NE2 GLN A 39 -22.324 -52.720 3.781 1.00 44.45 N flip ATOM 0 H GLN A 39 -19.703 -51.422 -1.050 1.00 42.01 H new ATOM 0 HA GLN A 39 -19.940 -53.725 0.606 1.00 72.41 H new ATOM 0 HB2 GLN A 39 -20.836 -51.515 1.209 1.00 13.51 H new ATOM 0 HB3 GLN A 39 -21.902 -51.537 -0.182 1.00 13.51 H new ATOM 0 HG2 GLN A 39 -23.331 -52.170 1.537 1.00 72.13 H new ATOM 0 HG3 GLN A 39 -22.876 -53.718 0.853 1.00 72.13 H new ATOM 0 HE21 GLN A 39 -22.959 -51.923 3.729 1.00 44.45 H new ATOM 0 HE22 GLN A 39 -21.972 -53.034 4.685 1.00 44.45 H new ATOM 594 N GLN A 40 -21.891 -53.575 -2.069 1.00 24.31 N ATOM 595 CA GLN A 40 -22.691 -54.387 -2.978 1.00 65.13 C ATOM 596 C GLN A 40 -21.802 -55.298 -3.820 1.00 12.44 C ATOM 597 O GLN A 40 -22.214 -56.387 -4.220 1.00 55.05 O ATOM 598 CB GLN A 40 -23.531 -53.491 -3.890 1.00 33.33 C ATOM 599 CG GLN A 40 -22.714 -52.460 -4.651 1.00 52.00 C ATOM 600 CD GLN A 40 -23.480 -51.846 -5.807 1.00 21.15 C ATOM 601 OE1 GLN A 40 -24.732 -51.479 -5.559 1.00 31.22 O flip ATOM 602 NE2 GLN A 40 -22.952 -51.703 -6.910 1.00 61.31 N flip ATOM 0 H GLN A 40 -21.844 -52.587 -2.316 1.00 24.31 H new ATOM 0 HA GLN A 40 -23.356 -55.010 -2.379 1.00 65.13 H new ATOM 0 HB2 GLN A 40 -24.068 -54.115 -4.604 1.00 33.33 H new ATOM 0 HB3 GLN A 40 -24.281 -52.976 -3.289 1.00 33.33 H new ATOM 0 HG2 GLN A 40 -22.403 -51.671 -3.966 1.00 52.00 H new ATOM 0 HG3 GLN A 40 -21.806 -52.929 -5.030 1.00 52.00 H new ATOM 0 HE21 GLN A 40 -21.987 -51.999 -7.056 1.00 61.31 H new ATOM 0 HE22 GLN A 40 -23.480 -51.288 -7.678 1.00 61.31 H new ATOM 611 N LEU A 41 -20.582 -54.845 -4.084 1.00 42.23 N ATOM 612 CA LEU A 41 -19.634 -55.619 -4.879 1.00 12.21 C ATOM 613 C LEU A 41 -19.248 -56.908 -4.162 1.00 21.42 C ATOM 614 O LEU A 41 -19.299 -57.992 -4.742 1.00 43.11 O ATOM 615 CB LEU A 41 -18.383 -54.788 -5.168 1.00 23.11 C ATOM 616 CG LEU A 41 -17.227 -55.528 -5.843 1.00 53.33 C ATOM 617 CD1 LEU A 41 -16.774 -54.785 -7.091 1.00 14.24 C ATOM 618 CD2 LEU A 41 -16.067 -55.703 -4.874 1.00 73.31 C ATOM 0 H LEU A 41 -20.225 -53.946 -3.760 1.00 42.23 H new ATOM 0 HA LEU A 41 -20.115 -55.880 -5.822 1.00 12.21 H new ATOM 0 HB2 LEU A 41 -18.668 -53.947 -5.800 1.00 23.11 H new ATOM 0 HB3 LEU A 41 -18.022 -54.372 -4.227 1.00 23.11 H new ATOM 0 HG LEU A 41 -17.578 -56.516 -6.140 1.00 53.33 H new ATOM 0 HD11 LEU A 41 -15.951 -55.326 -7.558 1.00 14.24 H new ATOM 0 HD12 LEU A 41 -17.605 -54.712 -7.793 1.00 14.24 H new ATOM 0 HD13 LEU A 41 -16.441 -53.784 -6.818 1.00 14.24 H new ATOM 0 HD21 LEU A 41 -15.254 -56.231 -5.372 1.00 73.31 H new ATOM 0 HD22 LEU A 41 -15.717 -54.725 -4.545 1.00 73.31 H new ATOM 0 HD23 LEU A 41 -16.399 -56.279 -4.010 1.00 73.31 H new ATOM 630 N ASN A 42 -18.864 -56.783 -2.896 1.00 21.25 N ATOM 631 CA ASN A 42 -18.471 -57.939 -2.098 1.00 64.32 C ATOM 632 C ASN A 42 -19.647 -58.891 -1.904 1.00 22.35 C ATOM 633 O ASN A 42 -19.527 -60.097 -2.126 1.00 55.11 O ATOM 634 CB ASN A 42 -17.935 -57.488 -0.738 1.00 25.30 C ATOM 635 CG ASN A 42 -16.500 -57.002 -0.814 1.00 52.43 C ATOM 636 OD1 ASN A 42 -16.225 -56.120 -1.769 1.00 65.12 O flip ATOM 637 ND2 ASN A 42 -15.651 -57.413 -0.024 1.00 23.42 N flip ATOM 0 H ASN A 42 -18.817 -55.893 -2.400 1.00 21.25 H new ATOM 0 HA ASN A 42 -17.683 -58.468 -2.634 1.00 64.32 H new ATOM 0 HB2 ASN A 42 -18.566 -56.689 -0.349 1.00 25.30 H new ATOM 0 HB3 ASN A 42 -17.998 -58.317 -0.033 1.00 25.30 H new ATOM 0 HD21 ASN A 42 -15.908 -58.091 0.694 1.00 23.42 H new ATOM 0 HD22 ASN A 42 -14.690 -57.076 -0.087 1.00 23.42 H new ATOM 644 N LEU A 43 -20.783 -58.342 -1.487 1.00 64.14 N ATOM 645 CA LEU A 43 -21.982 -59.142 -1.263 1.00 40.32 C ATOM 646 C LEU A 43 -22.341 -59.946 -2.509 1.00 12.34 C ATOM 647 O LEU A 43 -22.823 -61.074 -2.414 1.00 4.34 O ATOM 648 CB LEU A 43 -23.153 -58.240 -0.869 1.00 32.44 C ATOM 649 CG LEU A 43 -24.230 -58.883 0.007 1.00 63.33 C ATOM 650 CD1 LEU A 43 -24.923 -60.011 -0.742 1.00 54.31 C ATOM 651 CD2 LEU A 43 -23.625 -59.396 1.306 1.00 61.15 C ATOM 0 H LEU A 43 -20.899 -57.347 -1.297 1.00 64.14 H new ATOM 0 HA LEU A 43 -21.778 -59.839 -0.450 1.00 40.32 H new ATOM 0 HB2 LEU A 43 -22.756 -57.372 -0.343 1.00 32.44 H new ATOM 0 HB3 LEU A 43 -23.625 -57.873 -1.780 1.00 32.44 H new ATOM 0 HG LEU A 43 -24.974 -58.125 0.251 1.00 63.33 H new ATOM 0 HD11 LEU A 43 -25.686 -60.457 -0.104 1.00 54.31 H new ATOM 0 HD12 LEU A 43 -25.390 -59.616 -1.644 1.00 54.31 H new ATOM 0 HD13 LEU A 43 -24.190 -60.770 -1.016 1.00 54.31 H new ATOM 0 HD21 LEU A 43 -24.406 -59.850 1.917 1.00 61.15 H new ATOM 0 HD22 LEU A 43 -22.860 -60.140 1.082 1.00 61.15 H new ATOM 0 HD23 LEU A 43 -23.175 -58.566 1.851 1.00 61.15 H new ATOM 663 N ASN A 44 -22.101 -59.357 -3.676 1.00 75.30 N ATOM 664 CA ASN A 44 -22.398 -60.020 -4.941 1.00 53.40 C ATOM 665 C ASN A 44 -21.533 -61.263 -5.120 1.00 31.41 C ATOM 666 O ASN A 44 -22.011 -62.307 -5.567 1.00 52.23 O ATOM 667 CB ASN A 44 -22.175 -59.057 -6.109 1.00 71.12 C ATOM 668 CG ASN A 44 -21.088 -59.535 -7.052 1.00 70.05 C ATOM 669 OD1 ASN A 44 -21.430 -60.483 -7.918 1.00 34.43 O flip ATOM 670 ND2 ASN A 44 -19.954 -59.057 -7.004 1.00 12.44 N flip ATOM 0 H ASN A 44 -21.702 -58.423 -3.772 1.00 75.30 H new ATOM 0 HA ASN A 44 -23.444 -60.327 -4.926 1.00 53.40 H new ATOM 0 HB2 ASN A 44 -23.107 -58.939 -6.662 1.00 71.12 H new ATOM 0 HB3 ASN A 44 -21.909 -58.074 -5.720 1.00 71.12 H new ATOM 0 HD21 ASN A 44 -19.735 -58.330 -6.323 1.00 12.44 H new ATOM 0 HD22 ASN A 44 -19.234 -59.388 -7.646 1.00 12.44 H new ATOM 872 N GLN A 58 -29.379 -54.791 1.993 1.00 23.22 N ATOM 873 CA GLN A 58 -28.644 -53.805 2.776 1.00 14.43 C ATOM 874 C GLN A 58 -27.581 -53.117 1.927 1.00 64.44 C ATOM 875 O GLN A 58 -27.340 -51.917 2.065 1.00 74.23 O ATOM 876 CB GLN A 58 -27.993 -54.468 3.991 1.00 74.40 C ATOM 877 CG GLN A 58 -28.370 -53.820 5.313 1.00 2.23 C ATOM 878 CD GLN A 58 -29.266 -54.701 6.161 1.00 2.13 C ATOM 879 OE1 GLN A 58 -30.448 -54.410 6.345 1.00 52.04 O ATOM 880 NE2 GLN A 58 -28.706 -55.786 6.684 1.00 13.32 N ATOM 0 HA GLN A 58 -29.352 -53.051 3.119 1.00 14.43 H new ATOM 0 HB2 GLN A 58 -28.279 -55.520 4.017 1.00 74.40 H new ATOM 0 HB3 GLN A 58 -26.910 -54.435 3.876 1.00 74.40 H new ATOM 0 HG2 GLN A 58 -27.463 -53.587 5.871 1.00 2.23 H new ATOM 0 HG3 GLN A 58 -28.876 -52.874 5.118 1.00 2.23 H new ATOM 0 HE21 GLN A 58 -27.722 -55.989 6.505 1.00 13.32 H new ATOM 0 HE22 GLN A 58 -29.260 -56.416 7.264 1.00 13.32 H new ATOM 889 N LEU A 59 -26.946 -53.885 1.048 1.00 64.20 N ATOM 890 CA LEU A 59 -25.906 -53.350 0.175 1.00 32.41 C ATOM 891 C LEU A 59 -26.404 -52.117 -0.572 1.00 4.14 C ATOM 892 O LEU A 59 -25.740 -51.081 -0.588 1.00 42.22 O ATOM 893 CB LEU A 59 -25.453 -54.417 -0.824 1.00 2.25 C ATOM 894 CG LEU A 59 -26.566 -55.154 -1.570 1.00 5.41 C ATOM 895 CD1 LEU A 59 -26.655 -54.669 -3.009 1.00 10.24 C ATOM 896 CD2 LEU A 59 -26.333 -56.657 -1.525 1.00 41.22 C ATOM 0 H LEU A 59 -27.133 -54.880 0.921 1.00 64.20 H new ATOM 0 HA LEU A 59 -25.059 -53.059 0.796 1.00 32.41 H new ATOM 0 HB2 LEU A 59 -24.801 -53.945 -1.559 1.00 2.25 H new ATOM 0 HB3 LEU A 59 -24.851 -55.153 -0.291 1.00 2.25 H new ATOM 0 HG LEU A 59 -27.514 -54.939 -1.076 1.00 5.41 H new ATOM 0 HD11 LEU A 59 -27.452 -55.204 -3.525 1.00 10.24 H new ATOM 0 HD12 LEU A 59 -26.869 -53.600 -3.020 1.00 10.24 H new ATOM 0 HD13 LEU A 59 -25.707 -54.854 -3.515 1.00 10.24 H new ATOM 0 HD21 LEU A 59 -27.135 -57.166 -2.061 1.00 41.22 H new ATOM 0 HD22 LEU A 59 -25.377 -56.891 -1.994 1.00 41.22 H new ATOM 0 HD23 LEU A 59 -26.320 -56.992 -0.488 1.00 41.22 H new ATOM 908 N GLN A 60 -27.576 -52.236 -1.186 1.00 31.20 N ATOM 909 CA GLN A 60 -28.163 -51.130 -1.933 1.00 2.21 C ATOM 910 C GLN A 60 -28.762 -50.093 -0.989 1.00 11.23 C ATOM 911 O GLN A 60 -28.525 -48.895 -1.138 1.00 13.43 O ATOM 912 CB GLN A 60 -29.238 -51.647 -2.891 1.00 3.53 C ATOM 913 CG GLN A 60 -29.113 -51.093 -4.301 1.00 64.51 C ATOM 914 CD GLN A 60 -30.224 -50.123 -4.648 1.00 52.12 C ATOM 915 OE1 GLN A 60 -30.528 -49.216 -3.727 1.00 73.44 O flip ATOM 916 NE2 GLN A 60 -30.804 -50.187 -5.732 1.00 4.11 N flip ATOM 0 H GLN A 60 -28.138 -53.087 -1.181 1.00 31.20 H new ATOM 0 HA GLN A 60 -27.371 -50.654 -2.511 1.00 2.21 H new ATOM 0 HB2 GLN A 60 -29.185 -52.735 -2.931 1.00 3.53 H new ATOM 0 HB3 GLN A 60 -30.220 -51.390 -2.494 1.00 3.53 H new ATOM 0 HG2 GLN A 60 -28.151 -50.590 -4.406 1.00 64.51 H new ATOM 0 HG3 GLN A 60 -29.121 -51.918 -5.013 1.00 64.51 H new ATOM 0 HE21 GLN A 60 -30.538 -50.900 -6.411 1.00 4.11 H new ATOM 0 HE22 GLN A 60 -31.550 -49.527 -5.951 1.00 4.11 H new ATOM 925 N GLU A 61 -29.539 -50.563 -0.018 1.00 13.31 N ATOM 926 CA GLU A 61 -30.173 -49.675 0.949 1.00 12.44 C ATOM 927 C GLU A 61 -29.148 -48.735 1.579 1.00 75.22 C ATOM 928 O GLU A 61 -29.427 -47.558 1.806 1.00 14.14 O ATOM 929 CB GLU A 61 -30.873 -50.488 2.040 1.00 21.31 C ATOM 930 CG GLU A 61 -31.936 -51.434 1.507 1.00 40.23 C ATOM 931 CD GLU A 61 -33.267 -51.274 2.215 1.00 31.54 C ATOM 932 OE1 GLU A 61 -33.833 -50.162 2.173 1.00 20.31 O ATOM 933 OE2 GLU A 61 -33.743 -52.263 2.812 1.00 23.12 O ATOM 0 H GLU A 61 -29.744 -51.553 0.120 1.00 13.31 H new ATOM 0 HA GLU A 61 -30.914 -49.075 0.421 1.00 12.44 H new ATOM 0 HB2 GLU A 61 -30.127 -51.064 2.587 1.00 21.31 H new ATOM 0 HB3 GLU A 61 -31.332 -49.803 2.753 1.00 21.31 H new ATOM 0 HG2 GLU A 61 -32.073 -51.257 0.440 1.00 40.23 H new ATOM 0 HG3 GLU A 61 -31.591 -52.462 1.618 1.00 40.23 H new ATOM 940 N ARG A 62 -27.962 -49.265 1.858 1.00 40.01 N ATOM 941 CA ARG A 62 -26.896 -48.475 2.462 1.00 21.44 C ATOM 942 C ARG A 62 -26.183 -47.629 1.412 1.00 71.24 C ATOM 943 O ARG A 62 -25.777 -46.498 1.681 1.00 42.01 O ATOM 944 CB ARG A 62 -25.890 -49.390 3.164 1.00 12.22 C ATOM 945 CG ARG A 62 -25.323 -48.802 4.446 1.00 53.40 C ATOM 946 CD ARG A 62 -26.110 -49.258 5.664 1.00 33.43 C ATOM 947 NE ARG A 62 -27.296 -48.436 5.890 1.00 2.11 N ATOM 948 CZ ARG A 62 -27.921 -48.353 7.059 1.00 31.12 C ATOM 949 NH1 ARG A 62 -27.476 -49.039 8.103 1.00 42.21 N ATOM 950 NH2 ARG A 62 -28.994 -47.583 7.186 1.00 0.30 N ATOM 0 H ARG A 62 -27.715 -50.238 1.676 1.00 40.01 H new ATOM 0 HA ARG A 62 -27.345 -47.807 3.197 1.00 21.44 H new ATOM 0 HB2 ARG A 62 -26.374 -50.340 3.393 1.00 12.22 H new ATOM 0 HB3 ARG A 62 -25.070 -49.607 2.480 1.00 12.22 H new ATOM 0 HG2 ARG A 62 -24.280 -49.099 4.553 1.00 53.40 H new ATOM 0 HG3 ARG A 62 -25.340 -47.714 4.387 1.00 53.40 H new ATOM 0 HD2 ARG A 62 -26.409 -50.298 5.533 1.00 33.43 H new ATOM 0 HD3 ARG A 62 -25.469 -49.219 6.545 1.00 33.43 H new ATOM 0 HE ARG A 62 -27.665 -47.896 5.107 1.00 2.11 H new ATOM 0 HH11 ARG A 62 -26.652 -49.632 8.010 1.00 42.21 H new ATOM 0 HH12 ARG A 62 -27.958 -48.973 8.999 1.00 42.21 H new ATOM 0 HH21 ARG A 62 -29.340 -47.054 6.385 1.00 0.30 H new ATOM 0 HH22 ARG A 62 -29.473 -47.520 8.084 1.00 0.30 H new ATOM 964 N LEU A 63 -26.034 -48.185 0.214 1.00 12.41 N ATOM 965 CA LEU A 63 -25.370 -47.482 -0.878 1.00 40.41 C ATOM 966 C LEU A 63 -26.082 -46.170 -1.195 1.00 32.53 C ATOM 967 O LEU A 63 -25.463 -45.211 -1.652 1.00 53.23 O ATOM 968 CB LEU A 63 -25.324 -48.365 -2.126 1.00 54.22 C ATOM 969 CG LEU A 63 -25.168 -47.634 -3.460 1.00 52.13 C ATOM 970 CD1 LEU A 63 -23.860 -46.860 -3.495 1.00 24.01 C ATOM 971 CD2 LEU A 63 -25.239 -48.618 -4.619 1.00 1.11 C ATOM 0 H LEU A 63 -26.364 -49.120 -0.025 1.00 12.41 H new ATOM 0 HA LEU A 63 -24.351 -47.254 -0.564 1.00 40.41 H new ATOM 0 HB2 LEU A 63 -24.496 -49.066 -2.020 1.00 54.22 H new ATOM 0 HB3 LEU A 63 -26.240 -48.955 -2.163 1.00 54.22 H new ATOM 0 HG LEU A 63 -25.989 -46.924 -3.561 1.00 52.13 H new ATOM 0 HD11 LEU A 63 -23.767 -46.346 -4.452 1.00 24.01 H new ATOM 0 HD12 LEU A 63 -23.849 -46.128 -2.688 1.00 24.01 H new ATOM 0 HD13 LEU A 63 -23.025 -47.550 -3.371 1.00 24.01 H new ATOM 0 HD21 LEU A 63 -25.126 -48.080 -5.560 1.00 1.11 H new ATOM 0 HD22 LEU A 63 -24.439 -49.352 -4.522 1.00 1.11 H new ATOM 0 HD23 LEU A 63 -26.203 -49.127 -4.605 1.00 1.11 H new ATOM 983 N GLY A 64 -27.388 -46.137 -0.946 1.00 1.25 N ATOM 984 CA GLY A 64 -28.163 -44.938 -1.208 1.00 65.11 C ATOM 985 C GLY A 64 -27.583 -43.713 -0.529 1.00 33.13 C ATOM 986 O GLY A 64 -27.053 -42.810 -1.176 1.00 54.03 O ATOM 0 H GLY A 64 -27.923 -46.919 -0.568 1.00 1.25 H new ATOM 0 HA2 GLY A 64 -28.208 -44.766 -2.283 1.00 65.11 H new ATOM 0 HA3 GLY A 64 -29.187 -45.089 -0.866 1.00 65.11 H new ATOM 990 N PRO A 65 -27.683 -43.671 0.808 1.00 4.52 N ATOM 991 CA PRO A 65 -27.171 -42.551 1.605 1.00 62.42 C ATOM 992 C PRO A 65 -25.647 -42.499 1.618 1.00 1.25 C ATOM 993 O PRO A 65 -25.054 -41.478 1.969 1.00 42.44 O ATOM 994 CB PRO A 65 -27.708 -42.840 3.009 1.00 74.14 C ATOM 995 CG PRO A 65 -27.908 -44.316 3.042 1.00 74.04 C ATOM 996 CD PRO A 65 -28.302 -44.712 1.645 1.00 2.12 C ATOM 0 HA PRO A 65 -27.485 -41.588 1.204 1.00 62.42 H new ATOM 0 HB2 PRO A 65 -27.003 -42.519 3.776 1.00 74.14 H new ATOM 0 HB3 PRO A 65 -28.643 -42.310 3.192 1.00 74.14 H new ATOM 0 HG2 PRO A 65 -26.996 -44.827 3.350 1.00 74.04 H new ATOM 0 HG3 PRO A 65 -28.683 -44.589 3.758 1.00 74.04 H new ATOM 0 HD2 PRO A 65 -27.933 -45.705 1.390 1.00 2.12 H new ATOM 0 HD3 PRO A 65 -29.385 -44.734 1.524 1.00 2.12 H new ATOM 1004 N LEU A 66 -25.018 -43.604 1.235 1.00 30.42 N ATOM 1005 CA LEU A 66 -23.562 -43.684 1.203 1.00 63.13 C ATOM 1006 C LEU A 66 -22.986 -42.716 0.174 1.00 72.33 C ATOM 1007 O LEU A 66 -22.305 -41.752 0.524 1.00 21.23 O ATOM 1008 CB LEU A 66 -23.116 -45.112 0.882 1.00 55.12 C ATOM 1009 CG LEU A 66 -22.474 -45.889 2.031 1.00 31.13 C ATOM 1010 CD1 LEU A 66 -21.068 -45.378 2.301 1.00 5.31 C ATOM 1011 CD2 LEU A 66 -23.330 -45.790 3.286 1.00 45.41 C ATOM 0 H LEU A 66 -25.493 -44.458 0.942 1.00 30.42 H new ATOM 0 HA LEU A 66 -23.186 -43.405 2.188 1.00 63.13 H new ATOM 0 HB2 LEU A 66 -23.983 -45.672 0.531 1.00 55.12 H new ATOM 0 HB3 LEU A 66 -22.406 -45.072 0.056 1.00 55.12 H new ATOM 0 HG LEU A 66 -22.408 -46.938 1.742 1.00 31.13 H new ATOM 0 HD11 LEU A 66 -20.627 -45.943 3.122 1.00 5.31 H new ATOM 0 HD12 LEU A 66 -20.458 -45.502 1.406 1.00 5.31 H new ATOM 0 HD13 LEU A 66 -21.110 -44.322 2.568 1.00 5.31 H new ATOM 0 HD21 LEU A 66 -22.858 -46.349 4.094 1.00 45.41 H new ATOM 0 HD22 LEU A 66 -23.429 -44.744 3.578 1.00 45.41 H new ATOM 0 HD23 LEU A 66 -24.318 -46.206 3.086 1.00 45.41 H new ATOM 1023 N THR A 67 -23.266 -42.978 -1.099 1.00 73.43 N ATOM 1024 CA THR A 67 -22.778 -42.131 -2.180 1.00 1.25 C ATOM 1025 C THR A 67 -23.250 -40.692 -2.006 1.00 12.12 C ATOM 1026 O THR A 67 -22.517 -39.748 -2.300 1.00 63.04 O ATOM 1027 CB THR A 67 -23.242 -42.649 -3.554 1.00 1.01 C ATOM 1028 OG1 THR A 67 -22.774 -41.777 -4.589 1.00 74.54 O ATOM 1029 CG2 THR A 67 -24.759 -42.746 -3.612 1.00 0.52 C ATOM 0 H THR A 67 -23.829 -43.771 -1.407 1.00 73.43 H new ATOM 0 HA THR A 67 -21.689 -42.161 -2.138 1.00 1.25 H new ATOM 0 HB THR A 67 -22.825 -43.645 -3.702 1.00 1.01 H new ATOM 0 HG1 THR A 67 -23.072 -42.114 -5.460 1.00 74.54 H new ATOM 0 HG21 THR A 67 -25.063 -43.114 -4.592 1.00 0.52 H new ATOM 0 HG22 THR A 67 -25.109 -43.433 -2.842 1.00 0.52 H new ATOM 0 HG23 THR A 67 -25.193 -41.760 -3.444 1.00 0.52 H new ATOM 1037 N ARG A 68 -24.479 -40.531 -1.525 1.00 63.21 N ATOM 1038 CA ARG A 68 -25.049 -39.206 -1.313 1.00 23.24 C ATOM 1039 C ARG A 68 -24.332 -38.482 -0.177 1.00 14.05 C ATOM 1040 O ARG A 68 -24.244 -37.254 -0.168 1.00 21.10 O ATOM 1041 CB ARG A 68 -26.543 -39.314 -1.001 1.00 25.30 C ATOM 1042 CG ARG A 68 -27.165 -38.007 -0.540 1.00 3.52 C ATOM 1043 CD ARG A 68 -27.497 -38.040 0.944 1.00 62.22 C ATOM 1044 NE ARG A 68 -28.830 -38.582 1.194 1.00 3.12 N ATOM 1045 CZ ARG A 68 -29.419 -38.563 2.385 1.00 50.05 C ATOM 1046 NH1 ARG A 68 -28.797 -38.032 3.428 1.00 45.23 N ATOM 1047 NH2 ARG A 68 -30.634 -39.076 2.533 1.00 42.40 N ATOM 0 H ARG A 68 -25.099 -41.302 -1.275 1.00 63.21 H new ATOM 0 HA ARG A 68 -24.917 -38.630 -2.229 1.00 23.24 H new ATOM 0 HB2 ARG A 68 -27.067 -39.662 -1.891 1.00 25.30 H new ATOM 0 HB3 ARG A 68 -26.691 -40.069 -0.229 1.00 25.30 H new ATOM 0 HG2 ARG A 68 -26.478 -37.185 -0.742 1.00 3.52 H new ATOM 0 HG3 ARG A 68 -28.072 -37.813 -1.113 1.00 3.52 H new ATOM 0 HD2 ARG A 68 -26.756 -38.644 1.468 1.00 62.22 H new ATOM 0 HD3 ARG A 68 -27.433 -37.031 1.352 1.00 62.22 H new ATOM 0 HE ARG A 68 -29.336 -38.998 0.412 1.00 3.12 H new ATOM 0 HH11 ARG A 68 -27.863 -37.636 3.318 1.00 45.23 H new ATOM 0 HH12 ARG A 68 -29.252 -38.019 4.341 1.00 45.23 H new ATOM 0 HH21 ARG A 68 -31.116 -39.485 1.732 1.00 42.40 H new ATOM 0 HH22 ARG A 68 -31.086 -39.061 3.447 1.00 42.40 H new ATOM 1061 N ASP A 69 -23.824 -39.251 0.780 1.00 5.51 N ATOM 1062 CA ASP A 69 -23.114 -38.683 1.921 1.00 55.31 C ATOM 1063 C ASP A 69 -21.834 -37.984 1.472 1.00 35.44 C ATOM 1064 O ASP A 69 -21.740 -36.757 1.506 1.00 23.45 O ATOM 1065 CB ASP A 69 -22.784 -39.776 2.939 1.00 52.43 C ATOM 1066 CG ASP A 69 -23.637 -39.680 4.188 1.00 11.34 C ATOM 1067 OD1 ASP A 69 -24.835 -40.027 4.118 1.00 62.21 O ATOM 1068 OD2 ASP A 69 -23.107 -39.258 5.237 1.00 22.02 O ATOM 0 H ASP A 69 -23.890 -40.269 0.789 1.00 5.51 H new ATOM 0 HA ASP A 69 -23.764 -37.944 2.391 1.00 55.31 H new ATOM 0 HB2 ASP A 69 -22.928 -40.753 2.478 1.00 52.43 H new ATOM 0 HB3 ASP A 69 -21.732 -39.706 3.215 1.00 52.43 H new ATOM 1073 N PHE A 70 -20.851 -38.774 1.053 1.00 34.22 N ATOM 1074 CA PHE A 70 -19.576 -38.232 0.600 1.00 62.12 C ATOM 1075 C PHE A 70 -19.785 -37.204 -0.508 1.00 63.12 C ATOM 1076 O PHE A 70 -18.998 -36.269 -0.658 1.00 52.00 O ATOM 1077 CB PHE A 70 -18.667 -39.358 0.102 1.00 52.02 C ATOM 1078 CG PHE A 70 -18.777 -39.608 -1.375 1.00 75.31 C ATOM 1079 CD1 PHE A 70 -19.710 -40.505 -1.871 1.00 63.24 C ATOM 1080 CD2 PHE A 70 -17.949 -38.946 -2.267 1.00 74.31 C ATOM 1081 CE1 PHE A 70 -19.813 -40.738 -3.230 1.00 4.12 C ATOM 1082 CE2 PHE A 70 -18.048 -39.175 -3.627 1.00 0.42 C ATOM 1083 CZ PHE A 70 -18.982 -40.071 -4.109 1.00 4.13 C ATOM 0 H PHE A 70 -20.913 -39.791 1.018 1.00 34.22 H new ATOM 0 HA PHE A 70 -19.099 -37.737 1.446 1.00 62.12 H new ATOM 0 HB2 PHE A 70 -17.633 -39.114 0.345 1.00 52.02 H new ATOM 0 HB3 PHE A 70 -18.912 -40.276 0.637 1.00 52.02 H new ATOM 0 HD1 PHE A 70 -20.364 -41.028 -1.188 1.00 63.24 H new ATOM 0 HD2 PHE A 70 -17.218 -38.243 -1.896 1.00 74.31 H new ATOM 0 HE1 PHE A 70 -20.543 -41.441 -3.604 1.00 4.12 H new ATOM 0 HE2 PHE A 70 -17.396 -38.654 -4.312 1.00 0.42 H new ATOM 0 HZ PHE A 70 -19.062 -40.250 -5.171 1.00 4.13 H new ATOM 1093 N TRP A 71 -20.849 -37.385 -1.282 1.00 30.25 N ATOM 1094 CA TRP A 71 -21.162 -36.474 -2.377 1.00 23.12 C ATOM 1095 C TRP A 71 -21.188 -35.029 -1.892 1.00 4.20 C ATOM 1096 O TRP A 71 -20.297 -34.241 -2.212 1.00 32.11 O ATOM 1097 CB TRP A 71 -22.509 -36.839 -3.003 1.00 23.45 C ATOM 1098 CG TRP A 71 -23.031 -35.794 -3.941 1.00 0.44 C ATOM 1099 CD1 TRP A 71 -22.508 -35.445 -5.153 1.00 24.20 C ATOM 1100 CD2 TRP A 71 -24.178 -34.960 -3.742 1.00 2.22 C ATOM 1101 NE1 TRP A 71 -23.260 -34.445 -5.720 1.00 10.12 N ATOM 1102 CE2 TRP A 71 -24.291 -34.130 -4.875 1.00 22.05 C ATOM 1103 CE3 TRP A 71 -25.121 -34.835 -2.719 1.00 12.24 C ATOM 1104 CZ2 TRP A 71 -25.308 -33.189 -5.009 1.00 75.41 C ATOM 1105 CZ3 TRP A 71 -26.130 -33.901 -2.854 1.00 14.44 C ATOM 1106 CH2 TRP A 71 -26.218 -33.088 -3.992 1.00 73.30 C ATOM 0 H TRP A 71 -21.510 -38.154 -1.172 1.00 30.25 H new ATOM 0 HA TRP A 71 -20.381 -36.571 -3.131 1.00 23.12 H new ATOM 0 HB2 TRP A 71 -22.408 -37.782 -3.541 1.00 23.45 H new ATOM 0 HB3 TRP A 71 -23.238 -37.001 -2.209 1.00 23.45 H new ATOM 0 HD1 TRP A 71 -21.631 -35.890 -5.600 1.00 24.20 H new ATOM 0 HE1 TRP A 71 -23.080 -34.008 -6.624 1.00 10.12 H new ATOM 0 HE3 TRP A 71 -25.062 -35.457 -1.838 1.00 12.24 H new ATOM 0 HZ2 TRP A 71 -25.376 -32.561 -5.885 1.00 75.41 H new ATOM 0 HZ3 TRP A 71 -26.864 -33.796 -2.069 1.00 14.44 H new ATOM 0 HH2 TRP A 71 -27.019 -32.368 -4.068 1.00 73.30 H new ATOM 1117 N ASP A 72 -22.213 -34.687 -1.119 1.00 45.11 N ATOM 1118 CA ASP A 72 -22.353 -33.336 -0.589 1.00 11.30 C ATOM 1119 C ASP A 72 -21.175 -32.980 0.312 1.00 22.35 C ATOM 1120 O ASP A 72 -20.792 -31.816 0.420 1.00 61.22 O ATOM 1121 CB ASP A 72 -23.664 -33.203 0.188 1.00 22.51 C ATOM 1122 CG ASP A 72 -23.879 -31.802 0.726 1.00 72.51 C ATOM 1123 OD1 ASP A 72 -24.307 -30.927 -0.055 1.00 2.01 O ATOM 1124 OD2 ASP A 72 -23.619 -31.581 1.927 1.00 35.34 O ATOM 0 H ASP A 72 -22.959 -35.327 -0.846 1.00 45.11 H new ATOM 0 HA ASP A 72 -22.366 -32.643 -1.430 1.00 11.30 H new ATOM 0 HB2 ASP A 72 -24.497 -33.471 -0.462 1.00 22.51 H new ATOM 0 HB3 ASP A 72 -23.665 -33.911 1.016 1.00 22.51 H new ATOM 1129 N ASN A 73 -20.605 -33.992 0.959 1.00 11.14 N ATOM 1130 CA ASN A 73 -19.471 -33.786 1.853 1.00 13.13 C ATOM 1131 C ASN A 73 -18.288 -33.185 1.101 1.00 1.42 C ATOM 1132 O ASN A 73 -17.929 -32.025 1.311 1.00 71.00 O ATOM 1133 CB ASN A 73 -19.059 -35.109 2.501 1.00 20.23 C ATOM 1134 CG ASN A 73 -19.027 -35.027 4.015 1.00 15.52 C ATOM 1135 OD1 ASN A 73 -19.776 -35.722 4.702 1.00 71.23 O ATOM 1136 ND2 ASN A 73 -18.158 -34.172 4.543 1.00 72.50 N ATOM 0 H ASN A 73 -20.910 -34.962 0.881 1.00 11.14 H new ATOM 0 HA ASN A 73 -19.776 -33.087 2.632 1.00 13.13 H new ATOM 0 HB2 ASN A 73 -19.755 -35.891 2.197 1.00 20.23 H new ATOM 0 HB3 ASN A 73 -18.074 -35.398 2.135 1.00 20.23 H new ATOM 0 HD21 ASN A 73 -18.092 -34.072 5.556 1.00 72.50 H new ATOM 0 HD22 ASN A 73 -17.556 -33.616 3.935 1.00 72.50 H new ATOM 1143 N LEU A 74 -17.686 -33.980 0.224 1.00 25.13 N ATOM 1144 CA LEU A 74 -16.542 -33.527 -0.561 1.00 14.14 C ATOM 1145 C LEU A 74 -16.942 -32.395 -1.502 1.00 33.31 C ATOM 1146 O LEU A 74 -16.122 -31.547 -1.850 1.00 54.44 O ATOM 1147 CB LEU A 74 -15.956 -34.690 -1.363 1.00 13.00 C ATOM 1148 CG LEU A 74 -14.911 -35.542 -0.643 1.00 63.42 C ATOM 1149 CD1 LEU A 74 -15.270 -37.017 -0.735 1.00 24.42 C ATOM 1150 CD2 LEU A 74 -13.527 -35.291 -1.224 1.00 24.34 C ATOM 0 H LEU A 74 -17.970 -34.942 0.038 1.00 25.13 H new ATOM 0 HA LEU A 74 -15.785 -33.152 0.128 1.00 14.14 H new ATOM 0 HB2 LEU A 74 -16.774 -35.340 -1.673 1.00 13.00 H new ATOM 0 HB3 LEU A 74 -15.506 -34.289 -2.271 1.00 13.00 H new ATOM 0 HG LEU A 74 -14.899 -35.257 0.409 1.00 63.42 H new ATOM 0 HD11 LEU A 74 -14.515 -37.608 -0.217 1.00 24.42 H new ATOM 0 HD12 LEU A 74 -16.243 -37.184 -0.272 1.00 24.42 H new ATOM 0 HD13 LEU A 74 -15.310 -37.317 -1.782 1.00 24.42 H new ATOM 0 HD21 LEU A 74 -12.795 -35.906 -0.700 1.00 24.34 H new ATOM 0 HD22 LEU A 74 -13.525 -35.548 -2.283 1.00 24.34 H new ATOM 0 HD23 LEU A 74 -13.268 -34.239 -1.106 1.00 24.34 H new ATOM 1162 N GLU A 75 -18.208 -32.389 -1.908 1.00 33.34 N ATOM 1163 CA GLU A 75 -18.717 -31.361 -2.807 1.00 45.44 C ATOM 1164 C GLU A 75 -18.335 -29.968 -2.313 1.00 33.34 C ATOM 1165 O GLU A 75 -17.901 -29.118 -3.090 1.00 1.23 O ATOM 1166 CB GLU A 75 -20.237 -31.470 -2.935 1.00 54.44 C ATOM 1167 CG GLU A 75 -20.877 -30.277 -3.626 1.00 12.23 C ATOM 1168 CD GLU A 75 -20.384 -30.092 -5.048 1.00 31.13 C ATOM 1169 OE1 GLU A 75 -19.980 -31.097 -5.670 1.00 0.21 O ATOM 1170 OE2 GLU A 75 -20.402 -28.944 -5.538 1.00 41.01 O ATOM 0 H GLU A 75 -18.899 -33.085 -1.628 1.00 33.34 H new ATOM 0 HA GLU A 75 -18.266 -31.516 -3.787 1.00 45.44 H new ATOM 0 HB2 GLU A 75 -20.482 -32.375 -3.490 1.00 54.44 H new ATOM 0 HB3 GLU A 75 -20.670 -31.579 -1.941 1.00 54.44 H new ATOM 0 HG2 GLU A 75 -21.959 -30.405 -3.635 1.00 12.23 H new ATOM 0 HG3 GLU A 75 -20.667 -29.374 -3.052 1.00 12.23 H new ATOM 1177 N LYS A 76 -18.502 -29.742 -1.014 1.00 24.31 N ATOM 1178 CA LYS A 76 -18.175 -28.455 -0.413 1.00 11.32 C ATOM 1179 C LYS A 76 -16.676 -28.338 -0.156 1.00 70.51 C ATOM 1180 O LYS A 76 -16.049 -27.346 -0.527 1.00 34.45 O ATOM 1181 CB LYS A 76 -18.943 -28.271 0.898 1.00 55.01 C ATOM 1182 CG LYS A 76 -18.760 -26.899 1.523 1.00 21.14 C ATOM 1183 CD LYS A 76 -18.018 -26.984 2.847 1.00 63.35 C ATOM 1184 CE LYS A 76 -18.975 -27.196 4.010 1.00 64.13 C ATOM 1185 NZ LYS A 76 -18.858 -28.566 4.582 1.00 62.03 N ATOM 0 H LYS A 76 -18.862 -30.434 -0.357 1.00 24.31 H new ATOM 0 HA LYS A 76 -18.468 -27.672 -1.112 1.00 11.32 H new ATOM 0 HB2 LYS A 76 -20.004 -28.439 0.714 1.00 55.01 H new ATOM 0 HB3 LYS A 76 -18.619 -29.031 1.609 1.00 55.01 H new ATOM 0 HG2 LYS A 76 -18.209 -26.256 0.837 1.00 21.14 H new ATOM 0 HG3 LYS A 76 -19.735 -26.437 1.680 1.00 21.14 H new ATOM 0 HD2 LYS A 76 -17.300 -27.804 2.811 1.00 63.35 H new ATOM 0 HD3 LYS A 76 -17.448 -26.068 3.005 1.00 63.35 H new ATOM 0 HE2 LYS A 76 -18.771 -26.459 4.787 1.00 64.13 H new ATOM 0 HE3 LYS A 76 -19.998 -27.029 3.673 1.00 64.13 H new ATOM 0 HZ1 LYS A 76 -19.340 -28.600 5.503 1.00 62.03 H new ATOM 0 HZ2 LYS A 76 -19.299 -29.251 3.935 1.00 62.03 H new ATOM 0 HZ3 LYS A 76 -17.854 -28.805 4.707 1.00 62.03 H new ATOM 1199 N GLU A 77 -16.108 -29.359 0.479 1.00 61.14 N ATOM 1200 CA GLU A 77 -14.682 -29.370 0.783 1.00 20.02 C ATOM 1201 C GLU A 77 -13.855 -29.109 -0.473 1.00 13.55 C ATOM 1202 O GLU A 77 -13.183 -28.083 -0.585 1.00 42.04 O ATOM 1203 CB GLU A 77 -14.280 -30.711 1.402 1.00 52.34 C ATOM 1204 CG GLU A 77 -14.711 -30.866 2.850 1.00 34.42 C ATOM 1205 CD GLU A 77 -15.730 -31.974 3.040 1.00 50.41 C ATOM 1206 OE1 GLU A 77 -15.460 -33.110 2.599 1.00 35.45 O ATOM 1207 OE2 GLU A 77 -16.797 -31.702 3.629 1.00 31.35 O ATOM 0 H GLU A 77 -16.613 -30.188 0.792 1.00 61.14 H new ATOM 0 HA GLU A 77 -14.484 -28.573 1.500 1.00 20.02 H new ATOM 0 HB2 GLU A 77 -14.716 -31.518 0.814 1.00 52.34 H new ATOM 0 HB3 GLU A 77 -13.197 -30.820 1.340 1.00 52.34 H new ATOM 0 HG2 GLU A 77 -13.836 -31.073 3.466 1.00 34.42 H new ATOM 0 HG3 GLU A 77 -15.133 -29.925 3.202 1.00 34.42 H new ATOM 1214 N THR A 78 -13.910 -30.044 -1.415 1.00 64.43 N ATOM 1215 CA THR A 78 -13.166 -29.917 -2.662 1.00 63.40 C ATOM 1216 C THR A 78 -13.406 -28.558 -3.310 1.00 24.44 C ATOM 1217 O THR A 78 -12.460 -27.851 -3.659 1.00 15.13 O ATOM 1218 CB THR A 78 -13.551 -31.025 -3.661 1.00 43.43 C ATOM 1219 OG1 THR A 78 -14.909 -30.855 -4.081 1.00 32.12 O ATOM 1220 CG2 THR A 78 -13.375 -32.401 -3.038 1.00 31.12 C ATOM 0 H THR A 78 -14.462 -30.898 -1.338 1.00 64.43 H new ATOM 0 HA THR A 78 -12.110 -30.015 -2.411 1.00 63.40 H new ATOM 0 HB THR A 78 -12.892 -30.949 -4.526 1.00 43.43 H new ATOM 0 HG1 THR A 78 -15.492 -30.812 -3.294 1.00 32.12 H new ATOM 0 HG21 THR A 78 -13.653 -33.167 -3.762 1.00 31.12 H new ATOM 0 HG22 THR A 78 -12.334 -32.538 -2.747 1.00 31.12 H new ATOM 0 HG23 THR A 78 -14.012 -32.486 -2.158 1.00 31.12 H new ATOM 1228 N ASP A 79 -14.675 -28.199 -3.467 1.00 22.15 N ATOM 1229 CA ASP A 79 -15.039 -26.923 -4.071 1.00 10.21 C ATOM 1230 C ASP A 79 -14.419 -25.761 -3.301 1.00 54.42 C ATOM 1231 O ASP A 79 -14.144 -24.704 -3.869 1.00 42.05 O ATOM 1232 CB ASP A 79 -16.560 -26.770 -4.113 1.00 12.32 C ATOM 1233 CG ASP A 79 -16.991 -25.396 -4.587 1.00 40.23 C ATOM 1234 OD1 ASP A 79 -16.320 -24.840 -5.482 1.00 74.52 O ATOM 1235 OD2 ASP A 79 -17.998 -24.875 -4.063 1.00 73.42 O ATOM 0 H ASP A 79 -15.469 -28.774 -3.184 1.00 22.15 H new ATOM 0 HA ASP A 79 -14.652 -26.908 -5.090 1.00 10.21 H new ATOM 0 HB2 ASP A 79 -16.980 -27.528 -4.774 1.00 12.32 H new ATOM 0 HB3 ASP A 79 -16.968 -26.953 -3.119 1.00 12.32 H new ATOM 1240 N TRP A 80 -14.204 -25.963 -2.006 1.00 74.25 N ATOM 1241 CA TRP A 80 -13.618 -24.931 -1.159 1.00 33.24 C ATOM 1242 C TRP A 80 -12.111 -24.845 -1.369 1.00 23.31 C ATOM 1243 O TRP A 80 -11.584 -23.795 -1.737 1.00 73.13 O ATOM 1244 CB TRP A 80 -13.925 -25.216 0.313 1.00 51.04 C ATOM 1245 CG TRP A 80 -13.762 -24.016 1.196 1.00 33.53 C ATOM 1246 CD1 TRP A 80 -14.758 -23.239 1.714 1.00 54.30 C ATOM 1247 CD2 TRP A 80 -12.530 -23.457 1.664 1.00 60.42 C ATOM 1248 NE1 TRP A 80 -14.219 -22.230 2.475 1.00 14.42 N ATOM 1249 CE2 TRP A 80 -12.854 -22.342 2.461 1.00 34.31 C ATOM 1250 CE3 TRP A 80 -11.184 -23.791 1.488 1.00 34.25 C ATOM 1251 CZ2 TRP A 80 -11.881 -21.561 3.079 1.00 75.11 C ATOM 1252 CZ3 TRP A 80 -10.220 -23.015 2.102 1.00 10.30 C ATOM 1253 CH2 TRP A 80 -10.572 -21.911 2.890 1.00 50.20 C ATOM 0 H TRP A 80 -14.427 -26.832 -1.520 1.00 74.25 H new ATOM 0 HA TRP A 80 -14.059 -23.974 -1.437 1.00 33.24 H new ATOM 0 HB2 TRP A 80 -14.947 -25.585 0.399 1.00 51.04 H new ATOM 0 HB3 TRP A 80 -13.268 -26.011 0.667 1.00 51.04 H new ATOM 0 HD1 TRP A 80 -15.814 -23.395 1.550 1.00 54.30 H new ATOM 0 HE1 TRP A 80 -14.750 -21.513 2.970 1.00 14.42 H new ATOM 0 HE3 TRP A 80 -10.903 -24.640 0.883 1.00 34.25 H new ATOM 0 HZ2 TRP A 80 -12.150 -20.709 3.686 1.00 75.11 H new ATOM 0 HZ3 TRP A 80 -9.177 -23.264 1.972 1.00 10.30 H new ATOM 0 HH2 TRP A 80 -9.795 -21.325 3.357 1.00 50.20 H new ATOM 1264 N VAL A 81 -11.420 -25.956 -1.133 1.00 31.31 N ATOM 1265 CA VAL A 81 -9.972 -26.006 -1.298 1.00 74.30 C ATOM 1266 C VAL A 81 -9.565 -25.591 -2.707 1.00 74.24 C ATOM 1267 O VAL A 81 -8.510 -24.989 -2.908 1.00 35.11 O ATOM 1268 CB VAL A 81 -9.423 -27.416 -1.011 1.00 71.32 C ATOM 1269 CG1 VAL A 81 -9.669 -27.800 0.440 1.00 71.41 C ATOM 1270 CG2 VAL A 81 -10.049 -28.433 -1.954 1.00 25.31 C ATOM 0 H VAL A 81 -11.840 -26.834 -0.827 1.00 31.31 H new ATOM 0 HA VAL A 81 -9.547 -25.305 -0.579 1.00 74.30 H new ATOM 0 HB VAL A 81 -8.347 -27.410 -1.182 1.00 71.32 H new ATOM 0 HG11 VAL A 81 -9.274 -28.799 0.624 1.00 71.41 H new ATOM 0 HG12 VAL A 81 -9.169 -27.086 1.095 1.00 71.41 H new ATOM 0 HG13 VAL A 81 -10.740 -27.790 0.642 1.00 71.41 H new ATOM 0 HG21 VAL A 81 -9.650 -29.424 -1.737 1.00 25.31 H new ATOM 0 HG22 VAL A 81 -11.130 -28.439 -1.817 1.00 25.31 H new ATOM 0 HG23 VAL A 81 -9.816 -28.165 -2.985 1.00 25.31 H new ATOM 1280 N ARG A 82 -10.409 -25.917 -3.681 1.00 54.31 N ATOM 1281 CA ARG A 82 -10.137 -25.578 -5.073 1.00 33.32 C ATOM 1282 C ARG A 82 -10.391 -24.096 -5.331 1.00 63.04 C ATOM 1283 O ARG A 82 -9.583 -23.421 -5.969 1.00 72.24 O ATOM 1284 CB ARG A 82 -11.006 -26.425 -6.005 1.00 25.40 C ATOM 1285 CG ARG A 82 -10.754 -26.159 -7.480 1.00 73.42 C ATOM 1286 CD ARG A 82 -11.067 -27.383 -8.328 1.00 0.50 C ATOM 1287 NE ARG A 82 -9.993 -27.685 -9.270 1.00 3.30 N ATOM 1288 CZ ARG A 82 -10.154 -28.440 -10.351 1.00 2.11 C ATOM 1289 NH1 ARG A 82 -11.339 -28.966 -10.625 1.00 74.31 N ATOM 1290 NH2 ARG A 82 -9.128 -28.669 -11.160 1.00 62.44 N ATOM 0 H ARG A 82 -11.286 -26.415 -3.532 1.00 54.31 H new ATOM 0 HA ARG A 82 -9.087 -25.789 -5.274 1.00 33.32 H new ATOM 0 HB2 ARG A 82 -10.825 -27.480 -5.798 1.00 25.40 H new ATOM 0 HB3 ARG A 82 -12.056 -26.233 -5.784 1.00 25.40 H new ATOM 0 HG2 ARG A 82 -11.367 -25.320 -7.810 1.00 73.42 H new ATOM 0 HG3 ARG A 82 -9.713 -25.870 -7.626 1.00 73.42 H new ATOM 0 HD2 ARG A 82 -11.231 -28.242 -7.678 1.00 0.50 H new ATOM 0 HD3 ARG A 82 -11.994 -27.217 -8.876 1.00 0.50 H new ATOM 0 HE ARG A 82 -9.068 -27.295 -9.088 1.00 3.30 H new ATOM 0 HH11 ARG A 82 -12.130 -28.791 -10.005 1.00 74.31 H new ATOM 0 HH12 ARG A 82 -11.460 -29.545 -11.456 1.00 74.31 H new ATOM 0 HH21 ARG A 82 -8.215 -28.265 -10.952 1.00 62.44 H new ATOM 0 HH22 ARG A 82 -9.252 -29.249 -11.990 1.00 62.44 H new ATOM 1304 N GLN A 83 -11.517 -23.598 -4.832 1.00 52.42 N ATOM 1305 CA GLN A 83 -11.877 -22.196 -5.011 1.00 1.13 C ATOM 1306 C GLN A 83 -10.921 -21.287 -4.246 1.00 3.13 C ATOM 1307 O GLN A 83 -10.647 -20.164 -4.667 1.00 50.24 O ATOM 1308 CB GLN A 83 -13.313 -21.953 -4.545 1.00 14.24 C ATOM 1309 CG GLN A 83 -13.763 -20.507 -4.686 1.00 64.55 C ATOM 1310 CD GLN A 83 -14.016 -20.114 -6.128 1.00 72.14 C ATOM 1311 OE1 GLN A 83 -12.944 -19.930 -6.889 1.00 55.20 O flip ATOM 1312 NE2 GLN A 83 -15.163 -19.977 -6.554 1.00 63.04 N flip ATOM 0 H GLN A 83 -12.196 -24.144 -4.301 1.00 52.42 H new ATOM 0 HA GLN A 83 -11.802 -21.960 -6.073 1.00 1.13 H new ATOM 0 HB2 GLN A 83 -13.985 -22.591 -5.119 1.00 14.24 H new ATOM 0 HB3 GLN A 83 -13.403 -22.252 -3.501 1.00 14.24 H new ATOM 0 HG2 GLN A 83 -14.674 -20.356 -4.107 1.00 64.55 H new ATOM 0 HG3 GLN A 83 -13.003 -19.851 -4.262 1.00 64.55 H new ATOM 0 HE21 GLN A 83 -15.959 -20.128 -5.934 1.00 63.04 H new ATOM 0 HE22 GLN A 83 -15.317 -19.712 -7.527 1.00 63.04 H new ATOM 1321 N GLU A 84 -10.417 -21.781 -3.119 1.00 4.40 N ATOM 1322 CA GLU A 84 -9.492 -21.011 -2.295 1.00 62.00 C ATOM 1323 C GLU A 84 -8.077 -21.070 -2.865 1.00 14.13 C ATOM 1324 O GLU A 84 -7.255 -20.191 -2.605 1.00 75.52 O ATOM 1325 CB GLU A 84 -9.497 -21.536 -0.858 1.00 3.33 C ATOM 1326 CG GLU A 84 -9.490 -20.437 0.191 1.00 12.35 C ATOM 1327 CD GLU A 84 -10.883 -19.938 0.523 1.00 75.40 C ATOM 1328 OE1 GLU A 84 -11.828 -20.283 -0.218 1.00 30.32 O ATOM 1329 OE2 GLU A 84 -11.029 -19.204 1.522 1.00 14.21 O ATOM 0 H GLU A 84 -10.633 -22.709 -2.756 1.00 4.40 H new ATOM 0 HA GLU A 84 -9.822 -19.972 -2.296 1.00 62.00 H new ATOM 0 HB2 GLU A 84 -10.378 -22.161 -0.711 1.00 3.33 H new ATOM 0 HB3 GLU A 84 -8.625 -22.174 -0.710 1.00 3.33 H new ATOM 0 HG2 GLU A 84 -9.016 -20.810 1.099 1.00 12.35 H new ATOM 0 HG3 GLU A 84 -8.885 -19.603 -0.166 1.00 12.35 H new ATOM 1336 N MET A 85 -7.802 -22.112 -3.642 1.00 22.10 N ATOM 1337 CA MET A 85 -6.487 -22.286 -4.249 1.00 52.31 C ATOM 1338 C MET A 85 -6.050 -21.015 -4.971 1.00 24.13 C ATOM 1339 O MET A 85 -5.022 -20.425 -4.640 1.00 12.14 O ATOM 1340 CB MET A 85 -6.505 -23.462 -5.228 1.00 11.53 C ATOM 1341 CG MET A 85 -5.216 -23.613 -6.020 1.00 14.34 C ATOM 1342 SD MET A 85 -3.757 -23.692 -4.963 1.00 73.23 S ATOM 1343 CE MET A 85 -2.512 -24.203 -6.145 1.00 4.24 C ATOM 0 H MET A 85 -8.471 -22.848 -3.866 1.00 22.10 H new ATOM 0 HA MET A 85 -5.772 -22.496 -3.454 1.00 52.31 H new ATOM 0 HB2 MET A 85 -6.692 -24.382 -4.674 1.00 11.53 H new ATOM 0 HB3 MET A 85 -7.335 -23.334 -5.922 1.00 11.53 H new ATOM 0 HG2 MET A 85 -5.270 -24.517 -6.626 1.00 14.34 H new ATOM 0 HG3 MET A 85 -5.116 -22.774 -6.708 1.00 14.34 H new ATOM 0 HE1 MET A 85 -2.070 -25.146 -5.823 1.00 4.24 H new ATOM 0 HE2 MET A 85 -2.972 -24.334 -7.124 1.00 4.24 H new ATOM 0 HE3 MET A 85 -1.736 -23.441 -6.208 1.00 4.24 H new ATOM 1353 N ASN A 86 -6.836 -20.600 -5.958 1.00 51.04 N ATOM 1354 CA ASN A 86 -6.528 -19.399 -6.727 1.00 75.43 C ATOM 1355 C ASN A 86 -6.951 -18.145 -5.969 1.00 53.22 C ATOM 1356 O ASN A 86 -6.223 -17.152 -5.933 1.00 74.43 O ATOM 1357 CB ASN A 86 -7.227 -19.447 -8.088 1.00 13.25 C ATOM 1358 CG ASN A 86 -6.248 -19.589 -9.236 1.00 64.42 C ATOM 1359 OD1 ASN A 86 -6.415 -20.443 -10.107 1.00 72.03 O ATOM 1360 ND2 ASN A 86 -5.217 -18.751 -9.242 1.00 74.54 N ATOM 0 H ASN A 86 -7.691 -21.077 -6.245 1.00 51.04 H new ATOM 0 HA ASN A 86 -5.450 -19.362 -6.881 1.00 75.43 H new ATOM 0 HB2 ASN A 86 -7.926 -20.283 -8.105 1.00 13.25 H new ATOM 0 HB3 ASN A 86 -7.813 -18.538 -8.224 1.00 13.25 H new ATOM 0 HD21 ASN A 86 -4.524 -18.800 -9.989 1.00 74.54 H new ATOM 0 HD22 ASN A 86 -5.118 -18.059 -8.500 1.00 74.54 H new ATOM 1367 N LYS A 87 -8.133 -18.196 -5.363 1.00 62.25 N ATOM 1368 CA LYS A 87 -8.654 -17.066 -4.604 1.00 5.21 C ATOM 1369 C LYS A 87 -7.650 -16.611 -3.549 1.00 13.22 C ATOM 1370 O LYS A 87 -7.158 -15.483 -3.592 1.00 64.45 O ATOM 1371 CB LYS A 87 -9.978 -17.441 -3.935 1.00 40.03 C ATOM 1372 CG LYS A 87 -10.514 -16.368 -3.003 1.00 21.41 C ATOM 1373 CD LYS A 87 -10.406 -16.790 -1.547 1.00 70.31 C ATOM 1374 CE LYS A 87 -11.609 -16.325 -0.741 1.00 73.14 C ATOM 1375 NZ LYS A 87 -11.408 -16.523 0.721 1.00 42.22 N ATOM 0 H LYS A 87 -8.748 -19.009 -5.383 1.00 62.25 H new ATOM 0 HA LYS A 87 -8.825 -16.242 -5.297 1.00 5.21 H new ATOM 0 HB2 LYS A 87 -10.721 -17.644 -4.707 1.00 40.03 H new ATOM 0 HB3 LYS A 87 -9.842 -18.365 -3.372 1.00 40.03 H new ATOM 0 HG2 LYS A 87 -9.960 -15.442 -3.156 1.00 21.41 H new ATOM 0 HG3 LYS A 87 -11.556 -16.161 -3.246 1.00 21.41 H new ATOM 0 HD2 LYS A 87 -10.324 -17.875 -1.487 1.00 70.31 H new ATOM 0 HD3 LYS A 87 -9.495 -16.377 -1.114 1.00 70.31 H new ATOM 0 HE2 LYS A 87 -11.795 -15.270 -0.942 1.00 73.14 H new ATOM 0 HE3 LYS A 87 -12.495 -16.872 -1.063 1.00 73.14 H new ATOM 0 HZ1 LYS A 87 -12.291 -16.306 1.225 1.00 42.22 H new ATOM 0 HZ2 LYS A 87 -11.139 -17.511 0.904 1.00 42.22 H new ATOM 0 HZ3 LYS A 87 -10.653 -15.891 1.056 1.00 42.22 H new ATOM 1389 N ASP A 88 -7.351 -17.495 -2.603 1.00 53.33 N ATOM 1390 CA ASP A 88 -6.404 -17.185 -1.538 1.00 55.44 C ATOM 1391 C ASP A 88 -5.082 -16.689 -2.115 1.00 1.33 C ATOM 1392 O ASP A 88 -4.379 -15.893 -1.490 1.00 15.13 O ATOM 1393 CB ASP A 88 -6.164 -18.417 -0.665 1.00 75.13 C ATOM 1394 CG ASP A 88 -5.794 -18.054 0.759 1.00 32.24 C ATOM 1395 OD1 ASP A 88 -6.623 -17.418 1.443 1.00 4.14 O ATOM 1396 OD2 ASP A 88 -4.676 -18.406 1.190 1.00 3.21 O ATOM 0 H ASP A 88 -7.751 -18.432 -2.552 1.00 53.33 H new ATOM 0 HA ASP A 88 -6.832 -16.393 -0.924 1.00 55.44 H new ATOM 0 HB2 ASP A 88 -7.062 -19.034 -0.658 1.00 75.13 H new ATOM 0 HB3 ASP A 88 -5.367 -19.019 -1.102 1.00 75.13 H new ATOM 1401 N LEU A 89 -4.748 -17.165 -3.309 1.00 45.40 N ATOM 1402 CA LEU A 89 -3.508 -16.771 -3.970 1.00 51.40 C ATOM 1403 C LEU A 89 -3.443 -15.257 -4.147 1.00 63.00 C ATOM 1404 O LEU A 89 -2.452 -14.623 -3.786 1.00 20.03 O ATOM 1405 CB LEU A 89 -3.391 -17.460 -5.330 1.00 71.24 C ATOM 1406 CG LEU A 89 -2.100 -18.240 -5.579 1.00 23.55 C ATOM 1407 CD1 LEU A 89 -2.375 -19.736 -5.600 1.00 55.12 C ATOM 1408 CD2 LEU A 89 -1.451 -17.797 -6.881 1.00 64.15 C ATOM 0 H LEU A 89 -5.318 -17.824 -3.839 1.00 45.40 H new ATOM 0 HA LEU A 89 -2.675 -17.081 -3.340 1.00 51.40 H new ATOM 0 HB2 LEU A 89 -4.232 -18.144 -5.442 1.00 71.24 H new ATOM 0 HB3 LEU A 89 -3.490 -16.703 -6.108 1.00 71.24 H new ATOM 0 HG LEU A 89 -1.409 -18.030 -4.763 1.00 23.55 H new ATOM 0 HD11 LEU A 89 -1.444 -20.275 -5.778 1.00 55.12 H new ATOM 0 HD12 LEU A 89 -2.794 -20.042 -4.641 1.00 55.12 H new ATOM 0 HD13 LEU A 89 -3.085 -19.964 -6.395 1.00 55.12 H new ATOM 0 HD21 LEU A 89 -0.533 -18.363 -7.041 1.00 64.15 H new ATOM 0 HD22 LEU A 89 -2.137 -17.976 -7.709 1.00 64.15 H new ATOM 0 HD23 LEU A 89 -1.217 -16.734 -6.827 1.00 64.15 H new ATOM 1420 N GLU A 90 -4.506 -14.685 -4.703 1.00 41.23 N ATOM 1421 CA GLU A 90 -4.569 -13.245 -4.926 1.00 63.24 C ATOM 1422 C GLU A 90 -5.100 -12.526 -3.690 1.00 4.32 C ATOM 1423 O GLU A 90 -4.957 -11.311 -3.557 1.00 43.35 O ATOM 1424 CB GLU A 90 -5.456 -12.932 -6.133 1.00 14.24 C ATOM 1425 CG GLU A 90 -5.462 -11.462 -6.519 1.00 65.32 C ATOM 1426 CD GLU A 90 -5.505 -11.254 -8.021 1.00 21.24 C ATOM 1427 OE1 GLU A 90 -6.557 -11.543 -8.629 1.00 1.23 O ATOM 1428 OE2 GLU A 90 -4.488 -10.803 -8.587 1.00 63.42 O ATOM 0 H GLU A 90 -5.335 -15.196 -5.007 1.00 41.23 H new ATOM 0 HA GLU A 90 -3.558 -12.889 -5.125 1.00 63.24 H new ATOM 0 HB2 GLU A 90 -5.117 -13.521 -6.985 1.00 14.24 H new ATOM 0 HB3 GLU A 90 -6.477 -13.246 -5.914 1.00 14.24 H new ATOM 0 HG2 GLU A 90 -6.324 -10.974 -6.063 1.00 65.32 H new ATOM 0 HG3 GLU A 90 -4.572 -10.980 -6.114 1.00 65.32 H new ATOM 1435 N GLU A 91 -5.713 -13.286 -2.788 1.00 1.42 N ATOM 1436 CA GLU A 91 -6.266 -12.720 -1.563 1.00 34.21 C ATOM 1437 C GLU A 91 -5.168 -12.473 -0.533 1.00 41.10 C ATOM 1438 O GLU A 91 -5.209 -11.494 0.213 1.00 74.23 O ATOM 1439 CB GLU A 91 -7.328 -13.654 -0.978 1.00 71.11 C ATOM 1440 CG GLU A 91 -8.237 -12.982 0.037 1.00 54.12 C ATOM 1441 CD GLU A 91 -9.646 -13.543 0.020 1.00 51.25 C ATOM 1442 OE1 GLU A 91 -10.293 -13.488 -1.048 1.00 2.34 O ATOM 1443 OE2 GLU A 91 -10.102 -14.036 1.072 1.00 21.30 O ATOM 0 H GLU A 91 -5.839 -14.294 -2.882 1.00 1.42 H new ATOM 0 HA GLU A 91 -6.729 -11.765 -1.811 1.00 34.21 H new ATOM 0 HB2 GLU A 91 -7.936 -14.053 -1.790 1.00 71.11 H new ATOM 0 HB3 GLU A 91 -6.833 -14.502 -0.505 1.00 71.11 H new ATOM 0 HG2 GLU A 91 -7.814 -13.103 1.034 1.00 54.12 H new ATOM 0 HG3 GLU A 91 -8.274 -11.912 -0.166 1.00 54.12 H new ATOM 1450 N VAL A 92 -4.186 -13.368 -0.498 1.00 4.14 N ATOM 1451 CA VAL A 92 -3.075 -13.248 0.440 1.00 53.33 C ATOM 1452 C VAL A 92 -2.094 -12.170 -0.007 1.00 24.04 C ATOM 1453 O VAL A 92 -1.543 -11.437 0.815 1.00 22.11 O ATOM 1454 CB VAL A 92 -2.322 -14.582 0.591 1.00 24.30 C ATOM 1455 CG1 VAL A 92 -3.241 -15.654 1.158 1.00 42.51 C ATOM 1456 CG2 VAL A 92 -1.740 -15.020 -0.745 1.00 2.32 C ATOM 0 H VAL A 92 -4.137 -14.184 -1.108 1.00 4.14 H new ATOM 0 HA VAL A 92 -3.502 -12.970 1.404 1.00 53.33 H new ATOM 0 HB VAL A 92 -1.499 -14.436 1.290 1.00 24.30 H new ATOM 0 HG11 VAL A 92 -2.691 -16.590 1.257 1.00 42.51 H new ATOM 0 HG12 VAL A 92 -3.605 -15.341 2.137 1.00 42.51 H new ATOM 0 HG13 VAL A 92 -4.087 -15.800 0.487 1.00 42.51 H new ATOM 0 HG21 VAL A 92 -1.211 -15.965 -0.619 1.00 2.32 H new ATOM 0 HG22 VAL A 92 -2.545 -15.148 -1.468 1.00 2.32 H new ATOM 0 HG23 VAL A 92 -1.046 -14.261 -1.106 1.00 2.32 H new ATOM 1466 N LYS A 93 -1.879 -12.078 -1.315 1.00 22.24 N ATOM 1467 CA LYS A 93 -0.965 -11.089 -1.873 1.00 3.12 C ATOM 1468 C LYS A 93 -1.565 -9.689 -1.795 1.00 3.31 C ATOM 1469 O LYS A 93 -0.840 -8.695 -1.749 1.00 63.34 O ATOM 1470 CB LYS A 93 -0.634 -11.433 -3.327 1.00 23.22 C ATOM 1471 CG LYS A 93 -1.797 -11.225 -4.281 1.00 30.50 C ATOM 1472 CD LYS A 93 -1.731 -9.864 -4.952 1.00 52.05 C ATOM 1473 CE LYS A 93 -0.751 -9.863 -6.115 1.00 41.15 C ATOM 1474 NZ LYS A 93 -1.447 -9.751 -7.427 1.00 42.43 N ATOM 0 H LYS A 93 -2.326 -12.677 -2.009 1.00 22.24 H new ATOM 0 HA LYS A 93 -0.048 -11.106 -1.284 1.00 3.12 H new ATOM 0 HB2 LYS A 93 0.207 -10.821 -3.654 1.00 23.22 H new ATOM 0 HB3 LYS A 93 -0.312 -12.473 -3.381 1.00 23.22 H new ATOM 0 HG2 LYS A 93 -1.790 -12.007 -5.040 1.00 30.50 H new ATOM 0 HG3 LYS A 93 -2.737 -11.318 -3.736 1.00 30.50 H new ATOM 0 HD2 LYS A 93 -2.722 -9.585 -5.310 1.00 52.05 H new ATOM 0 HD3 LYS A 93 -1.432 -9.111 -4.222 1.00 52.05 H new ATOM 0 HE2 LYS A 93 -0.054 -9.033 -6.002 1.00 41.15 H new ATOM 0 HE3 LYS A 93 -0.161 -10.779 -6.094 1.00 41.15 H new ATOM 0 HZ1 LYS A 93 -0.745 -9.754 -8.194 1.00 42.43 H new ATOM 0 HZ2 LYS A 93 -2.094 -10.557 -7.547 1.00 42.43 H new ATOM 0 HZ3 LYS A 93 -1.989 -8.864 -7.458 1.00 42.43 H new ATOM 1488 N GLN A 94 -2.892 -9.619 -1.778 1.00 41.54 N ATOM 1489 CA GLN A 94 -3.588 -8.339 -1.705 1.00 21.40 C ATOM 1490 C GLN A 94 -3.857 -7.948 -0.256 1.00 22.45 C ATOM 1491 O GLN A 94 -4.145 -6.789 0.043 1.00 75.41 O ATOM 1492 CB GLN A 94 -4.905 -8.406 -2.480 1.00 62.14 C ATOM 1493 CG GLN A 94 -6.014 -9.130 -1.734 1.00 51.33 C ATOM 1494 CD GLN A 94 -7.177 -8.219 -1.391 1.00 24.43 C ATOM 1495 OE1 GLN A 94 -8.339 -8.589 -1.556 1.00 54.24 O ATOM 1496 NE2 GLN A 94 -6.868 -7.021 -0.909 1.00 31.15 N ATOM 0 H GLN A 94 -3.507 -10.432 -1.814 1.00 41.54 H new ATOM 0 HA GLN A 94 -2.948 -7.580 -2.155 1.00 21.40 H new ATOM 0 HB2 GLN A 94 -5.234 -7.392 -2.709 1.00 62.14 H new ATOM 0 HB3 GLN A 94 -4.732 -8.907 -3.432 1.00 62.14 H new ATOM 0 HG2 GLN A 94 -6.374 -9.960 -2.342 1.00 51.33 H new ATOM 0 HG3 GLN A 94 -5.610 -9.559 -0.817 1.00 51.33 H new ATOM 0 HE21 GLN A 94 -5.890 -6.756 -0.789 1.00 31.15 H new ATOM 0 HE22 GLN A 94 -7.608 -6.365 -0.659 1.00 31.15 H new ATOM 1505 N LYS A 95 -3.761 -8.923 0.642 1.00 4.05 N ATOM 1506 CA LYS A 95 -3.992 -8.682 2.062 1.00 53.13 C ATOM 1507 C LYS A 95 -2.713 -8.218 2.751 1.00 51.43 C ATOM 1508 O LYS A 95 -2.757 -7.445 3.708 1.00 32.12 O ATOM 1509 CB LYS A 95 -4.516 -9.952 2.737 1.00 42.41 C ATOM 1510 CG LYS A 95 -6.014 -9.935 2.984 1.00 34.31 C ATOM 1511 CD LYS A 95 -6.640 -11.292 2.706 1.00 52.31 C ATOM 1512 CE LYS A 95 -7.682 -11.651 3.755 1.00 42.44 C ATOM 1513 NZ LYS A 95 -8.930 -10.856 3.591 1.00 55.13 N ATOM 0 H LYS A 95 -3.525 -9.888 0.411 1.00 4.05 H new ATOM 0 HA LYS A 95 -4.739 -7.894 2.154 1.00 53.13 H new ATOM 0 HB2 LYS A 95 -4.268 -10.812 2.115 1.00 42.41 H new ATOM 0 HB3 LYS A 95 -4.001 -10.087 3.688 1.00 42.41 H new ATOM 0 HG2 LYS A 95 -6.210 -9.647 4.017 1.00 34.31 H new ATOM 0 HG3 LYS A 95 -6.480 -9.181 2.349 1.00 34.31 H new ATOM 0 HD2 LYS A 95 -7.103 -11.285 1.719 1.00 52.31 H new ATOM 0 HD3 LYS A 95 -5.862 -12.056 2.688 1.00 52.31 H new ATOM 0 HE2 LYS A 95 -7.916 -12.713 3.686 1.00 42.44 H new ATOM 0 HE3 LYS A 95 -7.270 -11.480 4.750 1.00 42.44 H new ATOM 0 HZ1 LYS A 95 -9.508 -10.935 4.452 1.00 55.13 H new ATOM 0 HZ2 LYS A 95 -8.687 -9.858 3.428 1.00 55.13 H new ATOM 0 HZ3 LYS A 95 -9.468 -11.218 2.778 1.00 55.13 H new ATOM 1527 N VAL A 96 -1.574 -8.692 2.256 1.00 32.44 N ATOM 1528 CA VAL A 96 -0.282 -8.324 2.823 1.00 53.41 C ATOM 1529 C VAL A 96 0.034 -6.856 2.560 1.00 43.33 C ATOM 1530 O VAL A 96 0.742 -6.215 3.336 1.00 25.20 O ATOM 1531 CB VAL A 96 0.852 -9.193 2.248 1.00 75.12 C ATOM 1532 CG1 VAL A 96 0.763 -10.612 2.789 1.00 62.14 C ATOM 1533 CG2 VAL A 96 0.806 -9.189 0.727 1.00 23.43 C ATOM 0 H VAL A 96 -1.520 -9.332 1.463 1.00 32.44 H new ATOM 0 HA VAL A 96 -0.348 -8.492 3.898 1.00 53.41 H new ATOM 0 HB VAL A 96 1.806 -8.770 2.561 1.00 75.12 H new ATOM 0 HG11 VAL A 96 1.572 -11.212 2.372 1.00 62.14 H new ATOM 0 HG12 VAL A 96 0.848 -10.593 3.876 1.00 62.14 H new ATOM 0 HG13 VAL A 96 -0.195 -11.049 2.508 1.00 62.14 H new ATOM 0 HG21 VAL A 96 1.614 -9.808 0.337 1.00 23.43 H new ATOM 0 HG22 VAL A 96 -0.151 -9.588 0.391 1.00 23.43 H new ATOM 0 HG23 VAL A 96 0.922 -8.168 0.362 1.00 23.43 H new ATOM 1543 N GLN A 97 -0.496 -6.330 1.460 1.00 3.43 N ATOM 1544 CA GLN A 97 -0.269 -4.936 1.095 1.00 61.42 C ATOM 1545 C GLN A 97 -0.744 -3.999 2.200 1.00 32.43 C ATOM 1546 O GLN A 97 0.026 -3.219 2.760 1.00 23.33 O ATOM 1547 CB GLN A 97 -0.989 -4.607 -0.214 1.00 1.21 C ATOM 1548 CG GLN A 97 -1.468 -3.167 -0.299 1.00 2.51 C ATOM 1549 CD GLN A 97 -2.121 -2.846 -1.629 1.00 31.22 C ATOM 1550 OE1 GLN A 97 -2.900 -3.788 -2.148 1.00 23.21 O flip ATOM 1551 NE2 GLN A 97 -1.928 -1.764 -2.184 1.00 13.21 N flip ATOM 0 H GLN A 97 -1.085 -6.847 0.807 1.00 3.43 H new ATOM 0 HA GLN A 97 0.803 -4.792 0.959 1.00 61.42 H new ATOM 0 HB2 GLN A 97 -0.317 -4.808 -1.049 1.00 1.21 H new ATOM 0 HB3 GLN A 97 -1.845 -5.273 -0.326 1.00 1.21 H new ATOM 0 HG2 GLN A 97 -2.178 -2.976 0.505 1.00 2.51 H new ATOM 0 HG3 GLN A 97 -0.622 -2.497 -0.143 1.00 2.51 H new ATOM 0 HE21 GLN A 97 -1.321 -1.069 -1.749 1.00 13.21 H new ATOM 0 HE22 GLN A 97 -2.375 -1.563 -3.079 1.00 13.21 H new ATOM 1560 N PRO A 98 -2.044 -4.076 2.523 1.00 2.43 N ATOM 1561 CA PRO A 98 -2.651 -3.241 3.565 1.00 60.35 C ATOM 1562 C PRO A 98 -2.180 -3.626 4.963 1.00 12.40 C ATOM 1563 O PRO A 98 -2.435 -2.911 5.933 1.00 43.44 O ATOM 1564 CB PRO A 98 -4.149 -3.516 3.410 1.00 0.13 C ATOM 1565 CG PRO A 98 -4.224 -4.869 2.791 1.00 54.41 C ATOM 1566 CD PRO A 98 -3.020 -4.983 1.897 1.00 15.51 C ATOM 0 HA PRO A 98 -2.383 -2.190 3.455 1.00 60.35 H new ATOM 0 HB2 PRO A 98 -4.657 -3.493 4.374 1.00 0.13 H new ATOM 0 HB3 PRO A 98 -4.626 -2.765 2.780 1.00 0.13 H new ATOM 0 HG2 PRO A 98 -4.219 -5.648 3.554 1.00 54.41 H new ATOM 0 HG3 PRO A 98 -5.146 -4.987 2.221 1.00 54.41 H new ATOM 0 HD2 PRO A 98 -2.647 -6.006 1.853 1.00 15.51 H new ATOM 0 HD3 PRO A 98 -3.249 -4.683 0.874 1.00 15.51 H new ATOM 1574 N TYR A 99 -1.493 -4.758 5.060 1.00 4.13 N ATOM 1575 CA TYR A 99 -0.988 -5.238 6.341 1.00 2.02 C ATOM 1576 C TYR A 99 -2.135 -5.636 7.264 1.00 34.23 C ATOM 1577 O TYR A 99 -2.495 -4.897 8.182 1.00 22.51 O ATOM 1578 CB TYR A 99 -0.130 -4.163 7.010 1.00 2.13 C ATOM 1579 CG TYR A 99 0.830 -3.478 6.064 1.00 71.13 C ATOM 1580 CD1 TYR A 99 1.853 -4.188 5.447 1.00 51.12 C ATOM 1581 CD2 TYR A 99 0.715 -2.122 5.787 1.00 54.42 C ATOM 1582 CE1 TYR A 99 2.733 -3.566 4.582 1.00 74.54 C ATOM 1583 CE2 TYR A 99 1.589 -1.492 4.922 1.00 73.20 C ATOM 1584 CZ TYR A 99 2.596 -2.219 4.322 1.00 1.31 C ATOM 1585 OH TYR A 99 3.470 -1.595 3.461 1.00 32.11 O ATOM 0 H TYR A 99 -1.273 -5.361 4.267 1.00 4.13 H new ATOM 0 HA TYR A 99 -0.374 -6.119 6.153 1.00 2.02 H new ATOM 0 HB2 TYR A 99 -0.784 -3.414 7.456 1.00 2.13 H new ATOM 0 HB3 TYR A 99 0.436 -4.616 7.823 1.00 2.13 H new ATOM 0 HD1 TYR A 99 1.962 -5.244 5.647 1.00 51.12 H new ATOM 0 HD2 TYR A 99 -0.072 -1.550 6.256 1.00 54.42 H new ATOM 0 HE1 TYR A 99 3.524 -4.132 4.112 1.00 74.54 H new ATOM 0 HE2 TYR A 99 1.484 -0.437 4.717 1.00 73.20 H new ATOM 0 HH TYR A 99 3.235 -0.647 3.386 1.00 32.11 H new ATOM 1595 N LEU A 100 -2.707 -6.809 7.015 1.00 65.32 N ATOM 1596 CA LEU A 100 -3.814 -7.309 7.823 1.00 4.51 C ATOM 1597 C LEU A 100 -3.428 -8.600 8.537 1.00 5.12 C ATOM 1598 O LEU A 100 -2.255 -8.972 8.578 1.00 44.33 O ATOM 1599 CB LEU A 100 -5.045 -7.546 6.946 1.00 4.44 C ATOM 1600 CG LEU A 100 -6.345 -6.899 7.426 1.00 44.23 C ATOM 1601 CD1 LEU A 100 -6.601 -5.599 6.679 1.00 73.34 C ATOM 1602 CD2 LEU A 100 -7.514 -7.857 7.250 1.00 65.10 C ATOM 0 H LEU A 100 -2.422 -7.432 6.259 1.00 65.32 H new ATOM 0 HA LEU A 100 -4.051 -6.557 8.575 1.00 4.51 H new ATOM 0 HB2 LEU A 100 -4.828 -7.178 5.943 1.00 4.44 H new ATOM 0 HB3 LEU A 100 -5.206 -8.621 6.864 1.00 4.44 H new ATOM 0 HG LEU A 100 -6.245 -6.671 8.487 1.00 44.23 H new ATOM 0 HD11 LEU A 100 -7.530 -5.153 7.033 1.00 73.34 H new ATOM 0 HD12 LEU A 100 -5.776 -4.909 6.856 1.00 73.34 H new ATOM 0 HD13 LEU A 100 -6.681 -5.803 5.611 1.00 73.34 H new ATOM 0 HD21 LEU A 100 -8.431 -7.380 7.597 1.00 65.10 H new ATOM 0 HD22 LEU A 100 -7.616 -8.117 6.196 1.00 65.10 H new ATOM 0 HD23 LEU A 100 -7.334 -8.762 7.831 1.00 65.10 H new ATOM 1614 N ASP A 101 -4.422 -9.280 9.097 1.00 23.02 N ATOM 1615 CA ASP A 101 -4.187 -10.532 9.807 1.00 21.11 C ATOM 1616 C ASP A 101 -4.608 -11.726 8.956 1.00 24.32 C ATOM 1617 O ASP A 101 -5.053 -12.747 9.480 1.00 40.21 O ATOM 1618 CB ASP A 101 -4.948 -10.542 11.133 1.00 14.45 C ATOM 1619 CG ASP A 101 -6.436 -10.316 10.949 1.00 51.24 C ATOM 1620 OD1 ASP A 101 -7.157 -11.300 10.682 1.00 73.02 O ATOM 1621 OD2 ASP A 101 -6.879 -9.155 11.072 1.00 74.03 O ATOM 0 H ASP A 101 -5.398 -8.986 9.073 1.00 23.02 H new ATOM 0 HA ASP A 101 -3.119 -10.611 10.010 1.00 21.11 H new ATOM 0 HB2 ASP A 101 -4.788 -11.497 11.633 1.00 14.45 H new ATOM 0 HB3 ASP A 101 -4.544 -9.768 11.786 1.00 14.45 H new ATOM 1626 N GLU A 102 -4.464 -11.590 7.642 1.00 41.03 N ATOM 1627 CA GLU A 102 -4.831 -12.658 6.719 1.00 52.41 C ATOM 1628 C GLU A 102 -4.104 -13.953 7.069 1.00 51.04 C ATOM 1629 O GLU A 102 -4.564 -15.045 6.735 1.00 21.44 O ATOM 1630 CB GLU A 102 -4.509 -12.251 5.279 1.00 25.45 C ATOM 1631 CG GLU A 102 -3.023 -12.064 5.018 1.00 35.51 C ATOM 1632 CD GLU A 102 -2.516 -10.711 5.476 1.00 54.32 C ATOM 1633 OE1 GLU A 102 -3.350 -9.867 5.866 1.00 51.52 O ATOM 1634 OE2 GLU A 102 -1.287 -10.495 5.444 1.00 61.21 O ATOM 0 H GLU A 102 -4.096 -10.752 7.193 1.00 41.03 H new ATOM 0 HA GLU A 102 -5.904 -12.829 6.809 1.00 52.41 H new ATOM 0 HB2 GLU A 102 -4.896 -13.011 4.600 1.00 25.45 H new ATOM 0 HB3 GLU A 102 -5.030 -11.322 5.048 1.00 25.45 H new ATOM 0 HG2 GLU A 102 -2.466 -12.849 5.530 1.00 35.51 H new ATOM 0 HG3 GLU A 102 -2.828 -12.179 3.952 1.00 35.51 H new ATOM 1641 N PHE A 103 -2.966 -13.822 7.742 1.00 62.43 N ATOM 1642 CA PHE A 103 -2.173 -14.981 8.136 1.00 74.43 C ATOM 1643 C PHE A 103 -2.976 -15.905 9.047 1.00 12.23 C ATOM 1644 O PHE A 103 -3.345 -17.012 8.656 1.00 11.22 O ATOM 1645 CB PHE A 103 -0.893 -14.534 8.844 1.00 12.31 C ATOM 1646 CG PHE A 103 -0.215 -13.371 8.178 1.00 1.21 C ATOM 1647 CD1 PHE A 103 0.137 -13.431 6.839 1.00 10.14 C ATOM 1648 CD2 PHE A 103 0.071 -12.218 8.891 1.00 2.41 C ATOM 1649 CE1 PHE A 103 0.761 -12.362 6.223 1.00 30.43 C ATOM 1650 CE2 PHE A 103 0.695 -11.146 8.280 1.00 14.13 C ATOM 1651 CZ PHE A 103 1.041 -11.219 6.945 1.00 0.22 C ATOM 0 H PHE A 103 -2.572 -12.925 8.026 1.00 62.43 H new ATOM 0 HA PHE A 103 -1.907 -15.531 7.233 1.00 74.43 H new ATOM 0 HB2 PHE A 103 -1.131 -14.265 9.873 1.00 12.31 H new ATOM 0 HB3 PHE A 103 -0.199 -15.373 8.887 1.00 12.31 H new ATOM 0 HD1 PHE A 103 -0.079 -14.323 6.270 1.00 10.14 H new ATOM 0 HD2 PHE A 103 -0.196 -12.156 9.936 1.00 2.41 H new ATOM 0 HE1 PHE A 103 1.029 -12.421 5.178 1.00 30.43 H new ATOM 0 HE2 PHE A 103 0.912 -10.252 8.846 1.00 14.13 H new ATOM 0 HZ PHE A 103 1.530 -10.383 6.467 1.00 0.22 H new ATOM 1661 N GLN A 104 -3.242 -15.441 10.264 1.00 1.50 N ATOM 1662 CA GLN A 104 -4.000 -16.225 11.232 1.00 44.11 C ATOM 1663 C GLN A 104 -5.409 -16.505 10.722 1.00 54.44 C ATOM 1664 O GLN A 104 -6.053 -17.467 11.140 1.00 13.12 O ATOM 1665 CB GLN A 104 -4.066 -15.493 12.573 1.00 2.13 C ATOM 1666 CG GLN A 104 -3.515 -16.303 13.736 1.00 12.41 C ATOM 1667 CD GLN A 104 -4.478 -16.375 14.905 1.00 40.51 C ATOM 1668 OE1 GLN A 104 -4.295 -15.697 15.917 1.00 34.51 O ATOM 1669 NE2 GLN A 104 -5.511 -17.198 14.771 1.00 13.23 N ATOM 0 H GLN A 104 -2.944 -14.526 10.603 1.00 1.50 H new ATOM 0 HA GLN A 104 -3.488 -17.177 11.371 1.00 44.11 H new ATOM 0 HB2 GLN A 104 -3.509 -14.559 12.495 1.00 2.13 H new ATOM 0 HB3 GLN A 104 -5.103 -15.230 12.783 1.00 2.13 H new ATOM 0 HG2 GLN A 104 -3.287 -17.313 13.395 1.00 12.41 H new ATOM 0 HG3 GLN A 104 -2.577 -15.860 14.070 1.00 12.41 H new ATOM 0 HE21 GLN A 104 -5.623 -17.741 13.915 1.00 13.23 H new ATOM 0 HE22 GLN A 104 -6.193 -17.288 15.524 1.00 13.23 H new ATOM 1678 N LYS A 105 -5.884 -15.657 9.815 1.00 31.11 N ATOM 1679 CA LYS A 105 -7.217 -15.812 9.246 1.00 35.40 C ATOM 1680 C LYS A 105 -7.329 -17.121 8.470 1.00 1.12 C ATOM 1681 O LYS A 105 -8.219 -17.932 8.725 1.00 32.33 O ATOM 1682 CB LYS A 105 -7.543 -14.633 8.327 1.00 44.22 C ATOM 1683 CG LYS A 105 -8.805 -14.831 7.506 1.00 34.14 C ATOM 1684 CD LYS A 105 -9.033 -13.676 6.545 1.00 31.53 C ATOM 1685 CE LYS A 105 -10.480 -13.208 6.570 1.00 42.31 C ATOM 1686 NZ LYS A 105 -11.065 -13.143 5.202 1.00 12.22 N ATOM 0 H LYS A 105 -5.364 -14.855 9.458 1.00 31.11 H new ATOM 0 HA LYS A 105 -7.934 -15.834 10.067 1.00 35.40 H new ATOM 0 HB2 LYS A 105 -7.650 -13.732 8.931 1.00 44.22 H new ATOM 0 HB3 LYS A 105 -6.703 -14.466 7.652 1.00 44.22 H new ATOM 0 HG2 LYS A 105 -8.733 -15.763 6.945 1.00 34.14 H new ATOM 0 HG3 LYS A 105 -9.662 -14.926 8.172 1.00 34.14 H new ATOM 0 HD2 LYS A 105 -8.377 -12.847 6.809 1.00 31.53 H new ATOM 0 HD3 LYS A 105 -8.767 -13.984 5.534 1.00 31.53 H new ATOM 0 HE2 LYS A 105 -11.071 -13.886 7.186 1.00 42.31 H new ATOM 0 HE3 LYS A 105 -10.536 -12.224 7.036 1.00 42.31 H new ATOM 0 HZ1 LYS A 105 -11.918 -12.548 5.217 1.00 12.22 H new ATOM 0 HZ2 LYS A 105 -10.369 -12.735 4.546 1.00 12.22 H new ATOM 0 HZ3 LYS A 105 -11.317 -14.101 4.886 1.00 12.22 H new ATOM 1700 N LYS A 106 -6.419 -17.321 7.523 1.00 71.03 N ATOM 1701 CA LYS A 106 -6.413 -18.532 6.711 1.00 62.20 C ATOM 1702 C LYS A 106 -6.301 -19.775 7.589 1.00 52.24 C ATOM 1703 O LYS A 106 -6.805 -20.841 7.237 1.00 70.51 O ATOM 1704 CB LYS A 106 -5.254 -18.495 5.712 1.00 53.04 C ATOM 1705 CG LYS A 106 -5.179 -19.723 4.821 1.00 35.23 C ATOM 1706 CD LYS A 106 -6.159 -19.633 3.663 1.00 42.10 C ATOM 1707 CE LYS A 106 -7.454 -20.369 3.969 1.00 11.15 C ATOM 1708 NZ LYS A 106 -7.226 -21.824 4.190 1.00 54.03 N ATOM 0 H LYS A 106 -5.676 -16.660 7.299 1.00 71.03 H new ATOM 0 HA LYS A 106 -7.355 -18.578 6.164 1.00 62.20 H new ATOM 0 HB2 LYS A 106 -5.353 -17.608 5.086 1.00 53.04 H new ATOM 0 HB3 LYS A 106 -4.317 -18.396 6.259 1.00 53.04 H new ATOM 0 HG2 LYS A 106 -4.166 -19.831 4.434 1.00 35.23 H new ATOM 0 HG3 LYS A 106 -5.392 -20.615 5.410 1.00 35.23 H new ATOM 0 HD2 LYS A 106 -6.376 -18.586 3.449 1.00 42.10 H new ATOM 0 HD3 LYS A 106 -5.704 -20.053 2.766 1.00 42.10 H new ATOM 0 HE2 LYS A 106 -7.918 -19.935 4.855 1.00 11.15 H new ATOM 0 HE3 LYS A 106 -8.153 -20.232 3.144 1.00 11.15 H new ATOM 0 HZ1 LYS A 106 -8.135 -22.293 4.379 1.00 54.03 H new ATOM 0 HZ2 LYS A 106 -6.791 -22.240 3.342 1.00 54.03 H new ATOM 0 HZ3 LYS A 106 -6.592 -21.956 5.004 1.00 54.03 H new ATOM 1722 N TRP A 107 -5.640 -19.629 8.731 1.00 11.21 N ATOM 1723 CA TRP A 107 -5.464 -20.740 9.659 1.00 13.15 C ATOM 1724 C TRP A 107 -6.808 -21.215 10.200 1.00 33.32 C ATOM 1725 O TRP A 107 -6.997 -22.403 10.466 1.00 54.43 O ATOM 1726 CB TRP A 107 -4.553 -20.326 10.816 1.00 50.30 C ATOM 1727 CG TRP A 107 -4.841 -21.059 12.091 1.00 63.20 C ATOM 1728 CD1 TRP A 107 -5.573 -20.605 13.151 1.00 41.15 C ATOM 1729 CD2 TRP A 107 -4.400 -22.376 12.440 1.00 11.13 C ATOM 1730 NE1 TRP A 107 -5.614 -21.560 14.138 1.00 42.14 N ATOM 1731 CE2 TRP A 107 -4.903 -22.656 13.726 1.00 1.01 C ATOM 1732 CE3 TRP A 107 -3.632 -23.346 11.792 1.00 63.24 C ATOM 1733 CZ2 TRP A 107 -4.660 -23.865 14.373 1.00 42.31 C ATOM 1734 CZ3 TRP A 107 -3.391 -24.545 12.435 1.00 32.21 C ATOM 1735 CH2 TRP A 107 -3.904 -24.797 13.715 1.00 54.54 C ATOM 0 H TRP A 107 -5.217 -18.753 9.037 1.00 11.21 H new ATOM 0 HA TRP A 107 -5.000 -21.564 9.117 1.00 13.15 H new ATOM 0 HB2 TRP A 107 -3.515 -20.500 10.532 1.00 50.30 H new ATOM 0 HB3 TRP A 107 -4.661 -19.255 10.989 1.00 50.30 H new ATOM 0 HD1 TRP A 107 -6.050 -19.637 13.205 1.00 41.15 H new ATOM 0 HE1 TRP A 107 -6.096 -21.468 15.032 1.00 42.14 H new ATOM 0 HE3 TRP A 107 -3.233 -23.162 10.805 1.00 63.24 H new ATOM 0 HZ2 TRP A 107 -5.054 -24.060 15.359 1.00 42.31 H new ATOM 0 HZ3 TRP A 107 -2.797 -25.301 11.943 1.00 32.21 H new ATOM 0 HH2 TRP A 107 -3.699 -25.745 14.191 1.00 54.54 H new ATOM 1746 N LYS A 108 -7.740 -20.282 10.361 1.00 11.11 N ATOM 1747 CA LYS A 108 -9.068 -20.605 10.869 1.00 71.31 C ATOM 1748 C LYS A 108 -9.948 -21.181 9.764 1.00 63.32 C ATOM 1749 O LYS A 108 -10.835 -21.992 10.025 1.00 75.31 O ATOM 1750 CB LYS A 108 -9.727 -19.358 11.462 1.00 33.23 C ATOM 1751 CG LYS A 108 -11.198 -19.546 11.790 1.00 14.35 C ATOM 1752 CD LYS A 108 -12.086 -19.128 10.630 1.00 33.12 C ATOM 1753 CE LYS A 108 -13.441 -18.634 11.115 1.00 60.54 C ATOM 1754 NZ LYS A 108 -13.401 -17.198 11.504 1.00 50.43 N ATOM 0 H LYS A 108 -7.600 -19.295 10.147 1.00 11.11 H new ATOM 0 HA LYS A 108 -8.958 -21.357 11.651 1.00 71.31 H new ATOM 0 HB2 LYS A 108 -9.195 -19.072 12.369 1.00 33.23 H new ATOM 0 HB3 LYS A 108 -9.623 -18.532 10.758 1.00 33.23 H new ATOM 0 HG2 LYS A 108 -11.386 -20.591 12.035 1.00 14.35 H new ATOM 0 HG3 LYS A 108 -11.452 -18.960 12.673 1.00 14.35 H new ATOM 0 HD2 LYS A 108 -11.594 -18.341 10.059 1.00 33.12 H new ATOM 0 HD3 LYS A 108 -12.226 -19.972 9.955 1.00 33.12 H new ATOM 0 HE2 LYS A 108 -14.182 -18.777 10.329 1.00 60.54 H new ATOM 0 HE3 LYS A 108 -13.762 -19.232 11.968 1.00 60.54 H new ATOM 0 HZ1 LYS A 108 -14.343 -16.900 11.829 1.00 50.43 H new ATOM 0 HZ2 LYS A 108 -12.712 -17.065 12.272 1.00 50.43 H new ATOM 0 HZ3 LYS A 108 -13.120 -16.624 10.684 1.00 50.43 H new ATOM 1768 N GLU A 109 -9.693 -20.757 8.530 1.00 75.43 N ATOM 1769 CA GLU A 109 -10.463 -21.233 7.386 1.00 41.41 C ATOM 1770 C GLU A 109 -10.071 -22.662 7.023 1.00 35.31 C ATOM 1771 O GLU A 109 -10.920 -23.551 6.955 1.00 34.42 O ATOM 1772 CB GLU A 109 -10.250 -20.313 6.182 1.00 43.31 C ATOM 1773 CG GLU A 109 -11.406 -19.359 5.932 1.00 1.04 C ATOM 1774 CD GLU A 109 -11.247 -18.573 4.645 1.00 23.51 C ATOM 1775 OE1 GLU A 109 -10.118 -18.527 4.114 1.00 41.25 O ATOM 1776 OE2 GLU A 109 -12.252 -18.005 4.169 1.00 32.54 O ATOM 0 H GLU A 109 -8.961 -20.086 8.297 1.00 75.43 H new ATOM 0 HA GLU A 109 -11.518 -21.223 7.661 1.00 41.41 H new ATOM 0 HB2 GLU A 109 -9.339 -19.734 6.335 1.00 43.31 H new ATOM 0 HB3 GLU A 109 -10.095 -20.923 5.292 1.00 43.31 H new ATOM 0 HG2 GLU A 109 -12.337 -19.924 5.895 1.00 1.04 H new ATOM 0 HG3 GLU A 109 -11.487 -18.666 6.769 1.00 1.04 H new ATOM 1783 N ASP A 110 -8.781 -22.875 6.790 1.00 10.05 N ATOM 1784 CA ASP A 110 -8.276 -24.196 6.435 1.00 42.01 C ATOM 1785 C ASP A 110 -8.712 -25.239 7.460 1.00 51.54 C ATOM 1786 O ASP A 110 -9.256 -26.284 7.104 1.00 64.31 O ATOM 1787 CB ASP A 110 -6.750 -24.171 6.332 1.00 20.21 C ATOM 1788 CG ASP A 110 -6.230 -25.062 5.221 1.00 50.21 C ATOM 1789 OD1 ASP A 110 -6.979 -25.298 4.250 1.00 71.03 O ATOM 1790 OD2 ASP A 110 -5.074 -25.522 5.322 1.00 63.01 O ATOM 0 H ASP A 110 -8.066 -22.150 6.841 1.00 10.05 H new ATOM 0 HA ASP A 110 -8.694 -24.469 5.466 1.00 42.01 H new ATOM 0 HB2 ASP A 110 -6.417 -23.148 6.159 1.00 20.21 H new ATOM 0 HB3 ASP A 110 -6.319 -24.490 7.281 1.00 20.21 H new ATOM 1795 N VAL A 111 -8.469 -24.947 8.734 1.00 53.35 N ATOM 1796 CA VAL A 111 -8.837 -25.859 9.810 1.00 1.52 C ATOM 1797 C VAL A 111 -10.339 -26.120 9.820 1.00 2.23 C ATOM 1798 O VAL A 111 -10.790 -27.186 10.238 1.00 51.33 O ATOM 1799 CB VAL A 111 -8.414 -25.305 11.184 1.00 50.43 C ATOM 1800 CG1 VAL A 111 -8.935 -26.194 12.302 1.00 75.10 C ATOM 1801 CG2 VAL A 111 -6.901 -25.170 11.260 1.00 3.34 C ATOM 0 H VAL A 111 -8.019 -24.086 9.046 1.00 53.35 H new ATOM 0 HA VAL A 111 -8.310 -26.795 9.626 1.00 1.52 H new ATOM 0 HB VAL A 111 -8.851 -24.314 11.307 1.00 50.43 H new ATOM 0 HG11 VAL A 111 -8.626 -25.787 13.265 1.00 75.10 H new ATOM 0 HG12 VAL A 111 -10.023 -26.235 12.257 1.00 75.10 H new ATOM 0 HG13 VAL A 111 -8.529 -27.199 12.187 1.00 75.10 H new ATOM 0 HG21 VAL A 111 -6.619 -24.777 12.237 1.00 3.34 H new ATOM 0 HG22 VAL A 111 -6.441 -26.147 11.115 1.00 3.34 H new ATOM 0 HG23 VAL A 111 -6.557 -24.488 10.482 1.00 3.34 H new ATOM 1811 N GLU A 112 -11.108 -25.139 9.357 1.00 23.13 N ATOM 1812 CA GLU A 112 -12.560 -25.264 9.314 1.00 41.34 C ATOM 1813 C GLU A 112 -12.984 -26.331 8.309 1.00 55.12 C ATOM 1814 O GLU A 112 -13.741 -27.245 8.639 1.00 13.12 O ATOM 1815 CB GLU A 112 -13.198 -23.922 8.949 1.00 14.23 C ATOM 1816 CG GLU A 112 -14.704 -23.888 9.154 1.00 24.32 C ATOM 1817 CD GLU A 112 -15.100 -23.227 10.460 1.00 31.41 C ATOM 1818 OE1 GLU A 112 -15.283 -21.992 10.467 1.00 4.24 O ATOM 1819 OE2 GLU A 112 -15.227 -23.945 11.474 1.00 14.31 O ATOM 0 H GLU A 112 -10.750 -24.250 9.007 1.00 23.13 H new ATOM 0 HA GLU A 112 -12.903 -25.565 10.304 1.00 41.34 H new ATOM 0 HB2 GLU A 112 -12.740 -23.136 9.550 1.00 14.23 H new ATOM 0 HB3 GLU A 112 -12.977 -23.696 7.906 1.00 14.23 H new ATOM 0 HG2 GLU A 112 -15.168 -23.353 8.325 1.00 24.32 H new ATOM 0 HG3 GLU A 112 -15.093 -24.906 9.134 1.00 24.32 H new ATOM 1826 N LEU A 113 -12.493 -26.208 7.081 1.00 4.20 N ATOM 1827 CA LEU A 113 -12.821 -27.161 6.026 1.00 4.14 C ATOM 1828 C LEU A 113 -12.261 -28.543 6.348 1.00 13.02 C ATOM 1829 O LEU A 113 -12.868 -29.562 6.016 1.00 3.15 O ATOM 1830 CB LEU A 113 -12.270 -26.675 4.684 1.00 35.51 C ATOM 1831 CG LEU A 113 -10.829 -27.073 4.366 1.00 24.03 C ATOM 1832 CD1 LEU A 113 -10.789 -28.421 3.664 1.00 71.32 C ATOM 1833 CD2 LEU A 113 -10.156 -26.006 3.515 1.00 54.13 C ATOM 0 H LEU A 113 -11.866 -25.458 6.791 1.00 4.20 H new ATOM 0 HA LEU A 113 -13.907 -27.235 5.961 1.00 4.14 H new ATOM 0 HB2 LEU A 113 -12.914 -27.055 3.891 1.00 35.51 H new ATOM 0 HB3 LEU A 113 -12.339 -25.588 4.658 1.00 35.51 H new ATOM 0 HG LEU A 113 -10.281 -27.160 5.305 1.00 24.03 H new ATOM 0 HD11 LEU A 113 -9.755 -28.687 3.446 1.00 71.32 H new ATOM 0 HD12 LEU A 113 -11.231 -29.180 4.309 1.00 71.32 H new ATOM 0 HD13 LEU A 113 -11.353 -28.363 2.733 1.00 71.32 H new ATOM 0 HD21 LEU A 113 -9.131 -26.306 3.298 1.00 54.13 H new ATOM 0 HD22 LEU A 113 -10.704 -25.887 2.580 1.00 54.13 H new ATOM 0 HD23 LEU A 113 -10.150 -25.060 4.056 1.00 54.13 H new ATOM 1845 N TYR A 114 -11.103 -28.570 6.998 1.00 41.02 N ATOM 1846 CA TYR A 114 -10.462 -29.827 7.365 1.00 44.03 C ATOM 1847 C TYR A 114 -11.321 -30.608 8.354 1.00 24.51 C ATOM 1848 O TYR A 114 -11.535 -31.810 8.193 1.00 53.01 O ATOM 1849 CB TYR A 114 -9.081 -29.562 7.969 1.00 74.24 C ATOM 1850 CG TYR A 114 -8.451 -30.784 8.597 1.00 31.35 C ATOM 1851 CD1 TYR A 114 -7.998 -31.838 7.813 1.00 75.11 C ATOM 1852 CD2 TYR A 114 -8.309 -30.886 9.976 1.00 50.12 C ATOM 1853 CE1 TYR A 114 -7.423 -32.957 8.383 1.00 65.01 C ATOM 1854 CE2 TYR A 114 -7.733 -32.000 10.554 1.00 30.23 C ATOM 1855 CZ TYR A 114 -7.292 -33.033 9.754 1.00 64.12 C ATOM 1856 OH TYR A 114 -6.719 -34.146 10.326 1.00 4.54 O ATOM 0 H TYR A 114 -10.589 -27.736 7.282 1.00 41.02 H new ATOM 0 HA TYR A 114 -10.347 -30.425 6.461 1.00 44.03 H new ATOM 0 HB2 TYR A 114 -8.420 -29.182 7.190 1.00 74.24 H new ATOM 0 HB3 TYR A 114 -9.167 -28.780 8.723 1.00 74.24 H new ATOM 0 HD1 TYR A 114 -8.097 -31.781 6.739 1.00 75.11 H new ATOM 0 HD2 TYR A 114 -8.655 -30.080 10.606 1.00 50.12 H new ATOM 0 HE1 TYR A 114 -7.078 -33.768 7.759 1.00 65.01 H new ATOM 0 HE2 TYR A 114 -7.628 -32.062 11.627 1.00 30.23 H new ATOM 0 HH TYR A 114 -7.296 -34.478 11.045 1.00 4.54 H new ATOM 1866 N ARG A 115 -11.810 -29.917 9.378 1.00 40.31 N ATOM 1867 CA ARG A 115 -12.645 -30.544 10.395 1.00 73.55 C ATOM 1868 C ARG A 115 -13.840 -31.249 9.758 1.00 64.23 C ATOM 1869 O ARG A 115 -14.343 -32.238 10.289 1.00 75.32 O ATOM 1870 CB ARG A 115 -13.133 -29.500 11.401 1.00 62.24 C ATOM 1871 CG ARG A 115 -12.164 -29.260 12.547 1.00 41.23 C ATOM 1872 CD ARG A 115 -12.896 -28.895 13.828 1.00 35.13 C ATOM 1873 NE ARG A 115 -12.724 -29.909 14.865 1.00 73.42 N ATOM 1874 CZ ARG A 115 -11.586 -30.104 15.521 1.00 2.52 C ATOM 1875 NH1 ARG A 115 -10.525 -29.356 15.250 1.00 22.13 N ATOM 1876 NH2 ARG A 115 -11.507 -31.047 16.451 1.00 13.33 N ATOM 0 H ARG A 115 -11.642 -28.922 9.525 1.00 40.31 H new ATOM 0 HA ARG A 115 -12.041 -31.287 10.917 1.00 73.55 H new ATOM 0 HB2 ARG A 115 -13.306 -28.559 10.880 1.00 62.24 H new ATOM 0 HB3 ARG A 115 -14.092 -29.820 11.808 1.00 62.24 H new ATOM 0 HG2 ARG A 115 -11.565 -30.155 12.712 1.00 41.23 H new ATOM 0 HG3 ARG A 115 -11.474 -28.459 12.280 1.00 41.23 H new ATOM 0 HD2 ARG A 115 -12.529 -27.936 14.194 1.00 35.13 H new ATOM 0 HD3 ARG A 115 -13.958 -28.770 13.616 1.00 35.13 H new ATOM 0 HE ARG A 115 -13.522 -30.500 15.098 1.00 73.42 H new ATOM 0 HH11 ARG A 115 -10.582 -28.629 14.537 1.00 22.13 H new ATOM 0 HH12 ARG A 115 -9.652 -29.507 15.755 1.00 22.13 H new ATOM 0 HH21 ARG A 115 -12.321 -31.624 16.663 1.00 13.33 H new ATOM 0 HH22 ARG A 115 -10.632 -31.195 16.954 1.00 13.33 H new ATOM 1890 N GLN A 116 -14.286 -30.732 8.618 1.00 74.13 N ATOM 1891 CA GLN A 116 -15.422 -31.311 7.910 1.00 61.41 C ATOM 1892 C GLN A 116 -15.069 -32.683 7.345 1.00 63.24 C ATOM 1893 O GLN A 116 -15.546 -33.709 7.831 1.00 4.20 O ATOM 1894 CB GLN A 116 -15.874 -30.383 6.782 1.00 53.23 C ATOM 1895 CG GLN A 116 -16.224 -28.980 7.252 1.00 44.13 C ATOM 1896 CD GLN A 116 -17.294 -28.974 8.326 1.00 44.34 C ATOM 1897 OE1 GLN A 116 -18.373 -29.538 8.146 1.00 71.21 O ATOM 1898 NE2 GLN A 116 -16.999 -28.334 9.451 1.00 13.42 N ATOM 0 H GLN A 116 -13.879 -29.914 8.165 1.00 74.13 H new ATOM 0 HA GLN A 116 -16.239 -31.430 8.622 1.00 61.41 H new ATOM 0 HB2 GLN A 116 -15.083 -30.320 6.035 1.00 53.23 H new ATOM 0 HB3 GLN A 116 -16.743 -30.820 6.290 1.00 53.23 H new ATOM 0 HG2 GLN A 116 -15.326 -28.495 7.636 1.00 44.13 H new ATOM 0 HG3 GLN A 116 -16.565 -28.391 6.401 1.00 44.13 H new ATOM 0 HE21 GLN A 116 -16.092 -27.880 9.557 1.00 13.42 H new ATOM 0 HE22 GLN A 116 -17.680 -28.296 10.210 1.00 13.42 H new ATOM 1907 N LYS A 117 -14.230 -32.695 6.314 1.00 11.20 N ATOM 1908 CA LYS A 117 -13.811 -33.940 5.682 1.00 73.12 C ATOM 1909 C LYS A 117 -13.201 -34.892 6.706 1.00 41.33 C ATOM 1910 O LYS A 117 -13.481 -36.090 6.697 1.00 22.03 O ATOM 1911 CB LYS A 117 -12.801 -33.656 4.568 1.00 1.11 C ATOM 1912 CG LYS A 117 -11.749 -32.628 4.949 1.00 73.14 C ATOM 1913 CD LYS A 117 -10.595 -32.620 3.961 1.00 43.32 C ATOM 1914 CE LYS A 117 -11.029 -33.118 2.591 1.00 13.01 C ATOM 1915 NZ LYS A 117 -10.025 -32.796 1.539 1.00 32.25 N ATOM 0 H LYS A 117 -13.827 -31.855 5.898 1.00 11.20 H new ATOM 0 HA LYS A 117 -14.693 -34.414 5.252 1.00 73.12 H new ATOM 0 HB2 LYS A 117 -12.305 -34.587 4.293 1.00 1.11 H new ATOM 0 HB3 LYS A 117 -13.336 -33.307 3.685 1.00 1.11 H new ATOM 0 HG2 LYS A 117 -12.203 -31.638 4.987 1.00 73.14 H new ATOM 0 HG3 LYS A 117 -11.372 -32.845 5.949 1.00 73.14 H new ATOM 0 HD2 LYS A 117 -10.198 -31.609 3.872 1.00 43.32 H new ATOM 0 HD3 LYS A 117 -9.788 -33.248 4.338 1.00 43.32 H new ATOM 0 HE2 LYS A 117 -11.182 -34.197 2.629 1.00 13.01 H new ATOM 0 HE3 LYS A 117 -11.987 -32.669 2.328 1.00 13.01 H new ATOM 0 HZ1 LYS A 117 -10.489 -32.784 0.608 1.00 32.25 H new ATOM 0 HZ2 LYS A 117 -9.609 -31.862 1.731 1.00 32.25 H new ATOM 0 HZ3 LYS A 117 -9.275 -33.517 1.543 1.00 32.25 H new ATOM 1929 N ALA A 118 -12.367 -34.350 7.587 1.00 11.43 N ATOM 1930 CA ALA A 118 -11.721 -35.150 8.620 1.00 65.14 C ATOM 1931 C ALA A 118 -12.750 -35.780 9.551 1.00 33.13 C ATOM 1932 O ALA A 118 -12.472 -36.779 10.214 1.00 35.33 O ATOM 1933 CB ALA A 118 -10.741 -34.298 9.412 1.00 4.41 C ATOM 0 H ALA A 118 -12.123 -33.360 7.606 1.00 11.43 H new ATOM 0 HA ALA A 118 -11.172 -35.955 8.131 1.00 65.14 H new ATOM 0 HB1 ALA A 118 -10.266 -34.909 10.180 1.00 4.41 H new ATOM 0 HB2 ALA A 118 -9.979 -33.901 8.741 1.00 4.41 H new ATOM 0 HB3 ALA A 118 -11.275 -33.473 9.883 1.00 4.41 H new ATOM 1939 N SER A 119 -13.940 -35.189 9.597 1.00 0.01 N ATOM 1940 CA SER A 119 -15.010 -35.690 10.452 1.00 71.15 C ATOM 1941 C SER A 119 -16.271 -35.964 9.638 1.00 34.31 C ATOM 1942 O SER A 119 -17.247 -35.216 9.687 1.00 55.42 O ATOM 1943 CB SER A 119 -15.316 -34.686 11.564 1.00 3.43 C ATOM 1944 OG SER A 119 -15.942 -35.320 12.666 1.00 53.32 O ATOM 0 H SER A 119 -14.187 -34.363 9.052 1.00 0.01 H new ATOM 0 HA SER A 119 -14.676 -36.626 10.900 1.00 71.15 H new ATOM 0 HB2 SER A 119 -14.392 -34.209 11.892 1.00 3.43 H new ATOM 0 HB3 SER A 119 -15.963 -33.898 11.179 1.00 3.43 H new ATOM 0 HG SER A 119 -16.126 -34.657 13.364 1.00 53.32 H new ATOM 1950 N PRO A 120 -16.252 -37.064 8.871 1.00 71.50 N ATOM 1951 CA PRO A 120 -17.386 -37.465 8.032 1.00 3.41 C ATOM 1952 C PRO A 120 -18.577 -37.941 8.856 1.00 21.11 C ATOM 1953 O PRO A 120 -18.513 -38.981 9.511 1.00 73.35 O ATOM 1954 CB PRO A 120 -16.820 -38.615 7.196 1.00 45.12 C ATOM 1955 CG PRO A 120 -15.708 -39.170 8.018 1.00 11.22 C ATOM 1956 CD PRO A 120 -15.122 -38.003 8.764 1.00 53.21 C ATOM 0 HA PRO A 120 -17.766 -36.635 7.437 1.00 3.41 H new ATOM 0 HB2 PRO A 120 -17.580 -39.371 6.996 1.00 45.12 H new ATOM 0 HB3 PRO A 120 -16.460 -38.262 6.230 1.00 45.12 H new ATOM 0 HG2 PRO A 120 -16.075 -39.930 8.708 1.00 11.22 H new ATOM 0 HG3 PRO A 120 -14.957 -39.647 7.388 1.00 11.22 H new ATOM 0 HD2 PRO A 120 -14.751 -38.299 9.745 1.00 53.21 H new ATOM 0 HD3 PRO A 120 -14.283 -37.562 8.226 1.00 53.21 H new ATOM 1964 N GLN A 121 -19.661 -37.174 8.819 1.00 55.34 N ATOM 1965 CA GLN A 121 -20.867 -37.519 9.563 1.00 41.22 C ATOM 1966 C GLN A 121 -21.382 -38.896 9.157 1.00 41.32 C ATOM 1967 O GLN A 121 -21.937 -39.628 9.975 1.00 52.12 O ATOM 1968 CB GLN A 121 -21.953 -36.467 9.332 1.00 40.41 C ATOM 1969 CG GLN A 121 -22.612 -36.562 7.966 1.00 73.54 C ATOM 1970 CD GLN A 121 -23.721 -35.545 7.780 1.00 45.14 C ATOM 1971 OE1 GLN A 121 -24.885 -35.904 7.601 1.00 42.44 O ATOM 1972 NE2 GLN A 121 -23.364 -34.266 7.821 1.00 22.52 N ATOM 0 H GLN A 121 -19.729 -36.310 8.282 1.00 55.34 H new ATOM 0 HA GLN A 121 -20.615 -37.544 10.623 1.00 41.22 H new ATOM 0 HB2 GLN A 121 -22.717 -36.570 10.103 1.00 40.41 H new ATOM 0 HB3 GLN A 121 -21.516 -35.475 9.447 1.00 40.41 H new ATOM 0 HG2 GLN A 121 -21.858 -36.417 7.192 1.00 73.54 H new ATOM 0 HG3 GLN A 121 -23.018 -37.565 7.832 1.00 73.54 H new ATOM 0 HE21 GLN A 121 -22.387 -34.014 7.972 1.00 22.52 H new ATOM 0 HE22 GLN A 121 -24.067 -33.536 7.702 1.00 22.52 H new ATOM 1981 N GLY A 122 -21.194 -39.242 7.887 1.00 43.12 N ATOM 1982 CA GLY A 122 -21.645 -40.530 7.394 1.00 35.14 C ATOM 1983 C GLY A 122 -20.934 -41.689 8.064 1.00 2.11 C ATOM 1984 O GLY A 122 -21.504 -42.768 8.222 1.00 4.05 O ATOM 0 H GLY A 122 -20.737 -38.653 7.191 1.00 43.12 H new ATOM 0 HA2 GLY A 122 -22.719 -40.623 7.558 1.00 35.14 H new ATOM 0 HA3 GLY A 122 -21.482 -40.581 6.318 1.00 35.14 H new ATOM 1988 N ALA A 123 -19.684 -41.466 8.457 1.00 62.11 N ATOM 1989 CA ALA A 123 -18.894 -42.500 9.113 1.00 24.22 C ATOM 1990 C ALA A 123 -19.592 -43.010 10.369 1.00 24.15 C ATOM 1991 O ALA A 123 -19.758 -44.216 10.552 1.00 45.33 O ATOM 1992 CB ALA A 123 -17.509 -41.969 9.455 1.00 72.41 C ATOM 0 H ALA A 123 -19.197 -40.578 8.332 1.00 62.11 H new ATOM 0 HA ALA A 123 -18.790 -43.336 8.422 1.00 24.22 H new ATOM 0 HB1 ALA A 123 -16.930 -42.752 9.945 1.00 72.41 H new ATOM 0 HB2 ALA A 123 -17.002 -41.660 8.541 1.00 72.41 H new ATOM 0 HB3 ALA A 123 -17.602 -41.114 10.125 1.00 72.41 H new ATOM 1998 N GLU A 124 -19.997 -42.084 11.233 1.00 75.23 N ATOM 1999 CA GLU A 124 -20.676 -42.442 12.473 1.00 52.13 C ATOM 2000 C GLU A 124 -22.151 -42.741 12.219 1.00 10.30 C ATOM 2001 O GLU A 124 -22.768 -43.531 12.934 1.00 31.23 O ATOM 2002 CB GLU A 124 -20.542 -41.314 13.497 1.00 10.44 C ATOM 2003 CG GLU A 124 -20.992 -39.960 12.975 1.00 52.25 C ATOM 2004 CD GLU A 124 -21.059 -38.907 14.063 1.00 5.54 C ATOM 2005 OE1 GLU A 124 -20.004 -38.320 14.386 1.00 61.23 O ATOM 2006 OE2 GLU A 124 -22.164 -38.669 14.593 1.00 1.31 O ATOM 0 H GLU A 124 -19.867 -41.081 11.097 1.00 75.23 H new ATOM 0 HA GLU A 124 -20.204 -43.341 12.869 1.00 52.13 H new ATOM 0 HB2 GLU A 124 -21.128 -41.566 14.381 1.00 10.44 H new ATOM 0 HB3 GLU A 124 -19.501 -41.244 13.814 1.00 10.44 H new ATOM 0 HG2 GLU A 124 -20.305 -39.629 12.196 1.00 52.25 H new ATOM 0 HG3 GLU A 124 -21.974 -40.061 12.512 1.00 52.25 H new ATOM 2013 N LEU A 125 -22.710 -42.103 11.197 1.00 52.13 N ATOM 2014 CA LEU A 125 -24.113 -42.299 10.848 1.00 51.14 C ATOM 2015 C LEU A 125 -24.410 -43.773 10.592 1.00 64.13 C ATOM 2016 O LEU A 125 -25.255 -44.370 11.258 1.00 50.04 O ATOM 2017 CB LEU A 125 -24.472 -41.473 9.611 1.00 4.32 C ATOM 2018 CG LEU A 125 -25.899 -41.634 9.087 1.00 61.12 C ATOM 2019 CD1 LEU A 125 -26.904 -41.472 10.216 1.00 11.15 C ATOM 2020 CD2 LEU A 125 -26.176 -40.631 7.976 1.00 24.22 C ATOM 0 H LEU A 125 -22.214 -41.446 10.595 1.00 52.13 H new ATOM 0 HA LEU A 125 -24.721 -41.965 11.689 1.00 51.14 H new ATOM 0 HB2 LEU A 125 -24.308 -40.420 9.842 1.00 4.32 H new ATOM 0 HB3 LEU A 125 -23.781 -41.736 8.810 1.00 4.32 H new ATOM 0 HG LEU A 125 -26.003 -42.638 8.677 1.00 61.12 H new ATOM 0 HD11 LEU A 125 -27.914 -41.590 9.824 1.00 11.15 H new ATOM 0 HD12 LEU A 125 -26.720 -42.229 10.978 1.00 11.15 H new ATOM 0 HD13 LEU A 125 -26.799 -40.481 10.657 1.00 11.15 H new ATOM 0 HD21 LEU A 125 -27.196 -40.760 7.615 1.00 24.22 H new ATOM 0 HD22 LEU A 125 -26.053 -39.619 8.361 1.00 24.22 H new ATOM 0 HD23 LEU A 125 -25.477 -40.795 7.155 1.00 24.22 H new ATOM 2310 N VAL A 143 -23.073 -63.291 4.850 1.00 52.23 N ATOM 2311 CA VAL A 143 -23.086 -61.897 4.423 1.00 2.30 C ATOM 2312 C VAL A 143 -22.352 -61.009 5.423 1.00 74.44 C ATOM 2313 O VAL A 143 -21.780 -59.984 5.055 1.00 71.14 O ATOM 2314 CB VAL A 143 -24.525 -61.376 4.250 1.00 1.41 C ATOM 2315 CG1 VAL A 143 -25.238 -62.135 3.142 1.00 53.12 C ATOM 2316 CG2 VAL A 143 -25.291 -61.483 5.560 1.00 60.11 C ATOM 0 HA VAL A 143 -22.575 -61.856 3.461 1.00 2.30 H new ATOM 0 HB VAL A 143 -24.481 -60.324 3.966 1.00 1.41 H new ATOM 0 HG11 VAL A 143 -26.253 -61.753 3.034 1.00 53.12 H new ATOM 0 HG12 VAL A 143 -24.699 -62.001 2.204 1.00 53.12 H new ATOM 0 HG13 VAL A 143 -25.274 -63.195 3.392 1.00 53.12 H new ATOM 0 HG21 VAL A 143 -26.306 -61.111 5.420 1.00 60.11 H new ATOM 0 HG22 VAL A 143 -25.328 -62.526 5.876 1.00 60.11 H new ATOM 0 HG23 VAL A 143 -24.789 -60.890 6.324 1.00 60.11 H new ATOM 2326 N ALA A 144 -22.373 -61.412 6.689 1.00 15.41 N ATOM 2327 CA ALA A 144 -21.708 -60.654 7.742 1.00 33.52 C ATOM 2328 C ALA A 144 -20.230 -60.454 7.424 1.00 33.35 C ATOM 2329 O ALA A 144 -19.607 -59.507 7.902 1.00 23.34 O ATOM 2330 CB ALA A 144 -21.872 -61.358 9.081 1.00 3.35 C ATOM 0 H ALA A 144 -22.843 -62.258 7.010 1.00 15.41 H new ATOM 0 HA ALA A 144 -22.176 -59.671 7.801 1.00 33.52 H new ATOM 0 HB1 ALA A 144 -21.371 -60.782 9.859 1.00 3.35 H new ATOM 0 HB2 ALA A 144 -22.932 -61.444 9.319 1.00 3.35 H new ATOM 0 HB3 ALA A 144 -21.431 -62.353 9.025 1.00 3.35 H new ATOM 2336 N GLU A 145 -19.676 -61.352 6.616 1.00 75.51 N ATOM 2337 CA GLU A 145 -18.271 -61.274 6.237 1.00 43.24 C ATOM 2338 C GLU A 145 -17.974 -59.961 5.518 1.00 42.04 C ATOM 2339 O GLU A 145 -17.143 -59.171 5.965 1.00 32.11 O ATOM 2340 CB GLU A 145 -17.895 -62.455 5.340 1.00 25.31 C ATOM 2341 CG GLU A 145 -18.202 -63.809 5.957 1.00 73.52 C ATOM 2342 CD GLU A 145 -17.275 -64.151 7.107 1.00 61.12 C ATOM 2343 OE1 GLU A 145 -16.331 -63.374 7.360 1.00 50.33 O ATOM 2344 OE2 GLU A 145 -17.494 -65.196 7.754 1.00 22.52 O ATOM 0 H GLU A 145 -20.179 -62.142 6.211 1.00 75.51 H new ATOM 0 HA GLU A 145 -17.673 -61.314 7.147 1.00 43.24 H new ATOM 0 HB2 GLU A 145 -18.429 -62.367 4.394 1.00 25.31 H new ATOM 0 HB3 GLU A 145 -16.831 -62.402 5.111 1.00 25.31 H new ATOM 0 HG2 GLU A 145 -19.233 -63.817 6.312 1.00 73.52 H new ATOM 0 HG3 GLU A 145 -18.123 -64.580 5.190 1.00 73.52 H new ATOM 2351 N GLU A 146 -18.659 -59.737 4.401 1.00 42.34 N ATOM 2352 CA GLU A 146 -18.467 -58.521 3.619 1.00 13.40 C ATOM 2353 C GLU A 146 -18.750 -57.281 4.463 1.00 74.20 C ATOM 2354 O GLU A 146 -18.029 -56.286 4.387 1.00 71.43 O ATOM 2355 CB GLU A 146 -19.375 -58.531 2.388 1.00 55.04 C ATOM 2356 CG GLU A 146 -19.390 -59.861 1.653 1.00 33.24 C ATOM 2357 CD GLU A 146 -18.030 -60.531 1.633 1.00 73.50 C ATOM 2358 OE1 GLU A 146 -17.019 -59.818 1.470 1.00 42.21 O ATOM 2359 OE2 GLU A 146 -17.978 -61.771 1.781 1.00 51.45 O ATOM 0 H GLU A 146 -19.351 -60.381 4.018 1.00 42.34 H new ATOM 0 HA GLU A 146 -17.427 -58.489 3.294 1.00 13.40 H new ATOM 0 HB2 GLU A 146 -20.391 -58.284 2.695 1.00 55.04 H new ATOM 0 HB3 GLU A 146 -19.050 -57.750 1.701 1.00 55.04 H new ATOM 0 HG2 GLU A 146 -20.112 -60.526 2.127 1.00 33.24 H new ATOM 0 HG3 GLU A 146 -19.728 -59.702 0.629 1.00 33.24 H new ATOM 2366 N PHE A 147 -19.806 -57.349 5.267 1.00 12.22 N ATOM 2367 CA PHE A 147 -20.187 -56.232 6.125 1.00 62.43 C ATOM 2368 C PHE A 147 -19.076 -55.908 7.120 1.00 54.22 C ATOM 2369 O PHE A 147 -18.570 -54.786 7.157 1.00 60.31 O ATOM 2370 CB PHE A 147 -21.481 -56.556 6.875 1.00 44.22 C ATOM 2371 CG PHE A 147 -22.430 -55.395 6.961 1.00 42.12 C ATOM 2372 CD1 PHE A 147 -22.003 -54.169 7.445 1.00 12.30 C ATOM 2373 CD2 PHE A 147 -23.748 -55.530 6.557 1.00 13.42 C ATOM 2374 CE1 PHE A 147 -22.875 -53.099 7.526 1.00 62.20 C ATOM 2375 CE2 PHE A 147 -24.624 -54.463 6.635 1.00 35.44 C ATOM 2376 CZ PHE A 147 -24.187 -53.246 7.120 1.00 63.35 C ATOM 0 H PHE A 147 -20.413 -58.165 5.343 1.00 12.22 H new ATOM 0 HA PHE A 147 -20.351 -55.359 5.493 1.00 62.43 H new ATOM 0 HB2 PHE A 147 -21.981 -57.388 6.379 1.00 44.22 H new ATOM 0 HB3 PHE A 147 -21.234 -56.889 7.883 1.00 44.22 H new ATOM 0 HD1 PHE A 147 -20.978 -54.048 7.762 1.00 12.30 H new ATOM 0 HD2 PHE A 147 -24.095 -56.479 6.177 1.00 13.42 H new ATOM 0 HE1 PHE A 147 -22.530 -52.149 7.907 1.00 62.20 H new ATOM 0 HE2 PHE A 147 -25.649 -54.581 6.317 1.00 35.44 H new ATOM 0 HZ PHE A 147 -24.869 -52.411 7.182 1.00 63.35 H new ATOM 2386 N ARG A 148 -18.704 -56.897 7.925 1.00 64.42 N ATOM 2387 CA ARG A 148 -17.655 -56.718 8.922 1.00 50.54 C ATOM 2388 C ARG A 148 -16.369 -56.214 8.273 1.00 62.31 C ATOM 2389 O ARG A 148 -15.588 -55.495 8.896 1.00 24.42 O ATOM 2390 CB ARG A 148 -17.388 -58.033 9.655 1.00 20.20 C ATOM 2391 CG ARG A 148 -16.317 -57.926 10.728 1.00 13.35 C ATOM 2392 CD ARG A 148 -16.166 -59.229 11.497 1.00 32.01 C ATOM 2393 NE ARG A 148 -15.913 -60.361 10.610 1.00 34.42 N ATOM 2394 CZ ARG A 148 -14.719 -60.645 10.103 1.00 21.52 C ATOM 2395 NH1 ARG A 148 -13.673 -59.884 10.394 1.00 34.04 N ATOM 2396 NH2 ARG A 148 -14.568 -61.694 9.303 1.00 15.54 N ATOM 0 H ARG A 148 -19.113 -57.831 7.907 1.00 64.42 H new ATOM 0 HA ARG A 148 -17.995 -55.973 9.641 1.00 50.54 H new ATOM 0 HB2 ARG A 148 -18.315 -58.379 10.112 1.00 20.20 H new ATOM 0 HB3 ARG A 148 -17.089 -58.789 8.929 1.00 20.20 H new ATOM 0 HG2 ARG A 148 -15.365 -57.661 10.268 1.00 13.35 H new ATOM 0 HG3 ARG A 148 -16.572 -57.122 11.419 1.00 13.35 H new ATOM 0 HD2 ARG A 148 -15.346 -59.137 12.210 1.00 32.01 H new ATOM 0 HD3 ARG A 148 -17.071 -59.416 12.075 1.00 32.01 H new ATOM 0 HE ARG A 148 -16.697 -60.967 10.366 1.00 34.42 H new ATOM 0 HH11 ARG A 148 -13.784 -59.078 11.009 1.00 34.04 H new ATOM 0 HH12 ARG A 148 -12.757 -60.105 10.003 1.00 34.04 H new ATOM 0 HH21 ARG A 148 -15.370 -62.283 9.077 1.00 15.54 H new ATOM 0 HH22 ARG A 148 -13.650 -61.911 8.914 1.00 15.54 H new ATOM 2410 N ASP A 149 -16.156 -56.597 7.019 1.00 61.31 N ATOM 2411 CA ASP A 149 -14.965 -56.185 6.285 1.00 0.22 C ATOM 2412 C ASP A 149 -15.121 -54.764 5.751 1.00 62.52 C ATOM 2413 O ASP A 149 -14.140 -54.035 5.605 1.00 12.52 O ATOM 2414 CB ASP A 149 -14.691 -57.150 5.131 1.00 72.21 C ATOM 2415 CG ASP A 149 -13.214 -57.260 4.806 1.00 55.23 C ATOM 2416 OD1 ASP A 149 -12.665 -56.308 4.212 1.00 71.22 O ATOM 2417 OD2 ASP A 149 -12.608 -58.297 5.146 1.00 41.21 O ATOM 0 H ASP A 149 -16.793 -57.192 6.489 1.00 61.31 H new ATOM 0 HA ASP A 149 -14.119 -56.205 6.972 1.00 0.22 H new ATOM 0 HB2 ASP A 149 -15.078 -58.136 5.386 1.00 72.21 H new ATOM 0 HB3 ASP A 149 -15.231 -56.815 4.245 1.00 72.21 H new ATOM 2422 N ARG A 150 -16.359 -54.380 5.459 1.00 11.14 N ATOM 2423 CA ARG A 150 -16.643 -53.048 4.939 1.00 42.12 C ATOM 2424 C ARG A 150 -16.567 -52.003 6.048 1.00 31.13 C ATOM 2425 O ARG A 150 -15.909 -50.974 5.901 1.00 51.32 O ATOM 2426 CB ARG A 150 -18.026 -53.016 4.287 1.00 15.01 C ATOM 2427 CG ARG A 150 -18.075 -52.208 3.001 1.00 53.41 C ATOM 2428 CD ARG A 150 -17.704 -53.057 1.795 1.00 52.50 C ATOM 2429 NE ARG A 150 -16.310 -53.490 1.839 1.00 52.44 N ATOM 2430 CZ ARG A 150 -15.280 -52.668 1.670 1.00 21.23 C ATOM 2431 NH1 ARG A 150 -15.486 -51.377 1.449 1.00 72.42 N ATOM 2432 NH2 ARG A 150 -14.040 -53.138 1.724 1.00 41.40 N ATOM 0 H ARG A 150 -17.181 -54.972 5.574 1.00 11.14 H new ATOM 0 HA ARG A 150 -15.889 -52.811 4.188 1.00 42.12 H new ATOM 0 HB2 ARG A 150 -18.343 -54.038 4.076 1.00 15.01 H new ATOM 0 HB3 ARG A 150 -18.743 -52.600 4.995 1.00 15.01 H new ATOM 0 HG2 ARG A 150 -19.076 -51.799 2.865 1.00 53.41 H new ATOM 0 HG3 ARG A 150 -17.392 -51.362 3.076 1.00 53.41 H new ATOM 0 HD2 ARG A 150 -18.354 -53.931 1.753 1.00 52.50 H new ATOM 0 HD3 ARG A 150 -17.878 -52.486 0.883 1.00 52.50 H new ATOM 0 HE ARG A 150 -16.117 -54.477 2.009 1.00 52.44 H new ATOM 0 HH11 ARG A 150 -16.438 -51.012 1.408 1.00 72.42 H new ATOM 0 HH12 ARG A 150 -14.693 -50.749 1.320 1.00 72.42 H new ATOM 0 HH21 ARG A 150 -13.878 -54.130 1.895 1.00 41.40 H new ATOM 0 HH22 ARG A 150 -13.249 -52.507 1.594 1.00 41.40 H new ATOM 2446 N MET A 151 -17.246 -52.276 7.158 1.00 4.31 N ATOM 2447 CA MET A 151 -17.254 -51.359 8.293 1.00 73.45 C ATOM 2448 C MET A 151 -15.836 -51.094 8.788 1.00 52.11 C ATOM 2449 O MET A 151 -15.486 -49.961 9.117 1.00 0.44 O ATOM 2450 CB MET A 151 -18.106 -51.929 9.429 1.00 42.21 C ATOM 2451 CG MET A 151 -17.672 -53.315 9.877 1.00 34.20 C ATOM 2452 SD MET A 151 -16.690 -53.281 11.389 1.00 60.04 S ATOM 2453 CE MET A 151 -17.891 -52.651 12.559 1.00 42.03 C ATOM 0 H MET A 151 -17.797 -53.123 7.296 1.00 4.31 H new ATOM 0 HA MET A 151 -17.686 -50.414 7.963 1.00 73.45 H new ATOM 0 HB2 MET A 151 -18.062 -51.250 10.281 1.00 42.21 H new ATOM 0 HB3 MET A 151 -19.147 -51.969 9.107 1.00 42.21 H new ATOM 0 HG2 MET A 151 -18.555 -53.934 10.036 1.00 34.20 H new ATOM 0 HG3 MET A 151 -17.092 -53.784 9.082 1.00 34.20 H new ATOM 0 HE1 MET A 151 -17.674 -53.047 13.551 1.00 42.03 H new ATOM 0 HE2 MET A 151 -17.839 -51.562 12.583 1.00 42.03 H new ATOM 0 HE3 MET A 151 -18.891 -52.960 12.256 1.00 42.03 H new ATOM 2463 N ARG A 152 -15.025 -52.145 8.838 1.00 31.50 N ATOM 2464 CA ARG A 152 -13.646 -52.025 9.295 1.00 62.42 C ATOM 2465 C ARG A 152 -12.812 -51.224 8.300 1.00 4.40 C ATOM 2466 O ARG A 152 -12.269 -50.170 8.635 1.00 63.03 O ATOM 2467 CB ARG A 152 -13.029 -53.411 9.493 1.00 34.33 C ATOM 2468 CG ARG A 152 -12.200 -53.533 10.761 1.00 32.23 C ATOM 2469 CD ARG A 152 -10.717 -53.361 10.475 1.00 4.04 C ATOM 2470 NE ARG A 152 -10.065 -54.634 10.178 1.00 11.21 N ATOM 2471 CZ ARG A 152 -9.834 -55.572 11.090 1.00 2.40 C ATOM 2472 NH1 ARG A 152 -10.199 -55.380 12.350 1.00 34.30 N ATOM 2473 NH2 ARG A 152 -9.236 -56.704 10.742 1.00 0.00 N ATOM 0 H ARG A 152 -15.299 -53.090 8.568 1.00 31.50 H new ATOM 0 HA ARG A 152 -13.651 -51.497 10.249 1.00 62.42 H new ATOM 0 HB2 ARG A 152 -13.826 -54.154 9.517 1.00 34.33 H new ATOM 0 HB3 ARG A 152 -12.400 -53.646 8.634 1.00 34.33 H new ATOM 0 HG2 ARG A 152 -12.522 -52.781 11.482 1.00 32.23 H new ATOM 0 HG3 ARG A 152 -12.373 -54.507 11.218 1.00 32.23 H new ATOM 0 HD2 ARG A 152 -10.587 -52.682 9.632 1.00 4.04 H new ATOM 0 HD3 ARG A 152 -10.233 -52.898 11.335 1.00 4.04 H new ATOM 0 HE ARG A 152 -9.771 -54.813 9.218 1.00 11.21 H new ATOM 0 HH11 ARG A 152 -10.658 -54.511 12.621 1.00 34.30 H new ATOM 0 HH12 ARG A 152 -10.021 -56.102 13.048 1.00 34.30 H new ATOM 0 HH21 ARG A 152 -8.953 -56.855 9.774 1.00 0.00 H new ATOM 0 HH22 ARG A 152 -9.059 -57.424 11.443 1.00 0.00 H new ATOM 2487 N THR A 153 -12.713 -51.730 7.075 1.00 50.24 N ATOM 2488 CA THR A 153 -11.944 -51.063 6.032 1.00 51.43 C ATOM 2489 C THR A 153 -12.403 -49.621 5.848 1.00 42.44 C ATOM 2490 O THR A 153 -11.617 -48.752 5.468 1.00 24.02 O ATOM 2491 CB THR A 153 -12.062 -51.803 4.686 1.00 54.20 C ATOM 2492 OG1 THR A 153 -11.624 -53.158 4.832 1.00 22.01 O ATOM 2493 CG2 THR A 153 -11.236 -51.110 3.613 1.00 52.11 C ATOM 0 H THR A 153 -13.156 -52.600 6.781 1.00 50.24 H new ATOM 0 HA THR A 153 -10.902 -51.072 6.353 1.00 51.43 H new ATOM 0 HB THR A 153 -13.108 -51.791 4.380 1.00 54.20 H new ATOM 0 HG1 THR A 153 -12.380 -53.719 5.105 1.00 22.01 H new ATOM 0 HG21 THR A 153 -11.335 -51.651 2.672 1.00 52.11 H new ATOM 0 HG22 THR A 153 -11.592 -50.088 3.484 1.00 52.11 H new ATOM 0 HG23 THR A 153 -10.188 -51.094 3.914 1.00 52.11 H new ATOM 2501 N HIS A 154 -13.680 -49.371 6.119 1.00 30.51 N ATOM 2502 CA HIS A 154 -14.243 -48.033 5.984 1.00 12.34 C ATOM 2503 C HIS A 154 -13.460 -47.027 6.823 1.00 33.12 C ATOM 2504 O HIS A 154 -12.775 -46.156 6.287 1.00 21.21 O ATOM 2505 CB HIS A 154 -15.713 -48.030 6.405 1.00 72.32 C ATOM 2506 CG HIS A 154 -16.309 -46.659 6.491 1.00 53.00 C ATOM 2507 ND1 HIS A 154 -15.840 -45.587 5.761 1.00 31.22 N ATOM 2508 CD2 HIS A 154 -17.344 -46.188 7.226 1.00 41.14 C ATOM 2509 CE1 HIS A 154 -16.559 -44.516 6.045 1.00 52.15 C ATOM 2510 NE2 HIS A 154 -17.479 -44.854 6.930 1.00 2.44 N ATOM 0 H HIS A 154 -14.344 -50.078 6.434 1.00 30.51 H new ATOM 0 HA HIS A 154 -14.172 -47.740 4.936 1.00 12.34 H new ATOM 0 HB2 HIS A 154 -16.287 -48.623 5.693 1.00 72.32 H new ATOM 0 HB3 HIS A 154 -15.806 -48.519 7.375 1.00 72.32 H new ATOM 0 HD1 HIS A 154 -15.060 -45.617 5.104 1.00 31.22 H new ATOM 0 HD2 HIS A 154 -17.950 -46.756 7.916 1.00 41.14 H new ATOM 0 HE1 HIS A 154 -16.418 -43.531 5.625 1.00 52.15 H new ATOM 2518 N VAL A 155 -13.568 -47.153 8.142 1.00 3.11 N ATOM 2519 CA VAL A 155 -12.870 -46.256 9.055 1.00 2.50 C ATOM 2520 C VAL A 155 -11.361 -46.457 8.977 1.00 44.10 C ATOM 2521 O VAL A 155 -10.587 -45.526 9.202 1.00 53.21 O ATOM 2522 CB VAL A 155 -13.330 -46.466 10.510 1.00 51.52 C ATOM 2523 CG1 VAL A 155 -12.650 -45.468 11.435 1.00 45.03 C ATOM 2524 CG2 VAL A 155 -14.844 -46.352 10.611 1.00 63.01 C ATOM 0 H VAL A 155 -14.132 -47.868 8.602 1.00 3.11 H new ATOM 0 HA VAL A 155 -13.115 -45.239 8.748 1.00 2.50 H new ATOM 0 HB VAL A 155 -13.041 -47.470 10.823 1.00 51.52 H new ATOM 0 HG11 VAL A 155 -12.988 -45.632 12.458 1.00 45.03 H new ATOM 0 HG12 VAL A 155 -11.569 -45.602 11.383 1.00 45.03 H new ATOM 0 HG13 VAL A 155 -12.905 -44.454 11.127 1.00 45.03 H new ATOM 0 HG21 VAL A 155 -15.152 -46.503 11.646 1.00 63.01 H new ATOM 0 HG22 VAL A 155 -15.157 -45.362 10.280 1.00 63.01 H new ATOM 0 HG23 VAL A 155 -15.309 -47.109 9.980 1.00 63.01 H new ATOM 2534 N ASP A 156 -10.948 -47.678 8.656 1.00 33.44 N ATOM 2535 CA ASP A 156 -9.531 -48.003 8.547 1.00 43.42 C ATOM 2536 C ASP A 156 -8.842 -47.093 7.534 1.00 71.21 C ATOM 2537 O ASP A 156 -8.014 -46.258 7.897 1.00 11.21 O ATOM 2538 CB ASP A 156 -9.350 -49.466 8.142 1.00 73.42 C ATOM 2539 CG ASP A 156 -7.894 -49.889 8.132 1.00 75.22 C ATOM 2540 OD1 ASP A 156 -7.238 -49.781 9.189 1.00 53.34 O ATOM 2541 OD2 ASP A 156 -7.411 -50.328 7.067 1.00 41.31 O ATOM 0 H ASP A 156 -11.575 -48.460 8.467 1.00 33.44 H new ATOM 0 HA ASP A 156 -9.072 -47.846 9.523 1.00 43.42 H new ATOM 0 HB2 ASP A 156 -9.905 -50.102 8.831 1.00 73.42 H new ATOM 0 HB3 ASP A 156 -9.777 -49.621 7.151 1.00 73.42 H new ATOM 2546 N SER A 157 -9.189 -47.263 6.262 1.00 13.51 N ATOM 2547 CA SER A 157 -8.601 -46.460 5.196 1.00 60.42 C ATOM 2548 C SER A 157 -8.832 -44.973 5.444 1.00 35.00 C ATOM 2549 O SER A 157 -7.925 -44.156 5.282 1.00 10.14 O ATOM 2550 CB SER A 157 -9.191 -46.861 3.842 1.00 33.14 C ATOM 2551 OG SER A 157 -8.341 -47.769 3.164 1.00 61.21 O ATOM 0 H SER A 157 -9.874 -47.949 5.945 1.00 13.51 H new ATOM 0 HA SER A 157 -7.527 -46.645 5.186 1.00 60.42 H new ATOM 0 HB2 SER A 157 -10.171 -47.316 3.989 1.00 33.14 H new ATOM 0 HB3 SER A 157 -9.341 -45.972 3.230 1.00 33.14 H new ATOM 0 HG SER A 157 -8.741 -48.011 2.303 1.00 61.21 H new ATOM 2557 N LEU A 158 -10.054 -44.629 5.838 1.00 45.42 N ATOM 2558 CA LEU A 158 -10.407 -43.239 6.109 1.00 25.31 C ATOM 2559 C LEU A 158 -9.378 -42.585 7.026 1.00 31.33 C ATOM 2560 O LEU A 158 -8.956 -41.453 6.793 1.00 4.35 O ATOM 2561 CB LEU A 158 -11.796 -43.160 6.744 1.00 71.23 C ATOM 2562 CG LEU A 158 -12.504 -41.808 6.644 1.00 64.31 C ATOM 2563 CD1 LEU A 158 -13.367 -41.749 5.393 1.00 5.51 C ATOM 2564 CD2 LEU A 158 -13.344 -41.553 7.887 1.00 70.24 C ATOM 0 H LEU A 158 -10.816 -45.293 5.977 1.00 45.42 H new ATOM 0 HA LEU A 158 -10.416 -42.700 5.161 1.00 25.31 H new ATOM 0 HB2 LEU A 158 -12.430 -43.915 6.278 1.00 71.23 H new ATOM 0 HB3 LEU A 158 -11.707 -43.424 7.798 1.00 71.23 H new ATOM 0 HG LEU A 158 -11.747 -41.027 6.575 1.00 64.31 H new ATOM 0 HD11 LEU A 158 -13.863 -40.780 5.339 1.00 5.51 H new ATOM 0 HD12 LEU A 158 -12.740 -41.886 4.512 1.00 5.51 H new ATOM 0 HD13 LEU A 158 -14.117 -42.539 5.431 1.00 5.51 H new ATOM 0 HD21 LEU A 158 -13.841 -40.587 7.799 1.00 70.24 H new ATOM 0 HD22 LEU A 158 -14.093 -42.338 7.987 1.00 70.24 H new ATOM 0 HD23 LEU A 158 -12.701 -41.551 8.767 1.00 70.24 H new ATOM 2576 N ARG A 159 -8.978 -43.307 8.068 1.00 32.10 N ATOM 2577 CA ARG A 159 -7.998 -42.797 9.020 1.00 74.53 C ATOM 2578 C ARG A 159 -6.581 -42.956 8.478 1.00 63.30 C ATOM 2579 O ARG A 159 -5.649 -42.298 8.942 1.00 20.45 O ATOM 2580 CB ARG A 159 -8.129 -43.526 10.358 1.00 21.33 C ATOM 2581 CG ARG A 159 -8.366 -42.597 11.537 1.00 11.23 C ATOM 2582 CD ARG A 159 -9.785 -42.723 12.069 1.00 0.15 C ATOM 2583 NE ARG A 159 -10.336 -41.431 12.471 1.00 23.21 N ATOM 2584 CZ ARG A 159 -10.040 -40.831 13.619 1.00 71.13 C ATOM 2585 NH1 ARG A 159 -9.203 -41.403 14.473 1.00 33.04 N ATOM 2586 NH2 ARG A 159 -10.582 -39.656 13.913 1.00 23.11 N ATOM 0 H ARG A 159 -9.317 -44.247 8.274 1.00 32.10 H new ATOM 0 HA ARG A 159 -8.193 -41.735 9.172 1.00 74.53 H new ATOM 0 HB2 ARG A 159 -8.953 -44.237 10.295 1.00 21.33 H new ATOM 0 HB3 ARG A 159 -7.222 -44.103 10.538 1.00 21.33 H new ATOM 0 HG2 ARG A 159 -7.657 -42.828 12.332 1.00 11.23 H new ATOM 0 HG3 ARG A 159 -8.180 -41.567 11.233 1.00 11.23 H new ATOM 0 HD2 ARG A 159 -10.421 -43.166 11.303 1.00 0.15 H new ATOM 0 HD3 ARG A 159 -9.793 -43.402 12.922 1.00 0.15 H new ATOM 0 HE ARG A 159 -10.983 -40.964 11.836 1.00 23.21 H new ATOM 0 HH11 ARG A 159 -8.784 -42.306 14.250 1.00 33.04 H new ATOM 0 HH12 ARG A 159 -8.977 -40.940 15.354 1.00 33.04 H new ATOM 0 HH21 ARG A 159 -11.226 -39.213 13.258 1.00 23.11 H new ATOM 0 HH22 ARG A 159 -10.355 -39.196 14.794 1.00 23.11 H new ATOM 2600 N THR A 160 -6.424 -43.835 7.492 1.00 12.34 N ATOM 2601 CA THR A 160 -5.121 -44.082 6.889 1.00 40.35 C ATOM 2602 C THR A 160 -4.636 -42.864 6.110 1.00 31.10 C ATOM 2603 O THR A 160 -3.466 -42.491 6.190 1.00 31.14 O ATOM 2604 CB THR A 160 -5.161 -45.298 5.944 1.00 23.13 C ATOM 2605 OG1 THR A 160 -5.632 -46.451 6.650 1.00 32.14 O ATOM 2606 CG2 THR A 160 -3.782 -45.580 5.366 1.00 11.33 C ATOM 0 H THR A 160 -7.184 -44.387 7.095 1.00 12.34 H new ATOM 0 HA THR A 160 -4.429 -44.288 7.705 1.00 40.35 H new ATOM 0 HB THR A 160 -5.842 -45.071 5.124 1.00 23.13 H new ATOM 0 HG1 THR A 160 -6.522 -46.269 7.017 1.00 32.14 H new ATOM 0 HG21 THR A 160 -3.835 -46.443 4.702 1.00 11.33 H new ATOM 0 HG22 THR A 160 -3.438 -44.711 4.805 1.00 11.33 H new ATOM 0 HG23 THR A 160 -3.083 -45.788 6.176 1.00 11.33 H new ATOM 2614 N GLN A 161 -5.543 -42.249 5.358 1.00 42.30 N ATOM 2615 CA GLN A 161 -5.206 -41.072 4.565 1.00 21.40 C ATOM 2616 C GLN A 161 -5.182 -39.819 5.434 1.00 51.05 C ATOM 2617 O GLN A 161 -4.322 -38.952 5.268 1.00 33.52 O ATOM 2618 CB GLN A 161 -6.208 -40.897 3.423 1.00 52.11 C ATOM 2619 CG GLN A 161 -7.659 -40.961 3.872 1.00 72.23 C ATOM 2620 CD GLN A 161 -8.474 -41.959 3.072 1.00 3.12 C ATOM 2621 OE1 GLN A 161 -9.609 -41.682 2.683 1.00 3.45 O ATOM 2622 NE2 GLN A 161 -7.897 -43.129 2.822 1.00 53.32 N ATOM 0 H GLN A 161 -6.516 -42.546 5.281 1.00 42.30 H new ATOM 0 HA GLN A 161 -4.211 -41.220 4.146 1.00 21.40 H new ATOM 0 HB2 GLN A 161 -6.029 -39.938 2.937 1.00 52.11 H new ATOM 0 HB3 GLN A 161 -6.033 -41.671 2.675 1.00 52.11 H new ATOM 0 HG2 GLN A 161 -7.697 -41.230 4.928 1.00 72.23 H new ATOM 0 HG3 GLN A 161 -8.108 -39.972 3.778 1.00 72.23 H new ATOM 0 HE21 GLN A 161 -6.954 -43.316 3.164 1.00 53.32 H new ATOM 0 HE22 GLN A 161 -8.397 -43.840 2.288 1.00 53.32 H new ATOM 2631 N LEU A 162 -6.131 -39.728 6.359 1.00 61.42 N ATOM 2632 CA LEU A 162 -6.219 -38.580 7.254 1.00 33.12 C ATOM 2633 C LEU A 162 -5.102 -38.611 8.292 1.00 62.22 C ATOM 2634 O LEU A 162 -4.719 -37.577 8.837 1.00 1.24 O ATOM 2635 CB LEU A 162 -7.580 -38.557 7.954 1.00 64.35 C ATOM 2636 CG LEU A 162 -8.658 -37.696 7.296 1.00 51.31 C ATOM 2637 CD1 LEU A 162 -8.201 -36.248 7.202 1.00 60.34 C ATOM 2638 CD2 LEU A 162 -9.007 -38.238 5.917 1.00 3.34 C ATOM 0 H LEU A 162 -6.850 -40.435 6.509 1.00 61.42 H new ATOM 0 HA LEU A 162 -6.109 -37.676 6.656 1.00 33.12 H new ATOM 0 HB2 LEU A 162 -7.950 -39.580 8.019 1.00 64.35 H new ATOM 0 HB3 LEU A 162 -7.435 -38.205 8.975 1.00 64.35 H new ATOM 0 HG LEU A 162 -9.554 -37.733 7.916 1.00 51.31 H new ATOM 0 HD11 LEU A 162 -8.981 -35.650 6.731 1.00 60.34 H new ATOM 0 HD12 LEU A 162 -8.003 -35.863 8.202 1.00 60.34 H new ATOM 0 HD13 LEU A 162 -7.291 -36.192 6.605 1.00 60.34 H new ATOM 0 HD21 LEU A 162 -9.776 -37.612 5.464 1.00 3.34 H new ATOM 0 HD22 LEU A 162 -8.117 -38.232 5.288 1.00 3.34 H new ATOM 0 HD23 LEU A 162 -9.378 -39.259 6.010 1.00 3.34 H new ATOM 2650 N ALA A 163 -4.581 -39.805 8.558 1.00 53.24 N ATOM 2651 CA ALA A 163 -3.505 -39.970 9.526 1.00 23.23 C ATOM 2652 C ALA A 163 -2.365 -38.995 9.252 1.00 64.44 C ATOM 2653 O ALA A 163 -2.037 -38.139 10.073 1.00 41.32 O ATOM 2654 CB ALA A 163 -2.993 -41.403 9.507 1.00 42.10 C ATOM 0 H ALA A 163 -4.887 -40.672 8.116 1.00 53.24 H new ATOM 0 HA ALA A 163 -3.904 -39.752 10.516 1.00 23.23 H new ATOM 0 HB1 ALA A 163 -2.189 -41.512 10.235 1.00 42.10 H new ATOM 0 HB2 ALA A 163 -3.806 -42.083 9.760 1.00 42.10 H new ATOM 0 HB3 ALA A 163 -2.616 -41.642 8.512 1.00 42.10 H new ATOM 2660 N PRO A 164 -1.744 -39.127 8.070 1.00 70.22 N ATOM 2661 CA PRO A 164 -0.631 -38.266 7.660 1.00 24.31 C ATOM 2662 C PRO A 164 -1.077 -36.836 7.377 1.00 74.23 C ATOM 2663 O PRO A 164 -0.473 -35.879 7.861 1.00 10.31 O ATOM 2664 CB PRO A 164 -0.121 -38.931 6.379 1.00 71.12 C ATOM 2665 CG PRO A 164 -1.297 -39.672 5.843 1.00 53.11 C ATOM 2666 CD PRO A 164 -2.082 -40.126 7.042 1.00 20.54 C ATOM 0 HA PRO A 164 0.125 -38.178 8.441 1.00 24.31 H new ATOM 0 HB2 PRO A 164 0.239 -38.190 5.665 1.00 71.12 H new ATOM 0 HB3 PRO A 164 0.710 -39.605 6.587 1.00 71.12 H new ATOM 0 HG2 PRO A 164 -1.902 -39.032 5.200 1.00 53.11 H new ATOM 0 HG3 PRO A 164 -0.980 -40.522 5.239 1.00 53.11 H new ATOM 0 HD2 PRO A 164 -3.152 -40.146 6.837 1.00 20.54 H new ATOM 0 HD3 PRO A 164 -1.798 -41.132 7.351 1.00 20.54 H new ATOM 2674 N HIS A 165 -2.140 -36.698 6.590 1.00 43.23 N ATOM 2675 CA HIS A 165 -2.668 -35.383 6.243 1.00 72.31 C ATOM 2676 C HIS A 165 -2.952 -34.564 7.498 1.00 53.41 C ATOM 2677 O HIS A 165 -2.873 -33.335 7.480 1.00 61.30 O ATOM 2678 CB HIS A 165 -3.944 -35.526 5.413 1.00 34.11 C ATOM 2679 CG HIS A 165 -3.690 -35.846 3.972 1.00 25.34 C ATOM 2680 ND1 HIS A 165 -4.231 -36.944 3.338 1.00 34.21 N ATOM 2681 CD2 HIS A 165 -2.947 -35.204 3.041 1.00 65.12 C ATOM 2682 CE1 HIS A 165 -3.831 -36.965 2.079 1.00 13.42 C ATOM 2683 NE2 HIS A 165 -3.051 -35.919 1.873 1.00 21.11 N ATOM 0 H HIS A 165 -2.652 -37.480 6.181 1.00 43.23 H new ATOM 0 HA HIS A 165 -1.916 -34.860 5.652 1.00 72.31 H new ATOM 0 HB2 HIS A 165 -4.564 -36.311 5.847 1.00 34.11 H new ATOM 0 HB3 HIS A 165 -4.514 -34.599 5.476 1.00 34.11 H new ATOM 0 HD1 HIS A 165 -4.845 -37.633 3.773 1.00 34.21 H new ATOM 0 HD2 HIS A 165 -2.378 -34.298 3.189 1.00 65.12 H new ATOM 0 HE1 HIS A 165 -4.096 -37.710 1.344 1.00 13.42 H new ATOM 2691 N SER A 166 -3.284 -35.252 8.586 1.00 53.53 N ATOM 2692 CA SER A 166 -3.585 -34.587 9.848 1.00 1.13 C ATOM 2693 C SER A 166 -2.320 -34.003 10.470 1.00 65.43 C ATOM 2694 O SER A 166 -2.296 -32.844 10.882 1.00 30.31 O ATOM 2695 CB SER A 166 -4.239 -35.568 10.823 1.00 72.35 C ATOM 2696 OG SER A 166 -4.423 -34.976 12.097 1.00 71.03 O ATOM 0 H SER A 166 -3.351 -36.269 8.619 1.00 53.53 H new ATOM 0 HA SER A 166 -4.279 -33.772 9.643 1.00 1.13 H new ATOM 0 HB2 SER A 166 -5.201 -35.892 10.427 1.00 72.35 H new ATOM 0 HB3 SER A 166 -3.618 -36.459 10.919 1.00 72.35 H new ATOM 0 HG SER A 166 -5.253 -34.456 12.099 1.00 71.03 H new ATOM 2702 N GLU A 167 -1.270 -34.816 10.533 1.00 65.34 N ATOM 2703 CA GLU A 167 -0.001 -34.381 11.104 1.00 24.24 C ATOM 2704 C GLU A 167 0.669 -33.339 10.213 1.00 20.30 C ATOM 2705 O GLU A 167 1.266 -32.381 10.703 1.00 63.23 O ATOM 2706 CB GLU A 167 0.933 -35.578 11.299 1.00 2.45 C ATOM 2707 CG GLU A 167 1.065 -36.017 12.748 1.00 75.41 C ATOM 2708 CD GLU A 167 0.297 -37.292 13.042 1.00 3.24 C ATOM 2709 OE1 GLU A 167 -0.909 -37.199 13.352 1.00 52.01 O ATOM 2710 OE2 GLU A 167 0.903 -38.381 12.964 1.00 74.00 O ATOM 0 H GLU A 167 -1.273 -35.779 10.196 1.00 65.34 H new ATOM 0 HA GLU A 167 -0.205 -33.927 12.073 1.00 24.24 H new ATOM 0 HB2 GLU A 167 0.565 -36.416 10.706 1.00 2.45 H new ATOM 0 HB3 GLU A 167 1.920 -35.324 10.914 1.00 2.45 H new ATOM 0 HG2 GLU A 167 2.118 -36.169 12.984 1.00 75.41 H new ATOM 0 HG3 GLU A 167 0.704 -35.221 13.400 1.00 75.41 H new ATOM 2717 N GLN A 168 0.565 -33.535 8.903 1.00 73.34 N ATOM 2718 CA GLN A 168 1.161 -32.614 7.943 1.00 42.30 C ATOM 2719 C GLN A 168 0.503 -31.240 8.026 1.00 23.30 C ATOM 2720 O GLN A 168 1.184 -30.215 8.044 1.00 24.40 O ATOM 2721 CB GLN A 168 1.033 -33.169 6.523 1.00 11.34 C ATOM 2722 CG GLN A 168 2.256 -32.912 5.657 1.00 34.42 C ATOM 2723 CD GLN A 168 2.154 -31.620 4.871 1.00 34.13 C ATOM 2724 OE1 GLN A 168 1.058 -31.112 4.629 1.00 63.31 O ATOM 2725 NE2 GLN A 168 3.298 -31.080 4.469 1.00 52.15 N ATOM 0 H GLN A 168 0.074 -34.323 8.482 1.00 73.34 H new ATOM 0 HA GLN A 168 2.217 -32.507 8.189 1.00 42.30 H new ATOM 0 HB2 GLN A 168 0.855 -34.243 6.576 1.00 11.34 H new ATOM 0 HB3 GLN A 168 0.160 -32.724 6.045 1.00 11.34 H new ATOM 0 HG2 GLN A 168 3.143 -32.879 6.289 1.00 34.42 H new ATOM 0 HG3 GLN A 168 2.388 -33.744 4.965 1.00 34.42 H new ATOM 0 HE21 GLN A 168 4.183 -31.535 4.692 1.00 52.15 H new ATOM 0 HE22 GLN A 168 3.292 -30.210 3.937 1.00 52.15 H new ATOM 2734 N MET A 169 -0.825 -31.228 8.076 1.00 43.21 N ATOM 2735 CA MET A 169 -1.574 -29.980 8.158 1.00 52.51 C ATOM 2736 C MET A 169 -1.157 -29.174 9.384 1.00 30.45 C ATOM 2737 O MET A 169 -1.214 -27.945 9.380 1.00 13.41 O ATOM 2738 CB MET A 169 -3.077 -30.264 8.207 1.00 24.20 C ATOM 2739 CG MET A 169 -3.936 -29.039 7.941 1.00 32.01 C ATOM 2740 SD MET A 169 -5.187 -29.330 6.675 1.00 44.51 S ATOM 2741 CE MET A 169 -4.156 -29.734 5.267 1.00 25.13 C ATOM 0 H MET A 169 -1.404 -32.068 8.061 1.00 43.21 H new ATOM 0 HA MET A 169 -1.351 -29.393 7.267 1.00 52.51 H new ATOM 0 HB2 MET A 169 -3.317 -31.033 7.472 1.00 24.20 H new ATOM 0 HB3 MET A 169 -3.330 -30.669 9.187 1.00 24.20 H new ATOM 0 HG2 MET A 169 -4.425 -28.735 8.866 1.00 32.01 H new ATOM 0 HG3 MET A 169 -3.297 -28.212 7.632 1.00 32.01 H new ATOM 0 HE1 MET A 169 -4.742 -30.288 4.534 1.00 25.13 H new ATOM 0 HE2 MET A 169 -3.783 -28.816 4.814 1.00 25.13 H new ATOM 0 HE3 MET A 169 -3.315 -30.345 5.595 1.00 25.13 H new ATOM 2751 N ARG A 170 -0.738 -29.876 10.433 1.00 40.33 N ATOM 2752 CA ARG A 170 -0.313 -29.226 11.666 1.00 1.44 C ATOM 2753 C ARG A 170 1.086 -28.635 11.516 1.00 51.35 C ATOM 2754 O ARG A 170 1.408 -27.616 12.126 1.00 25.31 O ATOM 2755 CB ARG A 170 -0.335 -30.222 12.827 1.00 63.11 C ATOM 2756 CG ARG A 170 -0.739 -29.602 14.154 1.00 34.34 C ATOM 2757 CD ARG A 170 -1.537 -30.579 15.005 1.00 51.52 C ATOM 2758 NE ARG A 170 -2.633 -29.920 15.712 1.00 64.35 N ATOM 2759 CZ ARG A 170 -3.766 -29.548 15.127 1.00 30.50 C ATOM 2760 NH1 ARG A 170 -3.952 -29.770 13.833 1.00 11.40 N ATOM 2761 NH2 ARG A 170 -4.717 -28.955 15.837 1.00 5.43 N ATOM 0 H ARG A 170 -0.684 -30.894 10.453 1.00 40.33 H new ATOM 0 HA ARG A 170 -1.010 -28.415 11.878 1.00 1.44 H new ATOM 0 HB2 ARG A 170 -1.026 -31.030 12.588 1.00 63.11 H new ATOM 0 HB3 ARG A 170 0.654 -30.668 12.930 1.00 63.11 H new ATOM 0 HG2 ARG A 170 0.153 -29.289 14.697 1.00 34.34 H new ATOM 0 HG3 ARG A 170 -1.333 -28.706 13.973 1.00 34.34 H new ATOM 0 HD2 ARG A 170 -1.938 -31.369 14.370 1.00 51.52 H new ATOM 0 HD3 ARG A 170 -0.874 -31.056 15.727 1.00 51.52 H new ATOM 0 HE ARG A 170 -2.522 -29.736 16.709 1.00 64.35 H new ATOM 0 HH11 ARG A 170 -3.224 -30.228 13.284 1.00 11.40 H new ATOM 0 HH12 ARG A 170 -4.823 -29.483 13.386 1.00 11.40 H new ATOM 0 HH21 ARG A 170 -4.578 -28.784 16.833 1.00 5.43 H new ATOM 0 HH22 ARG A 170 -5.587 -28.670 15.387 1.00 5.43 H new ATOM 2775 N GLU A 171 1.911 -29.282 10.699 1.00 42.03 N ATOM 2776 CA GLU A 171 3.275 -28.821 10.469 1.00 4.45 C ATOM 2777 C GLU A 171 3.300 -27.673 9.464 1.00 11.22 C ATOM 2778 O GLU A 171 3.935 -26.644 9.696 1.00 70.11 O ATOM 2779 CB GLU A 171 4.149 -29.972 9.967 1.00 41.11 C ATOM 2780 CG GLU A 171 5.041 -30.573 11.041 1.00 75.05 C ATOM 2781 CD GLU A 171 4.282 -31.486 11.985 1.00 43.42 C ATOM 2782 OE1 GLU A 171 4.174 -32.693 11.685 1.00 53.34 O ATOM 2783 OE2 GLU A 171 3.798 -30.992 13.025 1.00 53.34 O ATOM 0 H GLU A 171 1.659 -30.127 10.186 1.00 42.03 H new ATOM 0 HA GLU A 171 3.673 -28.459 11.417 1.00 4.45 H new ATOM 0 HB2 GLU A 171 3.507 -30.754 9.560 1.00 41.11 H new ATOM 0 HB3 GLU A 171 4.772 -29.613 9.148 1.00 41.11 H new ATOM 0 HG2 GLU A 171 5.846 -31.135 10.567 1.00 75.05 H new ATOM 0 HG3 GLU A 171 5.506 -29.770 11.613 1.00 75.05 H new ATOM 2790 N SER A 172 2.604 -27.858 8.347 1.00 41.41 N ATOM 2791 CA SER A 172 2.549 -26.840 7.304 1.00 70.24 C ATOM 2792 C SER A 172 2.010 -25.524 7.856 1.00 32.21 C ATOM 2793 O SER A 172 2.737 -24.535 7.957 1.00 61.20 O ATOM 2794 CB SER A 172 1.673 -27.316 6.143 1.00 31.33 C ATOM 2795 OG SER A 172 0.400 -27.735 6.604 1.00 70.51 O ATOM 0 H SER A 172 2.071 -28.703 8.141 1.00 41.41 H new ATOM 0 HA SER A 172 3.563 -26.673 6.941 1.00 70.24 H new ATOM 0 HB2 SER A 172 1.554 -26.510 5.419 1.00 31.33 H new ATOM 0 HB3 SER A 172 2.165 -28.139 5.626 1.00 31.33 H new ATOM 0 HG SER A 172 0.489 -28.584 7.085 1.00 70.51 H new ATOM 2801 N LEU A 173 0.730 -25.520 8.213 1.00 42.24 N ATOM 2802 CA LEU A 173 0.091 -24.326 8.755 1.00 3.15 C ATOM 2803 C LEU A 173 0.941 -23.709 9.862 1.00 33.33 C ATOM 2804 O LEU A 173 0.968 -22.491 10.032 1.00 53.34 O ATOM 2805 CB LEU A 173 -1.299 -24.668 9.294 1.00 1.42 C ATOM 2806 CG LEU A 173 -2.243 -25.370 8.318 1.00 71.20 C ATOM 2807 CD1 LEU A 173 -3.510 -25.819 9.030 1.00 65.50 C ATOM 2808 CD2 LEU A 173 -2.582 -24.454 7.151 1.00 65.32 C ATOM 0 H LEU A 173 0.115 -26.330 8.137 1.00 42.24 H new ATOM 0 HA LEU A 173 -0.007 -23.598 7.949 1.00 3.15 H new ATOM 0 HB2 LEU A 173 -1.180 -25.302 10.173 1.00 1.42 H new ATOM 0 HB3 LEU A 173 -1.774 -23.746 9.628 1.00 1.42 H new ATOM 0 HG LEU A 173 -1.738 -26.253 7.926 1.00 71.20 H new ATOM 0 HD11 LEU A 173 -4.170 -26.317 8.319 1.00 65.50 H new ATOM 0 HD12 LEU A 173 -3.251 -26.511 9.831 1.00 65.50 H new ATOM 0 HD13 LEU A 173 -4.018 -24.951 9.451 1.00 65.50 H new ATOM 0 HD21 LEU A 173 -3.255 -24.971 6.467 1.00 65.32 H new ATOM 0 HD22 LEU A 173 -3.067 -23.552 7.525 1.00 65.32 H new ATOM 0 HD23 LEU A 173 -1.667 -24.182 6.624 1.00 65.32 H new ATOM 2820 N ALA A 174 1.635 -24.560 10.612 1.00 54.52 N ATOM 2821 CA ALA A 174 2.488 -24.098 11.699 1.00 24.03 C ATOM 2822 C ALA A 174 3.599 -23.192 11.179 1.00 62.33 C ATOM 2823 O ALA A 174 3.722 -22.042 11.599 1.00 73.04 O ATOM 2824 CB ALA A 174 3.079 -25.285 12.447 1.00 51.54 C ATOM 0 H ALA A 174 1.623 -25.572 10.486 1.00 54.52 H new ATOM 0 HA ALA A 174 1.874 -23.517 12.387 1.00 24.03 H new ATOM 0 HB1 ALA A 174 3.714 -24.925 13.256 1.00 51.54 H new ATOM 0 HB2 ALA A 174 2.274 -25.892 12.860 1.00 51.54 H new ATOM 0 HB3 ALA A 174 3.673 -25.888 11.761 1.00 51.54 H new ATOM 2830 N GLN A 175 4.406 -23.719 10.263 1.00 30.33 N ATOM 2831 CA GLN A 175 5.508 -22.957 9.687 1.00 33.52 C ATOM 2832 C GLN A 175 4.986 -21.840 8.790 1.00 61.23 C ATOM 2833 O GLN A 175 5.672 -20.843 8.561 1.00 35.32 O ATOM 2834 CB GLN A 175 6.431 -23.880 8.889 1.00 10.22 C ATOM 2835 CG GLN A 175 7.669 -23.182 8.350 1.00 62.44 C ATOM 2836 CD GLN A 175 8.950 -23.704 8.971 1.00 40.31 C ATOM 2837 OE1 GLN A 175 9.925 -23.982 8.271 1.00 15.34 O ATOM 2838 NE2 GLN A 175 8.955 -23.839 10.292 1.00 62.12 N ATOM 0 H GLN A 175 4.317 -24.670 9.904 1.00 30.33 H new ATOM 0 HA GLN A 175 6.073 -22.508 10.504 1.00 33.52 H new ATOM 0 HB2 GLN A 175 6.739 -24.710 9.525 1.00 10.22 H new ATOM 0 HB3 GLN A 175 5.873 -24.307 8.056 1.00 10.22 H new ATOM 0 HG2 GLN A 175 7.714 -23.313 7.269 1.00 62.44 H new ATOM 0 HG3 GLN A 175 7.589 -22.111 8.538 1.00 62.44 H new ATOM 0 HE21 GLN A 175 8.125 -23.597 10.833 1.00 62.12 H new ATOM 0 HE22 GLN A 175 9.789 -24.185 10.766 1.00 62.12 H new ATOM 2847 N ARG A 176 3.770 -22.014 8.283 1.00 13.23 N ATOM 2848 CA ARG A 176 3.157 -21.021 7.409 1.00 1.43 C ATOM 2849 C ARG A 176 3.207 -19.634 8.043 1.00 3.43 C ATOM 2850 O ARG A 176 3.944 -18.757 7.588 1.00 32.43 O ATOM 2851 CB ARG A 176 1.707 -21.402 7.106 1.00 61.21 C ATOM 2852 CG ARG A 176 1.009 -20.440 6.159 1.00 44.41 C ATOM 2853 CD ARG A 176 -0.503 -20.569 6.248 1.00 72.03 C ATOM 2854 NE ARG A 176 -0.992 -20.353 7.607 1.00 71.12 N ATOM 2855 CZ ARG A 176 -1.118 -19.152 8.161 1.00 64.34 C ATOM 2856 NH1 ARG A 176 -0.792 -18.065 7.475 1.00 72.10 N ATOM 2857 NH2 ARG A 176 -1.570 -19.037 9.403 1.00 60.13 N ATOM 0 H ARG A 176 3.190 -22.833 8.462 1.00 13.23 H new ATOM 0 HA ARG A 176 3.722 -20.997 6.477 1.00 1.43 H new ATOM 0 HB2 ARG A 176 1.686 -22.403 6.674 1.00 61.21 H new ATOM 0 HB3 ARG A 176 1.149 -21.447 8.041 1.00 61.21 H new ATOM 0 HG2 ARG A 176 1.302 -19.417 6.396 1.00 44.41 H new ATOM 0 HG3 ARG A 176 1.332 -20.636 5.137 1.00 44.41 H new ATOM 0 HD2 ARG A 176 -0.968 -19.848 5.576 1.00 72.03 H new ATOM 0 HD3 ARG A 176 -0.803 -21.560 5.908 1.00 72.03 H new ATOM 0 HE ARG A 176 -1.251 -21.169 8.161 1.00 71.12 H new ATOM 0 HH11 ARG A 176 -0.444 -18.150 6.520 1.00 72.10 H new ATOM 0 HH12 ARG A 176 -0.890 -17.144 7.902 1.00 72.10 H new ATOM 0 HH21 ARG A 176 -1.821 -19.871 9.934 1.00 60.13 H new ATOM 0 HH22 ARG A 176 -1.666 -18.114 9.827 1.00 60.13 H new ATOM 2871 N LEU A 177 2.419 -19.441 9.095 1.00 4.04 N ATOM 2872 CA LEU A 177 2.373 -18.160 9.792 1.00 21.23 C ATOM 2873 C LEU A 177 3.770 -17.724 10.222 1.00 11.53 C ATOM 2874 O LEU A 177 4.057 -16.530 10.315 1.00 71.41 O ATOM 2875 CB LEU A 177 1.457 -18.255 11.014 1.00 44.10 C ATOM 2876 CG LEU A 177 1.681 -19.460 11.929 1.00 40.52 C ATOM 2877 CD1 LEU A 177 2.571 -19.081 13.102 1.00 45.20 C ATOM 2878 CD2 LEU A 177 0.350 -20.009 12.422 1.00 4.22 C ATOM 0 H LEU A 177 1.803 -20.155 9.484 1.00 4.04 H new ATOM 0 HA LEU A 177 1.975 -17.414 9.104 1.00 21.23 H new ATOM 0 HB2 LEU A 177 1.578 -17.348 11.605 1.00 44.10 H new ATOM 0 HB3 LEU A 177 0.424 -18.274 10.668 1.00 44.10 H new ATOM 0 HG LEU A 177 2.183 -20.239 11.356 1.00 40.52 H new ATOM 0 HD11 LEU A 177 2.719 -19.951 13.742 1.00 45.20 H new ATOM 0 HD12 LEU A 177 3.536 -18.735 12.730 1.00 45.20 H new ATOM 0 HD13 LEU A 177 2.097 -18.285 13.676 1.00 45.20 H new ATOM 0 HD21 LEU A 177 0.528 -20.866 13.072 1.00 4.22 H new ATOM 0 HD22 LEU A 177 -0.179 -19.235 12.979 1.00 4.22 H new ATOM 0 HD23 LEU A 177 -0.254 -20.319 11.569 1.00 4.22 H new ATOM 2890 N ALA A 178 4.635 -18.698 10.482 1.00 64.24 N ATOM 2891 CA ALA A 178 6.003 -18.414 10.897 1.00 24.53 C ATOM 2892 C ALA A 178 6.823 -17.853 9.741 1.00 65.45 C ATOM 2893 O ALA A 178 7.754 -17.076 9.948 1.00 24.01 O ATOM 2894 CB ALA A 178 6.658 -19.672 11.450 1.00 4.53 C ATOM 0 H ALA A 178 4.413 -19.691 10.413 1.00 64.24 H new ATOM 0 HA ALA A 178 5.969 -17.659 11.683 1.00 24.53 H new ATOM 0 HB1 ALA A 178 7.679 -19.446 11.756 1.00 4.53 H new ATOM 0 HB2 ALA A 178 6.092 -20.029 12.310 1.00 4.53 H new ATOM 0 HB3 ALA A 178 6.672 -20.443 10.680 1.00 4.53 H new ATOM 2900 N GLU A 179 6.471 -18.254 8.523 1.00 44.44 N ATOM 2901 CA GLU A 179 7.177 -17.791 7.334 1.00 42.25 C ATOM 2902 C GLU A 179 7.053 -16.278 7.181 1.00 12.54 C ATOM 2903 O GLU A 179 8.052 -15.573 7.030 1.00 72.01 O ATOM 2904 CB GLU A 179 6.630 -18.487 6.085 1.00 10.44 C ATOM 2905 CG GLU A 179 7.712 -18.990 5.145 1.00 23.14 C ATOM 2906 CD GLU A 179 8.714 -19.892 5.839 1.00 21.52 C ATOM 2907 OE1 GLU A 179 8.469 -21.116 5.897 1.00 1.21 O ATOM 2908 OE2 GLU A 179 9.742 -19.376 6.324 1.00 23.03 O ATOM 0 H GLU A 179 5.702 -18.897 8.334 1.00 44.44 H new ATOM 0 HA GLU A 179 8.231 -18.042 7.449 1.00 42.25 H new ATOM 0 HB2 GLU A 179 6.007 -19.327 6.391 1.00 10.44 H new ATOM 0 HB3 GLU A 179 5.986 -17.793 5.545 1.00 10.44 H new ATOM 0 HG2 GLU A 179 7.249 -19.534 4.321 1.00 23.14 H new ATOM 0 HG3 GLU A 179 8.235 -18.138 4.710 1.00 23.14 H new