USER MOD reduce.3.24.130724 H: found=0, std=0, add=1042, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1035 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 52 GLN : amide:sc= -4.54! C(o=-12!,f=-14!) USER MOD Set 1.2: A 56 THR OG1 : rot 180:sc= -0.571 USER MOD Set 1.3: A 107 MET CE :methyl 138:sc= -7.17! (180deg=-9.66!) USER MOD Set 2.1: A 11 LYS NZ :NH3+ 170:sc= 0 (180deg=0) USER MOD Set 2.2: A 24 LYS NZ :NH3+ -121:sc= -0.0255 (180deg=-0.254) USER MOD Single : A 1 SER N :NH3+ 147:sc= 0.0618 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0.0489 USER MOD Single : A 6 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 7 THR OG1 : rot 130:sc= 0 USER MOD Single : A 14 ASN : amide:sc= -3.88! C(o=-3.9!,f=-5.8!) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 50:sc= -3.51! USER MOD Single : A 26 THR OG1 : rot 9:sc= 0.328! USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN : amide:sc= -3.25! K(o=-3.3!,f=-1.2) USER MOD Single : A 31 HIS : no HD1:sc= -1.04 K(o=-1,f=-3!) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 42 GLN : amide:sc= -0.25 K(o=-0.25,f=-0.99) USER MOD Single : A 45 SER OG : rot -111:sc= 0.357 USER MOD Single : A 47 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 142:sc= 0.0655 (180deg=0) USER MOD Single : A 58 HIS : no HD1:sc= -0.512 X(o=-0.51,f=-0.41) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 HIS : no HD1:sc=-0.000981 X(o=-0.00098,f=-0.086) USER MOD Single : A 62 THR OG1 : rot 180:sc=0.000715 USER MOD Single : A 64 SER OG : rot 90:sc= -0.0303 USER MOD Single : A 70 ASN : amide:sc= -2.19 K(o=-2.2,f=-9.9!) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 HIS : no HE2:sc= -0.13 X(o=-0.13,f=-0.24) USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 173:sc= -1.45 USER MOD Single : A 89 ASN : amide:sc= -1.84 X(o=-1.8,f=-1.4) USER MOD Single : A 96 THR OG1 : rot 180:sc=-0.00923 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0.00592 USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 MET CE :methyl 180:sc= -0.0431 (180deg=-0.0431) USER MOD Single : A 110 SER OG : rot -160:sc= 0 USER MOD Single : A 114 ASN : amide:sc= -1.1 K(o=-1.1,f=-2.2) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot 103:sc= 0.115 USER MOD Single : A 138 SER OG : rot -71:sc= 0.00226 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -14.081 -23.100 -0.846 1.00 0.00 N ATOM 2 CA SER A 1 -13.003 -22.298 -1.479 1.00 0.00 C ATOM 3 C SER A 1 -13.536 -21.492 -2.659 1.00 0.00 C ATOM 4 O SER A 1 -14.470 -21.914 -3.340 1.00 0.00 O ATOM 5 CB SER A 1 -11.898 -23.248 -1.945 1.00 0.00 C ATOM 6 OG SER A 1 -11.471 -24.092 -0.889 1.00 0.00 O ATOM 0 H1 SER A 1 -13.683 -23.988 -0.479 1.00 0.00 H new ATOM 0 H2 SER A 1 -14.502 -22.560 -0.063 1.00 0.00 H new ATOM 0 H3 SER A 1 -14.814 -23.314 -1.552 1.00 0.00 H new ATOM 0 HA SER A 1 -12.608 -21.591 -0.750 1.00 0.00 H new ATOM 0 HB2 SER A 1 -12.261 -23.854 -2.775 1.00 0.00 H new ATOM 0 HB3 SER A 1 -11.052 -22.671 -2.318 1.00 0.00 H new ATOM 0 HG SER A 1 -10.766 -24.690 -1.213 1.00 0.00 H new ATOM 14 N GLY A 2 -12.936 -20.329 -2.894 1.00 0.00 N ATOM 15 CA GLY A 2 -13.363 -19.481 -3.992 1.00 0.00 C ATOM 16 C GLY A 2 -12.611 -18.166 -4.035 1.00 0.00 C ATOM 17 O GLY A 2 -11.913 -17.874 -5.007 1.00 0.00 O ATOM 0 H GLY A 2 -12.161 -19.959 -2.343 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -13.217 -20.010 -4.934 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -14.431 -19.283 -3.900 1.00 0.00 H new ATOM 21 N PHE A 3 -12.752 -17.369 -2.980 1.00 0.00 N ATOM 22 CA PHE A 3 -12.081 -16.078 -2.901 1.00 0.00 C ATOM 23 C PHE A 3 -10.698 -16.220 -2.271 1.00 0.00 C ATOM 24 O PHE A 3 -10.566 -16.694 -1.142 1.00 0.00 O ATOM 25 CB PHE A 3 -12.923 -15.090 -2.091 1.00 0.00 C ATOM 26 CG PHE A 3 -13.983 -14.400 -2.901 1.00 0.00 C ATOM 27 CD1 PHE A 3 -13.689 -13.248 -3.612 1.00 0.00 C ATOM 28 CD2 PHE A 3 -15.273 -14.904 -2.950 1.00 0.00 C ATOM 29 CE1 PHE A 3 -14.663 -12.611 -4.359 1.00 0.00 C ATOM 30 CE2 PHE A 3 -16.251 -14.271 -3.695 1.00 0.00 C ATOM 31 CZ PHE A 3 -15.945 -13.123 -4.399 1.00 0.00 C ATOM 0 H PHE A 3 -13.326 -17.596 -2.168 1.00 0.00 H new ATOM 0 HA PHE A 3 -11.961 -15.697 -3.915 1.00 0.00 H new ATOM 0 HB2 PHE A 3 -13.396 -15.621 -1.265 1.00 0.00 H new ATOM 0 HB3 PHE A 3 -12.266 -14.339 -1.653 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -12.688 -12.843 -3.583 1.00 0.00 H new ATOM 0 HD2 PHE A 3 -15.517 -15.801 -2.400 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -14.421 -11.714 -4.910 1.00 0.00 H new ATOM 0 HE2 PHE A 3 -17.253 -14.674 -3.726 1.00 0.00 H new ATOM 0 HZ PHE A 3 -16.708 -12.626 -4.980 1.00 0.00 H new ATOM 41 N VAL A 4 -9.673 -15.807 -3.008 1.00 0.00 N ATOM 42 CA VAL A 4 -8.300 -15.888 -2.522 1.00 0.00 C ATOM 43 C VAL A 4 -7.889 -14.598 -1.822 1.00 0.00 C ATOM 44 O VAL A 4 -6.718 -14.408 -1.487 1.00 0.00 O ATOM 45 CB VAL A 4 -7.313 -16.172 -3.671 1.00 0.00 C ATOM 46 CG1 VAL A 4 -7.521 -17.576 -4.220 1.00 0.00 C ATOM 47 CG2 VAL A 4 -7.462 -15.133 -4.773 1.00 0.00 C ATOM 0 H VAL A 4 -9.766 -15.413 -3.944 1.00 0.00 H new ATOM 0 HA VAL A 4 -8.264 -16.713 -1.810 1.00 0.00 H new ATOM 0 HB VAL A 4 -6.299 -16.108 -3.278 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -6.815 -17.758 -5.030 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -7.358 -18.305 -3.426 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -8.539 -17.672 -4.597 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -6.757 -15.350 -5.575 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -8.479 -15.162 -5.165 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -7.257 -14.142 -4.369 1.00 0.00 H new ATOM 57 N CYS A 5 -8.858 -13.716 -1.600 1.00 0.00 N ATOM 58 CA CYS A 5 -8.597 -12.442 -0.939 1.00 0.00 C ATOM 59 C CYS A 5 -8.190 -12.657 0.515 1.00 0.00 C ATOM 60 O CYS A 5 -8.869 -13.362 1.262 1.00 0.00 O ATOM 61 CB CYS A 5 -9.832 -11.544 -1.007 1.00 0.00 C ATOM 62 SG CYS A 5 -9.486 -9.780 -0.711 1.00 0.00 S ATOM 0 H CYS A 5 -9.832 -13.860 -1.868 1.00 0.00 H new ATOM 0 HA CYS A 5 -7.774 -11.954 -1.460 1.00 0.00 H new ATOM 0 HB2 CYS A 5 -10.294 -11.653 -1.988 1.00 0.00 H new ATOM 0 HB3 CYS A 5 -10.560 -11.889 -0.272 1.00 0.00 H new ATOM 67 N ASN A 6 -7.078 -12.045 0.910 1.00 0.00 N ATOM 68 CA ASN A 6 -6.581 -12.171 2.275 1.00 0.00 C ATOM 69 C ASN A 6 -5.578 -11.069 2.599 1.00 0.00 C ATOM 70 O ASN A 6 -5.399 -10.704 3.760 1.00 0.00 O ATOM 71 CB ASN A 6 -5.933 -13.542 2.480 1.00 0.00 C ATOM 72 CG ASN A 6 -5.608 -13.816 3.935 1.00 0.00 C ATOM 73 OD1 ASN A 6 -6.503 -14.019 4.755 1.00 0.00 O ATOM 74 ND2 ASN A 6 -4.320 -13.823 4.262 1.00 0.00 N ATOM 0 H ASN A 6 -6.505 -11.457 0.305 1.00 0.00 H new ATOM 0 HA ASN A 6 -7.430 -12.071 2.951 1.00 0.00 H new ATOM 0 HB2 ASN A 6 -6.603 -14.317 2.108 1.00 0.00 H new ATOM 0 HB3 ASN A 6 -5.019 -13.601 1.889 1.00 0.00 H new ATOM 0 HD21 ASN A 6 -4.040 -14.002 5.226 1.00 0.00 H new ATOM 0 HD22 ASN A 6 -3.612 -13.650 3.549 1.00 0.00 H new ATOM 81 N THR A 7 -4.921 -10.546 1.567 1.00 0.00 N ATOM 82 CA THR A 7 -3.934 -9.491 1.744 1.00 0.00 C ATOM 83 C THR A 7 -4.567 -8.221 2.301 1.00 0.00 C ATOM 84 O THR A 7 -3.908 -7.438 2.984 1.00 0.00 O ATOM 85 CB THR A 7 -3.269 -9.183 0.407 1.00 0.00 C ATOM 86 OG1 THR A 7 -2.214 -8.252 0.573 1.00 0.00 O ATOM 87 CG2 THR A 7 -4.234 -8.611 -0.608 1.00 0.00 C ATOM 0 H THR A 7 -5.056 -10.838 0.599 1.00 0.00 H new ATOM 0 HA THR A 7 -3.191 -9.842 2.460 1.00 0.00 H new ATOM 0 HB THR A 7 -2.892 -10.137 0.037 1.00 0.00 H new ATOM 0 HG1 THR A 7 -1.407 -8.590 0.132 1.00 0.00 H new ATOM 0 HG21 THR A 7 -3.706 -8.411 -1.540 1.00 0.00 H new ATOM 0 HG22 THR A 7 -5.036 -9.327 -0.791 1.00 0.00 H new ATOM 0 HG23 THR A 7 -4.657 -7.683 -0.225 1.00 0.00 H new ATOM 95 N CYS A 8 -5.843 -8.007 1.988 1.00 0.00 N ATOM 96 CA CYS A 8 -6.543 -6.812 2.445 1.00 0.00 C ATOM 97 C CYS A 8 -7.697 -7.146 3.393 1.00 0.00 C ATOM 98 O CYS A 8 -8.849 -7.246 2.969 1.00 0.00 O ATOM 99 CB CYS A 8 -7.065 -6.016 1.247 1.00 0.00 C ATOM 100 SG CYS A 8 -6.011 -6.119 -0.235 1.00 0.00 S ATOM 0 H CYS A 8 -6.409 -8.641 1.424 1.00 0.00 H new ATOM 0 HA CYS A 8 -5.826 -6.209 3.001 1.00 0.00 H new ATOM 0 HB2 CYS A 8 -8.063 -6.374 0.995 1.00 0.00 H new ATOM 0 HB3 CYS A 8 -7.165 -4.970 1.536 1.00 0.00 H new ATOM 105 N PRO A 9 -7.401 -7.314 4.695 1.00 0.00 N ATOM 106 CA PRO A 9 -8.418 -7.627 5.705 1.00 0.00 C ATOM 107 C PRO A 9 -9.312 -6.427 6.034 1.00 0.00 C ATOM 108 O PRO A 9 -10.399 -6.285 5.476 1.00 0.00 O ATOM 109 CB PRO A 9 -7.588 -8.034 6.925 1.00 0.00 C ATOM 110 CG PRO A 9 -6.297 -7.308 6.764 1.00 0.00 C ATOM 111 CD PRO A 9 -6.051 -7.210 5.282 1.00 0.00 C ATOM 0 HA PRO A 9 -9.107 -8.399 5.363 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -8.086 -7.755 7.854 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -7.434 -9.113 6.957 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -6.349 -6.318 7.216 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -5.486 -7.842 7.259 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -5.571 -6.268 5.017 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -5.399 -8.010 4.931 1.00 0.00 H new ATOM 119 N GLU A 10 -8.850 -5.570 6.946 1.00 0.00 N ATOM 120 CA GLU A 10 -9.613 -4.388 7.350 1.00 0.00 C ATOM 121 C GLU A 10 -9.559 -3.302 6.270 1.00 0.00 C ATOM 122 O GLU A 10 -10.078 -3.501 5.172 1.00 0.00 O ATOM 123 CB GLU A 10 -9.089 -3.856 8.688 1.00 0.00 C ATOM 124 CG GLU A 10 -9.998 -2.821 9.332 1.00 0.00 C ATOM 125 CD GLU A 10 -10.040 -2.942 10.842 1.00 0.00 C ATOM 126 OE1 GLU A 10 -8.962 -2.896 11.472 1.00 0.00 O ATOM 127 OE2 GLU A 10 -11.150 -3.083 11.396 1.00 0.00 O ATOM 0 H GLU A 10 -7.952 -5.672 7.419 1.00 0.00 H new ATOM 0 HA GLU A 10 -10.657 -4.676 7.475 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -8.960 -4.692 9.376 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -8.104 -3.416 8.533 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -9.655 -1.823 9.061 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -11.007 -2.931 8.934 1.00 0.00 H new ATOM 134 N LYS A 11 -8.931 -2.160 6.579 1.00 0.00 N ATOM 135 CA LYS A 11 -8.818 -1.063 5.613 1.00 0.00 C ATOM 136 C LYS A 11 -8.399 -1.620 4.260 1.00 0.00 C ATOM 137 O LYS A 11 -9.234 -1.765 3.370 1.00 0.00 O ATOM 138 CB LYS A 11 -7.814 -0.014 6.099 1.00 0.00 C ATOM 139 CG LYS A 11 -7.696 0.062 7.613 1.00 0.00 C ATOM 140 CD LYS A 11 -6.486 -0.709 8.115 1.00 0.00 C ATOM 141 CE LYS A 11 -6.775 -1.401 9.436 1.00 0.00 C ATOM 142 NZ LYS A 11 -6.241 -0.632 10.595 1.00 0.00 N ATOM 0 H LYS A 11 -8.497 -1.974 7.483 1.00 0.00 H new ATOM 0 HA LYS A 11 -9.788 -0.576 5.514 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -6.834 -0.239 5.678 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -8.109 0.963 5.717 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -7.618 1.105 7.921 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -8.600 -0.339 8.070 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -6.192 -1.450 7.372 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -5.644 -0.028 8.237 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -7.851 -1.529 9.551 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -6.334 -2.398 9.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -6.601 -1.043 11.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -5.202 -0.675 10.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -6.547 0.360 10.524 1.00 0.00 H new ATOM 155 N TRP A 12 -7.105 -1.946 4.137 1.00 0.00 N ATOM 156 CA TRP A 12 -6.531 -2.539 2.912 1.00 0.00 C ATOM 157 C TRP A 12 -7.614 -2.973 1.915 1.00 0.00 C ATOM 158 O TRP A 12 -8.565 -3.668 2.278 1.00 0.00 O ATOM 159 CB TRP A 12 -5.645 -3.745 3.263 1.00 0.00 C ATOM 160 CG TRP A 12 -5.349 -3.915 4.730 1.00 0.00 C ATOM 161 CD1 TRP A 12 -6.248 -3.936 5.762 1.00 0.00 C ATOM 162 CD2 TRP A 12 -4.060 -4.115 5.323 1.00 0.00 C ATOM 163 NE1 TRP A 12 -5.594 -4.117 6.956 1.00 0.00 N ATOM 164 CE2 TRP A 12 -4.251 -4.232 6.713 1.00 0.00 C ATOM 165 CE3 TRP A 12 -2.759 -4.201 4.815 1.00 0.00 C ATOM 166 CZ2 TRP A 12 -3.194 -4.430 7.598 1.00 0.00 C ATOM 167 CZ3 TRP A 12 -1.712 -4.398 5.694 1.00 0.00 C ATOM 168 CH2 TRP A 12 -1.934 -4.512 7.071 1.00 0.00 C ATOM 0 H TRP A 12 -6.423 -1.808 4.882 1.00 0.00 H new ATOM 0 HA TRP A 12 -5.929 -1.764 2.437 1.00 0.00 H new ATOM 0 HB2 TRP A 12 -6.130 -4.651 2.899 1.00 0.00 H new ATOM 0 HB3 TRP A 12 -4.701 -3.651 2.726 1.00 0.00 H new ATOM 0 HD1 TRP A 12 -7.317 -3.826 5.653 1.00 0.00 H new ATOM 0 HE1 TRP A 12 -6.036 -4.159 7.874 1.00 0.00 H new ATOM 0 HE3 TRP A 12 -2.577 -4.115 3.754 1.00 0.00 H new ATOM 0 HZ2 TRP A 12 -3.363 -4.516 8.661 1.00 0.00 H new ATOM 0 HZ3 TRP A 12 -0.704 -4.465 5.312 1.00 0.00 H new ATOM 0 HH2 TRP A 12 -1.094 -4.668 7.731 1.00 0.00 H new ATOM 179 N ILE A 13 -7.466 -2.557 0.656 1.00 0.00 N ATOM 180 CA ILE A 13 -8.436 -2.885 -0.385 1.00 0.00 C ATOM 181 C ILE A 13 -7.752 -3.285 -1.691 1.00 0.00 C ATOM 182 O ILE A 13 -6.965 -2.525 -2.240 1.00 0.00 O ATOM 183 CB ILE A 13 -9.340 -1.666 -0.661 1.00 0.00 C ATOM 184 CG1 ILE A 13 -9.049 -0.550 0.355 1.00 0.00 C ATOM 185 CG2 ILE A 13 -10.799 -2.074 -0.621 1.00 0.00 C ATOM 186 CD1 ILE A 13 -10.197 0.415 0.578 1.00 0.00 C ATOM 0 H ILE A 13 -6.681 -1.991 0.334 1.00 0.00 H new ATOM 0 HA ILE A 13 -9.025 -3.729 -0.025 1.00 0.00 H new ATOM 0 HB ILE A 13 -9.124 -1.282 -1.658 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -8.784 -1.005 1.309 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -8.179 0.013 0.017 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -11.426 -1.204 -0.817 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -10.985 -2.834 -1.380 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -11.037 -2.478 0.363 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -9.903 1.168 1.309 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -10.450 0.903 -0.363 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -11.065 -0.131 0.949 1.00 0.00 H new ATOM 198 N ASN A 14 -8.069 -4.472 -2.201 1.00 0.00 N ATOM 199 CA ASN A 14 -7.471 -4.941 -3.449 1.00 0.00 C ATOM 200 C ASN A 14 -8.448 -4.830 -4.613 1.00 0.00 C ATOM 201 O ASN A 14 -9.664 -4.905 -4.430 1.00 0.00 O ATOM 202 CB ASN A 14 -6.980 -6.382 -3.304 1.00 0.00 C ATOM 203 CG ASN A 14 -5.825 -6.700 -4.235 1.00 0.00 C ATOM 204 OD1 ASN A 14 -4.676 -6.802 -3.805 1.00 0.00 O ATOM 205 ND2 ASN A 14 -6.123 -6.860 -5.518 1.00 0.00 N ATOM 0 H ASN A 14 -8.730 -5.122 -1.775 1.00 0.00 H new ATOM 0 HA ASN A 14 -6.617 -4.299 -3.666 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -6.670 -6.554 -2.273 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -7.805 -7.065 -3.507 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -5.386 -7.076 -6.190 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -7.089 -6.767 -5.833 1.00 0.00 H new ATOM 212 N PHE A 15 -7.902 -4.642 -5.811 1.00 0.00 N ATOM 213 CA PHE A 15 -8.710 -4.511 -7.016 1.00 0.00 C ATOM 214 C PHE A 15 -8.249 -5.505 -8.083 1.00 0.00 C ATOM 215 O PHE A 15 -8.156 -6.704 -7.817 1.00 0.00 O ATOM 216 CB PHE A 15 -8.627 -3.074 -7.543 1.00 0.00 C ATOM 217 CG PHE A 15 -8.603 -2.035 -6.460 1.00 0.00 C ATOM 218 CD1 PHE A 15 -9.782 -1.538 -5.928 1.00 0.00 C ATOM 219 CD2 PHE A 15 -7.398 -1.556 -5.973 1.00 0.00 C ATOM 220 CE1 PHE A 15 -9.759 -0.582 -4.931 1.00 0.00 C ATOM 221 CE2 PHE A 15 -7.368 -0.599 -4.977 1.00 0.00 C ATOM 222 CZ PHE A 15 -8.550 -0.111 -4.455 1.00 0.00 C ATOM 0 H PHE A 15 -6.897 -4.577 -5.972 1.00 0.00 H new ATOM 0 HA PHE A 15 -9.748 -4.736 -6.772 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -7.729 -2.971 -8.153 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -9.479 -2.886 -8.196 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -10.729 -1.902 -6.297 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -6.471 -1.935 -6.377 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -10.685 -0.203 -4.524 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -6.422 -0.233 -4.607 1.00 0.00 H new ATOM 0 HZ PHE A 15 -8.530 0.637 -3.676 1.00 0.00 H new ATOM 232 N GLN A 16 -7.960 -5.008 -9.286 1.00 0.00 N ATOM 233 CA GLN A 16 -7.508 -5.860 -10.380 1.00 0.00 C ATOM 234 C GLN A 16 -6.357 -6.757 -9.936 1.00 0.00 C ATOM 235 O GLN A 16 -6.331 -7.947 -10.250 1.00 0.00 O ATOM 236 CB GLN A 16 -7.075 -5.007 -11.573 1.00 0.00 C ATOM 237 CG GLN A 16 -6.227 -3.806 -11.187 1.00 0.00 C ATOM 238 CD GLN A 16 -6.735 -2.515 -11.798 1.00 0.00 C ATOM 239 OE1 GLN A 16 -6.709 -2.338 -13.016 1.00 0.00 O ATOM 240 NE2 GLN A 16 -7.202 -1.604 -10.952 1.00 0.00 N ATOM 0 H GLN A 16 -8.032 -4.019 -9.525 1.00 0.00 H new ATOM 0 HA GLN A 16 -8.342 -6.495 -10.679 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -6.513 -5.630 -12.269 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -7.963 -4.660 -12.102 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -6.213 -3.709 -10.101 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -5.198 -3.975 -11.505 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -7.205 -1.793 -9.950 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -7.558 -0.716 -11.305 1.00 0.00 H new ATOM 249 N ARG A 17 -5.406 -6.182 -9.200 1.00 0.00 N ATOM 250 CA ARG A 17 -4.258 -6.944 -8.717 1.00 0.00 C ATOM 251 C ARG A 17 -3.456 -6.156 -7.685 1.00 0.00 C ATOM 252 O ARG A 17 -2.467 -6.654 -7.148 1.00 0.00 O ATOM 253 CB ARG A 17 -3.353 -7.342 -9.885 1.00 0.00 C ATOM 254 CG ARG A 17 -3.060 -6.200 -10.844 1.00 0.00 C ATOM 255 CD ARG A 17 -1.564 -6.006 -11.036 1.00 0.00 C ATOM 256 NE ARG A 17 -1.259 -4.746 -11.708 1.00 0.00 N ATOM 257 CZ ARG A 17 -1.311 -4.581 -13.027 1.00 0.00 C ATOM 258 NH1 ARG A 17 -1.655 -5.594 -13.811 1.00 0.00 N ATOM 259 NH2 ARG A 17 -1.020 -3.404 -13.562 1.00 0.00 N ATOM 0 H ARG A 17 -5.408 -5.199 -8.928 1.00 0.00 H new ATOM 0 HA ARG A 17 -4.640 -7.843 -8.234 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -2.412 -7.725 -9.490 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -3.822 -8.157 -10.436 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -3.529 -6.402 -11.807 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -3.502 -5.280 -10.462 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -1.068 -6.029 -10.066 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -1.163 -6.835 -11.619 1.00 0.00 H new ATOM 0 HE ARG A 17 -0.991 -3.947 -11.133 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -1.880 -6.501 -13.403 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -1.694 -5.466 -14.822 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -0.756 -2.623 -12.962 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -1.060 -3.280 -14.574 1.00 0.00 H new ATOM 273 N LYS A 18 -3.888 -4.933 -7.403 1.00 0.00 N ATOM 274 CA LYS A 18 -3.212 -4.094 -6.429 1.00 0.00 C ATOM 275 C LYS A 18 -4.115 -3.853 -5.231 1.00 0.00 C ATOM 276 O LYS A 18 -5.334 -3.961 -5.330 1.00 0.00 O ATOM 277 CB LYS A 18 -2.811 -2.762 -7.055 1.00 0.00 C ATOM 278 CG LYS A 18 -3.974 -1.803 -7.218 1.00 0.00 C ATOM 279 CD LYS A 18 -3.839 -0.978 -8.485 1.00 0.00 C ATOM 280 CE LYS A 18 -3.875 0.511 -8.184 1.00 0.00 C ATOM 281 NZ LYS A 18 -3.221 1.311 -9.255 1.00 0.00 N ATOM 0 H LYS A 18 -4.704 -4.502 -7.837 1.00 0.00 H new ATOM 0 HA LYS A 18 -2.310 -4.608 -6.098 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -2.046 -2.293 -6.436 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -2.362 -2.947 -8.031 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -4.908 -2.363 -7.245 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -4.025 -1.140 -6.354 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -2.903 -1.227 -8.985 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -4.645 -1.231 -9.173 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -4.910 0.833 -8.071 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -3.377 0.701 -7.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -3.267 2.321 -9.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -2.226 1.022 -9.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -3.712 1.150 -10.158 1.00 0.00 H new ATOM 294 N CYS A 19 -3.513 -3.523 -4.104 1.00 0.00 N ATOM 295 CA CYS A 19 -4.271 -3.266 -2.886 1.00 0.00 C ATOM 296 C CYS A 19 -3.839 -1.956 -2.235 1.00 0.00 C ATOM 297 O CYS A 19 -2.702 -1.513 -2.391 1.00 0.00 O ATOM 298 CB CYS A 19 -4.116 -4.433 -1.900 1.00 0.00 C ATOM 299 SG CYS A 19 -5.133 -4.293 -0.389 1.00 0.00 S ATOM 0 H CYS A 19 -2.503 -3.426 -4.003 1.00 0.00 H new ATOM 0 HA CYS A 19 -5.323 -3.176 -3.157 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -4.375 -5.360 -2.411 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -3.068 -4.510 -1.611 1.00 0.00 H new ATOM 304 N TYR A 20 -4.763 -1.348 -1.502 1.00 0.00 N ATOM 305 CA TYR A 20 -4.513 -0.092 -0.810 1.00 0.00 C ATOM 306 C TYR A 20 -4.858 -0.251 0.656 1.00 0.00 C ATOM 307 O TYR A 20 -6.009 -0.504 0.990 1.00 0.00 O ATOM 308 CB TYR A 20 -5.415 1.002 -1.392 1.00 0.00 C ATOM 309 CG TYR A 20 -4.884 1.670 -2.635 1.00 0.00 C ATOM 310 CD1 TYR A 20 -4.443 0.926 -3.718 1.00 0.00 C ATOM 311 CD2 TYR A 20 -4.834 3.054 -2.725 1.00 0.00 C ATOM 312 CE1 TYR A 20 -3.962 1.541 -4.858 1.00 0.00 C ATOM 313 CE2 TYR A 20 -4.356 3.680 -3.859 1.00 0.00 C ATOM 314 CZ TYR A 20 -3.919 2.920 -4.923 1.00 0.00 C ATOM 315 OH TYR A 20 -3.440 3.537 -6.056 1.00 0.00 O ATOM 0 H TYR A 20 -5.707 -1.712 -1.371 1.00 0.00 H new ATOM 0 HA TYR A 20 -3.464 0.178 -0.930 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -6.388 0.567 -1.619 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -5.576 1.763 -0.629 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -4.476 -0.152 -3.670 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -5.175 3.652 -1.893 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -3.622 0.947 -5.693 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -4.325 4.758 -3.912 1.00 0.00 H new ATOM 0 HH TYR A 20 -3.478 4.509 -5.940 1.00 0.00 H new ATOM 325 N TYR A 21 -3.893 -0.074 1.544 1.00 0.00 N ATOM 326 CA TYR A 21 -4.198 -0.201 2.955 1.00 0.00 C ATOM 327 C TYR A 21 -4.250 1.149 3.638 1.00 0.00 C ATOM 328 O TYR A 21 -3.239 1.834 3.799 1.00 0.00 O ATOM 329 CB TYR A 21 -3.240 -1.151 3.677 1.00 0.00 C ATOM 330 CG TYR A 21 -1.785 -1.019 3.310 1.00 0.00 C ATOM 331 CD1 TYR A 21 -1.286 -1.574 2.139 1.00 0.00 C ATOM 332 CD2 TYR A 21 -0.904 -0.367 4.157 1.00 0.00 C ATOM 333 CE1 TYR A 21 0.054 -1.475 1.820 1.00 0.00 C ATOM 334 CE2 TYR A 21 0.434 -0.267 3.851 1.00 0.00 C ATOM 335 CZ TYR A 21 0.910 -0.822 2.681 1.00 0.00 C ATOM 336 OH TYR A 21 2.247 -0.723 2.369 1.00 0.00 O ATOM 0 H TYR A 21 -2.923 0.151 1.322 1.00 0.00 H new ATOM 0 HA TYR A 21 -5.191 -0.645 3.018 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -3.340 -0.991 4.751 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -3.554 -2.175 3.476 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -1.956 -2.091 1.468 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -1.273 0.070 5.073 1.00 0.00 H new ATOM 0 HE1 TYR A 21 0.428 -1.906 0.903 1.00 0.00 H new ATOM 0 HE2 TYR A 21 1.108 0.243 4.523 1.00 0.00 H new ATOM 0 HH TYR A 21 2.345 -0.391 1.452 1.00 0.00 H new ATOM 346 N PHE A 22 -5.462 1.509 4.033 1.00 0.00 N ATOM 347 CA PHE A 22 -5.729 2.761 4.709 1.00 0.00 C ATOM 348 C PHE A 22 -5.665 2.553 6.214 1.00 0.00 C ATOM 349 O PHE A 22 -6.669 2.681 6.914 1.00 0.00 O ATOM 350 CB PHE A 22 -7.115 3.268 4.297 1.00 0.00 C ATOM 351 CG PHE A 22 -7.284 3.436 2.807 1.00 0.00 C ATOM 352 CD1 PHE A 22 -6.193 3.697 1.995 1.00 0.00 C ATOM 353 CD2 PHE A 22 -8.535 3.331 2.220 1.00 0.00 C ATOM 354 CE1 PHE A 22 -6.341 3.851 0.630 1.00 0.00 C ATOM 355 CE2 PHE A 22 -8.692 3.485 0.852 1.00 0.00 C ATOM 356 CZ PHE A 22 -7.592 3.745 0.056 1.00 0.00 C ATOM 0 H PHE A 22 -6.292 0.933 3.890 1.00 0.00 H new ATOM 0 HA PHE A 22 -4.980 3.502 4.429 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -7.870 2.572 4.663 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -7.301 4.225 4.785 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -5.211 3.782 2.436 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -9.398 3.127 2.836 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -5.479 4.054 0.012 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -9.673 3.402 0.408 1.00 0.00 H new ATOM 0 HZ PHE A 22 -7.711 3.865 -1.011 1.00 0.00 H new ATOM 366 N GLY A 23 -4.477 2.212 6.703 1.00 0.00 N ATOM 367 CA GLY A 23 -4.303 1.963 8.113 1.00 0.00 C ATOM 368 C GLY A 23 -4.290 3.237 8.934 1.00 0.00 C ATOM 369 O GLY A 23 -4.200 4.334 8.386 1.00 0.00 O ATOM 0 H GLY A 23 -3.632 2.105 6.142 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -5.107 1.316 8.466 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -3.368 1.425 8.270 1.00 0.00 H new ATOM 373 N LYS A 24 -4.394 3.092 10.251 1.00 0.00 N ATOM 374 CA LYS A 24 -4.408 4.243 11.150 1.00 0.00 C ATOM 375 C LYS A 24 -3.124 4.329 11.970 1.00 0.00 C ATOM 376 O LYS A 24 -2.596 3.314 12.427 1.00 0.00 O ATOM 377 CB LYS A 24 -5.617 4.171 12.084 1.00 0.00 C ATOM 378 CG LYS A 24 -5.709 2.868 12.861 1.00 0.00 C ATOM 379 CD LYS A 24 -6.896 2.867 13.810 1.00 0.00 C ATOM 380 CE LYS A 24 -7.779 1.649 13.596 1.00 0.00 C ATOM 381 NZ LYS A 24 -8.384 1.634 12.234 1.00 0.00 N ATOM 0 H LYS A 24 -4.470 2.190 10.720 1.00 0.00 H new ATOM 0 HA LYS A 24 -4.478 5.141 10.536 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -5.572 5.002 12.788 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -6.527 4.300 11.498 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -5.798 2.034 12.165 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -4.790 2.715 13.426 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -6.540 2.883 14.840 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -7.483 3.774 13.662 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -7.190 0.743 13.742 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -8.571 1.638 14.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -9.421 1.626 12.315 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -8.084 2.482 11.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -8.070 0.784 11.724 1.00 0.00 H new ATOM 394 N GLY A 25 -2.630 5.551 12.153 1.00 0.00 N ATOM 395 CA GLY A 25 -1.413 5.762 12.917 1.00 0.00 C ATOM 396 C GLY A 25 -0.884 7.179 12.780 1.00 0.00 C ATOM 397 O GLY A 25 -0.621 7.643 11.671 1.00 0.00 O ATOM 0 H GLY A 25 -3.054 6.402 11.784 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -1.605 5.549 13.968 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -0.651 5.058 12.583 1.00 0.00 H new ATOM 401 N THR A 26 -0.733 7.866 13.909 1.00 0.00 N ATOM 402 CA THR A 26 -0.238 9.240 13.909 1.00 0.00 C ATOM 403 C THR A 26 1.287 9.273 13.921 1.00 0.00 C ATOM 404 O THR A 26 1.925 8.611 14.740 1.00 0.00 O ATOM 405 CB THR A 26 -0.783 10.001 15.119 1.00 0.00 C ATOM 406 OG1 THR A 26 -0.074 9.650 16.294 1.00 0.00 O ATOM 407 CG2 THR A 26 -2.253 9.745 15.377 1.00 0.00 C ATOM 0 H THR A 26 -0.946 7.495 14.835 1.00 0.00 H new ATOM 0 HA THR A 26 -0.586 9.722 12.996 1.00 0.00 H new ATOM 0 HB THR A 26 -0.651 11.056 14.878 1.00 0.00 H new ATOM 0 HG1 THR A 26 0.704 9.103 16.056 1.00 0.00 H new ATOM 0 HG21 THR A 26 -2.574 10.315 16.249 1.00 0.00 H new ATOM 0 HG22 THR A 26 -2.834 10.053 14.508 1.00 0.00 H new ATOM 0 HG23 THR A 26 -2.410 8.682 15.561 1.00 0.00 H new ATOM 415 N LYS A 27 1.867 10.052 13.008 1.00 0.00 N ATOM 416 CA LYS A 27 3.320 10.173 12.916 1.00 0.00 C ATOM 417 C LYS A 27 3.718 11.331 11.998 1.00 0.00 C ATOM 418 O LYS A 27 3.839 12.471 12.444 1.00 0.00 O ATOM 419 CB LYS A 27 3.933 8.863 12.410 1.00 0.00 C ATOM 420 CG LYS A 27 3.019 8.073 11.486 1.00 0.00 C ATOM 421 CD LYS A 27 3.319 6.585 11.546 1.00 0.00 C ATOM 422 CE LYS A 27 2.159 5.808 12.149 1.00 0.00 C ATOM 423 NZ LYS A 27 2.414 4.341 12.150 1.00 0.00 N ATOM 0 H LYS A 27 1.353 10.607 12.324 1.00 0.00 H new ATOM 0 HA LYS A 27 3.705 10.381 13.914 1.00 0.00 H new ATOM 0 HB2 LYS A 27 4.861 9.087 11.883 1.00 0.00 H new ATOM 0 HB3 LYS A 27 4.194 8.241 13.266 1.00 0.00 H new ATOM 0 HG2 LYS A 27 1.980 8.247 11.764 1.00 0.00 H new ATOM 0 HG3 LYS A 27 3.139 8.429 10.463 1.00 0.00 H new ATOM 0 HD2 LYS A 27 3.525 6.213 10.542 1.00 0.00 H new ATOM 0 HD3 LYS A 27 4.218 6.417 12.139 1.00 0.00 H new ATOM 0 HE2 LYS A 27 1.987 6.147 13.170 1.00 0.00 H new ATOM 0 HE3 LYS A 27 1.250 6.018 11.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 1.600 3.847 12.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 2.553 4.012 11.173 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 3.267 4.137 12.709 1.00 0.00 H new ATOM 436 N GLN A 28 3.918 11.029 10.717 1.00 0.00 N ATOM 437 CA GLN A 28 4.302 12.038 9.732 1.00 0.00 C ATOM 438 C GLN A 28 4.294 11.441 8.331 1.00 0.00 C ATOM 439 O GLN A 28 3.997 10.259 8.154 1.00 0.00 O ATOM 440 CB GLN A 28 5.690 12.599 10.044 1.00 0.00 C ATOM 441 CG GLN A 28 5.664 14.003 10.627 1.00 0.00 C ATOM 442 CD GLN A 28 6.406 14.102 11.945 1.00 0.00 C ATOM 443 OE1 GLN A 28 7.397 13.406 12.168 1.00 0.00 O ATOM 444 NE2 GLN A 28 5.927 14.971 12.829 1.00 0.00 N ATOM 0 H GLN A 28 3.820 10.088 10.335 1.00 0.00 H new ATOM 0 HA GLN A 28 3.576 12.850 9.780 1.00 0.00 H new ATOM 0 HB2 GLN A 28 6.192 11.933 10.746 1.00 0.00 H new ATOM 0 HB3 GLN A 28 6.284 12.605 9.130 1.00 0.00 H new ATOM 0 HG2 GLN A 28 6.106 14.697 9.912 1.00 0.00 H new ATOM 0 HG3 GLN A 28 4.629 14.312 10.773 1.00 0.00 H new ATOM 0 HE21 GLN A 28 5.103 15.528 12.602 1.00 0.00 H new ATOM 0 HE22 GLN A 28 6.383 15.081 13.734 1.00 0.00 H new ATOM 453 N TRP A 29 4.623 12.258 7.335 1.00 0.00 N ATOM 454 CA TRP A 29 4.652 11.788 5.956 1.00 0.00 C ATOM 455 C TRP A 29 5.762 10.767 5.753 1.00 0.00 C ATOM 456 O TRP A 29 5.533 9.683 5.218 1.00 0.00 O ATOM 457 CB TRP A 29 4.840 12.945 4.976 1.00 0.00 C ATOM 458 CG TRP A 29 4.817 12.483 3.554 1.00 0.00 C ATOM 459 CD1 TRP A 29 3.724 12.384 2.743 1.00 0.00 C ATOM 460 CD2 TRP A 29 5.935 12.031 2.780 1.00 0.00 C ATOM 461 NE1 TRP A 29 4.094 11.894 1.515 1.00 0.00 N ATOM 462 CE2 TRP A 29 5.444 11.674 1.512 1.00 0.00 C ATOM 463 CE3 TRP A 29 7.302 11.896 3.036 1.00 0.00 C ATOM 464 CZ2 TRP A 29 6.269 11.186 0.504 1.00 0.00 C ATOM 465 CZ3 TRP A 29 8.123 11.413 2.033 1.00 0.00 C ATOM 466 CH2 TRP A 29 7.603 11.063 0.780 1.00 0.00 C ATOM 0 H TRP A 29 4.871 13.240 7.456 1.00 0.00 H new ATOM 0 HA TRP A 29 3.690 11.316 5.758 1.00 0.00 H new ATOM 0 HB2 TRP A 29 4.053 13.683 5.130 1.00 0.00 H new ATOM 0 HB3 TRP A 29 5.788 13.443 5.180 1.00 0.00 H new ATOM 0 HD1 TRP A 29 2.717 12.652 3.025 1.00 0.00 H new ATOM 0 HE1 TRP A 29 3.464 11.722 0.732 1.00 0.00 H new ATOM 0 HE3 TRP A 29 7.710 12.164 3.999 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 5.870 10.914 -0.462 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 9.181 11.304 2.219 1.00 0.00 H new ATOM 0 HH2 TRP A 29 8.269 10.689 0.017 1.00 0.00 H new ATOM 477 N VAL A 30 6.965 11.125 6.181 1.00 0.00 N ATOM 478 CA VAL A 30 8.118 10.244 6.049 1.00 0.00 C ATOM 479 C VAL A 30 7.832 8.897 6.693 1.00 0.00 C ATOM 480 O VAL A 30 8.327 7.862 6.248 1.00 0.00 O ATOM 481 CB VAL A 30 9.373 10.858 6.693 1.00 0.00 C ATOM 482 CG1 VAL A 30 9.905 11.996 5.838 1.00 0.00 C ATOM 483 CG2 VAL A 30 9.069 11.340 8.102 1.00 0.00 C ATOM 0 H VAL A 30 7.168 12.021 6.624 1.00 0.00 H new ATOM 0 HA VAL A 30 8.305 10.110 4.984 1.00 0.00 H new ATOM 0 HB VAL A 30 10.142 10.088 6.756 1.00 0.00 H new ATOM 0 HG11 VAL A 30 10.793 12.420 6.308 1.00 0.00 H new ATOM 0 HG12 VAL A 30 10.163 11.618 4.849 1.00 0.00 H new ATOM 0 HG13 VAL A 30 9.141 12.768 5.744 1.00 0.00 H new ATOM 0 HG21 VAL A 30 9.969 11.771 8.541 1.00 0.00 H new ATOM 0 HG22 VAL A 30 8.284 12.096 8.067 1.00 0.00 H new ATOM 0 HG23 VAL A 30 8.735 10.499 8.710 1.00 0.00 H new ATOM 493 N HIS A 31 7.021 8.920 7.740 1.00 0.00 N ATOM 494 CA HIS A 31 6.653 7.700 8.441 1.00 0.00 C ATOM 495 C HIS A 31 5.693 6.872 7.594 1.00 0.00 C ATOM 496 O HIS A 31 5.654 5.646 7.705 1.00 0.00 O ATOM 497 CB HIS A 31 6.017 8.031 9.791 1.00 0.00 C ATOM 498 CG HIS A 31 6.931 7.801 10.953 1.00 0.00 C ATOM 499 ND1 HIS A 31 6.673 6.873 11.942 1.00 0.00 N ATOM 500 CD2 HIS A 31 8.107 8.384 11.285 1.00 0.00 C ATOM 501 CE1 HIS A 31 7.651 6.897 12.831 1.00 0.00 C ATOM 502 NE2 HIS A 31 8.534 7.804 12.455 1.00 0.00 N ATOM 0 H HIS A 31 6.606 9.770 8.122 1.00 0.00 H new ATOM 0 HA HIS A 31 7.556 7.116 8.617 1.00 0.00 H new ATOM 0 HB2 HIS A 31 5.700 9.074 9.789 1.00 0.00 H new ATOM 0 HB3 HIS A 31 5.120 7.426 9.919 1.00 0.00 H new ATOM 0 HD2 HIS A 31 8.615 9.161 10.733 1.00 0.00 H new ATOM 0 HE1 HIS A 31 7.717 6.280 13.715 1.00 0.00 H new ATOM 0 HE2 HIS A 31 9.394 8.036 12.952 1.00 0.00 H new ATOM 511 N ALA A 32 4.921 7.550 6.744 1.00 0.00 N ATOM 512 CA ALA A 32 3.969 6.867 5.881 1.00 0.00 C ATOM 513 C ALA A 32 4.689 6.087 4.790 1.00 0.00 C ATOM 514 O ALA A 32 4.422 4.906 4.587 1.00 0.00 O ATOM 515 CB ALA A 32 2.999 7.865 5.266 1.00 0.00 C ATOM 0 H ALA A 32 4.939 8.564 6.638 1.00 0.00 H new ATOM 0 HA ALA A 32 3.404 6.161 6.490 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.294 7.338 4.623 1.00 0.00 H new ATOM 0 HB2 ALA A 32 2.454 8.379 6.058 1.00 0.00 H new ATOM 0 HB3 ALA A 32 3.553 8.594 4.675 1.00 0.00 H new ATOM 521 N ARG A 33 5.617 6.750 4.104 1.00 0.00 N ATOM 522 CA ARG A 33 6.386 6.107 3.048 1.00 0.00 C ATOM 523 C ARG A 33 7.194 4.947 3.613 1.00 0.00 C ATOM 524 O ARG A 33 7.342 3.907 2.970 1.00 0.00 O ATOM 525 CB ARG A 33 7.311 7.112 2.356 1.00 0.00 C ATOM 526 CG ARG A 33 8.159 7.926 3.319 1.00 0.00 C ATOM 527 CD ARG A 33 9.622 7.521 3.252 1.00 0.00 C ATOM 528 NE ARG A 33 10.194 7.748 1.928 1.00 0.00 N ATOM 529 CZ ARG A 33 11.243 7.085 1.453 1.00 0.00 C ATOM 530 NH1 ARG A 33 11.834 6.156 2.192 1.00 0.00 N ATOM 531 NH2 ARG A 33 11.703 7.350 0.238 1.00 0.00 N ATOM 0 H ARG A 33 5.852 7.730 4.262 1.00 0.00 H new ATOM 0 HA ARG A 33 5.688 5.720 2.306 1.00 0.00 H new ATOM 0 HB2 ARG A 33 7.968 6.576 1.671 1.00 0.00 H new ATOM 0 HB3 ARG A 33 6.709 7.791 1.753 1.00 0.00 H new ATOM 0 HG2 ARG A 33 8.063 8.986 3.084 1.00 0.00 H new ATOM 0 HG3 ARG A 33 7.789 7.790 4.335 1.00 0.00 H new ATOM 0 HD2 ARG A 33 10.188 8.085 3.993 1.00 0.00 H new ATOM 0 HD3 ARG A 33 9.718 6.467 3.512 1.00 0.00 H new ATOM 0 HE ARG A 33 9.764 8.456 1.333 1.00 0.00 H new ATOM 0 HH11 ARG A 33 11.483 5.949 3.127 1.00 0.00 H new ATOM 0 HH12 ARG A 33 12.639 5.648 1.825 1.00 0.00 H new ATOM 0 HH21 ARG A 33 11.252 8.064 -0.334 1.00 0.00 H new ATOM 0 HH22 ARG A 33 12.508 6.840 -0.125 1.00 0.00 H new ATOM 545 N TYR A 34 7.704 5.127 4.828 1.00 0.00 N ATOM 546 CA TYR A 34 8.481 4.086 5.486 1.00 0.00 C ATOM 547 C TYR A 34 7.593 2.887 5.779 1.00 0.00 C ATOM 548 O TYR A 34 8.035 1.739 5.711 1.00 0.00 O ATOM 549 CB TYR A 34 9.101 4.616 6.781 1.00 0.00 C ATOM 550 CG TYR A 34 10.613 4.630 6.767 1.00 0.00 C ATOM 551 CD1 TYR A 34 11.339 3.453 6.905 1.00 0.00 C ATOM 552 CD2 TYR A 34 11.314 5.819 6.617 1.00 0.00 C ATOM 553 CE1 TYR A 34 12.721 3.462 6.894 1.00 0.00 C ATOM 554 CE2 TYR A 34 12.695 5.837 6.604 1.00 0.00 C ATOM 555 CZ TYR A 34 13.394 4.656 6.743 1.00 0.00 C ATOM 556 OH TYR A 34 14.770 4.669 6.731 1.00 0.00 O ATOM 0 H TYR A 34 7.593 5.981 5.374 1.00 0.00 H new ATOM 0 HA TYR A 34 9.288 3.777 4.821 1.00 0.00 H new ATOM 0 HB2 TYR A 34 8.738 5.628 6.960 1.00 0.00 H new ATOM 0 HB3 TYR A 34 8.759 4.003 7.615 1.00 0.00 H new ATOM 0 HD1 TYR A 34 10.815 2.516 7.023 1.00 0.00 H new ATOM 0 HD2 TYR A 34 10.770 6.746 6.509 1.00 0.00 H new ATOM 0 HE1 TYR A 34 13.271 2.539 7.003 1.00 0.00 H new ATOM 0 HE2 TYR A 34 13.225 6.771 6.486 1.00 0.00 H new ATOM 0 HH TYR A 34 15.087 5.589 6.615 1.00 0.00 H new ATOM 566 N ALA A 35 6.328 3.162 6.085 1.00 0.00 N ATOM 567 CA ALA A 35 5.365 2.107 6.363 1.00 0.00 C ATOM 568 C ALA A 35 5.144 1.275 5.110 1.00 0.00 C ATOM 569 O ALA A 35 5.081 0.046 5.166 1.00 0.00 O ATOM 570 CB ALA A 35 4.052 2.699 6.854 1.00 0.00 C ATOM 0 H ALA A 35 5.949 4.107 6.146 1.00 0.00 H new ATOM 0 HA ALA A 35 5.759 1.463 7.150 1.00 0.00 H new ATOM 0 HB1 ALA A 35 3.344 1.896 7.057 1.00 0.00 H new ATOM 0 HB2 ALA A 35 4.228 3.267 7.768 1.00 0.00 H new ATOM 0 HB3 ALA A 35 3.642 3.359 6.090 1.00 0.00 H new ATOM 576 N CYS A 36 5.050 1.962 3.976 1.00 0.00 N ATOM 577 CA CYS A 36 4.863 1.302 2.698 1.00 0.00 C ATOM 578 C CYS A 36 5.979 0.299 2.470 1.00 0.00 C ATOM 579 O CYS A 36 5.736 -0.870 2.176 1.00 0.00 O ATOM 580 CB CYS A 36 4.862 2.326 1.562 1.00 0.00 C ATOM 581 SG CYS A 36 4.094 3.923 1.983 1.00 0.00 S ATOM 0 H CYS A 36 5.101 2.979 3.921 1.00 0.00 H new ATOM 0 HA CYS A 36 3.903 0.786 2.711 1.00 0.00 H new ATOM 0 HB2 CYS A 36 5.891 2.504 1.249 1.00 0.00 H new ATOM 0 HB3 CYS A 36 4.338 1.900 0.706 1.00 0.00 H new ATOM 586 N ASP A 37 7.208 0.776 2.616 1.00 0.00 N ATOM 587 CA ASP A 37 8.384 -0.062 2.434 1.00 0.00 C ATOM 588 C ASP A 37 8.332 -1.278 3.353 1.00 0.00 C ATOM 589 O ASP A 37 8.858 -2.341 3.023 1.00 0.00 O ATOM 590 CB ASP A 37 9.656 0.743 2.704 1.00 0.00 C ATOM 591 CG ASP A 37 10.311 1.238 1.429 1.00 0.00 C ATOM 592 OD1 ASP A 37 9.815 2.228 0.852 1.00 0.00 O ATOM 593 OD2 ASP A 37 11.320 0.633 1.006 1.00 0.00 O ATOM 0 H ASP A 37 7.416 1.744 2.861 1.00 0.00 H new ATOM 0 HA ASP A 37 8.396 -0.410 1.401 1.00 0.00 H new ATOM 0 HB2 ASP A 37 9.415 1.595 3.339 1.00 0.00 H new ATOM 0 HB3 ASP A 37 10.364 0.124 3.256 1.00 0.00 H new ATOM 598 N ASP A 38 7.688 -1.116 4.506 1.00 0.00 N ATOM 599 CA ASP A 38 7.562 -2.201 5.471 1.00 0.00 C ATOM 600 C ASP A 38 6.635 -3.289 4.939 1.00 0.00 C ATOM 601 O ASP A 38 6.785 -4.465 5.271 1.00 0.00 O ATOM 602 CB ASP A 38 7.034 -1.670 6.805 1.00 0.00 C ATOM 603 CG ASP A 38 7.717 -2.315 7.995 1.00 0.00 C ATOM 604 OD1 ASP A 38 8.964 -2.271 8.057 1.00 0.00 O ATOM 605 OD2 ASP A 38 7.007 -2.863 8.863 1.00 0.00 O ATOM 0 H ASP A 38 7.246 -0.243 4.793 1.00 0.00 H new ATOM 0 HA ASP A 38 8.550 -2.632 5.629 1.00 0.00 H new ATOM 0 HB2 ASP A 38 7.180 -0.591 6.847 1.00 0.00 H new ATOM 0 HB3 ASP A 38 5.960 -1.849 6.865 1.00 0.00 H new ATOM 610 N MET A 39 5.680 -2.887 4.105 1.00 0.00 N ATOM 611 CA MET A 39 4.732 -3.824 3.516 1.00 0.00 C ATOM 612 C MET A 39 5.113 -4.125 2.072 1.00 0.00 C ATOM 613 O MET A 39 4.433 -4.887 1.383 1.00 0.00 O ATOM 614 CB MET A 39 3.312 -3.261 3.579 1.00 0.00 C ATOM 615 CG MET A 39 2.898 -2.807 4.969 1.00 0.00 C ATOM 616 SD MET A 39 2.216 -4.147 5.963 1.00 0.00 S ATOM 617 CE MET A 39 3.065 -3.883 7.518 1.00 0.00 C ATOM 0 H MET A 39 5.543 -1.917 3.822 1.00 0.00 H new ATOM 0 HA MET A 39 4.764 -4.751 4.088 1.00 0.00 H new ATOM 0 HB2 MET A 39 3.234 -2.418 2.892 1.00 0.00 H new ATOM 0 HB3 MET A 39 2.613 -4.022 3.231 1.00 0.00 H new ATOM 0 HG2 MET A 39 3.762 -2.384 5.481 1.00 0.00 H new ATOM 0 HG3 MET A 39 2.158 -2.012 4.882 1.00 0.00 H new ATOM 0 HE1 MET A 39 2.747 -4.637 8.239 1.00 0.00 H new ATOM 0 HE2 MET A 39 4.141 -3.960 7.363 1.00 0.00 H new ATOM 0 HE3 MET A 39 2.824 -2.891 7.900 1.00 0.00 H new ATOM 627 N GLU A 40 6.210 -3.517 1.631 1.00 0.00 N ATOM 628 CA GLU A 40 6.717 -3.701 0.275 1.00 0.00 C ATOM 629 C GLU A 40 5.788 -3.076 -0.762 1.00 0.00 C ATOM 630 O GLU A 40 5.674 -3.573 -1.884 1.00 0.00 O ATOM 631 CB GLU A 40 6.917 -5.187 -0.029 1.00 0.00 C ATOM 632 CG GLU A 40 8.304 -5.700 0.324 1.00 0.00 C ATOM 633 CD GLU A 40 8.349 -6.378 1.679 1.00 0.00 C ATOM 634 OE1 GLU A 40 7.781 -7.482 1.809 1.00 0.00 O ATOM 635 OE2 GLU A 40 8.952 -5.804 2.610 1.00 0.00 O ATOM 0 H GLU A 40 6.771 -2.885 2.202 1.00 0.00 H new ATOM 0 HA GLU A 40 7.680 -3.193 0.216 1.00 0.00 H new ATOM 0 HB2 GLU A 40 6.174 -5.765 0.521 1.00 0.00 H new ATOM 0 HB3 GLU A 40 6.734 -5.360 -1.089 1.00 0.00 H new ATOM 0 HG2 GLU A 40 8.632 -6.404 -0.441 1.00 0.00 H new ATOM 0 HG3 GLU A 40 9.008 -4.868 0.315 1.00 0.00 H new ATOM 642 N GLY A 41 5.133 -1.984 -0.387 1.00 0.00 N ATOM 643 CA GLY A 41 4.234 -1.309 -1.300 1.00 0.00 C ATOM 644 C GLY A 41 4.781 0.023 -1.768 1.00 0.00 C ATOM 645 O GLY A 41 5.908 0.102 -2.258 1.00 0.00 O ATOM 0 H GLY A 41 5.209 -1.554 0.535 1.00 0.00 H new ATOM 0 HA2 GLY A 41 4.051 -1.948 -2.164 1.00 0.00 H new ATOM 0 HA3 GLY A 41 3.273 -1.152 -0.810 1.00 0.00 H new ATOM 649 N GLN A 42 3.976 1.065 -1.628 1.00 0.00 N ATOM 650 CA GLN A 42 4.366 2.402 -2.048 1.00 0.00 C ATOM 651 C GLN A 42 3.462 3.410 -1.384 1.00 0.00 C ATOM 652 O GLN A 42 2.358 3.065 -0.973 1.00 0.00 O ATOM 653 CB GLN A 42 4.247 2.541 -3.568 1.00 0.00 C ATOM 654 CG GLN A 42 4.490 3.956 -4.074 1.00 0.00 C ATOM 655 CD GLN A 42 4.169 4.110 -5.547 1.00 0.00 C ATOM 656 OE1 GLN A 42 4.785 3.472 -6.399 1.00 0.00 O ATOM 657 NE2 GLN A 42 3.197 4.961 -5.853 1.00 0.00 N ATOM 0 H GLN A 42 3.041 1.009 -1.223 1.00 0.00 H new ATOM 0 HA GLN A 42 5.402 2.577 -1.759 1.00 0.00 H new ATOM 0 HB2 GLN A 42 4.961 1.867 -4.043 1.00 0.00 H new ATOM 0 HB3 GLN A 42 3.252 2.220 -3.877 1.00 0.00 H new ATOM 0 HG2 GLN A 42 3.882 4.654 -3.498 1.00 0.00 H new ATOM 0 HG3 GLN A 42 5.532 4.225 -3.903 1.00 0.00 H new ATOM 0 HE21 GLN A 42 2.713 5.469 -5.113 1.00 0.00 H new ATOM 0 HE22 GLN A 42 2.935 5.106 -6.828 1.00 0.00 H new ATOM 666 N LEU A 43 3.885 4.659 -1.288 1.00 0.00 N ATOM 667 CA LEU A 43 3.014 5.629 -0.684 1.00 0.00 C ATOM 668 C LEU A 43 1.957 5.965 -1.717 1.00 0.00 C ATOM 669 O LEU A 43 2.245 6.536 -2.768 1.00 0.00 O ATOM 670 CB LEU A 43 3.811 6.876 -0.273 1.00 0.00 C ATOM 671 CG LEU A 43 3.228 7.731 0.862 1.00 0.00 C ATOM 672 CD1 LEU A 43 2.545 6.878 1.908 1.00 0.00 C ATOM 673 CD2 LEU A 43 4.321 8.564 1.507 1.00 0.00 C ATOM 0 H LEU A 43 4.789 5.007 -1.608 1.00 0.00 H new ATOM 0 HA LEU A 43 2.550 5.240 0.222 1.00 0.00 H new ATOM 0 HB2 LEU A 43 4.811 6.558 0.022 1.00 0.00 H new ATOM 0 HB3 LEU A 43 3.925 7.511 -1.152 1.00 0.00 H new ATOM 0 HG LEU A 43 2.479 8.392 0.426 1.00 0.00 H new ATOM 0 HD11 LEU A 43 2.145 7.518 2.695 1.00 0.00 H new ATOM 0 HD12 LEU A 43 1.731 6.318 1.447 1.00 0.00 H new ATOM 0 HD13 LEU A 43 3.266 6.182 2.337 1.00 0.00 H new ATOM 0 HD21 LEU A 43 3.894 9.165 2.310 1.00 0.00 H new ATOM 0 HD22 LEU A 43 5.088 7.905 1.915 1.00 0.00 H new ATOM 0 HD23 LEU A 43 4.767 9.220 0.760 1.00 0.00 H new ATOM 685 N VAL A 44 0.739 5.550 -1.394 1.00 0.00 N ATOM 686 CA VAL A 44 -0.438 5.717 -2.243 1.00 0.00 C ATOM 687 C VAL A 44 -0.175 6.509 -3.512 1.00 0.00 C ATOM 688 O VAL A 44 -0.101 5.942 -4.604 1.00 0.00 O ATOM 689 CB VAL A 44 -1.575 6.382 -1.467 1.00 0.00 C ATOM 690 CG1 VAL A 44 -2.758 5.444 -1.382 1.00 0.00 C ATOM 691 CG2 VAL A 44 -1.105 6.789 -0.083 1.00 0.00 C ATOM 0 H VAL A 44 0.535 5.076 -0.514 1.00 0.00 H new ATOM 0 HA VAL A 44 -0.720 4.709 -2.546 1.00 0.00 H new ATOM 0 HB VAL A 44 -1.886 7.284 -1.995 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -3.564 5.925 -0.828 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -3.103 5.201 -2.387 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -2.461 4.529 -0.870 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -1.926 7.261 0.456 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -0.773 5.906 0.463 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -0.278 7.493 -0.172 1.00 0.00 H new ATOM 701 N SER A 45 -0.069 7.817 -3.364 1.00 0.00 N ATOM 702 CA SER A 45 0.152 8.701 -4.502 1.00 0.00 C ATOM 703 C SER A 45 -1.070 8.679 -5.411 1.00 0.00 C ATOM 704 O SER A 45 -0.958 8.490 -6.623 1.00 0.00 O ATOM 705 CB SER A 45 1.400 8.279 -5.280 1.00 0.00 C ATOM 706 OG SER A 45 2.245 9.386 -5.528 1.00 0.00 O ATOM 0 H SER A 45 -0.132 8.295 -2.465 1.00 0.00 H new ATOM 0 HA SER A 45 0.308 9.715 -4.135 1.00 0.00 H new ATOM 0 HB2 SER A 45 1.944 7.521 -4.717 1.00 0.00 H new ATOM 0 HB3 SER A 45 1.106 7.823 -6.225 1.00 0.00 H new ATOM 0 HG SER A 45 2.240 9.593 -6.486 1.00 0.00 H new ATOM 712 N ILE A 46 -2.241 8.854 -4.803 1.00 0.00 N ATOM 713 CA ILE A 46 -3.506 8.840 -5.531 1.00 0.00 C ATOM 714 C ILE A 46 -3.449 9.732 -6.765 1.00 0.00 C ATOM 715 O ILE A 46 -2.923 10.843 -6.721 1.00 0.00 O ATOM 716 CB ILE A 46 -4.696 9.285 -4.650 1.00 0.00 C ATOM 717 CG1 ILE A 46 -4.215 9.809 -3.289 1.00 0.00 C ATOM 718 CG2 ILE A 46 -5.679 8.136 -4.474 1.00 0.00 C ATOM 719 CD1 ILE A 46 -3.916 8.723 -2.275 1.00 0.00 C ATOM 0 H ILE A 46 -2.339 9.008 -3.800 1.00 0.00 H new ATOM 0 HA ILE A 46 -3.664 7.805 -5.834 1.00 0.00 H new ATOM 0 HB ILE A 46 -5.207 10.105 -5.155 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -3.316 10.407 -3.440 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -4.975 10.474 -2.879 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -6.512 8.462 -3.852 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -6.054 7.825 -5.449 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -5.175 7.296 -3.995 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -3.582 9.178 -1.342 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -4.817 8.138 -2.092 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -3.133 8.071 -2.661 1.00 0.00 H new ATOM 731 N HIS A 47 -3.999 9.231 -7.867 1.00 0.00 N ATOM 732 CA HIS A 47 -4.019 9.973 -9.120 1.00 0.00 C ATOM 733 C HIS A 47 -5.415 9.968 -9.730 1.00 0.00 C ATOM 734 O HIS A 47 -5.640 10.542 -10.796 1.00 0.00 O ATOM 735 CB HIS A 47 -3.017 9.375 -10.109 1.00 0.00 C ATOM 736 CG HIS A 47 -2.917 7.883 -10.033 1.00 0.00 C ATOM 737 ND1 HIS A 47 -3.808 7.036 -10.660 1.00 0.00 N ATOM 738 CD2 HIS A 47 -2.024 7.084 -9.402 1.00 0.00 C ATOM 739 CE1 HIS A 47 -3.469 5.783 -10.415 1.00 0.00 C ATOM 740 NE2 HIS A 47 -2.389 5.784 -9.655 1.00 0.00 N ATOM 0 H HIS A 47 -4.438 8.311 -7.916 1.00 0.00 H new ATOM 0 HA HIS A 47 -3.737 11.004 -8.907 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -3.304 9.660 -11.121 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -2.034 9.807 -9.923 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -1.181 7.409 -8.810 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -3.987 4.906 -10.775 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -1.905 4.955 -9.312 1.00 0.00 H new ATOM 749 N SER A 48 -6.354 9.318 -9.047 1.00 0.00 N ATOM 750 CA SER A 48 -7.726 9.243 -9.520 1.00 0.00 C ATOM 751 C SER A 48 -8.672 9.868 -8.507 1.00 0.00 C ATOM 752 O SER A 48 -8.712 9.448 -7.351 1.00 0.00 O ATOM 753 CB SER A 48 -8.122 7.787 -9.778 1.00 0.00 C ATOM 754 OG SER A 48 -8.884 7.668 -10.967 1.00 0.00 O ATOM 0 H SER A 48 -6.186 8.836 -8.164 1.00 0.00 H new ATOM 0 HA SER A 48 -7.798 9.798 -10.455 1.00 0.00 H new ATOM 0 HB2 SER A 48 -7.226 7.171 -9.854 1.00 0.00 H new ATOM 0 HB3 SER A 48 -8.698 7.409 -8.934 1.00 0.00 H new ATOM 0 HG SER A 48 -9.123 6.728 -11.110 1.00 0.00 H new ATOM 760 N PRO A 49 -9.453 10.881 -8.925 1.00 0.00 N ATOM 761 CA PRO A 49 -10.402 11.550 -8.038 1.00 0.00 C ATOM 762 C PRO A 49 -11.219 10.544 -7.240 1.00 0.00 C ATOM 763 O PRO A 49 -11.640 10.817 -6.116 1.00 0.00 O ATOM 764 CB PRO A 49 -11.293 12.330 -9.003 1.00 0.00 C ATOM 765 CG PRO A 49 -10.415 12.618 -10.171 1.00 0.00 C ATOM 766 CD PRO A 49 -9.477 11.445 -10.290 1.00 0.00 C ATOM 0 HA PRO A 49 -9.913 12.182 -7.296 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -12.166 11.747 -9.297 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -11.662 13.249 -8.548 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -11.004 12.740 -11.080 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -9.862 13.546 -10.023 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -9.835 10.717 -11.018 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -8.484 11.757 -10.613 1.00 0.00 H new ATOM 774 N GLU A 50 -11.424 9.370 -7.832 1.00 0.00 N ATOM 775 CA GLU A 50 -12.174 8.308 -7.182 1.00 0.00 C ATOM 776 C GLU A 50 -11.362 7.676 -6.066 1.00 0.00 C ATOM 777 O GLU A 50 -11.869 7.450 -4.971 1.00 0.00 O ATOM 778 CB GLU A 50 -12.570 7.232 -8.189 1.00 0.00 C ATOM 779 CG GLU A 50 -13.235 6.028 -7.548 1.00 0.00 C ATOM 780 CD GLU A 50 -13.171 4.792 -8.424 1.00 0.00 C ATOM 781 OE1 GLU A 50 -14.020 4.662 -9.331 1.00 0.00 O ATOM 782 OE2 GLU A 50 -12.273 3.952 -8.203 1.00 0.00 O ATOM 0 H GLU A 50 -11.079 9.134 -8.762 1.00 0.00 H new ATOM 0 HA GLU A 50 -13.075 8.753 -6.759 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -13.248 7.664 -8.925 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -11.681 6.904 -8.728 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -12.754 5.817 -6.593 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -14.277 6.264 -7.335 1.00 0.00 H new ATOM 789 N GLU A 51 -10.102 7.377 -6.359 1.00 0.00 N ATOM 790 CA GLU A 51 -9.226 6.756 -5.386 1.00 0.00 C ATOM 791 C GLU A 51 -9.015 7.675 -4.189 1.00 0.00 C ATOM 792 O GLU A 51 -9.123 7.245 -3.042 1.00 0.00 O ATOM 793 CB GLU A 51 -7.888 6.394 -6.030 1.00 0.00 C ATOM 794 CG GLU A 51 -7.994 5.302 -7.081 1.00 0.00 C ATOM 795 CD GLU A 51 -8.346 3.952 -6.486 1.00 0.00 C ATOM 796 OE1 GLU A 51 -7.593 3.474 -5.612 1.00 0.00 O ATOM 797 OE2 GLU A 51 -9.376 3.375 -6.892 1.00 0.00 O ATOM 0 H GLU A 51 -9.668 7.557 -7.265 1.00 0.00 H new ATOM 0 HA GLU A 51 -9.698 5.840 -5.032 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -7.461 7.287 -6.487 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -7.195 6.072 -5.252 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -8.751 5.580 -7.814 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -7.047 5.224 -7.615 1.00 0.00 H new ATOM 804 N GLN A 52 -8.729 8.946 -4.460 1.00 0.00 N ATOM 805 CA GLN A 52 -8.524 9.920 -3.398 1.00 0.00 C ATOM 806 C GLN A 52 -9.789 10.035 -2.557 1.00 0.00 C ATOM 807 O GLN A 52 -9.728 10.111 -1.332 1.00 0.00 O ATOM 808 CB GLN A 52 -8.127 11.284 -3.978 1.00 0.00 C ATOM 809 CG GLN A 52 -9.307 12.161 -4.375 1.00 0.00 C ATOM 810 CD GLN A 52 -9.599 13.259 -3.365 1.00 0.00 C ATOM 811 OE1 GLN A 52 -10.209 14.274 -3.700 1.00 0.00 O ATOM 812 NE2 GLN A 52 -9.165 13.065 -2.122 1.00 0.00 N ATOM 0 H GLN A 52 -8.635 9.322 -5.403 1.00 0.00 H new ATOM 0 HA GLN A 52 -7.707 9.581 -2.761 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -7.524 11.817 -3.243 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -7.497 11.125 -4.853 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -9.106 12.613 -5.346 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -10.193 11.537 -4.491 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -8.663 12.209 -1.885 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -9.334 13.772 -1.406 1.00 0.00 H new ATOM 821 N ASP A 53 -10.933 10.013 -3.233 1.00 0.00 N ATOM 822 CA ASP A 53 -12.226 10.078 -2.577 1.00 0.00 C ATOM 823 C ASP A 53 -12.477 8.786 -1.817 1.00 0.00 C ATOM 824 O ASP A 53 -13.109 8.778 -0.763 1.00 0.00 O ATOM 825 CB ASP A 53 -13.337 10.312 -3.602 1.00 0.00 C ATOM 826 CG ASP A 53 -14.639 10.744 -2.957 1.00 0.00 C ATOM 827 OD1 ASP A 53 -14.608 11.671 -2.120 1.00 0.00 O ATOM 828 OD2 ASP A 53 -15.689 10.155 -3.288 1.00 0.00 O ATOM 0 H ASP A 53 -10.986 9.950 -4.250 1.00 0.00 H new ATOM 0 HA ASP A 53 -12.225 10.913 -1.877 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -13.017 11.074 -4.313 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -13.502 9.396 -4.169 1.00 0.00 H new ATOM 833 N PHE A 54 -11.983 7.690 -2.384 1.00 0.00 N ATOM 834 CA PHE A 54 -12.145 6.373 -1.800 1.00 0.00 C ATOM 835 C PHE A 54 -11.532 6.324 -0.409 1.00 0.00 C ATOM 836 O PHE A 54 -12.183 5.927 0.557 1.00 0.00 O ATOM 837 CB PHE A 54 -11.452 5.353 -2.702 1.00 0.00 C ATOM 838 CG PHE A 54 -12.371 4.318 -3.272 1.00 0.00 C ATOM 839 CD1 PHE A 54 -13.116 4.593 -4.403 1.00 0.00 C ATOM 840 CD2 PHE A 54 -12.480 3.073 -2.683 1.00 0.00 C ATOM 841 CE1 PHE A 54 -13.960 3.642 -4.940 1.00 0.00 C ATOM 842 CE2 PHE A 54 -13.323 2.114 -3.213 1.00 0.00 C ATOM 843 CZ PHE A 54 -14.064 2.399 -4.345 1.00 0.00 C ATOM 0 H PHE A 54 -11.461 7.695 -3.260 1.00 0.00 H new ATOM 0 HA PHE A 54 -13.207 6.144 -1.714 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -10.964 5.881 -3.521 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -10.668 4.854 -2.133 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -13.037 5.563 -4.872 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -11.901 2.847 -1.800 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -14.538 3.869 -5.824 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -13.403 1.144 -2.744 1.00 0.00 H new ATOM 0 HZ PHE A 54 -14.722 1.652 -4.763 1.00 0.00 H new ATOM 853 N LEU A 55 -10.284 6.758 -0.312 1.00 0.00 N ATOM 854 CA LEU A 55 -9.585 6.797 0.964 1.00 0.00 C ATOM 855 C LEU A 55 -10.119 7.938 1.812 1.00 0.00 C ATOM 856 O LEU A 55 -10.193 7.842 3.035 1.00 0.00 O ATOM 857 CB LEU A 55 -8.086 6.968 0.756 1.00 0.00 C ATOM 858 CG LEU A 55 -7.701 7.848 -0.424 1.00 0.00 C ATOM 859 CD1 LEU A 55 -7.137 9.167 0.066 1.00 0.00 C ATOM 860 CD2 LEU A 55 -6.703 7.129 -1.312 1.00 0.00 C ATOM 0 H LEU A 55 -9.733 7.089 -1.104 1.00 0.00 H new ATOM 0 HA LEU A 55 -9.757 5.851 1.478 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -7.654 7.391 1.663 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -7.638 5.984 0.618 1.00 0.00 H new ATOM 0 HG LEU A 55 -8.593 8.057 -1.014 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.866 9.787 -0.789 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -7.887 9.683 0.665 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -6.252 8.981 0.674 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -6.436 7.770 -2.152 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.808 6.893 -0.737 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -7.147 6.207 -1.686 1.00 0.00 H new ATOM 872 N THR A 56 -10.487 9.022 1.137 1.00 0.00 N ATOM 873 CA THR A 56 -11.017 10.199 1.802 1.00 0.00 C ATOM 874 C THR A 56 -12.286 9.831 2.560 1.00 0.00 C ATOM 875 O THR A 56 -12.499 10.267 3.692 1.00 0.00 O ATOM 876 CB THR A 56 -11.294 11.302 0.770 1.00 0.00 C ATOM 877 OG1 THR A 56 -10.317 12.324 0.849 1.00 0.00 O ATOM 878 CG2 THR A 56 -12.647 11.957 0.918 1.00 0.00 C ATOM 0 H THR A 56 -10.426 9.106 0.122 1.00 0.00 H new ATOM 0 HA THR A 56 -10.285 10.576 2.516 1.00 0.00 H new ATOM 0 HB THR A 56 -11.264 10.792 -0.193 1.00 0.00 H new ATOM 0 HG1 THR A 56 -10.512 13.015 0.182 1.00 0.00 H new ATOM 0 HG21 THR A 56 -12.766 12.724 0.153 1.00 0.00 H new ATOM 0 HG22 THR A 56 -13.429 11.206 0.804 1.00 0.00 H new ATOM 0 HG23 THR A 56 -12.724 12.414 1.905 1.00 0.00 H new ATOM 886 N LYS A 57 -13.110 9.003 1.931 1.00 0.00 N ATOM 887 CA LYS A 57 -14.342 8.542 2.541 1.00 0.00 C ATOM 888 C LYS A 57 -14.017 7.511 3.610 1.00 0.00 C ATOM 889 O LYS A 57 -14.676 7.440 4.647 1.00 0.00 O ATOM 890 CB LYS A 57 -15.272 7.938 1.486 1.00 0.00 C ATOM 891 CG LYS A 57 -16.718 8.385 1.621 1.00 0.00 C ATOM 892 CD LYS A 57 -16.927 9.776 1.045 1.00 0.00 C ATOM 893 CE LYS A 57 -17.143 9.729 -0.459 1.00 0.00 C ATOM 894 NZ LYS A 57 -17.593 11.042 -0.997 1.00 0.00 N ATOM 0 H LYS A 57 -12.943 8.637 0.994 1.00 0.00 H new ATOM 0 HA LYS A 57 -14.854 9.389 2.998 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -14.908 8.209 0.495 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -15.229 6.851 1.555 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -17.368 7.676 1.108 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -17.005 8.378 2.672 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -17.788 10.243 1.523 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -16.061 10.398 1.270 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -16.215 9.434 -0.950 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -17.885 8.966 -0.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -17.147 11.209 -1.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -18.627 11.036 -1.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -17.319 11.799 -0.339 1.00 0.00 H new ATOM 907 N HIS A 58 -12.979 6.722 3.346 1.00 0.00 N ATOM 908 CA HIS A 58 -12.539 5.700 4.280 1.00 0.00 C ATOM 909 C HIS A 58 -11.997 6.342 5.550 1.00 0.00 C ATOM 910 O HIS A 58 -12.090 5.767 6.635 1.00 0.00 O ATOM 911 CB HIS A 58 -11.467 4.816 3.640 1.00 0.00 C ATOM 912 CG HIS A 58 -11.522 3.390 4.091 1.00 0.00 C ATOM 913 ND1 HIS A 58 -11.279 3.001 5.392 1.00 0.00 N ATOM 914 CD2 HIS A 58 -11.795 2.253 3.407 1.00 0.00 C ATOM 915 CE1 HIS A 58 -11.399 1.689 5.489 1.00 0.00 C ATOM 916 NE2 HIS A 58 -11.712 1.211 4.298 1.00 0.00 N ATOM 0 H HIS A 58 -12.428 6.774 2.489 1.00 0.00 H new ATOM 0 HA HIS A 58 -13.396 5.078 4.538 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -11.578 4.851 2.556 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -10.484 5.225 3.873 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -12.034 2.180 2.356 1.00 0.00 H new ATOM 0 HE1 HIS A 58 -11.264 1.107 6.388 1.00 0.00 H new ATOM 0 HE2 HIS A 58 -11.867 0.228 4.076 1.00 0.00 H new ATOM 925 N ALA A 59 -11.431 7.541 5.413 1.00 0.00 N ATOM 926 CA ALA A 59 -10.882 8.255 6.558 1.00 0.00 C ATOM 927 C ALA A 59 -11.997 8.750 7.474 1.00 0.00 C ATOM 928 O ALA A 59 -12.728 9.680 7.131 1.00 0.00 O ATOM 929 CB ALA A 59 -10.020 9.417 6.094 1.00 0.00 C ATOM 0 H ALA A 59 -11.342 8.033 4.524 1.00 0.00 H new ATOM 0 HA ALA A 59 -10.258 7.564 7.125 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -9.617 9.940 6.961 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -9.199 9.040 5.484 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -10.625 10.105 5.503 1.00 0.00 H new ATOM 935 N SER A 60 -12.123 8.120 8.639 1.00 0.00 N ATOM 936 CA SER A 60 -13.151 8.491 9.605 1.00 0.00 C ATOM 937 C SER A 60 -13.035 9.962 9.996 1.00 0.00 C ATOM 938 O SER A 60 -13.715 10.818 9.431 1.00 0.00 O ATOM 939 CB SER A 60 -13.049 7.609 10.851 1.00 0.00 C ATOM 940 OG SER A 60 -14.279 7.578 11.556 1.00 0.00 O ATOM 0 H SER A 60 -11.525 7.349 8.936 1.00 0.00 H new ATOM 0 HA SER A 60 -14.123 8.339 9.137 1.00 0.00 H new ATOM 0 HB2 SER A 60 -12.766 6.597 10.562 1.00 0.00 H new ATOM 0 HB3 SER A 60 -12.261 7.986 11.504 1.00 0.00 H new ATOM 0 HG SER A 60 -14.188 7.007 12.347 1.00 0.00 H new ATOM 946 N HIS A 61 -12.170 10.247 10.964 1.00 0.00 N ATOM 947 CA HIS A 61 -11.968 11.615 11.429 1.00 0.00 C ATOM 948 C HIS A 61 -10.566 12.106 11.081 1.00 0.00 C ATOM 949 O HIS A 61 -10.346 13.302 10.893 1.00 0.00 O ATOM 950 CB HIS A 61 -12.192 11.703 12.939 1.00 0.00 C ATOM 951 CG HIS A 61 -13.270 12.665 13.330 1.00 0.00 C ATOM 952 ND1 HIS A 61 -13.314 13.968 12.880 1.00 0.00 N ATOM 953 CD2 HIS A 61 -14.349 12.509 14.133 1.00 0.00 C ATOM 954 CE1 HIS A 61 -14.373 14.571 13.390 1.00 0.00 C ATOM 955 NE2 HIS A 61 -15.018 13.708 14.152 1.00 0.00 N ATOM 0 H HIS A 61 -11.598 9.550 11.441 1.00 0.00 H new ATOM 0 HA HIS A 61 -12.693 12.254 10.925 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -12.445 10.713 13.319 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -11.260 12.000 13.419 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -14.631 11.609 14.660 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -14.662 15.597 13.213 1.00 0.00 H new ATOM 0 HE2 HIS A 61 -15.875 13.900 14.671 1.00 0.00 H new ATOM 964 N THR A 62 -9.623 11.173 10.999 1.00 0.00 N ATOM 965 CA THR A 62 -8.242 11.509 10.675 1.00 0.00 C ATOM 966 C THR A 62 -7.990 11.383 9.176 1.00 0.00 C ATOM 967 O THR A 62 -8.476 10.453 8.531 1.00 0.00 O ATOM 968 CB THR A 62 -7.281 10.601 11.443 1.00 0.00 C ATOM 969 OG1 THR A 62 -7.596 9.237 11.224 1.00 0.00 O ATOM 970 CG2 THR A 62 -7.296 10.841 12.937 1.00 0.00 C ATOM 0 H THR A 62 -9.790 10.179 11.152 1.00 0.00 H new ATOM 0 HA THR A 62 -8.067 12.544 10.970 1.00 0.00 H new ATOM 0 HB THR A 62 -6.289 10.843 11.062 1.00 0.00 H new ATOM 0 HG1 THR A 62 -6.969 8.672 11.722 1.00 0.00 H new ATOM 0 HG21 THR A 62 -6.592 10.164 13.421 1.00 0.00 H new ATOM 0 HG22 THR A 62 -7.008 11.872 13.143 1.00 0.00 H new ATOM 0 HG23 THR A 62 -8.299 10.660 13.325 1.00 0.00 H new ATOM 978 N GLY A 63 -7.228 12.325 8.629 1.00 0.00 N ATOM 979 CA GLY A 63 -6.922 12.304 7.210 1.00 0.00 C ATOM 980 C GLY A 63 -6.051 11.128 6.819 1.00 0.00 C ATOM 981 O GLY A 63 -5.901 10.175 7.585 1.00 0.00 O ATOM 0 H GLY A 63 -6.816 13.103 9.144 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -7.852 12.267 6.642 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -6.418 13.231 6.937 1.00 0.00 H new ATOM 985 N SER A 64 -5.476 11.195 5.625 1.00 0.00 N ATOM 986 CA SER A 64 -4.615 10.129 5.127 1.00 0.00 C ATOM 987 C SER A 64 -3.342 10.700 4.513 1.00 0.00 C ATOM 988 O SER A 64 -3.283 11.881 4.166 1.00 0.00 O ATOM 989 CB SER A 64 -5.363 9.287 4.092 1.00 0.00 C ATOM 990 OG SER A 64 -5.135 9.770 2.780 1.00 0.00 O ATOM 0 H SER A 64 -5.591 11.978 4.982 1.00 0.00 H new ATOM 0 HA SER A 64 -4.336 9.495 5.969 1.00 0.00 H new ATOM 0 HB2 SER A 64 -5.040 8.248 4.162 1.00 0.00 H new ATOM 0 HB3 SER A 64 -6.431 9.304 4.308 1.00 0.00 H new ATOM 0 HG SER A 64 -4.348 9.326 2.400 1.00 0.00 H new ATOM 996 N TRP A 65 -2.327 9.854 4.374 1.00 0.00 N ATOM 997 CA TRP A 65 -1.056 10.272 3.793 1.00 0.00 C ATOM 998 C TRP A 65 -0.918 9.713 2.386 1.00 0.00 C ATOM 999 O TRP A 65 -1.162 8.533 2.156 1.00 0.00 O ATOM 1000 CB TRP A 65 0.109 9.796 4.663 1.00 0.00 C ATOM 1001 CG TRP A 65 0.465 10.758 5.753 1.00 0.00 C ATOM 1002 CD1 TRP A 65 0.857 12.057 5.603 1.00 0.00 C ATOM 1003 CD2 TRP A 65 0.461 10.499 7.161 1.00 0.00 C ATOM 1004 NE1 TRP A 65 1.096 12.622 6.833 1.00 0.00 N ATOM 1005 CE2 TRP A 65 0.861 11.685 7.805 1.00 0.00 C ATOM 1006 CE3 TRP A 65 0.159 9.380 7.942 1.00 0.00 C ATOM 1007 CZ2 TRP A 65 0.965 11.783 9.189 1.00 0.00 C ATOM 1008 CZ3 TRP A 65 0.263 9.478 9.316 1.00 0.00 C ATOM 1009 CH2 TRP A 65 0.662 10.672 9.928 1.00 0.00 C ATOM 0 H TRP A 65 -2.360 8.874 4.656 1.00 0.00 H new ATOM 0 HA TRP A 65 -1.034 11.361 3.746 1.00 0.00 H new ATOM 0 HB2 TRP A 65 -0.147 8.834 5.106 1.00 0.00 H new ATOM 0 HB3 TRP A 65 0.982 9.634 4.031 1.00 0.00 H new ATOM 0 HD1 TRP A 65 0.964 12.566 4.657 1.00 0.00 H new ATOM 0 HE1 TRP A 65 1.399 13.582 6.996 1.00 0.00 H new ATOM 0 HE3 TRP A 65 -0.150 8.455 7.479 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 1.274 12.703 9.663 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 0.033 8.619 9.928 1.00 0.00 H new ATOM 0 HH2 TRP A 65 0.732 10.717 11.005 1.00 0.00 H new ATOM 1020 N ILE A 66 -0.534 10.566 1.445 1.00 0.00 N ATOM 1021 CA ILE A 66 -0.380 10.140 0.061 1.00 0.00 C ATOM 1022 C ILE A 66 1.070 10.211 -0.390 1.00 0.00 C ATOM 1023 O ILE A 66 1.911 10.808 0.279 1.00 0.00 O ATOM 1024 CB ILE A 66 -1.260 10.971 -0.893 1.00 0.00 C ATOM 1025 CG1 ILE A 66 -0.559 12.278 -1.281 1.00 0.00 C ATOM 1026 CG2 ILE A 66 -2.614 11.243 -0.248 1.00 0.00 C ATOM 1027 CD1 ILE A 66 -1.500 13.353 -1.773 1.00 0.00 C ATOM 0 H ILE A 66 -0.325 11.550 1.613 1.00 0.00 H new ATOM 0 HA ILE A 66 -0.708 9.101 0.020 1.00 0.00 H new ATOM 0 HB ILE A 66 -1.422 10.401 -1.808 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -0.011 12.655 -0.418 1.00 0.00 H new ATOM 0 HG13 ILE A 66 0.176 12.068 -2.058 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -3.230 11.831 -0.929 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -3.111 10.297 -0.034 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -2.470 11.796 0.680 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -0.930 14.247 -2.028 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -2.030 12.996 -2.656 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -2.220 13.593 -0.990 1.00 0.00 H new ATOM 1039 N GLY A 67 1.352 9.581 -1.524 1.00 0.00 N ATOM 1040 CA GLY A 67 2.700 9.563 -2.055 1.00 0.00 C ATOM 1041 C GLY A 67 3.100 10.868 -2.715 1.00 0.00 C ATOM 1042 O GLY A 67 3.550 10.874 -3.859 1.00 0.00 O ATOM 0 H GLY A 67 0.666 9.080 -2.088 1.00 0.00 H new ATOM 0 HA2 GLY A 67 3.399 9.343 -1.248 1.00 0.00 H new ATOM 0 HA3 GLY A 67 2.787 8.755 -2.781 1.00 0.00 H new ATOM 1046 N LEU A 68 2.942 11.974 -1.998 1.00 0.00 N ATOM 1047 CA LEU A 68 3.298 13.279 -2.532 1.00 0.00 C ATOM 1048 C LEU A 68 4.264 14.029 -1.617 1.00 0.00 C ATOM 1049 O LEU A 68 4.000 14.217 -0.429 1.00 0.00 O ATOM 1050 CB LEU A 68 2.044 14.123 -2.750 1.00 0.00 C ATOM 1051 CG LEU A 68 1.908 14.722 -4.142 1.00 0.00 C ATOM 1052 CD1 LEU A 68 0.794 15.749 -4.166 1.00 0.00 C ATOM 1053 CD2 LEU A 68 3.222 15.340 -4.570 1.00 0.00 C ATOM 0 H LEU A 68 2.571 11.992 -1.048 1.00 0.00 H new ATOM 0 HA LEU A 68 3.800 13.110 -3.485 1.00 0.00 H new ATOM 0 HB2 LEU A 68 1.169 13.505 -2.549 1.00 0.00 H new ATOM 0 HB3 LEU A 68 2.037 14.932 -2.020 1.00 0.00 H new ATOM 0 HG LEU A 68 1.654 13.930 -4.847 1.00 0.00 H new ATOM 0 HD11 LEU A 68 0.708 16.169 -5.168 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -0.147 15.272 -3.891 1.00 0.00 H new ATOM 0 HD13 LEU A 68 1.018 16.546 -3.457 1.00 0.00 H new ATOM 0 HD21 LEU A 68 3.116 15.766 -5.567 1.00 0.00 H new ATOM 0 HD22 LEU A 68 3.501 16.125 -3.867 1.00 0.00 H new ATOM 0 HD23 LEU A 68 3.997 14.574 -4.584 1.00 0.00 H new ATOM 1065 N ARG A 69 5.373 14.474 -2.198 1.00 0.00 N ATOM 1066 CA ARG A 69 6.388 15.234 -1.475 1.00 0.00 C ATOM 1067 C ARG A 69 6.899 16.383 -2.345 1.00 0.00 C ATOM 1068 O ARG A 69 7.392 16.152 -3.449 1.00 0.00 O ATOM 1069 CB ARG A 69 7.544 14.319 -1.062 1.00 0.00 C ATOM 1070 CG ARG A 69 8.797 15.068 -0.634 1.00 0.00 C ATOM 1071 CD ARG A 69 10.008 14.638 -1.446 1.00 0.00 C ATOM 1072 NE ARG A 69 11.100 14.172 -0.596 1.00 0.00 N ATOM 1073 CZ ARG A 69 12.320 13.896 -1.047 1.00 0.00 C ATOM 1074 NH1 ARG A 69 12.603 14.038 -2.335 1.00 0.00 N ATOM 1075 NH2 ARG A 69 13.259 13.477 -0.209 1.00 0.00 N ATOM 0 H ARG A 69 5.594 14.319 -3.182 1.00 0.00 H new ATOM 0 HA ARG A 69 5.941 15.651 -0.573 1.00 0.00 H new ATOM 0 HB2 ARG A 69 7.215 13.681 -0.241 1.00 0.00 H new ATOM 0 HB3 ARG A 69 7.791 13.663 -1.896 1.00 0.00 H new ATOM 0 HG2 ARG A 69 8.640 16.140 -0.753 1.00 0.00 H new ATOM 0 HG3 ARG A 69 8.985 14.889 0.425 1.00 0.00 H new ATOM 0 HD2 ARG A 69 9.719 13.843 -2.134 1.00 0.00 H new ATOM 0 HD3 ARG A 69 10.353 15.475 -2.053 1.00 0.00 H new ATOM 0 HE ARG A 69 10.917 14.051 0.400 1.00 0.00 H new ATOM 0 HH11 ARG A 69 11.884 14.360 -2.983 1.00 0.00 H new ATOM 0 HH12 ARG A 69 13.540 13.825 -2.678 1.00 0.00 H new ATOM 0 HH21 ARG A 69 13.045 13.366 0.782 1.00 0.00 H new ATOM 0 HH22 ARG A 69 14.195 13.265 -0.556 1.00 0.00 H new ATOM 1089 N ASN A 70 6.782 17.616 -1.860 1.00 0.00 N ATOM 1090 CA ASN A 70 7.236 18.772 -2.630 1.00 0.00 C ATOM 1091 C ASN A 70 8.748 18.943 -2.536 1.00 0.00 C ATOM 1092 O ASN A 70 9.370 18.571 -1.540 1.00 0.00 O ATOM 1093 CB ASN A 70 6.521 20.046 -2.167 1.00 0.00 C ATOM 1094 CG ASN A 70 7.486 21.151 -1.780 1.00 0.00 C ATOM 1095 OD1 ASN A 70 8.037 21.153 -0.680 1.00 0.00 O ATOM 1096 ND2 ASN A 70 7.696 22.096 -2.689 1.00 0.00 N ATOM 0 H ASN A 70 6.382 17.840 -0.949 1.00 0.00 H new ATOM 0 HA ASN A 70 6.984 18.593 -3.675 1.00 0.00 H new ATOM 0 HB2 ASN A 70 5.869 20.402 -2.964 1.00 0.00 H new ATOM 0 HB3 ASN A 70 5.884 19.811 -1.315 1.00 0.00 H new ATOM 0 HD21 ASN A 70 8.336 22.864 -2.488 1.00 0.00 H new ATOM 0 HD22 ASN A 70 7.217 22.054 -3.589 1.00 0.00 H new ATOM 1103 N LEU A 71 9.332 19.507 -3.592 1.00 0.00 N ATOM 1104 CA LEU A 71 10.772 19.730 -3.649 1.00 0.00 C ATOM 1105 C LEU A 71 11.238 20.659 -2.532 1.00 0.00 C ATOM 1106 O LEU A 71 11.667 20.200 -1.473 1.00 0.00 O ATOM 1107 CB LEU A 71 11.162 20.312 -5.010 1.00 0.00 C ATOM 1108 CG LEU A 71 11.667 19.292 -6.030 1.00 0.00 C ATOM 1109 CD1 LEU A 71 11.307 19.725 -7.443 1.00 0.00 C ATOM 1110 CD2 LEU A 71 13.171 19.104 -5.896 1.00 0.00 C ATOM 0 H LEU A 71 8.826 19.818 -4.421 1.00 0.00 H new ATOM 0 HA LEU A 71 11.264 18.767 -3.513 1.00 0.00 H new ATOM 0 HB2 LEU A 71 10.297 20.825 -5.430 1.00 0.00 H new ATOM 0 HB3 LEU A 71 11.936 21.064 -4.858 1.00 0.00 H new ATOM 0 HG LEU A 71 11.181 18.337 -5.830 1.00 0.00 H new ATOM 0 HD11 LEU A 71 11.675 18.986 -8.155 1.00 0.00 H new ATOM 0 HD12 LEU A 71 10.224 19.808 -7.533 1.00 0.00 H new ATOM 0 HD13 LEU A 71 11.764 20.692 -7.655 1.00 0.00 H new ATOM 0 HD21 LEU A 71 13.513 18.374 -6.630 1.00 0.00 H new ATOM 0 HD22 LEU A 71 13.673 20.056 -6.069 1.00 0.00 H new ATOM 0 HD23 LEU A 71 13.405 18.747 -4.893 1.00 0.00 H new ATOM 1122 N ASP A 72 11.160 21.965 -2.775 1.00 0.00 N ATOM 1123 CA ASP A 72 11.586 22.949 -1.784 1.00 0.00 C ATOM 1124 C ASP A 72 10.612 24.120 -1.699 1.00 0.00 C ATOM 1125 O ASP A 72 10.843 25.176 -2.290 1.00 0.00 O ATOM 1126 CB ASP A 72 12.988 23.462 -2.120 1.00 0.00 C ATOM 1127 CG ASP A 72 13.181 23.689 -3.607 1.00 0.00 C ATOM 1128 OD1 ASP A 72 13.497 22.714 -4.321 1.00 0.00 O ATOM 1129 OD2 ASP A 72 13.014 24.843 -4.057 1.00 0.00 O ATOM 0 H ASP A 72 10.808 22.365 -3.645 1.00 0.00 H new ATOM 0 HA ASP A 72 11.602 22.455 -0.813 1.00 0.00 H new ATOM 0 HB2 ASP A 72 13.168 24.395 -1.587 1.00 0.00 H new ATOM 0 HB3 ASP A 72 13.729 22.745 -1.766 1.00 0.00 H new ATOM 1134 N LEU A 73 9.532 23.929 -0.947 1.00 0.00 N ATOM 1135 CA LEU A 73 8.521 24.967 -0.757 1.00 0.00 C ATOM 1136 C LEU A 73 7.932 25.441 -2.086 1.00 0.00 C ATOM 1137 O LEU A 73 6.896 24.943 -2.528 1.00 0.00 O ATOM 1138 CB LEU A 73 9.118 26.155 0.002 1.00 0.00 C ATOM 1139 CG LEU A 73 8.237 26.717 1.119 1.00 0.00 C ATOM 1140 CD1 LEU A 73 9.009 26.772 2.429 1.00 0.00 C ATOM 1141 CD2 LEU A 73 7.719 28.097 0.745 1.00 0.00 C ATOM 0 H LEU A 73 9.333 23.058 -0.455 1.00 0.00 H new ATOM 0 HA LEU A 73 7.712 24.530 -0.172 1.00 0.00 H new ATOM 0 HB2 LEU A 73 10.072 25.850 0.431 1.00 0.00 H new ATOM 0 HB3 LEU A 73 9.329 26.953 -0.710 1.00 0.00 H new ATOM 0 HG LEU A 73 7.382 26.054 1.252 1.00 0.00 H new ATOM 0 HD11 LEU A 73 8.367 27.174 3.213 1.00 0.00 H new ATOM 0 HD12 LEU A 73 9.331 25.768 2.704 1.00 0.00 H new ATOM 0 HD13 LEU A 73 9.882 27.414 2.310 1.00 0.00 H new ATOM 0 HD21 LEU A 73 7.094 28.482 1.551 1.00 0.00 H new ATOM 0 HD22 LEU A 73 8.561 28.771 0.585 1.00 0.00 H new ATOM 0 HD23 LEU A 73 7.130 28.029 -0.170 1.00 0.00 H new ATOM 1153 N LYS A 74 8.589 26.416 -2.710 1.00 0.00 N ATOM 1154 CA LYS A 74 8.123 26.968 -3.978 1.00 0.00 C ATOM 1155 C LYS A 74 8.409 26.024 -5.141 1.00 0.00 C ATOM 1156 O LYS A 74 8.207 26.378 -6.302 1.00 0.00 O ATOM 1157 CB LYS A 74 8.782 28.324 -4.238 1.00 0.00 C ATOM 1158 CG LYS A 74 10.299 28.289 -4.155 1.00 0.00 C ATOM 1159 CD LYS A 74 10.874 29.668 -3.871 1.00 0.00 C ATOM 1160 CE LYS A 74 11.726 29.667 -2.612 1.00 0.00 C ATOM 1161 NZ LYS A 74 12.967 30.472 -2.780 1.00 0.00 N ATOM 0 H LYS A 74 9.447 26.840 -2.357 1.00 0.00 H new ATOM 0 HA LYS A 74 7.043 27.096 -3.905 1.00 0.00 H new ATOM 0 HB2 LYS A 74 8.489 28.678 -5.226 1.00 0.00 H new ATOM 0 HB3 LYS A 74 8.403 29.047 -3.515 1.00 0.00 H new ATOM 0 HG2 LYS A 74 10.606 27.597 -3.370 1.00 0.00 H new ATOM 0 HG3 LYS A 74 10.707 27.909 -5.092 1.00 0.00 H new ATOM 0 HD2 LYS A 74 11.476 29.994 -4.719 1.00 0.00 H new ATOM 0 HD3 LYS A 74 10.062 30.387 -3.762 1.00 0.00 H new ATOM 0 HE2 LYS A 74 11.145 30.065 -1.780 1.00 0.00 H new ATOM 0 HE3 LYS A 74 11.991 28.642 -2.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 13.520 30.446 -1.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 13.534 30.077 -3.557 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 12.715 31.456 -3.001 1.00 0.00 H new ATOM 1174 N GLY A 75 8.874 24.819 -4.825 1.00 0.00 N ATOM 1175 CA GLY A 75 9.172 23.848 -5.859 1.00 0.00 C ATOM 1176 C GLY A 75 7.928 23.145 -6.365 1.00 0.00 C ATOM 1177 O GLY A 75 6.808 23.565 -6.072 1.00 0.00 O ATOM 0 H GLY A 75 9.049 24.499 -3.872 1.00 0.00 H new ATOM 0 HA2 GLY A 75 9.668 24.348 -6.691 1.00 0.00 H new ATOM 0 HA3 GLY A 75 9.871 23.108 -5.469 1.00 0.00 H new ATOM 1181 N GLU A 76 8.123 22.071 -7.120 1.00 0.00 N ATOM 1182 CA GLU A 76 7.014 21.301 -7.662 1.00 0.00 C ATOM 1183 C GLU A 76 6.805 20.034 -6.846 1.00 0.00 C ATOM 1184 O GLU A 76 7.766 19.401 -6.409 1.00 0.00 O ATOM 1185 CB GLU A 76 7.274 20.946 -9.127 1.00 0.00 C ATOM 1186 CG GLU A 76 7.758 22.120 -9.962 1.00 0.00 C ATOM 1187 CD GLU A 76 8.747 21.705 -11.034 1.00 0.00 C ATOM 1188 OE1 GLU A 76 9.705 20.974 -10.706 1.00 0.00 O ATOM 1189 OE2 GLU A 76 8.563 22.111 -12.200 1.00 0.00 O ATOM 0 H GLU A 76 9.045 21.713 -7.371 1.00 0.00 H new ATOM 0 HA GLU A 76 6.111 21.909 -7.607 1.00 0.00 H new ATOM 0 HB2 GLU A 76 8.016 20.149 -9.173 1.00 0.00 H new ATOM 0 HB3 GLU A 76 6.356 20.553 -9.565 1.00 0.00 H new ATOM 0 HG2 GLU A 76 6.902 22.605 -10.431 1.00 0.00 H new ATOM 0 HG3 GLU A 76 8.224 22.858 -9.309 1.00 0.00 H new ATOM 1196 N PHE A 77 5.546 19.674 -6.631 1.00 0.00 N ATOM 1197 CA PHE A 77 5.225 18.487 -5.854 1.00 0.00 C ATOM 1198 C PHE A 77 5.571 17.229 -6.636 1.00 0.00 C ATOM 1199 O PHE A 77 5.043 16.991 -7.722 1.00 0.00 O ATOM 1200 CB PHE A 77 3.742 18.454 -5.451 1.00 0.00 C ATOM 1201 CG PHE A 77 3.165 19.766 -4.979 1.00 0.00 C ATOM 1202 CD1 PHE A 77 3.950 20.905 -4.852 1.00 0.00 C ATOM 1203 CD2 PHE A 77 1.818 19.853 -4.667 1.00 0.00 C ATOM 1204 CE1 PHE A 77 3.404 22.100 -4.429 1.00 0.00 C ATOM 1205 CE2 PHE A 77 1.267 21.047 -4.241 1.00 0.00 C ATOM 1206 CZ PHE A 77 2.060 22.171 -4.125 1.00 0.00 C ATOM 0 H PHE A 77 4.736 20.185 -6.982 1.00 0.00 H new ATOM 0 HA PHE A 77 5.823 18.525 -4.944 1.00 0.00 H new ATOM 0 HB2 PHE A 77 3.160 18.108 -6.305 1.00 0.00 H new ATOM 0 HB3 PHE A 77 3.616 17.716 -4.659 1.00 0.00 H new ATOM 0 HD1 PHE A 77 5.003 20.855 -5.088 1.00 0.00 H new ATOM 0 HD2 PHE A 77 1.191 18.978 -4.758 1.00 0.00 H new ATOM 0 HE1 PHE A 77 4.027 22.977 -4.336 1.00 0.00 H new ATOM 0 HE2 PHE A 77 0.216 21.101 -3.999 1.00 0.00 H new ATOM 0 HZ PHE A 77 1.629 23.105 -3.797 1.00 0.00 H new ATOM 1216 N ILE A 78 6.460 16.431 -6.071 1.00 0.00 N ATOM 1217 CA ILE A 78 6.890 15.192 -6.692 1.00 0.00 C ATOM 1218 C ILE A 78 6.453 14.002 -5.850 1.00 0.00 C ATOM 1219 O ILE A 78 6.505 14.047 -4.624 1.00 0.00 O ATOM 1220 CB ILE A 78 8.422 15.168 -6.886 1.00 0.00 C ATOM 1221 CG1 ILE A 78 8.759 15.314 -8.379 1.00 0.00 C ATOM 1222 CG2 ILE A 78 9.033 13.904 -6.285 1.00 0.00 C ATOM 1223 CD1 ILE A 78 9.571 14.174 -8.963 1.00 0.00 C ATOM 0 H ILE A 78 6.902 16.623 -5.172 1.00 0.00 H new ATOM 0 HA ILE A 78 6.421 15.127 -7.674 1.00 0.00 H new ATOM 0 HB ILE A 78 8.861 16.012 -6.354 1.00 0.00 H new ATOM 0 HG12 ILE A 78 7.829 15.403 -8.940 1.00 0.00 H new ATOM 0 HG13 ILE A 78 9.309 16.244 -8.524 1.00 0.00 H new ATOM 0 HG21 ILE A 78 10.112 13.914 -6.436 1.00 0.00 H new ATOM 0 HG22 ILE A 78 8.817 13.867 -5.217 1.00 0.00 H new ATOM 0 HG23 ILE A 78 8.607 13.027 -6.772 1.00 0.00 H new ATOM 0 HD11 ILE A 78 9.759 14.365 -10.019 1.00 0.00 H new ATOM 0 HD12 ILE A 78 10.520 14.095 -8.434 1.00 0.00 H new ATOM 0 HD13 ILE A 78 9.017 13.241 -8.856 1.00 0.00 H new ATOM 1235 N TRP A 79 6.019 12.943 -6.511 1.00 0.00 N ATOM 1236 CA TRP A 79 5.569 11.752 -5.809 1.00 0.00 C ATOM 1237 C TRP A 79 6.753 10.968 -5.260 1.00 0.00 C ATOM 1238 O TRP A 79 7.847 11.000 -5.822 1.00 0.00 O ATOM 1239 CB TRP A 79 4.743 10.857 -6.738 1.00 0.00 C ATOM 1240 CG TRP A 79 3.458 11.480 -7.200 1.00 0.00 C ATOM 1241 CD1 TRP A 79 2.878 12.624 -6.730 1.00 0.00 C ATOM 1242 CD2 TRP A 79 2.592 10.985 -8.229 1.00 0.00 C ATOM 1243 NE1 TRP A 79 1.706 12.871 -7.405 1.00 0.00 N ATOM 1244 CE2 TRP A 79 1.508 11.878 -8.328 1.00 0.00 C ATOM 1245 CE3 TRP A 79 2.628 9.873 -9.074 1.00 0.00 C ATOM 1246 CZ2 TRP A 79 0.472 11.693 -9.240 1.00 0.00 C ATOM 1247 CZ3 TRP A 79 1.599 9.690 -9.979 1.00 0.00 C ATOM 1248 CH2 TRP A 79 0.534 10.596 -10.056 1.00 0.00 C ATOM 0 H TRP A 79 5.968 12.882 -7.528 1.00 0.00 H new ATOM 0 HA TRP A 79 4.943 12.072 -4.976 1.00 0.00 H new ATOM 0 HB2 TRP A 79 5.345 10.601 -7.610 1.00 0.00 H new ATOM 0 HB3 TRP A 79 4.518 9.924 -6.221 1.00 0.00 H new ATOM 0 HD1 TRP A 79 3.281 13.244 -5.943 1.00 0.00 H new ATOM 0 HE1 TRP A 79 1.085 13.664 -7.245 1.00 0.00 H new ATOM 0 HE3 TRP A 79 3.445 9.169 -9.021 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 -0.351 12.390 -9.301 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 1.617 8.834 -10.637 1.00 0.00 H new ATOM 0 HH2 TRP A 79 -0.255 10.426 -10.774 1.00 0.00 H new ATOM 1259 N VAL A 80 6.521 10.264 -4.159 1.00 0.00 N ATOM 1260 CA VAL A 80 7.557 9.461 -3.521 1.00 0.00 C ATOM 1261 C VAL A 80 8.092 8.409 -4.490 1.00 0.00 C ATOM 1262 O VAL A 80 9.224 7.944 -4.360 1.00 0.00 O ATOM 1263 CB VAL A 80 7.001 8.760 -2.265 1.00 0.00 C ATOM 1264 CG1 VAL A 80 5.593 8.267 -2.530 1.00 0.00 C ATOM 1265 CG2 VAL A 80 7.905 7.619 -1.819 1.00 0.00 C ATOM 0 H VAL A 80 5.618 10.233 -3.686 1.00 0.00 H new ATOM 0 HA VAL A 80 8.369 10.128 -3.231 1.00 0.00 H new ATOM 0 HB VAL A 80 6.972 9.485 -1.451 1.00 0.00 H new ATOM 0 HG11 VAL A 80 5.207 7.773 -1.639 1.00 0.00 H new ATOM 0 HG12 VAL A 80 4.953 9.112 -2.782 1.00 0.00 H new ATOM 0 HG13 VAL A 80 5.605 7.560 -3.360 1.00 0.00 H new ATOM 0 HG21 VAL A 80 7.484 7.147 -0.932 1.00 0.00 H new ATOM 0 HG22 VAL A 80 7.984 6.883 -2.619 1.00 0.00 H new ATOM 0 HG23 VAL A 80 8.896 8.009 -1.587 1.00 0.00 H new ATOM 1275 N ASP A 81 7.267 8.048 -5.466 1.00 0.00 N ATOM 1276 CA ASP A 81 7.647 7.057 -6.465 1.00 0.00 C ATOM 1277 C ASP A 81 8.573 7.675 -7.505 1.00 0.00 C ATOM 1278 O ASP A 81 8.984 7.017 -8.461 1.00 0.00 O ATOM 1279 CB ASP A 81 6.404 6.484 -7.148 1.00 0.00 C ATOM 1280 CG ASP A 81 6.700 5.207 -7.910 1.00 0.00 C ATOM 1281 OD1 ASP A 81 7.326 4.298 -7.324 1.00 0.00 O ATOM 1282 OD2 ASP A 81 6.306 5.115 -9.092 1.00 0.00 O ATOM 0 H ASP A 81 6.328 8.428 -5.587 1.00 0.00 H new ATOM 0 HA ASP A 81 8.176 6.249 -5.960 1.00 0.00 H new ATOM 0 HB2 ASP A 81 5.639 6.287 -6.397 1.00 0.00 H new ATOM 0 HB3 ASP A 81 5.995 7.226 -7.833 1.00 0.00 H new ATOM 1287 N GLY A 82 8.900 8.946 -7.303 1.00 0.00 N ATOM 1288 CA GLY A 82 9.777 9.642 -8.220 1.00 0.00 C ATOM 1289 C GLY A 82 9.070 10.084 -9.485 1.00 0.00 C ATOM 1290 O GLY A 82 9.668 10.104 -10.561 1.00 0.00 O ATOM 0 H GLY A 82 8.571 9.507 -6.517 1.00 0.00 H new ATOM 0 HA2 GLY A 82 10.199 10.514 -7.721 1.00 0.00 H new ATOM 0 HA3 GLY A 82 10.611 8.991 -8.483 1.00 0.00 H new ATOM 1294 N SER A 83 7.795 10.441 -9.360 1.00 0.00 N ATOM 1295 CA SER A 83 7.015 10.885 -10.508 1.00 0.00 C ATOM 1296 C SER A 83 6.222 12.147 -10.181 1.00 0.00 C ATOM 1297 O SER A 83 5.447 12.173 -9.230 1.00 0.00 O ATOM 1298 CB SER A 83 6.064 9.776 -10.964 1.00 0.00 C ATOM 1299 OG SER A 83 6.492 9.208 -12.190 1.00 0.00 O ATOM 0 H SER A 83 7.283 10.431 -8.478 1.00 0.00 H new ATOM 0 HA SER A 83 7.710 11.117 -11.315 1.00 0.00 H new ATOM 0 HB2 SER A 83 6.011 9.001 -10.199 1.00 0.00 H new ATOM 0 HB3 SER A 83 5.058 10.180 -11.078 1.00 0.00 H new ATOM 0 HG SER A 83 5.869 8.501 -12.458 1.00 0.00 H new ATOM 1305 N HIS A 84 6.421 13.192 -10.979 1.00 0.00 N ATOM 1306 CA HIS A 84 5.724 14.456 -10.772 1.00 0.00 C ATOM 1307 C HIS A 84 4.213 14.244 -10.734 1.00 0.00 C ATOM 1308 O HIS A 84 3.689 13.327 -11.368 1.00 0.00 O ATOM 1309 CB HIS A 84 6.084 15.449 -11.879 1.00 0.00 C ATOM 1310 CG HIS A 84 5.916 14.894 -13.260 1.00 0.00 C ATOM 1311 ND1 HIS A 84 4.710 14.887 -13.928 1.00 0.00 N ATOM 1312 CD2 HIS A 84 6.813 14.325 -14.101 1.00 0.00 C ATOM 1313 CE1 HIS A 84 4.871 14.338 -15.119 1.00 0.00 C ATOM 1314 NE2 HIS A 84 6.138 13.990 -15.249 1.00 0.00 N ATOM 0 H HIS A 84 7.059 13.188 -11.775 1.00 0.00 H new ATOM 0 HA HIS A 84 6.040 14.864 -9.812 1.00 0.00 H new ATOM 0 HB2 HIS A 84 5.461 16.337 -11.775 1.00 0.00 H new ATOM 0 HB3 HIS A 84 7.118 15.768 -11.748 1.00 0.00 H new ATOM 0 HD1 HIS A 84 3.830 15.249 -13.560 1.00 0.00 H new ATOM 0 HD2 HIS A 84 7.863 14.165 -13.905 1.00 0.00 H new ATOM 0 HE1 HIS A 84 4.098 14.198 -15.860 1.00 0.00 H new ATOM 1323 N VAL A 85 3.525 15.098 -9.986 1.00 0.00 N ATOM 1324 CA VAL A 85 2.074 15.013 -9.857 1.00 0.00 C ATOM 1325 C VAL A 85 1.399 15.015 -11.227 1.00 0.00 C ATOM 1326 O VAL A 85 1.937 15.556 -12.193 1.00 0.00 O ATOM 1327 CB VAL A 85 1.517 16.176 -9.011 1.00 0.00 C ATOM 1328 CG1 VAL A 85 0.003 16.112 -8.940 1.00 0.00 C ATOM 1329 CG2 VAL A 85 2.118 16.156 -7.616 1.00 0.00 C ATOM 0 H VAL A 85 3.950 15.860 -9.458 1.00 0.00 H new ATOM 0 HA VAL A 85 1.853 14.073 -9.352 1.00 0.00 H new ATOM 0 HB VAL A 85 1.796 17.113 -9.493 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -0.368 16.942 -8.338 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -0.412 16.179 -9.946 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -0.300 15.169 -8.485 1.00 0.00 H new ATOM 0 HG21 VAL A 85 1.713 16.984 -7.034 1.00 0.00 H new ATOM 0 HG22 VAL A 85 1.871 15.214 -7.127 1.00 0.00 H new ATOM 0 HG23 VAL A 85 3.201 16.256 -7.685 1.00 0.00 H new ATOM 1339 N ASP A 86 0.221 14.399 -11.304 1.00 0.00 N ATOM 1340 CA ASP A 86 -0.521 14.325 -12.558 1.00 0.00 C ATOM 1341 C ASP A 86 -1.756 15.222 -12.534 1.00 0.00 C ATOM 1342 O ASP A 86 -1.914 16.094 -13.390 1.00 0.00 O ATOM 1343 CB ASP A 86 -0.936 12.880 -12.840 1.00 0.00 C ATOM 1344 CG ASP A 86 -0.287 12.326 -14.093 1.00 0.00 C ATOM 1345 OD1 ASP A 86 -0.793 12.613 -15.199 1.00 0.00 O ATOM 1346 OD2 ASP A 86 0.726 11.606 -13.970 1.00 0.00 O ATOM 0 H ASP A 86 -0.238 13.945 -10.514 1.00 0.00 H new ATOM 0 HA ASP A 86 0.137 14.677 -13.353 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -0.667 12.255 -11.988 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -2.020 12.830 -12.943 1.00 0.00 H new ATOM 1351 N TYR A 87 -2.638 14.998 -11.563 1.00 0.00 N ATOM 1352 CA TYR A 87 -3.865 15.783 -11.451 1.00 0.00 C ATOM 1353 C TYR A 87 -3.863 16.659 -10.202 1.00 0.00 C ATOM 1354 O TYR A 87 -4.376 17.779 -10.223 1.00 0.00 O ATOM 1355 CB TYR A 87 -5.083 14.859 -11.435 1.00 0.00 C ATOM 1356 CG TYR A 87 -5.821 14.805 -12.754 1.00 0.00 C ATOM 1357 CD1 TYR A 87 -6.846 15.700 -13.037 1.00 0.00 C ATOM 1358 CD2 TYR A 87 -5.492 13.859 -13.717 1.00 0.00 C ATOM 1359 CE1 TYR A 87 -7.521 15.654 -14.241 1.00 0.00 C ATOM 1360 CE2 TYR A 87 -6.163 13.807 -14.924 1.00 0.00 C ATOM 1361 CZ TYR A 87 -7.177 14.706 -15.180 1.00 0.00 C ATOM 1362 OH TYR A 87 -7.848 14.656 -16.381 1.00 0.00 O ATOM 0 H TYR A 87 -2.527 14.282 -10.845 1.00 0.00 H new ATOM 0 HA TYR A 87 -3.916 16.439 -12.320 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -4.761 13.853 -11.167 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -5.770 15.192 -10.657 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -7.119 16.444 -12.303 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -4.699 13.153 -13.519 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -8.314 16.358 -14.446 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -5.895 13.066 -15.663 1.00 0.00 H new ATOM 0 HH TYR A 87 -7.482 13.931 -16.930 1.00 0.00 H new ATOM 1372 N SER A 88 -3.293 16.140 -9.117 1.00 0.00 N ATOM 1373 CA SER A 88 -3.229 16.867 -7.847 1.00 0.00 C ATOM 1374 C SER A 88 -4.629 17.178 -7.322 1.00 0.00 C ATOM 1375 O SER A 88 -5.592 17.225 -8.087 1.00 0.00 O ATOM 1376 CB SER A 88 -2.428 18.162 -7.999 1.00 0.00 C ATOM 1377 OG SER A 88 -1.965 18.337 -9.326 1.00 0.00 O ATOM 0 H SER A 88 -2.866 15.214 -9.090 1.00 0.00 H new ATOM 0 HA SER A 88 -2.723 16.226 -7.126 1.00 0.00 H new ATOM 0 HB2 SER A 88 -3.050 19.011 -7.716 1.00 0.00 H new ATOM 0 HB3 SER A 88 -1.579 18.147 -7.316 1.00 0.00 H new ATOM 0 HG SER A 88 -1.551 19.221 -9.414 1.00 0.00 H new ATOM 1383 N ASN A 89 -4.746 17.375 -6.009 1.00 0.00 N ATOM 1384 CA ASN A 89 -6.040 17.662 -5.405 1.00 0.00 C ATOM 1385 C ASN A 89 -5.975 18.803 -4.386 1.00 0.00 C ATOM 1386 O ASN A 89 -7.018 19.318 -3.985 1.00 0.00 O ATOM 1387 CB ASN A 89 -6.592 16.406 -4.730 1.00 0.00 C ATOM 1388 CG ASN A 89 -7.028 15.348 -5.723 1.00 0.00 C ATOM 1389 OD1 ASN A 89 -7.229 15.629 -6.904 1.00 0.00 O ATOM 1390 ND2 ASN A 89 -7.179 14.120 -5.243 1.00 0.00 N ATOM 0 H ASN A 89 -3.967 17.341 -5.352 1.00 0.00 H new ATOM 0 HA ASN A 89 -6.703 17.980 -6.210 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -5.830 15.988 -4.072 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -7.440 16.680 -4.102 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -7.473 13.363 -5.861 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -7.001 13.933 -4.256 1.00 0.00 H new ATOM 1397 N TRP A 90 -4.766 19.190 -3.954 1.00 0.00 N ATOM 1398 CA TRP A 90 -4.617 20.265 -2.971 1.00 0.00 C ATOM 1399 C TRP A 90 -5.586 21.410 -3.244 1.00 0.00 C ATOM 1400 O TRP A 90 -5.307 22.301 -4.046 1.00 0.00 O ATOM 1401 CB TRP A 90 -3.184 20.800 -2.943 1.00 0.00 C ATOM 1402 CG TRP A 90 -2.411 20.575 -4.206 1.00 0.00 C ATOM 1403 CD1 TRP A 90 -1.676 19.472 -4.529 1.00 0.00 C ATOM 1404 CD2 TRP A 90 -2.281 21.483 -5.307 1.00 0.00 C ATOM 1405 NE1 TRP A 90 -1.096 19.638 -5.762 1.00 0.00 N ATOM 1406 CE2 TRP A 90 -1.455 20.862 -6.262 1.00 0.00 C ATOM 1407 CE3 TRP A 90 -2.784 22.758 -5.579 1.00 0.00 C ATOM 1408 CZ2 TRP A 90 -1.120 21.473 -7.468 1.00 0.00 C ATOM 1409 CZ3 TRP A 90 -2.452 23.363 -6.778 1.00 0.00 C ATOM 1410 CH2 TRP A 90 -1.627 22.720 -7.709 1.00 0.00 C ATOM 0 H TRP A 90 -3.887 18.778 -4.268 1.00 0.00 H new ATOM 0 HA TRP A 90 -4.850 19.836 -1.997 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -3.213 21.870 -2.736 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -2.650 20.330 -2.117 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -1.567 18.597 -3.906 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -0.495 18.960 -6.230 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -3.420 23.262 -4.866 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -0.483 20.980 -8.187 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -2.836 24.348 -7.000 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -1.386 23.219 -8.636 1.00 0.00 H new ATOM 1421 N ALA A 91 -6.725 21.369 -2.562 1.00 0.00 N ATOM 1422 CA ALA A 91 -7.761 22.388 -2.704 1.00 0.00 C ATOM 1423 C ALA A 91 -8.283 22.466 -4.140 1.00 0.00 C ATOM 1424 O ALA A 91 -7.584 22.104 -5.087 1.00 0.00 O ATOM 1425 CB ALA A 91 -7.235 23.740 -2.253 1.00 0.00 C ATOM 0 H ALA A 91 -6.957 20.631 -1.897 1.00 0.00 H new ATOM 0 HA ALA A 91 -8.598 22.103 -2.066 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -8.018 24.490 -2.364 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -6.933 23.683 -1.207 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -6.376 24.018 -2.864 1.00 0.00 H new ATOM 1431 N PRO A 92 -9.528 22.943 -4.322 1.00 0.00 N ATOM 1432 CA PRO A 92 -10.138 23.067 -5.650 1.00 0.00 C ATOM 1433 C PRO A 92 -9.493 24.170 -6.481 1.00 0.00 C ATOM 1434 O PRO A 92 -9.559 24.154 -7.710 1.00 0.00 O ATOM 1435 CB PRO A 92 -11.596 23.414 -5.341 1.00 0.00 C ATOM 1436 CG PRO A 92 -11.554 24.066 -4.003 1.00 0.00 C ATOM 1437 CD PRO A 92 -10.437 23.397 -3.252 1.00 0.00 C ATOM 0 HA PRO A 92 -10.019 22.158 -6.240 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -12.012 24.083 -6.094 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -12.221 22.521 -5.327 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -11.375 25.137 -4.096 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -12.503 23.946 -3.480 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -9.941 24.088 -2.570 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -10.800 22.562 -2.652 1.00 0.00 H new ATOM 1445 N GLY A 93 -8.869 25.128 -5.801 1.00 0.00 N ATOM 1446 CA GLY A 93 -8.219 26.226 -6.492 1.00 0.00 C ATOM 1447 C GLY A 93 -7.829 27.352 -5.555 1.00 0.00 C ATOM 1448 O GLY A 93 -7.310 28.380 -5.992 1.00 0.00 O ATOM 0 H GLY A 93 -8.802 25.163 -4.784 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -7.329 25.855 -7.000 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -8.887 26.613 -7.262 1.00 0.00 H new ATOM 1452 N GLU A 94 -8.079 27.159 -4.263 1.00 0.00 N ATOM 1453 CA GLU A 94 -7.749 28.167 -3.263 1.00 0.00 C ATOM 1454 C GLU A 94 -7.613 27.537 -1.877 1.00 0.00 C ATOM 1455 O GLU A 94 -8.568 27.515 -1.100 1.00 0.00 O ATOM 1456 CB GLU A 94 -8.821 29.259 -3.237 1.00 0.00 C ATOM 1457 CG GLU A 94 -8.293 30.621 -2.814 1.00 0.00 C ATOM 1458 CD GLU A 94 -7.383 31.241 -3.856 1.00 0.00 C ATOM 1459 OE1 GLU A 94 -7.859 31.498 -4.981 1.00 0.00 O ATOM 1460 OE2 GLU A 94 -6.195 31.472 -3.544 1.00 0.00 O ATOM 0 H GLU A 94 -8.509 26.314 -3.885 1.00 0.00 H new ATOM 0 HA GLU A 94 -6.792 28.613 -3.535 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -9.266 29.343 -4.228 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -9.617 28.959 -2.555 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -9.133 31.290 -2.626 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -7.749 30.520 -1.875 1.00 0.00 H new ATOM 1467 N PRO A 95 -6.417 27.014 -1.549 1.00 0.00 N ATOM 1468 CA PRO A 95 -6.159 26.380 -0.251 1.00 0.00 C ATOM 1469 C PRO A 95 -6.392 27.336 0.916 1.00 0.00 C ATOM 1470 O PRO A 95 -6.597 26.904 2.051 1.00 0.00 O ATOM 1471 CB PRO A 95 -4.680 25.982 -0.326 1.00 0.00 C ATOM 1472 CG PRO A 95 -4.363 25.946 -1.782 1.00 0.00 C ATOM 1473 CD PRO A 95 -5.226 26.996 -2.416 1.00 0.00 C ATOM 0 HA PRO A 95 -6.829 25.539 -0.073 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -4.051 26.702 0.197 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -4.508 25.011 0.139 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -3.307 26.150 -1.957 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -4.571 24.962 -2.203 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -4.730 27.966 -2.440 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -5.480 26.742 -3.445 1.00 0.00 H new ATOM 1481 N THR A 96 -6.357 28.634 0.627 1.00 0.00 N ATOM 1482 CA THR A 96 -6.562 29.655 1.649 1.00 0.00 C ATOM 1483 C THR A 96 -5.560 29.498 2.788 1.00 0.00 C ATOM 1484 O THR A 96 -5.875 29.766 3.949 1.00 0.00 O ATOM 1485 CB THR A 96 -7.990 29.583 2.194 1.00 0.00 C ATOM 1486 OG1 THR A 96 -8.877 29.080 1.211 1.00 0.00 O ATOM 1487 CG2 THR A 96 -8.524 30.924 2.652 1.00 0.00 C ATOM 0 H THR A 96 -6.188 29.004 -0.309 1.00 0.00 H new ATOM 0 HA THR A 96 -6.406 30.630 1.187 1.00 0.00 H new ATOM 0 HB THR A 96 -7.937 28.918 3.056 1.00 0.00 H new ATOM 0 HG1 THR A 96 -9.784 29.040 1.579 1.00 0.00 H new ATOM 0 HG21 THR A 96 -9.540 30.802 3.027 1.00 0.00 H new ATOM 0 HG22 THR A 96 -7.889 31.316 3.446 1.00 0.00 H new ATOM 0 HG23 THR A 96 -8.528 31.620 1.813 1.00 0.00 H new ATOM 1495 N SER A 97 -4.350 29.061 2.450 1.00 0.00 N ATOM 1496 CA SER A 97 -3.301 28.869 3.443 1.00 0.00 C ATOM 1497 C SER A 97 -2.584 30.182 3.740 1.00 0.00 C ATOM 1498 O SER A 97 -2.449 31.038 2.865 1.00 0.00 O ATOM 1499 CB SER A 97 -2.294 27.825 2.956 1.00 0.00 C ATOM 1500 OG SER A 97 -1.631 28.262 1.782 1.00 0.00 O ATOM 0 H SER A 97 -4.073 28.833 1.495 1.00 0.00 H new ATOM 0 HA SER A 97 -3.767 28.515 4.362 1.00 0.00 H new ATOM 0 HB2 SER A 97 -1.562 27.629 3.739 1.00 0.00 H new ATOM 0 HB3 SER A 97 -2.808 26.884 2.758 1.00 0.00 H new ATOM 0 HG SER A 97 -0.992 27.577 1.493 1.00 0.00 H new ATOM 1506 N ARG A 98 -2.126 30.334 4.979 1.00 0.00 N ATOM 1507 CA ARG A 98 -1.423 31.543 5.391 1.00 0.00 C ATOM 1508 C ARG A 98 -0.074 31.202 6.014 1.00 0.00 C ATOM 1509 O ARG A 98 0.581 32.059 6.609 1.00 0.00 O ATOM 1510 CB ARG A 98 -2.272 32.338 6.386 1.00 0.00 C ATOM 1511 CG ARG A 98 -3.551 32.897 5.784 1.00 0.00 C ATOM 1512 CD ARG A 98 -4.598 33.165 6.852 1.00 0.00 C ATOM 1513 NE ARG A 98 -5.650 34.060 6.376 1.00 0.00 N ATOM 1514 CZ ARG A 98 -6.097 35.105 7.066 1.00 0.00 C ATOM 1515 NH1 ARG A 98 -5.586 35.385 8.258 1.00 0.00 N ATOM 1516 NH2 ARG A 98 -7.056 35.871 6.565 1.00 0.00 N ATOM 0 H ARG A 98 -2.229 29.635 5.714 1.00 0.00 H new ATOM 0 HA ARG A 98 -1.249 32.153 4.504 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -2.528 31.695 7.228 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -1.677 33.161 6.782 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -3.330 33.821 5.250 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -3.948 32.193 5.052 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -5.041 32.221 7.170 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -4.119 33.603 7.728 1.00 0.00 H new ATOM 0 HE ARG A 98 -6.065 33.873 5.463 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -4.848 34.798 8.647 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -5.931 36.187 8.785 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -7.452 35.659 5.649 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -7.398 36.672 7.095 1.00 0.00 H new ATOM 1530 N SER A 99 0.337 29.946 5.873 1.00 0.00 N ATOM 1531 CA SER A 99 1.609 29.490 6.422 1.00 0.00 C ATOM 1532 C SER A 99 2.648 29.317 5.318 1.00 0.00 C ATOM 1533 O SER A 99 3.844 29.218 5.590 1.00 0.00 O ATOM 1534 CB SER A 99 1.421 28.169 7.172 1.00 0.00 C ATOM 1535 OG SER A 99 0.478 27.339 6.515 1.00 0.00 O ATOM 0 H SER A 99 -0.193 29.225 5.383 1.00 0.00 H new ATOM 0 HA SER A 99 1.968 30.248 7.118 1.00 0.00 H new ATOM 0 HB2 SER A 99 2.377 27.650 7.247 1.00 0.00 H new ATOM 0 HB3 SER A 99 1.087 28.369 8.190 1.00 0.00 H new ATOM 0 HG SER A 99 0.377 26.501 7.013 1.00 0.00 H new ATOM 1541 N GLN A 100 2.179 29.283 4.073 1.00 0.00 N ATOM 1542 CA GLN A 100 3.062 29.124 2.923 1.00 0.00 C ATOM 1543 C GLN A 100 3.892 27.849 3.041 1.00 0.00 C ATOM 1544 O GLN A 100 4.986 27.755 2.487 1.00 0.00 O ATOM 1545 CB GLN A 100 3.985 30.337 2.786 1.00 0.00 C ATOM 1546 CG GLN A 100 3.953 30.975 1.408 1.00 0.00 C ATOM 1547 CD GLN A 100 3.180 32.279 1.386 1.00 0.00 C ATOM 1548 OE1 GLN A 100 1.989 32.314 1.697 1.00 0.00 O ATOM 1549 NE2 GLN A 100 3.856 33.362 1.018 1.00 0.00 N ATOM 0 H GLN A 100 1.190 29.364 3.836 1.00 0.00 H new ATOM 0 HA GLN A 100 2.440 29.048 2.031 1.00 0.00 H new ATOM 0 HB2 GLN A 100 3.703 31.083 3.529 1.00 0.00 H new ATOM 0 HB3 GLN A 100 5.007 30.032 3.012 1.00 0.00 H new ATOM 0 HG2 GLN A 100 4.974 31.157 1.072 1.00 0.00 H new ATOM 0 HG3 GLN A 100 3.504 30.279 0.700 1.00 0.00 H new ATOM 0 HE21 GLN A 100 4.842 33.287 0.768 1.00 0.00 H new ATOM 0 HE22 GLN A 100 3.389 34.268 0.985 1.00 0.00 H new ATOM 1558 N GLY A 101 3.361 26.869 3.767 1.00 0.00 N ATOM 1559 CA GLY A 101 4.064 25.612 3.945 1.00 0.00 C ATOM 1560 C GLY A 101 3.983 24.725 2.718 1.00 0.00 C ATOM 1561 O GLY A 101 2.982 24.737 2.002 1.00 0.00 O ATOM 0 H GLY A 101 2.456 26.924 4.235 1.00 0.00 H new ATOM 0 HA2 GLY A 101 5.110 25.814 4.176 1.00 0.00 H new ATOM 0 HA3 GLY A 101 3.645 25.083 4.801 1.00 0.00 H new ATOM 1565 N GLU A 102 5.038 23.954 2.475 1.00 0.00 N ATOM 1566 CA GLU A 102 5.081 23.059 1.325 1.00 0.00 C ATOM 1567 C GLU A 102 6.155 21.989 1.499 1.00 0.00 C ATOM 1568 O GLU A 102 7.341 22.300 1.617 1.00 0.00 O ATOM 1569 CB GLU A 102 5.342 23.854 0.044 1.00 0.00 C ATOM 1570 CG GLU A 102 4.162 23.870 -0.914 1.00 0.00 C ATOM 1571 CD GLU A 102 3.677 25.274 -1.218 1.00 0.00 C ATOM 1572 OE1 GLU A 102 4.518 26.132 -1.557 1.00 0.00 O ATOM 1573 OE2 GLU A 102 2.455 25.514 -1.116 1.00 0.00 O ATOM 0 H GLU A 102 5.874 23.931 3.059 1.00 0.00 H new ATOM 0 HA GLU A 102 4.113 22.564 1.250 1.00 0.00 H new ATOM 0 HB2 GLU A 102 5.598 24.880 0.309 1.00 0.00 H new ATOM 0 HB3 GLU A 102 6.208 23.431 -0.466 1.00 0.00 H new ATOM 0 HG2 GLU A 102 4.447 23.379 -1.844 1.00 0.00 H new ATOM 0 HG3 GLU A 102 3.343 23.291 -0.486 1.00 0.00 H new ATOM 1580 N ASP A 103 5.728 20.729 1.510 1.00 0.00 N ATOM 1581 CA ASP A 103 6.646 19.603 1.663 1.00 0.00 C ATOM 1582 C ASP A 103 5.902 18.282 1.513 1.00 0.00 C ATOM 1583 O ASP A 103 6.425 17.323 0.945 1.00 0.00 O ATOM 1584 CB ASP A 103 7.342 19.659 3.022 1.00 0.00 C ATOM 1585 CG ASP A 103 8.607 18.824 3.059 1.00 0.00 C ATOM 1586 OD1 ASP A 103 8.498 17.588 3.200 1.00 0.00 O ATOM 1587 OD2 ASP A 103 9.707 19.405 2.945 1.00 0.00 O ATOM 0 H ASP A 103 4.748 20.461 1.414 1.00 0.00 H new ATOM 0 HA ASP A 103 7.401 19.671 0.880 1.00 0.00 H new ATOM 0 HB2 ASP A 103 7.586 20.694 3.259 1.00 0.00 H new ATOM 0 HB3 ASP A 103 6.656 19.308 3.793 1.00 0.00 H new ATOM 1592 N CYS A 104 4.675 18.242 2.022 1.00 0.00 N ATOM 1593 CA CYS A 104 3.852 17.040 1.938 1.00 0.00 C ATOM 1594 C CYS A 104 2.381 17.401 1.770 1.00 0.00 C ATOM 1595 O CYS A 104 1.939 18.484 2.162 1.00 0.00 O ATOM 1596 CB CYS A 104 4.035 16.163 3.181 1.00 0.00 C ATOM 1597 SG CYS A 104 3.430 16.921 4.725 1.00 0.00 S ATOM 0 H CYS A 104 4.229 19.027 2.497 1.00 0.00 H new ATOM 0 HA CYS A 104 4.177 16.477 1.063 1.00 0.00 H new ATOM 0 HB2 CYS A 104 3.515 15.218 3.025 1.00 0.00 H new ATOM 0 HB3 CYS A 104 5.094 15.929 3.294 1.00 0.00 H new ATOM 1602 N VAL A 105 1.622 16.487 1.182 1.00 0.00 N ATOM 1603 CA VAL A 105 0.206 16.705 0.964 1.00 0.00 C ATOM 1604 C VAL A 105 -0.627 15.773 1.834 1.00 0.00 C ATOM 1605 O VAL A 105 -0.313 14.592 1.984 1.00 0.00 O ATOM 1606 CB VAL A 105 -0.165 16.509 -0.517 1.00 0.00 C ATOM 1607 CG1 VAL A 105 -1.673 16.433 -0.698 1.00 0.00 C ATOM 1608 CG2 VAL A 105 0.410 17.641 -1.348 1.00 0.00 C ATOM 0 H VAL A 105 1.967 15.587 0.848 1.00 0.00 H new ATOM 0 HA VAL A 105 -0.013 17.736 1.243 1.00 0.00 H new ATOM 0 HB VAL A 105 0.261 15.565 -0.856 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -1.906 16.294 -1.754 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -2.066 15.592 -0.126 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -2.129 17.358 -0.344 1.00 0.00 H new ATOM 0 HG21 VAL A 105 0.143 17.496 -2.395 1.00 0.00 H new ATOM 0 HG22 VAL A 105 0.005 18.591 -0.999 1.00 0.00 H new ATOM 0 HG23 VAL A 105 1.495 17.651 -1.248 1.00 0.00 H new ATOM 1618 N MET A 106 -1.689 16.322 2.405 1.00 0.00 N ATOM 1619 CA MET A 106 -2.580 15.564 3.267 1.00 0.00 C ATOM 1620 C MET A 106 -3.976 15.525 2.668 1.00 0.00 C ATOM 1621 O MET A 106 -4.272 16.246 1.720 1.00 0.00 O ATOM 1622 CB MET A 106 -2.625 16.180 4.666 1.00 0.00 C ATOM 1623 CG MET A 106 -2.991 17.655 4.672 1.00 0.00 C ATOM 1624 SD MET A 106 -2.987 18.365 6.330 1.00 0.00 S ATOM 1625 CE MET A 106 -4.149 19.712 6.125 1.00 0.00 C ATOM 0 H MET A 106 -1.955 17.299 2.284 1.00 0.00 H new ATOM 0 HA MET A 106 -2.200 14.546 3.349 1.00 0.00 H new ATOM 0 HB2 MET A 106 -3.348 15.633 5.271 1.00 0.00 H new ATOM 0 HB3 MET A 106 -1.652 16.054 5.140 1.00 0.00 H new ATOM 0 HG2 MET A 106 -2.287 18.202 4.045 1.00 0.00 H new ATOM 0 HG3 MET A 106 -3.979 17.782 4.229 1.00 0.00 H new ATOM 0 HE1 MET A 106 -4.254 20.249 7.068 1.00 0.00 H new ATOM 0 HE2 MET A 106 -3.783 20.395 5.358 1.00 0.00 H new ATOM 0 HE3 MET A 106 -5.118 19.314 5.824 1.00 0.00 H new ATOM 1635 N MET A 107 -4.826 14.674 3.213 1.00 0.00 N ATOM 1636 CA MET A 107 -6.187 14.541 2.719 1.00 0.00 C ATOM 1637 C MET A 107 -7.186 14.755 3.854 1.00 0.00 C ATOM 1638 O MET A 107 -7.053 14.170 4.928 1.00 0.00 O ATOM 1639 CB MET A 107 -6.372 13.160 2.081 1.00 0.00 C ATOM 1640 CG MET A 107 -7.766 12.589 2.232 1.00 0.00 C ATOM 1641 SD MET A 107 -7.959 11.602 3.728 1.00 0.00 S ATOM 1642 CE MET A 107 -9.540 12.195 4.320 1.00 0.00 C ATOM 0 H MET A 107 -4.599 14.064 3.998 1.00 0.00 H new ATOM 0 HA MET A 107 -6.370 15.302 1.961 1.00 0.00 H new ATOM 0 HB2 MET A 107 -6.132 13.227 1.020 1.00 0.00 H new ATOM 0 HB3 MET A 107 -5.658 12.468 2.526 1.00 0.00 H new ATOM 0 HG2 MET A 107 -8.488 13.405 2.245 1.00 0.00 H new ATOM 0 HG3 MET A 107 -7.997 11.973 1.363 1.00 0.00 H new ATOM 0 HE1 MET A 107 -10.135 11.353 4.674 1.00 0.00 H new ATOM 0 HE2 MET A 107 -9.382 12.897 5.139 1.00 0.00 H new ATOM 0 HE3 MET A 107 -10.067 12.697 3.509 1.00 0.00 H new ATOM 1652 N ARG A 108 -8.179 15.607 3.613 1.00 0.00 N ATOM 1653 CA ARG A 108 -9.191 15.907 4.620 1.00 0.00 C ATOM 1654 C ARG A 108 -10.524 15.252 4.275 1.00 0.00 C ATOM 1655 O ARG A 108 -10.748 14.835 3.138 1.00 0.00 O ATOM 1656 CB ARG A 108 -9.374 17.419 4.752 1.00 0.00 C ATOM 1657 CG ARG A 108 -9.140 17.940 6.161 1.00 0.00 C ATOM 1658 CD ARG A 108 -10.227 18.916 6.581 1.00 0.00 C ATOM 1659 NE ARG A 108 -10.185 19.198 8.014 1.00 0.00 N ATOM 1660 CZ ARG A 108 -11.029 20.021 8.629 1.00 0.00 C ATOM 1661 NH1 ARG A 108 -11.976 20.641 7.939 1.00 0.00 N ATOM 1662 NH2 ARG A 108 -10.925 20.223 9.935 1.00 0.00 N ATOM 0 H ARG A 108 -8.304 16.101 2.729 1.00 0.00 H new ATOM 0 HA ARG A 108 -8.847 15.501 5.571 1.00 0.00 H new ATOM 0 HB2 ARG A 108 -8.688 17.920 4.070 1.00 0.00 H new ATOM 0 HB3 ARG A 108 -10.384 17.683 4.439 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -9.111 17.104 6.859 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -8.169 18.432 6.212 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -10.113 19.847 6.025 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -11.203 18.506 6.321 1.00 0.00 H new ATOM 0 HE ARG A 108 -9.468 18.738 8.574 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -12.058 20.487 6.934 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -12.622 21.272 8.413 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -10.197 19.747 10.468 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -11.573 20.854 10.407 1.00 0.00 H new ATOM 1676 N GLY A 109 -11.405 15.165 5.268 1.00 0.00 N ATOM 1677 CA GLY A 109 -12.707 14.560 5.057 1.00 0.00 C ATOM 1678 C GLY A 109 -13.571 15.358 4.100 1.00 0.00 C ATOM 1679 O GLY A 109 -14.626 14.890 3.671 1.00 0.00 O ATOM 0 H GLY A 109 -11.239 15.503 6.216 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -12.576 13.551 4.667 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -13.220 14.468 6.014 1.00 0.00 H new ATOM 1683 N SER A 110 -13.122 16.564 3.765 1.00 0.00 N ATOM 1684 CA SER A 110 -13.862 17.428 2.852 1.00 0.00 C ATOM 1685 C SER A 110 -14.080 16.734 1.511 1.00 0.00 C ATOM 1686 O SER A 110 -15.097 16.946 0.850 1.00 0.00 O ATOM 1687 CB SER A 110 -13.112 18.744 2.642 1.00 0.00 C ATOM 1688 OG SER A 110 -13.293 19.616 3.745 1.00 0.00 O ATOM 0 H SER A 110 -12.250 16.964 4.112 1.00 0.00 H new ATOM 0 HA SER A 110 -14.835 17.640 3.296 1.00 0.00 H new ATOM 0 HB2 SER A 110 -12.050 18.543 2.504 1.00 0.00 H new ATOM 0 HB3 SER A 110 -13.466 19.227 1.731 1.00 0.00 H new ATOM 0 HG SER A 110 -13.089 20.535 3.472 1.00 0.00 H new ATOM 1694 N GLY A 111 -13.121 15.900 1.121 1.00 0.00 N ATOM 1695 CA GLY A 111 -13.227 15.180 -0.133 1.00 0.00 C ATOM 1696 C GLY A 111 -12.080 15.475 -1.078 1.00 0.00 C ATOM 1697 O GLY A 111 -12.187 15.240 -2.281 1.00 0.00 O ATOM 0 H GLY A 111 -12.271 15.710 1.653 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -13.259 14.109 0.070 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -14.168 15.441 -0.618 1.00 0.00 H new ATOM 1701 N ARG A 112 -10.979 15.990 -0.537 1.00 0.00 N ATOM 1702 CA ARG A 112 -9.816 16.312 -1.350 1.00 0.00 C ATOM 1703 C ARG A 112 -8.546 16.374 -0.506 1.00 0.00 C ATOM 1704 O ARG A 112 -8.508 15.893 0.627 1.00 0.00 O ATOM 1705 CB ARG A 112 -10.024 17.647 -2.068 1.00 0.00 C ATOM 1706 CG ARG A 112 -10.650 18.725 -1.196 1.00 0.00 C ATOM 1707 CD ARG A 112 -9.596 19.652 -0.610 1.00 0.00 C ATOM 1708 NE ARG A 112 -10.179 20.632 0.303 1.00 0.00 N ATOM 1709 CZ ARG A 112 -10.350 20.418 1.604 1.00 0.00 C ATOM 1710 NH1 ARG A 112 -9.983 19.264 2.143 1.00 0.00 N ATOM 1711 NH2 ARG A 112 -10.886 21.360 2.367 1.00 0.00 N ATOM 0 H ARG A 112 -10.870 16.192 0.457 1.00 0.00 H new ATOM 0 HA ARG A 112 -9.698 15.518 -2.087 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -9.062 18.004 -2.436 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -10.658 17.485 -2.939 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -11.359 19.306 -1.787 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -11.215 18.259 -0.389 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -8.848 19.062 -0.080 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -9.079 20.171 -1.418 1.00 0.00 H new ATOM 0 HE ARG A 112 -10.471 21.531 -0.079 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -9.568 18.538 1.559 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -10.115 19.102 3.141 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -11.168 22.250 1.956 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -11.017 21.195 3.365 1.00 0.00 H new ATOM 1725 N TRP A 113 -7.510 16.975 -1.080 1.00 0.00 N ATOM 1726 CA TRP A 113 -6.223 17.123 -0.418 1.00 0.00 C ATOM 1727 C TRP A 113 -5.977 18.556 -0.005 1.00 0.00 C ATOM 1728 O TRP A 113 -6.556 19.490 -0.554 1.00 0.00 O ATOM 1729 CB TRP A 113 -5.060 16.781 -1.340 1.00 0.00 C ATOM 1730 CG TRP A 113 -5.071 15.434 -1.969 1.00 0.00 C ATOM 1731 CD1 TRP A 113 -5.896 14.378 -1.717 1.00 0.00 C ATOM 1732 CD2 TRP A 113 -4.169 15.016 -2.984 1.00 0.00 C ATOM 1733 NE1 TRP A 113 -5.553 13.320 -2.529 1.00 0.00 N ATOM 1734 CE2 TRP A 113 -4.489 13.691 -3.316 1.00 0.00 C ATOM 1735 CE3 TRP A 113 -3.115 15.653 -3.644 1.00 0.00 C ATOM 1736 CZ2 TRP A 113 -3.787 12.981 -4.287 1.00 0.00 C ATOM 1737 CZ3 TRP A 113 -2.419 14.950 -4.609 1.00 0.00 C ATOM 1738 CH2 TRP A 113 -2.757 13.625 -4.923 1.00 0.00 C ATOM 0 H TRP A 113 -7.541 17.373 -2.019 1.00 0.00 H new ATOM 0 HA TRP A 113 -6.268 16.448 0.437 1.00 0.00 H new ATOM 0 HB2 TRP A 113 -5.028 17.526 -2.135 1.00 0.00 H new ATOM 0 HB3 TRP A 113 -4.136 16.882 -0.771 1.00 0.00 H new ATOM 0 HD1 TRP A 113 -6.696 14.372 -0.992 1.00 0.00 H new ATOM 0 HE1 TRP A 113 -6.013 12.410 -2.544 1.00 0.00 H new ATOM 0 HE3 TRP A 113 -2.850 16.672 -3.405 1.00 0.00 H new ATOM 0 HZ2 TRP A 113 -4.044 11.961 -4.530 1.00 0.00 H new ATOM 0 HZ3 TRP A 113 -1.602 15.428 -5.129 1.00 0.00 H new ATOM 0 HH2 TRP A 113 -2.194 13.101 -5.682 1.00 0.00 H new ATOM 1749 N ASN A 114 -5.038 18.714 0.903 1.00 0.00 N ATOM 1750 CA ASN A 114 -4.609 20.018 1.332 1.00 0.00 C ATOM 1751 C ASN A 114 -3.087 20.030 1.333 1.00 0.00 C ATOM 1752 O ASN A 114 -2.450 19.240 2.030 1.00 0.00 O ATOM 1753 CB ASN A 114 -5.151 20.340 2.726 1.00 0.00 C ATOM 1754 CG ASN A 114 -6.661 20.480 2.742 1.00 0.00 C ATOM 1755 OD1 ASN A 114 -7.352 19.780 3.483 1.00 0.00 O ATOM 1756 ND2 ASN A 114 -7.181 21.386 1.922 1.00 0.00 N ATOM 0 H ASN A 114 -4.555 17.941 1.361 1.00 0.00 H new ATOM 0 HA ASN A 114 -4.993 20.779 0.653 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -4.855 19.552 3.419 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -4.699 21.265 3.083 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -8.191 21.524 1.889 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -6.570 21.944 1.325 1.00 0.00 H new ATOM 1763 N ASP A 115 -2.514 20.914 0.535 1.00 0.00 N ATOM 1764 CA ASP A 115 -1.069 21.019 0.420 1.00 0.00 C ATOM 1765 C ASP A 115 -0.491 21.956 1.474 1.00 0.00 C ATOM 1766 O ASP A 115 -0.827 23.139 1.521 1.00 0.00 O ATOM 1767 CB ASP A 115 -0.703 21.509 -0.976 1.00 0.00 C ATOM 1768 CG ASP A 115 0.796 21.532 -1.192 1.00 0.00 C ATOM 1769 OD1 ASP A 115 1.400 20.444 -1.292 1.00 0.00 O ATOM 1770 OD2 ASP A 115 1.368 22.640 -1.255 1.00 0.00 O ATOM 0 H ASP A 115 -3.031 21.574 -0.047 1.00 0.00 H new ATOM 0 HA ASP A 115 -0.640 20.031 0.586 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -1.167 20.863 -1.721 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -1.107 22.510 -1.127 1.00 0.00 H new ATOM 1775 N ALA A 116 0.389 21.417 2.313 1.00 0.00 N ATOM 1776 CA ALA A 116 1.026 22.197 3.362 1.00 0.00 C ATOM 1777 C ALA A 116 2.333 21.548 3.790 1.00 0.00 C ATOM 1778 O ALA A 116 2.551 20.367 3.534 1.00 0.00 O ATOM 1779 CB ALA A 116 0.090 22.351 4.553 1.00 0.00 C ATOM 0 H ALA A 116 0.676 20.439 2.284 1.00 0.00 H new ATOM 0 HA ALA A 116 1.248 23.189 2.968 1.00 0.00 H new ATOM 0 HB1 ALA A 116 0.582 22.937 5.329 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -0.821 22.860 4.237 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -0.162 21.367 4.947 1.00 0.00 H new ATOM 1785 N PHE A 117 3.197 22.321 4.445 1.00 0.00 N ATOM 1786 CA PHE A 117 4.482 21.807 4.913 1.00 0.00 C ATOM 1787 C PHE A 117 4.343 20.362 5.372 1.00 0.00 C ATOM 1788 O PHE A 117 4.864 19.445 4.740 1.00 0.00 O ATOM 1789 CB PHE A 117 5.011 22.665 6.062 1.00 0.00 C ATOM 1790 CG PHE A 117 6.481 22.952 5.970 1.00 0.00 C ATOM 1791 CD1 PHE A 117 6.943 24.045 5.256 1.00 0.00 C ATOM 1792 CD2 PHE A 117 7.400 22.128 6.598 1.00 0.00 C ATOM 1793 CE1 PHE A 117 8.297 24.312 5.171 1.00 0.00 C ATOM 1794 CE2 PHE A 117 8.755 22.389 6.516 1.00 0.00 C ATOM 1795 CZ PHE A 117 9.203 23.483 5.801 1.00 0.00 C ATOM 0 H PHE A 117 3.031 23.303 4.663 1.00 0.00 H new ATOM 0 HA PHE A 117 5.189 21.848 4.084 1.00 0.00 H new ATOM 0 HB2 PHE A 117 4.466 23.609 6.081 1.00 0.00 H new ATOM 0 HB3 PHE A 117 4.806 22.160 7.006 1.00 0.00 H new ATOM 0 HD1 PHE A 117 6.238 24.696 4.760 1.00 0.00 H new ATOM 0 HD2 PHE A 117 7.054 21.272 7.158 1.00 0.00 H new ATOM 0 HE1 PHE A 117 8.645 25.168 4.612 1.00 0.00 H new ATOM 0 HE2 PHE A 117 9.462 21.739 7.010 1.00 0.00 H new ATOM 0 HZ PHE A 117 10.261 23.689 5.735 1.00 0.00 H new ATOM 1805 N CYS A 118 3.613 20.180 6.466 1.00 0.00 N ATOM 1806 CA CYS A 118 3.360 18.857 7.029 1.00 0.00 C ATOM 1807 C CYS A 118 2.592 18.986 8.339 1.00 0.00 C ATOM 1808 O CYS A 118 1.407 18.661 8.404 1.00 0.00 O ATOM 1809 CB CYS A 118 4.671 18.094 7.252 1.00 0.00 C ATOM 1810 SG CYS A 118 5.013 16.811 5.997 1.00 0.00 S ATOM 0 H CYS A 118 3.180 20.942 6.987 1.00 0.00 H new ATOM 0 HA CYS A 118 2.758 18.291 6.318 1.00 0.00 H new ATOM 0 HB2 CYS A 118 5.496 18.806 7.261 1.00 0.00 H new ATOM 0 HB3 CYS A 118 4.643 17.626 8.236 1.00 0.00 H new ATOM 1815 N ASP A 119 3.273 19.478 9.373 1.00 0.00 N ATOM 1816 CA ASP A 119 2.658 19.669 10.685 1.00 0.00 C ATOM 1817 C ASP A 119 1.837 18.453 11.098 1.00 0.00 C ATOM 1818 O ASP A 119 0.649 18.361 10.788 1.00 0.00 O ATOM 1819 CB ASP A 119 1.773 20.917 10.676 1.00 0.00 C ATOM 1820 CG ASP A 119 2.554 22.182 10.975 1.00 0.00 C ATOM 1821 OD1 ASP A 119 2.728 22.504 12.169 1.00 0.00 O ATOM 1822 OD2 ASP A 119 2.991 22.849 10.014 1.00 0.00 O ATOM 0 H ASP A 119 4.254 19.752 9.327 1.00 0.00 H new ATOM 0 HA ASP A 119 3.459 19.799 11.413 1.00 0.00 H new ATOM 0 HB2 ASP A 119 1.293 21.011 9.702 1.00 0.00 H new ATOM 0 HB3 ASP A 119 0.979 20.801 11.413 1.00 0.00 H new ATOM 1827 N ARG A 120 2.480 17.525 11.801 1.00 0.00 N ATOM 1828 CA ARG A 120 1.814 16.310 12.264 1.00 0.00 C ATOM 1829 C ARG A 120 0.431 16.626 12.828 1.00 0.00 C ATOM 1830 O ARG A 120 0.307 17.204 13.908 1.00 0.00 O ATOM 1831 CB ARG A 120 2.666 15.613 13.327 1.00 0.00 C ATOM 1832 CG ARG A 120 2.023 14.360 13.899 1.00 0.00 C ATOM 1833 CD ARG A 120 1.333 14.644 15.222 1.00 0.00 C ATOM 1834 NE ARG A 120 1.162 13.434 16.022 1.00 0.00 N ATOM 1835 CZ ARG A 120 0.893 13.442 17.325 1.00 0.00 C ATOM 1836 NH1 ARG A 120 0.762 14.592 17.972 1.00 0.00 N ATOM 1837 NH2 ARG A 120 0.754 12.299 17.982 1.00 0.00 N ATOM 0 H ARG A 120 3.463 17.591 12.063 1.00 0.00 H new ATOM 0 HA ARG A 120 1.692 15.644 11.410 1.00 0.00 H new ATOM 0 HB2 ARG A 120 3.630 15.350 12.892 1.00 0.00 H new ATOM 0 HB3 ARG A 120 2.863 16.313 14.139 1.00 0.00 H new ATOM 0 HG2 ARG A 120 1.299 13.964 13.187 1.00 0.00 H new ATOM 0 HG3 ARG A 120 2.783 13.592 14.041 1.00 0.00 H new ATOM 0 HD2 ARG A 120 1.916 15.372 15.786 1.00 0.00 H new ATOM 0 HD3 ARG A 120 0.358 15.094 15.033 1.00 0.00 H new ATOM 0 HE ARG A 120 1.254 12.532 15.555 1.00 0.00 H new ATOM 0 HH11 ARG A 120 0.867 15.474 17.471 1.00 0.00 H new ATOM 0 HH12 ARG A 120 0.556 14.595 18.971 1.00 0.00 H new ATOM 0 HH21 ARG A 120 0.853 11.412 17.489 1.00 0.00 H new ATOM 0 HH22 ARG A 120 0.548 12.307 18.981 1.00 0.00 H new ATOM 1851 N LYS A 121 -0.603 16.245 12.087 1.00 0.00 N ATOM 1852 CA LYS A 121 -1.978 16.488 12.507 1.00 0.00 C ATOM 1853 C LYS A 121 -2.918 15.422 11.951 1.00 0.00 C ATOM 1854 O LYS A 121 -4.139 15.572 11.999 1.00 0.00 O ATOM 1855 CB LYS A 121 -2.435 17.874 12.050 1.00 0.00 C ATOM 1856 CG LYS A 121 -2.987 18.736 13.173 1.00 0.00 C ATOM 1857 CD LYS A 121 -4.378 19.251 12.848 1.00 0.00 C ATOM 1858 CE LYS A 121 -5.445 18.514 13.642 1.00 0.00 C ATOM 1859 NZ LYS A 121 -6.467 17.892 12.755 1.00 0.00 N ATOM 0 H LYS A 121 -0.515 15.766 11.191 1.00 0.00 H new ATOM 0 HA LYS A 121 -2.010 16.441 13.596 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -1.594 18.390 11.588 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -3.200 17.760 11.282 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -3.019 18.156 14.096 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -2.318 19.578 13.349 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -4.432 20.318 13.066 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -4.571 19.134 11.782 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -4.975 17.742 14.252 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -5.933 19.208 14.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -7.176 17.399 13.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -6.933 18.631 12.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -6.006 17.210 12.119 1.00 0.00 H new ATOM 1872 N LEU A 122 -2.342 14.345 11.424 1.00 0.00 N ATOM 1873 CA LEU A 122 -3.130 13.255 10.861 1.00 0.00 C ATOM 1874 C LEU A 122 -3.290 12.127 11.874 1.00 0.00 C ATOM 1875 O LEU A 122 -3.019 12.306 13.061 1.00 0.00 O ATOM 1876 CB LEU A 122 -2.469 12.728 9.586 1.00 0.00 C ATOM 1877 CG LEU A 122 -2.630 13.625 8.357 1.00 0.00 C ATOM 1878 CD1 LEU A 122 -1.364 14.432 8.117 1.00 0.00 C ATOM 1879 CD2 LEU A 122 -2.973 12.792 7.131 1.00 0.00 C ATOM 0 H LEU A 122 -1.333 14.205 11.376 1.00 0.00 H new ATOM 0 HA LEU A 122 -4.120 13.639 10.613 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -1.405 12.587 9.778 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -2.885 11.747 9.358 1.00 0.00 H new ATOM 0 HG LEU A 122 -3.450 14.319 8.542 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -1.496 15.064 7.239 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -1.160 15.057 8.987 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -0.526 13.754 7.953 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -3.084 13.446 6.266 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -2.174 12.075 6.943 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -3.907 12.258 7.304 1.00 0.00 H new ATOM 1891 N GLY A 123 -3.732 10.964 11.402 1.00 0.00 N ATOM 1892 CA GLY A 123 -3.918 9.832 12.289 1.00 0.00 C ATOM 1893 C GLY A 123 -4.125 8.526 11.546 1.00 0.00 C ATOM 1894 O GLY A 123 -4.639 7.562 12.112 1.00 0.00 O ATOM 0 H GLY A 123 -3.963 10.787 10.424 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -3.048 9.740 12.939 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -4.778 10.018 12.932 1.00 0.00 H new ATOM 1898 N ALA A 124 -3.730 8.492 10.277 1.00 0.00 N ATOM 1899 CA ALA A 124 -3.880 7.289 9.468 1.00 0.00 C ATOM 1900 C ALA A 124 -2.791 7.199 8.405 1.00 0.00 C ATOM 1901 O ALA A 124 -2.556 8.153 7.664 1.00 0.00 O ATOM 1902 CB ALA A 124 -5.256 7.260 8.819 1.00 0.00 C ATOM 0 H ALA A 124 -3.305 9.281 9.789 1.00 0.00 H new ATOM 0 HA ALA A 124 -3.779 6.425 10.125 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -5.356 6.357 8.217 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -6.024 7.267 9.593 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -5.376 8.136 8.181 1.00 0.00 H new ATOM 1908 N TRP A 125 -2.140 6.040 8.323 1.00 0.00 N ATOM 1909 CA TRP A 125 -1.091 5.827 7.337 1.00 0.00 C ATOM 1910 C TRP A 125 -1.616 4.941 6.220 1.00 0.00 C ATOM 1911 O TRP A 125 -2.219 3.896 6.474 1.00 0.00 O ATOM 1912 CB TRP A 125 0.149 5.197 7.979 1.00 0.00 C ATOM 1913 CG TRP A 125 -0.145 3.960 8.771 1.00 0.00 C ATOM 1914 CD1 TRP A 125 -0.679 3.899 10.023 1.00 0.00 C ATOM 1915 CD2 TRP A 125 0.087 2.606 8.366 1.00 0.00 C ATOM 1916 NE1 TRP A 125 -0.801 2.590 10.422 1.00 0.00 N ATOM 1917 CE2 TRP A 125 -0.335 1.777 9.422 1.00 0.00 C ATOM 1918 CE3 TRP A 125 0.609 2.013 7.212 1.00 0.00 C ATOM 1919 CZ2 TRP A 125 -0.252 0.388 9.359 1.00 0.00 C ATOM 1920 CZ3 TRP A 125 0.691 0.635 7.151 1.00 0.00 C ATOM 1921 CH2 TRP A 125 0.262 -0.165 8.219 1.00 0.00 C ATOM 0 H TRP A 125 -2.322 5.238 8.927 1.00 0.00 H new ATOM 0 HA TRP A 125 -0.798 6.793 6.925 1.00 0.00 H new ATOM 0 HB2 TRP A 125 0.868 4.954 7.197 1.00 0.00 H new ATOM 0 HB3 TRP A 125 0.622 5.931 8.631 1.00 0.00 H new ATOM 0 HD1 TRP A 125 -0.965 4.755 10.616 1.00 0.00 H new ATOM 0 HE1 TRP A 125 -1.177 2.275 11.316 1.00 0.00 H new ATOM 0 HE3 TRP A 125 0.942 2.621 6.384 1.00 0.00 H new ATOM 0 HZ2 TRP A 125 -0.582 -0.230 10.181 1.00 0.00 H new ATOM 0 HZ3 TRP A 125 1.093 0.166 6.265 1.00 0.00 H new ATOM 0 HH2 TRP A 125 0.339 -1.239 8.140 1.00 0.00 H new ATOM 1932 N VAL A 126 -1.412 5.370 4.982 1.00 0.00 N ATOM 1933 CA VAL A 126 -1.899 4.611 3.848 1.00 0.00 C ATOM 1934 C VAL A 126 -0.833 4.420 2.774 1.00 0.00 C ATOM 1935 O VAL A 126 -0.201 5.373 2.318 1.00 0.00 O ATOM 1936 CB VAL A 126 -3.142 5.280 3.228 1.00 0.00 C ATOM 1937 CG1 VAL A 126 -3.105 6.785 3.436 1.00 0.00 C ATOM 1938 CG2 VAL A 126 -3.260 4.944 1.753 1.00 0.00 C ATOM 0 H VAL A 126 -0.918 6.230 4.743 1.00 0.00 H new ATOM 0 HA VAL A 126 -2.169 3.627 4.231 1.00 0.00 H new ATOM 0 HB VAL A 126 -4.024 4.888 3.735 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -3.992 7.236 2.990 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -3.084 7.004 4.503 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -2.213 7.196 2.963 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -4.145 5.428 1.339 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -2.373 5.298 1.227 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -3.347 3.864 1.632 1.00 0.00 H new ATOM 1948 N CYS A 127 -0.677 3.171 2.367 1.00 0.00 N ATOM 1949 CA CYS A 127 0.264 2.784 1.325 1.00 0.00 C ATOM 1950 C CYS A 127 -0.389 1.719 0.457 1.00 0.00 C ATOM 1951 O CYS A 127 -1.385 1.120 0.860 1.00 0.00 O ATOM 1952 CB CYS A 127 1.571 2.256 1.913 1.00 0.00 C ATOM 1953 SG CYS A 127 2.423 3.420 3.020 1.00 0.00 S ATOM 0 H CYS A 127 -1.205 2.388 2.754 1.00 0.00 H new ATOM 0 HA CYS A 127 0.511 3.662 0.729 1.00 0.00 H new ATOM 0 HB2 CYS A 127 1.363 1.338 2.462 1.00 0.00 H new ATOM 0 HB3 CYS A 127 2.243 1.993 1.096 1.00 0.00 H new ATOM 1958 N ASP A 128 0.152 1.481 -0.725 1.00 0.00 N ATOM 1959 CA ASP A 128 -0.418 0.483 -1.611 1.00 0.00 C ATOM 1960 C ASP A 128 0.631 -0.523 -2.053 1.00 0.00 C ATOM 1961 O ASP A 128 1.793 -0.183 -2.254 1.00 0.00 O ATOM 1962 CB ASP A 128 -1.051 1.151 -2.833 1.00 0.00 C ATOM 1963 CG ASP A 128 -0.185 2.257 -3.406 1.00 0.00 C ATOM 1964 OD1 ASP A 128 1.051 2.192 -3.241 1.00 0.00 O ATOM 1965 OD2 ASP A 128 -0.745 3.189 -4.022 1.00 0.00 O ATOM 0 H ASP A 128 0.976 1.959 -1.090 1.00 0.00 H new ATOM 0 HA ASP A 128 -1.191 -0.051 -1.058 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -1.230 0.399 -3.602 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -2.022 1.561 -2.556 1.00 0.00 H new ATOM 1970 N ARG A 129 0.196 -1.763 -2.207 1.00 0.00 N ATOM 1971 CA ARG A 129 1.073 -2.847 -2.626 1.00 0.00 C ATOM 1972 C ARG A 129 0.300 -3.861 -3.456 1.00 0.00 C ATOM 1973 O ARG A 129 -0.895 -4.067 -3.245 1.00 0.00 O ATOM 1974 CB ARG A 129 1.691 -3.535 -1.406 1.00 0.00 C ATOM 1975 CG ARG A 129 0.663 -4.132 -0.459 1.00 0.00 C ATOM 1976 CD ARG A 129 1.325 -4.772 0.750 1.00 0.00 C ATOM 1977 NE ARG A 129 1.227 -6.228 0.721 1.00 0.00 N ATOM 1978 CZ ARG A 129 1.018 -6.975 1.801 1.00 0.00 C ATOM 1979 NH1 ARG A 129 0.883 -6.405 2.991 1.00 0.00 N ATOM 1980 NH2 ARG A 129 0.942 -8.294 1.692 1.00 0.00 N ATOM 0 H ARG A 129 -0.770 -2.047 -2.046 1.00 0.00 H new ATOM 0 HA ARG A 129 1.873 -2.427 -3.236 1.00 0.00 H new ATOM 0 HB2 ARG A 129 2.362 -4.324 -1.745 1.00 0.00 H new ATOM 0 HB3 ARG A 129 2.299 -2.813 -0.861 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -0.025 -3.353 -0.129 1.00 0.00 H new ATOM 0 HG3 ARG A 129 0.070 -4.878 -0.988 1.00 0.00 H new ATOM 0 HD2 ARG A 129 2.375 -4.480 0.785 1.00 0.00 H new ATOM 0 HD3 ARG A 129 0.859 -4.395 1.660 1.00 0.00 H new ATOM 0 HE ARG A 129 1.324 -6.699 -0.178 1.00 0.00 H new ATOM 0 HH11 ARG A 129 0.939 -5.390 3.080 1.00 0.00 H new ATOM 0 HH12 ARG A 129 0.723 -6.981 3.817 1.00 0.00 H new ATOM 0 HH21 ARG A 129 1.044 -8.737 0.779 1.00 0.00 H new ATOM 0 HH22 ARG A 129 0.782 -8.866 2.521 1.00 0.00 H new ATOM 1994 N LEU A 130 0.984 -4.490 -4.401 1.00 0.00 N ATOM 1995 CA LEU A 130 0.350 -5.479 -5.264 1.00 0.00 C ATOM 1996 C LEU A 130 0.156 -6.801 -4.532 1.00 0.00 C ATOM 1997 O LEU A 130 1.072 -7.306 -3.881 1.00 0.00 O ATOM 1998 CB LEU A 130 1.183 -5.692 -6.529 1.00 0.00 C ATOM 1999 CG LEU A 130 1.790 -4.420 -7.126 1.00 0.00 C ATOM 2000 CD1 LEU A 130 2.444 -4.718 -8.465 1.00 0.00 C ATOM 2001 CD2 LEU A 130 0.729 -3.337 -7.277 1.00 0.00 C ATOM 0 H LEU A 130 1.974 -4.335 -4.590 1.00 0.00 H new ATOM 0 HA LEU A 130 -0.632 -5.100 -5.547 1.00 0.00 H new ATOM 0 HB2 LEU A 130 1.989 -6.389 -6.302 1.00 0.00 H new ATOM 0 HB3 LEU A 130 0.555 -6.166 -7.284 1.00 0.00 H new ATOM 0 HG LEU A 130 2.557 -4.054 -6.443 1.00 0.00 H new ATOM 0 HD11 LEU A 130 2.870 -3.802 -8.874 1.00 0.00 H new ATOM 0 HD12 LEU A 130 3.235 -5.456 -8.328 1.00 0.00 H new ATOM 0 HD13 LEU A 130 1.697 -5.111 -9.155 1.00 0.00 H new ATOM 0 HD21 LEU A 130 1.181 -2.441 -7.703 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -0.063 -3.693 -7.937 1.00 0.00 H new ATOM 0 HD23 LEU A 130 0.308 -3.101 -6.300 1.00 0.00 H new ATOM 2013 N ALA A 131 -1.046 -7.353 -4.644 1.00 0.00 N ATOM 2014 CA ALA A 131 -1.376 -8.617 -3.993 1.00 0.00 C ATOM 2015 C ALA A 131 -2.468 -9.358 -4.758 1.00 0.00 C ATOM 2016 O ALA A 131 -2.796 -9.001 -5.890 1.00 0.00 O ATOM 2017 CB ALA A 131 -1.810 -8.369 -2.559 1.00 0.00 C ATOM 0 H ALA A 131 -1.811 -6.945 -5.181 1.00 0.00 H new ATOM 0 HA ALA A 131 -0.483 -9.243 -3.989 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -2.054 -9.319 -2.083 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -1.000 -7.886 -2.012 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -2.688 -7.723 -2.551 1.00 0.00 H new ATOM 2023 N THR A 132 -3.029 -10.391 -4.135 1.00 0.00 N ATOM 2024 CA THR A 132 -4.080 -11.176 -4.761 1.00 0.00 C ATOM 2025 C THR A 132 -5.362 -11.140 -3.936 1.00 0.00 C ATOM 2026 O THR A 132 -5.325 -11.193 -2.706 1.00 0.00 O ATOM 2027 CB THR A 132 -3.622 -12.622 -4.955 1.00 0.00 C ATOM 2028 OG1 THR A 132 -3.390 -13.246 -3.705 1.00 0.00 O ATOM 2029 CG2 THR A 132 -2.355 -12.744 -5.773 1.00 0.00 C ATOM 0 H THR A 132 -2.771 -10.701 -3.198 1.00 0.00 H new ATOM 0 HA THR A 132 -4.290 -10.735 -5.736 1.00 0.00 H new ATOM 0 HB THR A 132 -4.432 -13.112 -5.496 1.00 0.00 H new ATOM 0 HG1 THR A 132 -3.099 -14.171 -3.850 1.00 0.00 H new ATOM 0 HG21 THR A 132 -2.086 -13.796 -5.872 1.00 0.00 H new ATOM 0 HG22 THR A 132 -2.518 -12.316 -6.762 1.00 0.00 H new ATOM 0 HG23 THR A 132 -1.547 -12.208 -5.275 1.00 0.00 H new ATOM 2037 N CYS A 133 -6.496 -11.052 -4.626 1.00 0.00 N ATOM 2038 CA CYS A 133 -7.796 -11.010 -3.966 1.00 0.00 C ATOM 2039 C CYS A 133 -8.911 -11.372 -4.941 1.00 0.00 C ATOM 2040 O CYS A 133 -9.677 -12.306 -4.705 1.00 0.00 O ATOM 2041 CB CYS A 133 -8.050 -9.621 -3.380 1.00 0.00 C ATOM 2042 SG CYS A 133 -7.685 -9.485 -1.599 1.00 0.00 S ATOM 0 H CYS A 133 -6.540 -11.008 -5.644 1.00 0.00 H new ATOM 0 HA CYS A 133 -7.789 -11.742 -3.158 1.00 0.00 H new ATOM 0 HB2 CYS A 133 -7.444 -8.894 -3.921 1.00 0.00 H new ATOM 0 HB3 CYS A 133 -9.093 -9.353 -3.547 1.00 0.00 H new ATOM 2047 N THR A 134 -8.992 -10.627 -6.039 1.00 0.00 N ATOM 2048 CA THR A 134 -10.011 -10.868 -7.054 1.00 0.00 C ATOM 2049 C THR A 134 -9.401 -11.522 -8.292 1.00 0.00 C ATOM 2050 O THR A 134 -8.658 -10.882 -9.037 1.00 0.00 O ATOM 2051 CB THR A 134 -10.694 -9.555 -7.441 1.00 0.00 C ATOM 2052 OG1 THR A 134 -10.405 -8.541 -6.494 1.00 0.00 O ATOM 2053 CG2 THR A 134 -12.199 -9.670 -7.545 1.00 0.00 C ATOM 0 H THR A 134 -8.364 -9.851 -6.248 1.00 0.00 H new ATOM 0 HA THR A 134 -10.754 -11.547 -6.635 1.00 0.00 H new ATOM 0 HB THR A 134 -10.297 -9.303 -8.424 1.00 0.00 H new ATOM 0 HG1 THR A 134 -9.725 -7.937 -6.859 1.00 0.00 H new ATOM 0 HG21 THR A 134 -12.619 -8.703 -7.823 1.00 0.00 H new ATOM 0 HG22 THR A 134 -12.456 -10.409 -8.304 1.00 0.00 H new ATOM 0 HG23 THR A 134 -12.607 -9.981 -6.583 1.00 0.00 H new ATOM 2061 N PRO A 135 -9.708 -12.810 -8.530 1.00 0.00 N ATOM 2062 CA PRO A 135 -9.184 -13.544 -9.687 1.00 0.00 C ATOM 2063 C PRO A 135 -9.746 -13.026 -11.008 1.00 0.00 C ATOM 2064 O PRO A 135 -10.955 -13.071 -11.237 1.00 0.00 O ATOM 2065 CB PRO A 135 -9.645 -14.983 -9.438 1.00 0.00 C ATOM 2066 CG PRO A 135 -10.841 -14.852 -8.559 1.00 0.00 C ATOM 2067 CD PRO A 135 -10.587 -13.649 -7.695 1.00 0.00 C ATOM 0 HA PRO A 135 -8.103 -13.439 -9.777 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -9.894 -15.486 -10.372 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -8.863 -15.571 -8.958 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -11.748 -14.724 -9.150 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -10.980 -15.747 -7.952 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -11.513 -13.133 -7.442 1.00 0.00 H new ATOM 0 HD3 PRO A 135 -10.107 -13.923 -6.755 1.00 0.00 H new ATOM 2075 N PRO A 136 -8.872 -12.524 -11.901 1.00 0.00 N ATOM 2076 CA PRO A 136 -9.290 -11.997 -13.203 1.00 0.00 C ATOM 2077 C PRO A 136 -9.677 -13.102 -14.181 1.00 0.00 C ATOM 2078 O PRO A 136 -10.007 -12.834 -15.336 1.00 0.00 O ATOM 2079 CB PRO A 136 -8.048 -11.257 -13.697 1.00 0.00 C ATOM 2080 CG PRO A 136 -6.908 -11.968 -13.052 1.00 0.00 C ATOM 2081 CD PRO A 136 -7.411 -12.430 -11.711 1.00 0.00 C ATOM 0 HA PRO A 136 -10.176 -11.368 -13.123 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -7.972 -11.290 -14.784 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -8.073 -10.205 -13.411 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -6.582 -12.813 -13.658 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -6.049 -11.306 -12.940 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -6.981 -13.391 -11.431 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -7.154 -11.724 -10.922 1.00 0.00 H new ATOM 2089 N ALA A 137 -9.630 -14.345 -13.710 1.00 0.00 N ATOM 2090 CA ALA A 137 -9.974 -15.492 -14.542 1.00 0.00 C ATOM 2091 C ALA A 137 -11.415 -15.403 -15.034 1.00 0.00 C ATOM 2092 O ALA A 137 -12.356 -15.616 -14.269 1.00 0.00 O ATOM 2093 CB ALA A 137 -9.757 -16.785 -13.771 1.00 0.00 C ATOM 0 H ALA A 137 -9.357 -14.583 -12.756 1.00 0.00 H new ATOM 0 HA ALA A 137 -9.320 -15.486 -15.414 1.00 0.00 H new ATOM 0 HB1 ALA A 137 -10.017 -17.634 -14.403 1.00 0.00 H new ATOM 0 HB2 ALA A 137 -8.711 -16.861 -13.475 1.00 0.00 H new ATOM 0 HB3 ALA A 137 -10.387 -16.788 -12.882 1.00 0.00 H new ATOM 2099 N SER A 138 -11.578 -15.087 -16.315 1.00 0.00 N ATOM 2100 CA SER A 138 -12.903 -14.970 -16.911 1.00 0.00 C ATOM 2101 C SER A 138 -12.923 -15.567 -18.314 1.00 0.00 C ATOM 2102 O SER A 138 -13.987 -15.858 -18.861 1.00 0.00 O ATOM 2103 CB SER A 138 -13.335 -13.503 -16.963 1.00 0.00 C ATOM 2104 OG SER A 138 -12.382 -12.715 -17.656 1.00 0.00 O ATOM 0 H SER A 138 -10.808 -14.907 -16.960 1.00 0.00 H new ATOM 0 HA SER A 138 -13.604 -15.526 -16.288 1.00 0.00 H new ATOM 0 HB2 SER A 138 -14.304 -13.423 -17.455 1.00 0.00 H new ATOM 0 HB3 SER A 138 -13.460 -13.121 -15.950 1.00 0.00 H new ATOM 0 HG SER A 138 -11.572 -12.627 -17.111 1.00 0.00 H new ATOM 2110 N GLU A 139 -11.739 -15.748 -18.891 1.00 0.00 N ATOM 2111 CA GLU A 139 -11.617 -16.311 -20.230 1.00 0.00 C ATOM 2112 C GLU A 139 -11.959 -17.797 -20.228 1.00 0.00 C ATOM 2113 O GLU A 139 -11.332 -18.588 -19.523 1.00 0.00 O ATOM 2114 CB GLU A 139 -10.200 -16.103 -20.767 1.00 0.00 C ATOM 2115 CG GLU A 139 -10.113 -15.059 -21.867 1.00 0.00 C ATOM 2116 CD GLU A 139 -8.799 -14.303 -21.852 1.00 0.00 C ATOM 2117 OE1 GLU A 139 -7.739 -14.954 -21.960 1.00 0.00 O ATOM 2118 OE2 GLU A 139 -8.830 -13.060 -21.732 1.00 0.00 O ATOM 0 H GLU A 139 -10.850 -15.512 -18.451 1.00 0.00 H new ATOM 0 HA GLU A 139 -12.323 -15.794 -20.880 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -9.549 -15.807 -19.945 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -9.822 -17.052 -21.148 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -10.237 -15.545 -22.835 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -10.936 -14.352 -21.758 1.00 0.00 H new ATOM 2125 N GLY A 140 -12.960 -18.170 -21.022 1.00 0.00 N ATOM 2126 CA GLY A 140 -13.369 -19.561 -21.097 1.00 0.00 C ATOM 2127 C GLY A 140 -12.303 -20.446 -21.713 1.00 0.00 C ATOM 2128 O GLY A 140 -11.818 -20.172 -22.811 1.00 0.00 O ATOM 0 H GLY A 140 -13.494 -17.534 -21.614 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -13.603 -19.922 -20.096 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -14.284 -19.636 -21.685 1.00 0.00 H new ATOM 2132 N SER A 141 -11.939 -21.510 -21.005 1.00 0.00 N ATOM 2133 CA SER A 141 -10.923 -22.439 -21.487 1.00 0.00 C ATOM 2134 C SER A 141 -11.442 -23.241 -22.676 1.00 0.00 C ATOM 2135 O SER A 141 -12.638 -23.513 -22.781 1.00 0.00 O ATOM 2136 CB SER A 141 -10.495 -23.386 -20.365 1.00 0.00 C ATOM 2137 OG SER A 141 -9.323 -22.918 -19.721 1.00 0.00 O ATOM 0 H SER A 141 -12.332 -21.751 -20.095 1.00 0.00 H new ATOM 0 HA SER A 141 -10.059 -21.859 -21.812 1.00 0.00 H new ATOM 0 HB2 SER A 141 -11.301 -23.480 -19.637 1.00 0.00 H new ATOM 0 HB3 SER A 141 -10.317 -24.381 -20.773 1.00 0.00 H new ATOM 0 HG SER A 141 -9.072 -23.540 -19.007 1.00 0.00 H new ATOM 2143 N ALA A 142 -10.532 -23.618 -23.570 1.00 0.00 N ATOM 2144 CA ALA A 142 -10.897 -24.390 -24.752 1.00 0.00 C ATOM 2145 C ALA A 142 -10.521 -25.859 -24.585 1.00 0.00 C ATOM 2146 O ALA A 142 -9.633 -26.365 -25.272 1.00 0.00 O ATOM 2147 CB ALA A 142 -10.228 -23.807 -25.988 1.00 0.00 C ATOM 0 H ALA A 142 -9.538 -23.401 -23.498 1.00 0.00 H new ATOM 0 HA ALA A 142 -11.978 -24.332 -24.876 1.00 0.00 H new ATOM 0 HB1 ALA A 142 -10.508 -24.392 -26.864 1.00 0.00 H new ATOM 0 HB2 ALA A 142 -10.550 -22.774 -26.123 1.00 0.00 H new ATOM 0 HB3 ALA A 142 -9.146 -23.836 -25.864 1.00 0.00 H new ATOM 2153 N GLU A 143 -11.203 -26.537 -23.669 1.00 0.00 N ATOM 2154 CA GLU A 143 -10.943 -27.949 -23.410 1.00 0.00 C ATOM 2155 C GLU A 143 -11.798 -28.834 -24.312 1.00 0.00 C ATOM 2156 O GLU A 143 -13.037 -28.679 -24.289 1.00 0.00 O ATOM 2157 CB GLU A 143 -11.218 -28.280 -21.943 1.00 0.00 C ATOM 2158 CG GLU A 143 -10.058 -27.951 -21.017 1.00 0.00 C ATOM 2159 CD GLU A 143 -10.315 -28.380 -19.585 1.00 0.00 C ATOM 2160 OE1 GLU A 143 -10.346 -29.603 -19.329 1.00 0.00 O ATOM 2161 OE2 GLU A 143 -10.484 -27.495 -18.722 1.00 0.00 O ATOM 2162 OXT GLU A 143 -11.221 -29.674 -25.035 1.00 0.00 O ATOM 0 H GLU A 143 -11.941 -26.132 -23.093 1.00 0.00 H new ATOM 0 HA GLU A 143 -9.893 -28.145 -23.628 1.00 0.00 H new ATOM 0 HB2 GLU A 143 -12.101 -27.731 -21.615 1.00 0.00 H new ATOM 0 HB3 GLU A 143 -11.452 -29.341 -21.856 1.00 0.00 H new ATOM 0 HG2 GLU A 143 -9.156 -28.441 -21.383 1.00 0.00 H new ATOM 0 HG3 GLU A 143 -9.871 -26.878 -21.043 1.00 0.00 H new TER 2169 GLU A 143