USER MOD reduce.3.24.130724 H: found=0, std=0, add=982, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 983 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 14 TYR OH : rot 117:sc= 1.1 USER MOD Set 1.2: A 115 GLN : amide:sc= -8.56! C(o=-5!,f=-6.9!) USER MOD Set 1.3: A 117 TYR OH : rot 12:sc= 2.47 USER MOD Set 2.1: A 98 ASN : amide:sc= -0.252 X(o=-0.27,f=-0.69) USER MOD Set 2.2: A 100 LYS NZ :NH3+ 164:sc= -0.021 (180deg=0) USER MOD Set 3.1: A 42 GLN : amide:sc= -0.696 X(o=-0.7,f=-0.36) USER MOD Set 3.2: A 84 MET CE :methyl -138:sc=-0.00115 (180deg=0) USER MOD Set 4.1: A 50 LYS NZ :NH3+ 166:sc= 1.18 (180deg=0) USER MOD Set 4.2: A 52 SER OG : rot -115:sc= 0.636 USER MOD Set 4.3: A 57 ASN : amide:sc= -0.0528 K(o=1.8,f=-1.8!) USER MOD Set 5.1: A 46 LYS NZ :NH3+ -123:sc= 1.2 (180deg=-1.29) USER MOD Set 5.2: A 48 THR OG1 : rot 180:sc= 0.14 USER MOD Single : A 1 ALA N :NH3+ -150:sc= 0.0024 (180deg=0) USER MOD Single : A 5 THR OG1 : rot -97:sc= -7.36! USER MOD Single : A 7 LYS NZ :NH3+ 151:sc= 0 (180deg=-0.32) USER MOD Single : A 11 ASN :FLIP amide:sc= 0.729 F(o=0,f=0.73) USER MOD Single : A 13 ASN : amide:sc= -1.53 K(o=-1.5,f=-2.9!) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 MET CE :methyl 178:sc= 0 (180deg=-0.00504) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 MET CE :methyl -170:sc= -6.01! (180deg=-6.76!) USER MOD Single : A 24 ASN : amide:sc=-0.00629 X(o=-0.0063,f=-0.17) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot 79:sc= -6.19! USER MOD Single : A 41 THR OG1 : rot -90:sc= 0.678 USER MOD Single : A 45 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 54 ASN : amide:sc= -0.674 K(o=-0.67,f=-1.5) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot -169:sc= 0.229 USER MOD Single : A 76 THR OG1 : rot -81:sc= 0.405 USER MOD Single : A 79 THR OG1 : rot 180:sc= -0.891 USER MOD Single : A 81 THR OG1 : rot 180:sc= -0.0742 USER MOD Single : A 83 THR OG1 : rot -81:sc= 0.17 USER MOD Single : A 87 ASN : amide:sc= -0.125 X(o=-0.12,f=-0.13) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ -168:sc=-0.00488 (180deg=-0.175) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 116 THR OG1 : rot -53:sc= 0.0315 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 TYR OH : rot 90:sc= -1.24 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 3.404 7.573 3.709 1.00 0.00 N ATOM 2 CA ALA A 1 3.810 8.679 4.528 1.00 0.00 C ATOM 3 C ALA A 1 5.193 9.139 4.001 1.00 0.00 C ATOM 4 O ALA A 1 5.209 10.042 3.199 1.00 0.00 O ATOM 5 CB ALA A 1 3.919 8.157 5.942 1.00 0.00 C ATOM 0 H1 ALA A 1 2.366 7.548 3.648 1.00 0.00 H new ATOM 0 H2 ALA A 1 3.804 7.682 2.755 1.00 0.00 H new ATOM 0 H3 ALA A 1 3.747 6.686 4.129 1.00 0.00 H new ATOM 0 HA ALA A 1 3.113 9.517 4.503 1.00 0.00 H new ATOM 0 HB1 ALA A 1 4.227 8.965 6.606 1.00 0.00 H new ATOM 0 HB2 ALA A 1 2.951 7.772 6.263 1.00 0.00 H new ATOM 0 HB3 ALA A 1 4.658 7.357 5.978 1.00 0.00 H new ATOM 13 N PHE A 2 6.306 8.500 4.474 1.00 0.00 N ATOM 14 CA PHE A 2 7.665 8.870 4.042 1.00 0.00 C ATOM 15 C PHE A 2 7.956 8.420 2.586 1.00 0.00 C ATOM 16 O PHE A 2 8.364 7.326 2.272 1.00 0.00 O ATOM 17 CB PHE A 2 8.838 8.389 4.925 1.00 0.00 C ATOM 18 CG PHE A 2 8.468 7.691 6.198 1.00 0.00 C ATOM 19 CD1 PHE A 2 7.845 6.474 6.291 1.00 0.00 C ATOM 20 CD2 PHE A 2 8.781 8.315 7.413 1.00 0.00 C ATOM 21 CE1 PHE A 2 7.531 5.880 7.500 1.00 0.00 C ATOM 22 CE2 PHE A 2 8.482 7.747 8.637 1.00 0.00 C ATOM 23 CZ PHE A 2 7.854 6.524 8.689 1.00 0.00 C ATOM 0 H PHE A 2 6.276 7.735 5.148 1.00 0.00 H new ATOM 0 HA PHE A 2 7.634 9.956 4.136 1.00 0.00 H new ATOM 0 HB2 PHE A 2 9.458 7.715 4.333 1.00 0.00 H new ATOM 0 HB3 PHE A 2 9.454 9.252 5.175 1.00 0.00 H new ATOM 0 HD1 PHE A 2 7.588 5.955 5.379 1.00 0.00 H new ATOM 0 HD2 PHE A 2 9.274 9.276 7.392 1.00 0.00 H new ATOM 0 HE1 PHE A 2 7.037 4.920 7.520 1.00 0.00 H new ATOM 0 HE2 PHE A 2 8.741 8.262 9.550 1.00 0.00 H new ATOM 0 HZ PHE A 2 7.615 6.071 9.640 1.00 0.00 H new ATOM 33 N ASP A 3 7.735 9.315 1.628 1.00 0.00 N ATOM 34 CA ASP A 3 7.960 9.126 0.174 1.00 0.00 C ATOM 35 C ASP A 3 8.735 10.304 -0.360 1.00 0.00 C ATOM 36 O ASP A 3 8.548 11.379 0.224 1.00 0.00 O ATOM 37 CB ASP A 3 6.691 8.870 -0.647 1.00 0.00 C ATOM 38 CG ASP A 3 5.843 7.877 0.113 1.00 0.00 C ATOM 39 OD1 ASP A 3 6.022 6.653 0.096 1.00 0.00 O ATOM 40 OD2 ASP A 3 4.901 8.449 0.789 1.00 0.00 O ATOM 0 H ASP A 3 7.375 10.245 1.842 1.00 0.00 H new ATOM 0 HA ASP A 3 8.536 8.208 0.062 1.00 0.00 H new ATOM 0 HB2 ASP A 3 6.143 9.799 -0.804 1.00 0.00 H new ATOM 0 HB3 ASP A 3 6.946 8.480 -1.632 1.00 0.00 H new ATOM 45 N GLY A 4 9.566 10.108 -1.381 1.00 0.00 N ATOM 46 CA GLY A 4 10.285 11.286 -1.774 1.00 0.00 C ATOM 47 C GLY A 4 11.608 11.611 -1.044 1.00 0.00 C ATOM 48 O GLY A 4 12.296 10.730 -0.585 1.00 0.00 O ATOM 0 H GLY A 4 9.739 9.244 -1.894 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.504 11.203 -2.839 1.00 0.00 H new ATOM 0 HA3 GLY A 4 9.618 12.140 -1.651 1.00 0.00 H new ATOM 52 N THR A 5 11.799 12.910 -1.015 1.00 0.00 N ATOM 53 CA THR A 5 12.820 13.655 -0.372 1.00 0.00 C ATOM 54 C THR A 5 12.339 13.964 1.014 1.00 0.00 C ATOM 55 O THR A 5 11.180 13.712 1.284 1.00 0.00 O ATOM 56 CB THR A 5 13.102 14.929 -1.211 1.00 0.00 C ATOM 57 OG1 THR A 5 11.772 15.489 -1.180 1.00 0.00 O ATOM 58 CG2 THR A 5 13.523 14.520 -2.599 1.00 0.00 C ATOM 0 H THR A 5 11.155 13.530 -1.506 1.00 0.00 H new ATOM 0 HA THR A 5 13.759 13.106 -0.296 1.00 0.00 H new ATOM 0 HB THR A 5 13.888 15.602 -0.869 1.00 0.00 H new ATOM 0 HG1 THR A 5 11.296 15.247 -2.001 1.00 0.00 H new ATOM 0 HG21 THR A 5 13.723 15.410 -3.196 1.00 0.00 H new ATOM 0 HG22 THR A 5 14.425 13.911 -2.541 1.00 0.00 H new ATOM 0 HG23 THR A 5 12.725 13.942 -3.066 1.00 0.00 H new ATOM 66 N TRP A 6 13.301 14.471 1.722 1.00 0.00 N ATOM 67 CA TRP A 6 13.170 14.766 3.122 1.00 0.00 C ATOM 68 C TRP A 6 14.559 15.165 3.614 1.00 0.00 C ATOM 69 O TRP A 6 15.450 14.794 2.885 1.00 0.00 O ATOM 70 CB TRP A 6 13.045 13.304 3.659 1.00 0.00 C ATOM 71 CG TRP A 6 11.650 12.813 3.691 1.00 0.00 C ATOM 72 CD1 TRP A 6 11.284 11.520 3.460 1.00 0.00 C ATOM 73 CD2 TRP A 6 10.450 13.545 3.900 1.00 0.00 C ATOM 74 NE1 TRP A 6 9.936 11.364 3.494 1.00 0.00 N ATOM 75 CE2 TRP A 6 9.412 12.589 3.752 1.00 0.00 C ATOM 76 CE3 TRP A 6 10.049 14.842 4.176 1.00 0.00 C ATOM 77 CZ2 TRP A 6 8.059 12.899 3.853 1.00 0.00 C ATOM 78 CZ3 TRP A 6 8.702 15.145 4.287 1.00 0.00 C ATOM 79 CH2 TRP A 6 7.723 14.178 4.123 1.00 0.00 C ATOM 0 H TRP A 6 14.219 14.697 1.338 1.00 0.00 H new ATOM 0 HA TRP A 6 12.404 15.498 3.379 1.00 0.00 H new ATOM 0 HB2 TRP A 6 13.642 12.641 3.033 1.00 0.00 H new ATOM 0 HB3 TRP A 6 13.464 13.256 4.664 1.00 0.00 H new ATOM 0 HD1 TRP A 6 11.982 10.717 3.273 1.00 0.00 H new ATOM 0 HE1 TRP A 6 9.418 10.496 3.353 1.00 0.00 H new ATOM 0 HE3 TRP A 6 10.788 15.619 4.305 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 7.302 12.140 3.720 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 8.407 16.160 4.507 1.00 0.00 H new ATOM 0 HH2 TRP A 6 6.682 14.450 4.212 1.00 0.00 H new ATOM 90 N LYS A 7 14.769 15.775 4.748 1.00 0.00 N ATOM 91 CA LYS A 7 16.153 16.180 5.089 1.00 0.00 C ATOM 92 C LYS A 7 16.229 16.248 6.578 1.00 0.00 C ATOM 93 O LYS A 7 15.648 15.387 7.250 1.00 0.00 O ATOM 94 CB LYS A 7 16.391 17.512 4.352 1.00 0.00 C ATOM 95 CG LYS A 7 15.759 17.534 2.992 1.00 0.00 C ATOM 96 CD LYS A 7 16.034 18.642 1.973 1.00 0.00 C ATOM 97 CE LYS A 7 17.532 19.014 1.824 1.00 0.00 C ATOM 98 NZ LYS A 7 17.965 19.167 0.427 1.00 0.00 N ATOM 0 H LYS A 7 14.055 16.005 5.439 1.00 0.00 H new ATOM 0 HA LYS A 7 16.939 15.493 4.777 1.00 0.00 H new ATOM 0 HB2 LYS A 7 15.990 18.331 4.949 1.00 0.00 H new ATOM 0 HB3 LYS A 7 17.463 17.684 4.254 1.00 0.00 H new ATOM 0 HG2 LYS A 7 16.026 16.594 2.509 1.00 0.00 H new ATOM 0 HG3 LYS A 7 14.681 17.516 3.149 1.00 0.00 H new ATOM 0 HD2 LYS A 7 15.651 18.329 1.002 1.00 0.00 H new ATOM 0 HD3 LYS A 7 15.477 19.533 2.263 1.00 0.00 H new ATOM 0 HE2 LYS A 7 17.721 19.945 2.358 1.00 0.00 H new ATOM 0 HE3 LYS A 7 18.138 18.244 2.301 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 18.748 19.850 0.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 18.284 18.248 0.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 17.169 19.512 -0.147 1.00 0.00 H new ATOM 112 N VAL A 8 16.910 17.261 7.068 1.00 0.00 N ATOM 113 CA VAL A 8 17.022 17.502 8.481 1.00 0.00 C ATOM 114 C VAL A 8 17.288 19.004 8.678 1.00 0.00 C ATOM 115 O VAL A 8 18.287 19.394 9.242 1.00 0.00 O ATOM 116 CB VAL A 8 17.905 16.567 9.279 1.00 0.00 C ATOM 117 CG1 VAL A 8 18.063 17.082 10.724 1.00 0.00 C ATOM 118 CG2 VAL A 8 17.418 15.093 9.326 1.00 0.00 C ATOM 0 H VAL A 8 17.403 17.942 6.490 1.00 0.00 H new ATOM 0 HA VAL A 8 16.071 17.234 8.940 1.00 0.00 H new ATOM 0 HB VAL A 8 18.859 16.564 8.751 1.00 0.00 H new ATOM 0 HG11 VAL A 8 18.701 16.399 11.286 1.00 0.00 H new ATOM 0 HG12 VAL A 8 18.517 18.073 10.709 1.00 0.00 H new ATOM 0 HG13 VAL A 8 17.084 17.138 11.199 1.00 0.00 H new ATOM 0 HG21 VAL A 8 18.113 14.499 9.919 1.00 0.00 H new ATOM 0 HG22 VAL A 8 16.427 15.051 9.778 1.00 0.00 H new ATOM 0 HG23 VAL A 8 17.372 14.693 8.313 1.00 0.00 H new ATOM 128 N ASP A 9 16.323 19.759 8.154 1.00 0.00 N ATOM 129 CA ASP A 9 16.268 21.195 8.147 1.00 0.00 C ATOM 130 C ASP A 9 16.753 21.882 9.436 1.00 0.00 C ATOM 131 O ASP A 9 17.494 22.835 9.370 1.00 0.00 O ATOM 132 CB ASP A 9 14.772 21.566 8.059 1.00 0.00 C ATOM 133 CG ASP A 9 14.405 22.848 7.393 1.00 0.00 C ATOM 134 OD1 ASP A 9 14.874 23.903 7.708 1.00 0.00 O ATOM 135 OD2 ASP A 9 13.526 22.670 6.432 1.00 0.00 O ATOM 0 H ASP A 9 15.512 19.343 7.696 1.00 0.00 H new ATOM 0 HA ASP A 9 16.910 21.521 7.328 1.00 0.00 H new ATOM 0 HB2 ASP A 9 14.259 20.759 7.536 1.00 0.00 H new ATOM 0 HB3 ASP A 9 14.374 21.591 9.074 1.00 0.00 H new ATOM 140 N ARG A 10 16.242 21.323 10.504 1.00 0.00 N ATOM 141 CA ARG A 10 16.577 21.916 11.740 1.00 0.00 C ATOM 142 C ARG A 10 17.122 20.901 12.685 1.00 0.00 C ATOM 143 O ARG A 10 17.217 19.712 12.291 1.00 0.00 O ATOM 144 CB ARG A 10 15.353 22.671 12.250 1.00 0.00 C ATOM 145 CG ARG A 10 14.043 22.433 11.507 1.00 0.00 C ATOM 146 CD ARG A 10 13.742 23.537 10.496 1.00 0.00 C ATOM 147 NE ARG A 10 13.054 24.661 11.132 1.00 0.00 N ATOM 148 CZ ARG A 10 12.963 25.902 10.582 1.00 0.00 C ATOM 149 NH1 ARG A 10 13.535 26.119 9.407 1.00 0.00 N ATOM 150 NH2 ARG A 10 12.321 26.875 11.206 1.00 0.00 N ATOM 0 H ARG A 10 15.630 20.507 10.533 1.00 0.00 H new ATOM 0 HA ARG A 10 17.383 22.642 11.629 1.00 0.00 H new ATOM 0 HB2 ARG A 10 15.203 22.408 13.297 1.00 0.00 H new ATOM 0 HB3 ARG A 10 15.574 23.738 12.218 1.00 0.00 H new ATOM 0 HG2 ARG A 10 14.089 21.474 10.991 1.00 0.00 H new ATOM 0 HG3 ARG A 10 13.226 22.369 12.226 1.00 0.00 H new ATOM 0 HD2 ARG A 10 14.671 23.884 10.044 1.00 0.00 H new ATOM 0 HD3 ARG A 10 13.126 23.138 9.690 1.00 0.00 H new ATOM 0 HE ARG A 10 12.617 24.505 12.040 1.00 0.00 H new ATOM 0 HH11 ARG A 10 14.031 25.364 8.934 1.00 0.00 H new ATOM 0 HH12 ARG A 10 13.480 27.042 8.975 1.00 0.00 H new ATOM 0 HH21 ARG A 10 11.886 26.700 12.112 1.00 0.00 H new ATOM 0 HH22 ARG A 10 12.261 27.801 10.782 1.00 0.00 H new ATOM 164 N ASN A 11 17.490 21.307 13.889 1.00 0.00 N ATOM 165 CA ASN A 11 18.039 20.279 14.753 1.00 0.00 C ATOM 166 C ASN A 11 17.950 20.601 16.215 1.00 0.00 C ATOM 167 O ASN A 11 18.667 21.500 16.709 1.00 0.00 O ATOM 168 CB ASN A 11 19.505 20.088 14.319 1.00 0.00 C ATOM 169 CG ASN A 11 20.185 21.353 13.858 1.00 0.00 C ATOM 170 OD1 ASN A 11 20.699 21.331 12.640 1.00 0.00 O flip ATOM 171 ND2 ASN A 11 20.274 22.363 14.550 1.00 0.00 N flip ATOM 0 H ASN A 11 17.428 22.253 14.266 1.00 0.00 H new ATOM 0 HA ASN A 11 17.453 19.367 14.642 1.00 0.00 H new ATOM 0 HB2 ASN A 11 20.068 19.670 15.154 1.00 0.00 H new ATOM 0 HB3 ASN A 11 19.541 19.355 13.513 1.00 0.00 H new ATOM 0 HD21 ASN A 11 19.876 22.375 15.489 1.00 0.00 H new ATOM 0 HD22 ASN A 11 20.746 23.191 14.186 1.00 0.00 H new ATOM 178 N GLU A 12 17.071 19.856 16.880 1.00 0.00 N ATOM 179 CA GLU A 12 16.823 19.992 18.322 1.00 0.00 C ATOM 180 C GLU A 12 17.534 18.814 19.021 1.00 0.00 C ATOM 181 O GLU A 12 17.607 17.720 18.503 1.00 0.00 O ATOM 182 CB GLU A 12 15.353 20.017 18.788 1.00 0.00 C ATOM 183 CG GLU A 12 14.873 21.365 19.375 1.00 0.00 C ATOM 184 CD GLU A 12 15.509 21.652 20.725 1.00 0.00 C ATOM 185 OE1 GLU A 12 16.559 22.210 20.891 1.00 0.00 O ATOM 186 OE2 GLU A 12 14.766 21.219 21.710 1.00 0.00 O ATOM 0 H GLU A 12 16.504 19.134 16.435 1.00 0.00 H new ATOM 0 HA GLU A 12 17.203 20.978 18.588 1.00 0.00 H new ATOM 0 HB2 GLU A 12 14.716 19.759 17.942 1.00 0.00 H new ATOM 0 HB3 GLU A 12 15.213 19.241 19.540 1.00 0.00 H new ATOM 0 HG2 GLU A 12 15.115 22.170 18.681 1.00 0.00 H new ATOM 0 HG3 GLU A 12 13.788 21.350 19.480 1.00 0.00 H new ATOM 193 N ASN A 13 18.076 19.035 20.213 1.00 0.00 N ATOM 194 CA ASN A 13 18.797 18.045 21.024 1.00 0.00 C ATOM 195 C ASN A 13 19.852 17.329 20.166 1.00 0.00 C ATOM 196 O ASN A 13 20.243 16.255 20.566 1.00 0.00 O ATOM 197 CB ASN A 13 17.864 17.062 21.745 1.00 0.00 C ATOM 198 CG ASN A 13 17.700 17.342 23.219 1.00 0.00 C ATOM 199 OD1 ASN A 13 18.320 18.230 23.813 1.00 0.00 O ATOM 200 ND2 ASN A 13 16.832 16.595 23.924 1.00 0.00 N ATOM 0 H ASN A 13 18.026 19.948 20.666 1.00 0.00 H new ATOM 0 HA ASN A 13 19.310 18.583 21.821 1.00 0.00 H new ATOM 0 HB2 ASN A 13 16.884 17.091 21.269 1.00 0.00 H new ATOM 0 HB3 ASN A 13 18.250 16.051 21.618 1.00 0.00 H new ATOM 0 HD21 ASN A 13 16.701 16.770 24.920 1.00 0.00 H new ATOM 0 HD22 ASN A 13 16.305 15.854 23.462 1.00 0.00 H new ATOM 207 N TYR A 14 20.225 17.975 19.066 1.00 0.00 N ATOM 208 CA TYR A 14 21.191 17.484 18.104 1.00 0.00 C ATOM 209 C TYR A 14 22.669 17.533 18.459 1.00 0.00 C ATOM 210 O TYR A 14 23.368 16.574 18.174 1.00 0.00 O ATOM 211 CB TYR A 14 20.834 18.185 16.776 1.00 0.00 C ATOM 212 CG TYR A 14 20.971 17.431 15.527 1.00 0.00 C ATOM 213 CD1 TYR A 14 22.199 16.996 15.035 1.00 0.00 C ATOM 214 CD2 TYR A 14 19.842 17.124 14.769 1.00 0.00 C ATOM 215 CE1 TYR A 14 22.246 16.290 13.840 1.00 0.00 C ATOM 216 CE2 TYR A 14 19.873 16.414 13.569 1.00 0.00 C ATOM 217 CZ TYR A 14 21.105 15.990 13.097 1.00 0.00 C ATOM 218 OH TYR A 14 21.175 15.290 11.919 1.00 0.00 O ATOM 0 H TYR A 14 19.846 18.888 18.816 1.00 0.00 H new ATOM 0 HA TYR A 14 21.094 16.399 18.055 1.00 0.00 H new ATOM 0 HB2 TYR A 14 19.800 18.523 16.847 1.00 0.00 H new ATOM 0 HB3 TYR A 14 21.456 19.077 16.695 1.00 0.00 H new ATOM 0 HD1 TYR A 14 23.108 17.206 15.579 1.00 0.00 H new ATOM 0 HD2 TYR A 14 18.882 17.457 15.134 1.00 0.00 H new ATOM 0 HE1 TYR A 14 23.206 15.960 13.471 1.00 0.00 H new ATOM 0 HE2 TYR A 14 18.965 16.201 13.024 1.00 0.00 H new ATOM 0 HH TYR A 14 20.686 14.446 12.011 1.00 0.00 H new ATOM 228 N GLU A 15 23.198 18.577 19.063 1.00 0.00 N ATOM 229 CA GLU A 15 24.613 18.543 19.367 1.00 0.00 C ATOM 230 C GLU A 15 25.016 17.525 20.448 1.00 0.00 C ATOM 231 O GLU A 15 25.989 16.805 20.300 1.00 0.00 O ATOM 232 CB GLU A 15 25.175 19.918 19.811 1.00 0.00 C ATOM 233 CG GLU A 15 24.565 21.110 19.076 1.00 0.00 C ATOM 234 CD GLU A 15 25.555 22.228 18.981 1.00 0.00 C ATOM 235 OE1 GLU A 15 26.426 22.366 19.799 1.00 0.00 O ATOM 236 OE2 GLU A 15 25.342 22.977 17.945 1.00 0.00 O ATOM 0 H GLU A 15 22.699 19.422 19.342 1.00 0.00 H new ATOM 0 HA GLU A 15 25.045 18.239 18.414 1.00 0.00 H new ATOM 0 HB2 GLU A 15 25.005 20.039 20.881 1.00 0.00 H new ATOM 0 HB3 GLU A 15 26.254 19.924 19.657 1.00 0.00 H new ATOM 0 HG2 GLU A 15 24.252 20.807 18.077 1.00 0.00 H new ATOM 0 HG3 GLU A 15 23.672 21.450 19.600 1.00 0.00 H new ATOM 243 N LYS A 16 24.253 17.472 21.537 1.00 0.00 N ATOM 244 CA LYS A 16 24.551 16.530 22.633 1.00 0.00 C ATOM 245 C LYS A 16 24.172 15.121 22.248 1.00 0.00 C ATOM 246 O LYS A 16 24.724 14.126 22.716 1.00 0.00 O ATOM 247 CB LYS A 16 23.912 16.985 23.928 1.00 0.00 C ATOM 248 CG LYS A 16 24.582 16.367 25.154 1.00 0.00 C ATOM 249 CD LYS A 16 24.278 17.282 26.325 1.00 0.00 C ATOM 250 CE LYS A 16 25.295 17.299 27.443 1.00 0.00 C ATOM 251 NZ LYS A 16 24.730 17.860 28.687 1.00 0.00 N ATOM 0 H LYS A 16 23.433 18.058 21.691 1.00 0.00 H new ATOM 0 HA LYS A 16 25.627 16.524 22.808 1.00 0.00 H new ATOM 0 HB2 LYS A 16 23.967 18.071 23.996 1.00 0.00 H new ATOM 0 HB3 LYS A 16 22.855 16.719 23.922 1.00 0.00 H new ATOM 0 HG2 LYS A 16 24.200 15.363 25.338 1.00 0.00 H new ATOM 0 HG3 LYS A 16 25.658 16.277 25.003 1.00 0.00 H new ATOM 0 HD2 LYS A 16 24.169 18.298 25.946 1.00 0.00 H new ATOM 0 HD3 LYS A 16 23.314 16.993 26.744 1.00 0.00 H new ATOM 0 HE2 LYS A 16 25.648 16.285 27.629 1.00 0.00 H new ATOM 0 HE3 LYS A 16 26.161 17.887 27.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 25.456 17.855 29.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 24.416 18.836 28.516 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 23.919 17.284 28.991 1.00 0.00 H new ATOM 265 N PHE A 17 23.187 14.923 21.349 1.00 0.00 N ATOM 266 CA PHE A 17 22.663 13.656 20.839 1.00 0.00 C ATOM 267 C PHE A 17 23.738 12.742 20.199 1.00 0.00 C ATOM 268 O PHE A 17 23.787 11.515 20.322 1.00 0.00 O ATOM 269 CB PHE A 17 21.510 13.898 19.830 1.00 0.00 C ATOM 270 CG PHE A 17 21.433 12.940 18.679 1.00 0.00 C ATOM 271 CD1 PHE A 17 20.867 11.684 18.824 1.00 0.00 C ATOM 272 CD2 PHE A 17 21.957 13.359 17.451 1.00 0.00 C ATOM 273 CE1 PHE A 17 20.839 10.867 17.716 1.00 0.00 C ATOM 274 CE2 PHE A 17 21.917 12.522 16.346 1.00 0.00 C ATOM 275 CZ PHE A 17 21.349 11.250 16.468 1.00 0.00 C ATOM 0 H PHE A 17 22.702 15.717 20.931 1.00 0.00 H new ATOM 0 HA PHE A 17 22.285 13.127 21.714 1.00 0.00 H new ATOM 0 HB2 PHE A 17 20.565 13.860 20.372 1.00 0.00 H new ATOM 0 HB3 PHE A 17 21.609 14.908 19.431 1.00 0.00 H new ATOM 0 HD1 PHE A 17 20.463 11.358 19.771 1.00 0.00 H new ATOM 0 HD2 PHE A 17 22.396 14.342 17.363 1.00 0.00 H new ATOM 0 HE1 PHE A 17 20.403 9.884 17.813 1.00 0.00 H new ATOM 0 HE2 PHE A 17 22.321 12.850 15.400 1.00 0.00 H new ATOM 0 HZ PHE A 17 21.304 10.580 15.622 1.00 0.00 H new ATOM 285 N MET A 18 24.614 13.426 19.493 1.00 0.00 N ATOM 286 CA MET A 18 25.709 12.812 18.810 1.00 0.00 C ATOM 287 C MET A 18 26.809 12.538 19.836 1.00 0.00 C ATOM 288 O MET A 18 27.338 11.456 19.890 1.00 0.00 O ATOM 289 CB MET A 18 26.295 13.857 17.818 1.00 0.00 C ATOM 290 CG MET A 18 25.746 13.594 16.455 1.00 0.00 C ATOM 291 SD MET A 18 26.580 14.544 15.164 1.00 0.00 S ATOM 292 CE MET A 18 25.526 14.035 13.808 1.00 0.00 C ATOM 0 H MET A 18 24.576 14.439 19.382 1.00 0.00 H new ATOM 0 HA MET A 18 25.383 11.902 18.306 1.00 0.00 H new ATOM 0 HB2 MET A 18 26.038 14.866 18.139 1.00 0.00 H new ATOM 0 HB3 MET A 18 27.383 13.794 17.804 1.00 0.00 H new ATOM 0 HG2 MET A 18 25.836 12.531 16.232 1.00 0.00 H new ATOM 0 HG3 MET A 18 24.683 13.833 16.445 1.00 0.00 H new ATOM 0 HE1 MET A 18 25.841 14.538 12.894 1.00 0.00 H new ATOM 0 HE2 MET A 18 25.603 12.956 13.673 1.00 0.00 H new ATOM 0 HE3 MET A 18 24.493 14.300 14.031 1.00 0.00 H new ATOM 302 N GLU A 19 27.076 13.579 20.585 1.00 0.00 N ATOM 303 CA GLU A 19 28.106 13.611 21.603 1.00 0.00 C ATOM 304 C GLU A 19 28.113 12.429 22.563 1.00 0.00 C ATOM 305 O GLU A 19 29.116 11.770 22.789 1.00 0.00 O ATOM 306 CB GLU A 19 27.856 14.829 22.523 1.00 0.00 C ATOM 307 CG GLU A 19 29.152 15.505 22.985 1.00 0.00 C ATOM 308 CD GLU A 19 29.526 16.699 22.156 1.00 0.00 C ATOM 309 OE1 GLU A 19 28.766 17.081 21.293 1.00 0.00 O ATOM 310 OE2 GLU A 19 30.668 17.222 22.454 1.00 0.00 O ATOM 0 H GLU A 19 26.567 14.459 20.503 1.00 0.00 H new ATOM 0 HA GLU A 19 29.040 13.623 21.041 1.00 0.00 H new ATOM 0 HB2 GLU A 19 27.241 15.557 21.994 1.00 0.00 H new ATOM 0 HB3 GLU A 19 27.289 14.508 23.396 1.00 0.00 H new ATOM 0 HG2 GLU A 19 29.042 15.813 24.025 1.00 0.00 H new ATOM 0 HG3 GLU A 19 29.964 14.779 22.952 1.00 0.00 H new ATOM 317 N LYS A 20 26.922 12.225 23.144 1.00 0.00 N ATOM 318 CA LYS A 20 26.777 11.175 24.157 1.00 0.00 C ATOM 319 C LYS A 20 27.003 9.758 23.694 1.00 0.00 C ATOM 320 O LYS A 20 27.490 8.948 24.504 1.00 0.00 O ATOM 321 CB LYS A 20 25.432 11.396 24.865 1.00 0.00 C ATOM 322 CG LYS A 20 25.423 12.664 25.666 1.00 0.00 C ATOM 323 CD LYS A 20 24.321 12.556 26.700 1.00 0.00 C ATOM 324 CE LYS A 20 24.751 12.428 28.118 1.00 0.00 C ATOM 325 NZ LYS A 20 23.700 12.997 28.985 1.00 0.00 N ATOM 0 H LYS A 20 26.074 12.753 22.939 1.00 0.00 H new ATOM 0 HA LYS A 20 27.601 11.280 24.863 1.00 0.00 H new ATOM 0 HB2 LYS A 20 24.633 11.429 24.124 1.00 0.00 H new ATOM 0 HB3 LYS A 20 25.224 10.551 25.521 1.00 0.00 H new ATOM 0 HG2 LYS A 20 26.387 12.815 26.151 1.00 0.00 H new ATOM 0 HG3 LYS A 20 25.254 13.524 25.017 1.00 0.00 H new ATOM 0 HD2 LYS A 20 23.686 13.438 26.615 1.00 0.00 H new ATOM 0 HD3 LYS A 20 23.704 11.693 26.452 1.00 0.00 H new ATOM 0 HE2 LYS A 20 24.921 11.381 28.368 1.00 0.00 H new ATOM 0 HE3 LYS A 20 25.694 12.951 28.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 23.989 12.914 29.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 23.560 14.000 28.748 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 22.810 12.479 28.838 1.00 0.00 H new ATOM 339 N MET A 21 26.681 9.403 22.435 1.00 0.00 N ATOM 340 CA MET A 21 26.920 8.024 21.998 1.00 0.00 C ATOM 341 C MET A 21 28.444 7.733 22.066 1.00 0.00 C ATOM 342 O MET A 21 28.832 6.577 22.158 1.00 0.00 O ATOM 343 CB MET A 21 26.285 7.631 20.672 1.00 0.00 C ATOM 344 CG MET A 21 26.838 8.444 19.482 1.00 0.00 C ATOM 345 SD MET A 21 27.776 7.492 18.299 1.00 0.00 S ATOM 346 CE MET A 21 29.060 6.860 19.364 1.00 0.00 C ATOM 0 H MET A 21 26.274 10.023 21.735 1.00 0.00 H new ATOM 0 HA MET A 21 26.392 7.373 22.695 1.00 0.00 H new ATOM 0 HB2 MET A 21 26.456 6.570 20.492 1.00 0.00 H new ATOM 0 HB3 MET A 21 25.206 7.774 20.734 1.00 0.00 H new ATOM 0 HG2 MET A 21 26.004 8.919 18.966 1.00 0.00 H new ATOM 0 HG3 MET A 21 27.471 9.243 19.868 1.00 0.00 H new ATOM 0 HE1 MET A 21 29.835 6.389 18.759 1.00 0.00 H new ATOM 0 HE2 MET A 21 29.494 7.680 19.936 1.00 0.00 H new ATOM 0 HE3 MET A 21 28.636 6.125 20.048 1.00 0.00 H new ATOM 356 N GLY A 22 29.178 8.852 22.020 1.00 0.00 N ATOM 357 CA GLY A 22 30.643 8.946 22.054 1.00 0.00 C ATOM 358 C GLY A 22 31.257 9.996 21.115 1.00 0.00 C ATOM 359 O GLY A 22 32.491 10.145 21.078 1.00 0.00 O ATOM 0 H GLY A 22 28.739 9.770 21.954 1.00 0.00 H new ATOM 0 HA2 GLY A 22 30.952 9.171 23.075 1.00 0.00 H new ATOM 0 HA3 GLY A 22 31.059 7.970 21.802 1.00 0.00 H new ATOM 363 N ILE A 23 30.461 10.749 20.340 1.00 0.00 N ATOM 364 CA ILE A 23 30.974 11.753 19.428 1.00 0.00 C ATOM 365 C ILE A 23 31.731 12.811 20.213 1.00 0.00 C ATOM 366 O ILE A 23 31.438 13.061 21.377 1.00 0.00 O ATOM 367 CB ILE A 23 29.875 12.442 18.639 1.00 0.00 C ATOM 368 CG1 ILE A 23 29.225 11.542 17.638 1.00 0.00 C ATOM 369 CG2 ILE A 23 30.379 13.722 17.927 1.00 0.00 C ATOM 370 CD1 ILE A 23 29.543 10.063 17.854 1.00 0.00 C ATOM 0 H ILE A 23 29.444 10.670 20.337 1.00 0.00 H new ATOM 0 HA ILE A 23 31.626 11.238 18.723 1.00 0.00 H new ATOM 0 HB ILE A 23 29.127 12.721 19.381 1.00 0.00 H new ATOM 0 HG12 ILE A 23 28.145 11.684 17.681 1.00 0.00 H new ATOM 0 HG13 ILE A 23 29.545 11.832 16.637 1.00 0.00 H new ATOM 0 HG21 ILE A 23 29.557 14.179 17.376 1.00 0.00 H new ATOM 0 HG22 ILE A 23 30.755 14.427 18.669 1.00 0.00 H new ATOM 0 HG23 ILE A 23 31.180 13.462 17.235 1.00 0.00 H new ATOM 0 HD11 ILE A 23 29.039 9.468 17.093 1.00 0.00 H new ATOM 0 HD12 ILE A 23 30.620 9.908 17.782 1.00 0.00 H new ATOM 0 HD13 ILE A 23 29.197 9.757 18.841 1.00 0.00 H new ATOM 382 N ASN A 24 32.718 13.426 19.529 1.00 0.00 N ATOM 383 CA ASN A 24 33.544 14.453 20.105 1.00 0.00 C ATOM 384 C ASN A 24 33.467 15.799 19.432 1.00 0.00 C ATOM 385 O ASN A 24 32.757 15.975 18.445 1.00 0.00 O ATOM 386 CB ASN A 24 34.994 14.030 20.347 1.00 0.00 C ATOM 387 CG ASN A 24 35.260 12.548 20.154 1.00 0.00 C ATOM 388 OD1 ASN A 24 34.828 11.729 20.962 1.00 0.00 O ATOM 389 ND2 ASN A 24 35.976 12.236 19.080 1.00 0.00 N ATOM 0 H ASN A 24 32.948 13.208 18.559 1.00 0.00 H new ATOM 0 HA ASN A 24 33.086 14.591 21.084 1.00 0.00 H new ATOM 0 HB2 ASN A 24 35.640 14.593 19.673 1.00 0.00 H new ATOM 0 HB3 ASN A 24 35.275 14.307 21.363 1.00 0.00 H new ATOM 0 HD21 ASN A 24 36.201 11.261 18.882 1.00 0.00 H new ATOM 0 HD22 ASN A 24 36.301 12.972 18.453 1.00 0.00 H new ATOM 396 N VAL A 25 34.224 16.711 20.017 1.00 0.00 N ATOM 397 CA VAL A 25 34.281 18.081 19.508 1.00 0.00 C ATOM 398 C VAL A 25 35.116 18.345 18.267 1.00 0.00 C ATOM 399 O VAL A 25 34.915 19.354 17.585 1.00 0.00 O ATOM 400 CB VAL A 25 34.272 19.172 20.594 1.00 0.00 C ATOM 401 CG1 VAL A 25 33.198 18.745 21.590 1.00 0.00 C ATOM 402 CG2 VAL A 25 35.584 19.239 21.319 1.00 0.00 C ATOM 0 H VAL A 25 34.805 16.536 20.837 1.00 0.00 H new ATOM 0 HA VAL A 25 33.298 18.186 19.048 1.00 0.00 H new ATOM 0 HB VAL A 25 34.089 20.150 20.148 1.00 0.00 H new ATOM 0 HG11 VAL A 25 33.135 19.478 22.394 1.00 0.00 H new ATOM 0 HG12 VAL A 25 32.236 18.681 21.082 1.00 0.00 H new ATOM 0 HG13 VAL A 25 33.454 17.771 22.006 1.00 0.00 H new ATOM 0 HG21 VAL A 25 35.541 20.020 22.078 1.00 0.00 H new ATOM 0 HG22 VAL A 25 35.785 18.280 21.796 1.00 0.00 H new ATOM 0 HG23 VAL A 25 36.380 19.466 20.610 1.00 0.00 H new ATOM 412 N VAL A 26 36.069 17.491 17.899 1.00 0.00 N ATOM 413 CA VAL A 26 36.908 17.652 16.712 1.00 0.00 C ATOM 414 C VAL A 26 36.073 17.618 15.447 1.00 0.00 C ATOM 415 O VAL A 26 36.425 18.176 14.397 1.00 0.00 O ATOM 416 CB VAL A 26 38.136 16.775 16.681 1.00 0.00 C ATOM 417 CG1 VAL A 26 38.784 16.726 18.065 1.00 0.00 C ATOM 418 CG2 VAL A 26 37.691 15.366 16.355 1.00 0.00 C ATOM 0 H VAL A 26 36.285 16.647 18.430 1.00 0.00 H new ATOM 0 HA VAL A 26 37.343 18.650 16.772 1.00 0.00 H new ATOM 0 HB VAL A 26 38.841 17.169 15.949 1.00 0.00 H new ATOM 0 HG11 VAL A 26 39.669 16.090 18.030 1.00 0.00 H new ATOM 0 HG12 VAL A 26 39.072 17.733 18.368 1.00 0.00 H new ATOM 0 HG13 VAL A 26 38.074 16.320 18.785 1.00 0.00 H new ATOM 0 HG21 VAL A 26 38.559 14.708 16.326 1.00 0.00 H new ATOM 0 HG22 VAL A 26 36.997 15.017 17.120 1.00 0.00 H new ATOM 0 HG23 VAL A 26 37.195 15.356 15.384 1.00 0.00 H new ATOM 428 N LYS A 27 34.939 16.924 15.619 1.00 0.00 N ATOM 429 CA LYS A 27 33.937 16.741 14.623 1.00 0.00 C ATOM 430 C LYS A 27 33.074 18.032 14.586 1.00 0.00 C ATOM 431 O LYS A 27 32.492 18.389 13.548 1.00 0.00 O ATOM 432 CB LYS A 27 33.060 15.510 14.817 1.00 0.00 C ATOM 433 CG LYS A 27 31.731 15.469 14.028 1.00 0.00 C ATOM 434 CD LYS A 27 30.407 15.613 14.788 1.00 0.00 C ATOM 435 CE LYS A 27 29.899 17.057 14.958 1.00 0.00 C ATOM 436 NZ LYS A 27 29.322 17.294 16.287 1.00 0.00 N ATOM 0 H LYS A 27 34.709 16.466 16.501 1.00 0.00 H new ATOM 0 HA LYS A 27 34.443 16.562 13.674 1.00 0.00 H new ATOM 0 HB2 LYS A 27 33.644 14.631 14.545 1.00 0.00 H new ATOM 0 HB3 LYS A 27 32.828 15.422 15.878 1.00 0.00 H new ATOM 0 HG2 LYS A 27 31.768 16.261 13.280 1.00 0.00 H new ATOM 0 HG3 LYS A 27 31.699 14.523 13.488 1.00 0.00 H new ATOM 0 HD2 LYS A 27 29.643 15.036 14.267 1.00 0.00 H new ATOM 0 HD3 LYS A 27 30.524 15.168 15.776 1.00 0.00 H new ATOM 0 HE2 LYS A 27 30.723 17.751 14.794 1.00 0.00 H new ATOM 0 HE3 LYS A 27 29.148 17.267 14.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 28.995 18.279 16.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 28.518 16.651 16.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 30.044 17.120 17.015 1.00 0.00 H new ATOM 595 N LYS A 37 19.216 15.612 3.042 1.00 0.00 N ATOM 596 CA LYS A 37 18.234 14.827 2.354 1.00 0.00 C ATOM 597 C LYS A 37 18.355 13.343 2.625 1.00 0.00 C ATOM 598 O LYS A 37 18.902 12.613 1.819 1.00 0.00 O ATOM 599 CB LYS A 37 18.120 15.128 0.871 1.00 0.00 C ATOM 600 CG LYS A 37 16.679 15.239 0.362 1.00 0.00 C ATOM 601 CD LYS A 37 16.668 15.027 -1.132 1.00 0.00 C ATOM 602 CE LYS A 37 17.705 15.908 -1.827 1.00 0.00 C ATOM 603 NZ LYS A 37 17.609 15.834 -3.285 1.00 0.00 N ATOM 0 HA LYS A 37 17.288 15.148 2.790 1.00 0.00 H new ATOM 0 HB2 LYS A 37 18.641 16.062 0.660 1.00 0.00 H new ATOM 0 HB3 LYS A 37 18.632 14.344 0.312 1.00 0.00 H new ATOM 0 HG2 LYS A 37 16.048 14.497 0.852 1.00 0.00 H new ATOM 0 HG3 LYS A 37 16.268 16.218 0.606 1.00 0.00 H new ATOM 0 HD2 LYS A 37 16.871 13.979 -1.354 1.00 0.00 H new ATOM 0 HD3 LYS A 37 15.676 15.250 -1.526 1.00 0.00 H new ATOM 0 HE2 LYS A 37 17.572 16.942 -1.508 1.00 0.00 H new ATOM 0 HE3 LYS A 37 18.704 15.604 -1.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 18.332 16.448 -3.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 17.762 14.853 -3.594 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 16.665 16.149 -3.587 1.00 0.00 H new ATOM 617 N LEU A 38 17.778 12.978 3.785 1.00 0.00 N ATOM 618 CA LEU A 38 17.671 11.605 4.207 1.00 0.00 C ATOM 619 C LEU A 38 16.977 10.968 3.006 1.00 0.00 C ATOM 620 O LEU A 38 17.377 9.847 2.724 1.00 0.00 O ATOM 621 CB LEU A 38 16.577 11.435 5.272 1.00 0.00 C ATOM 622 CG LEU A 38 16.342 10.100 5.929 1.00 0.00 C ATOM 623 CD1 LEU A 38 15.884 9.036 4.965 1.00 0.00 C ATOM 624 CD2 LEU A 38 17.693 9.613 6.455 1.00 0.00 C ATOM 0 H LEU A 38 17.377 13.644 4.445 1.00 0.00 H new ATOM 0 HA LEU A 38 18.636 11.230 4.548 1.00 0.00 H new ATOM 0 HB2 LEU A 38 16.790 12.150 6.067 1.00 0.00 H new ATOM 0 HB3 LEU A 38 15.635 11.737 4.815 1.00 0.00 H new ATOM 0 HG LEU A 38 15.576 10.244 6.691 1.00 0.00 H new ATOM 0 HD11 LEU A 38 15.733 8.099 5.502 1.00 0.00 H new ATOM 0 HD12 LEU A 38 14.947 9.344 4.502 1.00 0.00 H new ATOM 0 HD13 LEU A 38 16.641 8.894 4.193 1.00 0.00 H new ATOM 0 HD21 LEU A 38 17.567 8.645 6.940 1.00 0.00 H new ATOM 0 HD22 LEU A 38 18.393 9.515 5.625 1.00 0.00 H new ATOM 0 HD23 LEU A 38 18.084 10.332 7.175 1.00 0.00 H new ATOM 636 N THR A 39 16.085 11.754 2.484 1.00 0.00 N ATOM 637 CA THR A 39 15.213 11.497 1.320 1.00 0.00 C ATOM 638 C THR A 39 14.618 10.137 1.436 1.00 0.00 C ATOM 639 O THR A 39 15.362 9.181 1.451 1.00 0.00 O ATOM 640 CB THR A 39 16.097 11.537 0.029 1.00 0.00 C ATOM 641 OG1 THR A 39 17.068 12.519 0.290 1.00 0.00 O ATOM 642 CG2 THR A 39 15.331 11.863 -1.244 1.00 0.00 C ATOM 0 H THR A 39 15.914 12.679 2.878 1.00 0.00 H new ATOM 0 HA THR A 39 14.421 12.245 1.277 1.00 0.00 H new ATOM 0 HB THR A 39 16.517 10.550 -0.164 1.00 0.00 H new ATOM 0 HG1 THR A 39 17.768 12.143 0.864 1.00 0.00 H new ATOM 0 HG21 THR A 39 16.018 11.870 -2.090 1.00 0.00 H new ATOM 0 HG22 THR A 39 14.561 11.109 -1.408 1.00 0.00 H new ATOM 0 HG23 THR A 39 14.864 12.843 -1.147 1.00 0.00 H new ATOM 650 N ILE A 40 13.309 9.916 1.495 1.00 0.00 N ATOM 651 CA ILE A 40 12.777 8.552 1.599 1.00 0.00 C ATOM 652 C ILE A 40 11.779 8.149 0.547 1.00 0.00 C ATOM 653 O ILE A 40 10.794 8.831 0.402 1.00 0.00 O ATOM 654 CB ILE A 40 12.084 8.341 2.969 1.00 0.00 C ATOM 655 CG1 ILE A 40 13.064 8.699 4.085 1.00 0.00 C ATOM 656 CG2 ILE A 40 11.525 6.901 3.044 1.00 0.00 C ATOM 657 CD1 ILE A 40 12.419 9.160 5.410 1.00 0.00 C ATOM 0 H ILE A 40 12.601 10.650 1.473 1.00 0.00 H new ATOM 0 HA ILE A 40 13.662 7.930 1.464 1.00 0.00 H new ATOM 0 HB ILE A 40 11.226 9.002 3.093 1.00 0.00 H new ATOM 0 HG12 ILE A 40 13.690 7.830 4.288 1.00 0.00 H new ATOM 0 HG13 ILE A 40 13.723 9.490 3.727 1.00 0.00 H new ATOM 0 HG21 ILE A 40 11.037 6.750 4.007 1.00 0.00 H new ATOM 0 HG22 ILE A 40 10.802 6.749 2.243 1.00 0.00 H new ATOM 0 HG23 ILE A 40 12.342 6.187 2.935 1.00 0.00 H new ATOM 0 HD11 ILE A 40 13.200 9.390 6.135 1.00 0.00 H new ATOM 0 HD12 ILE A 40 11.817 10.051 5.231 1.00 0.00 H new ATOM 0 HD13 ILE A 40 11.784 8.365 5.801 1.00 0.00 H new ATOM 669 N THR A 41 11.950 7.053 -0.184 1.00 0.00 N ATOM 670 CA THR A 41 11.008 6.642 -1.193 1.00 0.00 C ATOM 671 C THR A 41 9.970 5.676 -0.641 1.00 0.00 C ATOM 672 O THR A 41 8.816 6.056 -0.588 1.00 0.00 O ATOM 673 CB THR A 41 11.628 5.943 -2.415 1.00 0.00 C ATOM 674 OG1 THR A 41 12.536 4.972 -2.043 1.00 0.00 O ATOM 675 CG2 THR A 41 12.237 6.976 -3.330 1.00 0.00 C ATOM 0 H THR A 41 12.751 6.430 -0.086 1.00 0.00 H new ATOM 0 HA THR A 41 10.567 7.587 -1.509 1.00 0.00 H new ATOM 0 HB THR A 41 10.841 5.422 -2.961 1.00 0.00 H new ATOM 0 HG1 THR A 41 13.429 5.369 -1.973 1.00 0.00 H new ATOM 0 HG21 THR A 41 12.676 6.481 -4.196 1.00 0.00 H new ATOM 0 HG22 THR A 41 11.464 7.669 -3.662 1.00 0.00 H new ATOM 0 HG23 THR A 41 13.011 7.525 -2.794 1.00 0.00 H new ATOM 683 N GLN A 42 10.464 4.524 -0.307 1.00 0.00 N ATOM 684 CA GLN A 42 9.705 3.418 0.212 1.00 0.00 C ATOM 685 C GLN A 42 9.519 2.433 -0.915 1.00 0.00 C ATOM 686 O GLN A 42 9.157 2.824 -2.017 1.00 0.00 O ATOM 687 CB GLN A 42 8.386 3.900 0.792 1.00 0.00 C ATOM 688 CG GLN A 42 7.661 2.926 1.744 1.00 0.00 C ATOM 689 CD GLN A 42 7.483 3.440 3.167 1.00 0.00 C ATOM 690 OE1 GLN A 42 6.458 3.275 3.898 1.00 0.00 O ATOM 691 NE2 GLN A 42 8.533 4.107 3.614 1.00 0.00 N ATOM 0 H GLN A 42 11.459 4.315 -0.392 1.00 0.00 H new ATOM 0 HA GLN A 42 10.229 2.928 1.033 1.00 0.00 H new ATOM 0 HB2 GLN A 42 8.568 4.831 1.329 1.00 0.00 H new ATOM 0 HB3 GLN A 42 7.714 4.135 -0.034 1.00 0.00 H new ATOM 0 HG2 GLN A 42 6.679 2.698 1.329 1.00 0.00 H new ATOM 0 HG3 GLN A 42 8.218 1.990 1.778 1.00 0.00 H new ATOM 0 HE21 GLN A 42 9.350 4.232 3.016 1.00 0.00 H new ATOM 0 HE22 GLN A 42 8.526 4.496 4.557 1.00 0.00 H new ATOM 700 N GLU A 43 9.773 1.164 -0.665 1.00 0.00 N ATOM 701 CA GLU A 43 9.672 0.134 -1.688 1.00 0.00 C ATOM 702 C GLU A 43 9.310 -1.141 -0.976 1.00 0.00 C ATOM 703 O GLU A 43 10.230 -1.776 -0.491 1.00 0.00 O ATOM 704 CB GLU A 43 11.003 0.077 -2.456 1.00 0.00 C ATOM 705 CG GLU A 43 10.894 0.539 -3.908 1.00 0.00 C ATOM 706 CD GLU A 43 11.211 -0.673 -4.718 1.00 0.00 C ATOM 707 OE1 GLU A 43 10.565 -1.697 -4.663 1.00 0.00 O ATOM 708 OE2 GLU A 43 12.257 -0.494 -5.483 1.00 0.00 O ATOM 0 H GLU A 43 10.055 0.815 0.251 1.00 0.00 H new ATOM 0 HA GLU A 43 8.904 0.329 -2.436 1.00 0.00 H new ATOM 0 HB2 GLU A 43 11.737 0.697 -1.941 1.00 0.00 H new ATOM 0 HB3 GLU A 43 11.380 -0.946 -2.437 1.00 0.00 H new ATOM 0 HG2 GLU A 43 9.895 0.913 -4.130 1.00 0.00 H new ATOM 0 HG3 GLU A 43 11.592 1.349 -4.119 1.00 0.00 H new ATOM 715 N GLY A 44 8.004 -1.452 -0.961 1.00 0.00 N ATOM 716 CA GLY A 44 7.417 -2.633 -0.338 1.00 0.00 C ATOM 717 C GLY A 44 7.780 -2.528 1.132 1.00 0.00 C ATOM 718 O GLY A 44 6.978 -2.096 1.968 1.00 0.00 O ATOM 0 H GLY A 44 7.304 -0.857 -1.404 1.00 0.00 H new ATOM 0 HA2 GLY A 44 6.336 -2.655 -0.476 1.00 0.00 H new ATOM 0 HA3 GLY A 44 7.813 -3.548 -0.777 1.00 0.00 H new ATOM 722 N ASN A 45 9.028 -2.949 1.364 1.00 0.00 N ATOM 723 CA ASN A 45 9.582 -2.928 2.695 1.00 0.00 C ATOM 724 C ASN A 45 10.755 -1.909 2.678 1.00 0.00 C ATOM 725 O ASN A 45 10.614 -0.830 3.211 1.00 0.00 O ATOM 726 CB ASN A 45 10.021 -4.336 3.130 1.00 0.00 C ATOM 727 CG ASN A 45 8.995 -5.431 2.810 1.00 0.00 C ATOM 728 OD1 ASN A 45 9.256 -6.418 2.086 1.00 0.00 O ATOM 729 ND2 ASN A 45 7.823 -5.217 3.380 1.00 0.00 N ATOM 0 H ASN A 45 9.658 -3.303 0.645 1.00 0.00 H new ATOM 0 HA ASN A 45 8.840 -2.618 3.431 1.00 0.00 H new ATOM 0 HB2 ASN A 45 10.964 -4.580 2.640 1.00 0.00 H new ATOM 0 HB3 ASN A 45 10.211 -4.332 4.203 1.00 0.00 H new ATOM 0 HD21 ASN A 45 7.060 -5.880 3.241 1.00 0.00 H new ATOM 0 HD22 ASN A 45 7.681 -4.389 3.959 1.00 0.00 H new ATOM 736 N LYS A 46 11.839 -2.311 2.066 1.00 0.00 N ATOM 737 CA LYS A 46 13.022 -1.459 1.951 1.00 0.00 C ATOM 738 C LYS A 46 12.596 -0.121 1.414 1.00 0.00 C ATOM 739 O LYS A 46 11.485 0.127 0.902 1.00 0.00 O ATOM 740 CB LYS A 46 14.019 -1.978 0.898 1.00 0.00 C ATOM 741 CG LYS A 46 14.479 -1.039 -0.188 1.00 0.00 C ATOM 742 CD LYS A 46 13.429 -0.602 -1.219 1.00 0.00 C ATOM 743 CE LYS A 46 13.751 -1.081 -2.644 1.00 0.00 C ATOM 744 NZ LYS A 46 14.148 -0.070 -3.627 1.00 0.00 N ATOM 0 H LYS A 46 11.939 -3.229 1.632 1.00 0.00 H new ATOM 0 HA LYS A 46 13.479 -1.429 2.940 1.00 0.00 H new ATOM 0 HB2 LYS A 46 14.904 -2.331 1.427 1.00 0.00 H new ATOM 0 HB3 LYS A 46 13.569 -2.846 0.416 1.00 0.00 H new ATOM 0 HG2 LYS A 46 14.882 -0.144 0.286 1.00 0.00 H new ATOM 0 HG3 LYS A 46 15.301 -1.515 -0.722 1.00 0.00 H new ATOM 0 HD2 LYS A 46 12.454 -0.989 -0.923 1.00 0.00 H new ATOM 0 HD3 LYS A 46 13.355 0.485 -1.215 1.00 0.00 H new ATOM 0 HE2 LYS A 46 14.552 -1.817 -2.578 1.00 0.00 H new ATOM 0 HE3 LYS A 46 12.873 -1.599 -3.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 13.505 -0.108 -4.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 14.101 0.874 -3.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 15.121 -0.257 -3.944 1.00 0.00 H new ATOM 758 N PHE A 47 13.571 0.793 1.511 1.00 0.00 N ATOM 759 CA PHE A 47 13.297 2.105 0.962 1.00 0.00 C ATOM 760 C PHE A 47 14.535 2.846 0.499 1.00 0.00 C ATOM 761 O PHE A 47 15.409 3.243 1.227 1.00 0.00 O ATOM 762 CB PHE A 47 12.513 2.968 1.997 1.00 0.00 C ATOM 763 CG PHE A 47 13.203 3.302 3.272 1.00 0.00 C ATOM 764 CD1 PHE A 47 14.402 2.769 3.725 1.00 0.00 C ATOM 765 CD2 PHE A 47 12.608 4.242 4.138 1.00 0.00 C ATOM 766 CE1 PHE A 47 15.010 3.101 4.914 1.00 0.00 C ATOM 767 CE2 PHE A 47 13.178 4.613 5.353 1.00 0.00 C ATOM 768 CZ PHE A 47 14.403 4.042 5.761 1.00 0.00 C ATOM 0 H PHE A 47 14.489 0.656 1.934 1.00 0.00 H new ATOM 0 HA PHE A 47 12.690 1.940 0.072 1.00 0.00 H new ATOM 0 HB2 PHE A 47 12.231 3.902 1.512 1.00 0.00 H new ATOM 0 HB3 PHE A 47 11.589 2.444 2.241 1.00 0.00 H new ATOM 0 HD1 PHE A 47 14.894 2.040 3.098 1.00 0.00 H new ATOM 0 HD2 PHE A 47 11.671 4.693 3.847 1.00 0.00 H new ATOM 0 HE1 PHE A 47 15.947 2.641 5.193 1.00 0.00 H new ATOM 0 HE2 PHE A 47 12.683 5.337 5.983 1.00 0.00 H new ATOM 0 HZ PHE A 47 14.861 4.321 6.699 1.00 0.00 H new ATOM 778 N THR A 48 14.569 3.016 -0.815 1.00 0.00 N ATOM 779 CA THR A 48 15.589 3.669 -1.546 1.00 0.00 C ATOM 780 C THR A 48 15.582 5.019 -0.898 1.00 0.00 C ATOM 781 O THR A 48 14.786 5.902 -1.260 1.00 0.00 O ATOM 782 CB THR A 48 15.333 3.784 -3.081 1.00 0.00 C ATOM 783 OG1 THR A 48 15.489 2.503 -3.634 1.00 0.00 O ATOM 784 CG2 THR A 48 16.255 4.801 -3.768 1.00 0.00 C ATOM 0 H THR A 48 13.823 2.669 -1.418 1.00 0.00 H new ATOM 0 HA THR A 48 16.532 3.124 -1.510 1.00 0.00 H new ATOM 0 HB THR A 48 14.322 4.157 -3.245 1.00 0.00 H new ATOM 0 HG1 THR A 48 15.332 2.543 -4.601 1.00 0.00 H new ATOM 0 HG21 THR A 48 16.029 4.836 -4.834 1.00 0.00 H new ATOM 0 HG22 THR A 48 16.098 5.787 -3.332 1.00 0.00 H new ATOM 0 HG23 THR A 48 17.294 4.503 -3.627 1.00 0.00 H new ATOM 792 N VAL A 49 16.465 5.150 0.050 1.00 0.00 N ATOM 793 CA VAL A 49 16.655 6.357 0.851 1.00 0.00 C ATOM 794 C VAL A 49 17.965 6.916 0.434 1.00 0.00 C ATOM 795 O VAL A 49 18.947 6.203 0.221 1.00 0.00 O ATOM 796 CB VAL A 49 16.735 5.979 2.328 1.00 0.00 C ATOM 797 CG1 VAL A 49 17.972 6.540 2.991 1.00 0.00 C ATOM 798 CG2 VAL A 49 15.479 6.417 3.064 1.00 0.00 C ATOM 0 H VAL A 49 17.104 4.398 0.307 1.00 0.00 H new ATOM 0 HA VAL A 49 15.838 7.065 0.711 1.00 0.00 H new ATOM 0 HB VAL A 49 16.807 4.893 2.381 1.00 0.00 H new ATOM 0 HG11 VAL A 49 17.987 6.246 4.041 1.00 0.00 H new ATOM 0 HG12 VAL A 49 18.860 6.151 2.492 1.00 0.00 H new ATOM 0 HG13 VAL A 49 17.962 7.628 2.919 1.00 0.00 H new ATOM 0 HG21 VAL A 49 15.557 6.138 4.115 1.00 0.00 H new ATOM 0 HG22 VAL A 49 15.368 7.498 2.983 1.00 0.00 H new ATOM 0 HG23 VAL A 49 14.610 5.929 2.623 1.00 0.00 H new ATOM 808 N LYS A 50 18.015 8.210 0.310 1.00 0.00 N ATOM 809 CA LYS A 50 19.242 8.909 -0.081 1.00 0.00 C ATOM 810 C LYS A 50 19.993 9.068 1.183 1.00 0.00 C ATOM 811 O LYS A 50 20.146 8.046 1.856 1.00 0.00 O ATOM 812 CB LYS A 50 18.859 10.263 -0.631 1.00 0.00 C ATOM 813 CG LYS A 50 19.904 10.886 -1.510 1.00 0.00 C ATOM 814 CD LYS A 50 19.420 12.213 -2.036 1.00 0.00 C ATOM 815 CE LYS A 50 20.023 12.384 -3.376 1.00 0.00 C ATOM 816 NZ LYS A 50 21.325 13.055 -3.274 1.00 0.00 N ATOM 0 H LYS A 50 17.218 8.825 0.473 1.00 0.00 H new ATOM 0 HA LYS A 50 19.824 8.383 -0.838 1.00 0.00 H new ATOM 0 HB2 LYS A 50 17.934 10.164 -1.199 1.00 0.00 H new ATOM 0 HB3 LYS A 50 18.652 10.936 0.201 1.00 0.00 H new ATOM 0 HG2 LYS A 50 20.827 11.025 -0.947 1.00 0.00 H new ATOM 0 HG3 LYS A 50 20.135 10.220 -2.341 1.00 0.00 H new ATOM 0 HD2 LYS A 50 18.332 12.232 -2.096 1.00 0.00 H new ATOM 0 HD3 LYS A 50 19.717 13.024 -1.371 1.00 0.00 H new ATOM 0 HE2 LYS A 50 20.145 11.411 -3.853 1.00 0.00 H new ATOM 0 HE3 LYS A 50 19.355 12.968 -4.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 21.837 12.957 -4.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 21.180 14.064 -3.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 21.881 12.620 -2.510 1.00 0.00 H new ATOM 830 N GLU A 51 20.377 10.292 1.421 1.00 0.00 N ATOM 831 CA GLU A 51 21.062 10.766 2.606 1.00 0.00 C ATOM 832 C GLU A 51 22.296 11.476 2.095 1.00 0.00 C ATOM 833 O GLU A 51 23.414 11.107 2.448 1.00 0.00 O ATOM 834 CB GLU A 51 21.568 9.670 3.494 1.00 0.00 C ATOM 835 CG GLU A 51 22.183 10.209 4.785 1.00 0.00 C ATOM 836 CD GLU A 51 21.594 11.532 5.176 1.00 0.00 C ATOM 837 OE1 GLU A 51 21.987 12.501 4.612 1.00 0.00 O ATOM 838 OE2 GLU A 51 20.631 11.577 6.157 1.00 0.00 O ATOM 0 H GLU A 51 20.211 11.041 0.749 1.00 0.00 H new ATOM 0 HA GLU A 51 20.363 11.371 3.184 1.00 0.00 H new ATOM 0 HB2 GLU A 51 20.748 8.995 3.739 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.313 9.084 2.956 1.00 0.00 H new ATOM 0 HG2 GLU A 51 22.027 9.490 5.589 1.00 0.00 H new ATOM 0 HG3 GLU A 51 23.260 10.315 4.657 1.00 0.00 H new ATOM 845 N SER A 52 22.157 12.480 1.282 1.00 0.00 N ATOM 846 CA SER A 52 23.348 13.165 0.808 1.00 0.00 C ATOM 847 C SER A 52 23.607 14.223 1.893 1.00 0.00 C ATOM 848 O SER A 52 23.503 15.393 1.577 1.00 0.00 O ATOM 849 CB SER A 52 23.199 13.820 -0.508 1.00 0.00 C ATOM 850 OG SER A 52 23.166 12.801 -1.490 1.00 0.00 O ATOM 0 H SER A 52 21.269 12.843 0.936 1.00 0.00 H new ATOM 0 HA SER A 52 24.159 12.453 0.656 1.00 0.00 H new ATOM 0 HB2 SER A 52 22.285 14.413 -0.540 1.00 0.00 H new ATOM 0 HB3 SER A 52 24.028 14.503 -0.692 1.00 0.00 H new ATOM 0 HG SER A 52 23.951 12.881 -2.071 1.00 0.00 H new ATOM 856 N SER A 53 23.921 13.718 3.063 1.00 0.00 N ATOM 857 CA SER A 53 24.209 14.480 4.254 1.00 0.00 C ATOM 858 C SER A 53 25.245 15.536 4.004 1.00 0.00 C ATOM 859 O SER A 53 25.739 15.678 2.888 1.00 0.00 O ATOM 860 CB SER A 53 24.699 13.591 5.410 1.00 0.00 C ATOM 861 OG SER A 53 25.791 12.818 4.984 1.00 0.00 O ATOM 0 H SER A 53 23.986 12.712 3.217 1.00 0.00 H new ATOM 0 HA SER A 53 23.266 14.949 4.534 1.00 0.00 H new ATOM 0 HB2 SER A 53 24.989 14.210 6.259 1.00 0.00 H new ATOM 0 HB3 SER A 53 23.892 12.942 5.749 1.00 0.00 H new ATOM 0 HG SER A 53 26.101 12.255 5.723 1.00 0.00 H new ATOM 867 N ASN A 54 25.599 16.307 5.006 1.00 0.00 N ATOM 868 CA ASN A 54 26.590 17.382 4.753 1.00 0.00 C ATOM 869 C ASN A 54 27.891 16.908 4.194 1.00 0.00 C ATOM 870 O ASN A 54 28.831 17.732 4.119 1.00 0.00 O ATOM 871 CB ASN A 54 26.845 18.243 6.026 1.00 0.00 C ATOM 872 CG ASN A 54 27.558 19.543 5.750 1.00 0.00 C ATOM 873 OD1 ASN A 54 27.430 20.112 4.649 1.00 0.00 O ATOM 874 ND2 ASN A 54 28.314 20.041 6.720 1.00 0.00 N ATOM 0 H ASN A 54 25.251 16.236 5.962 1.00 0.00 H new ATOM 0 HA ASN A 54 26.128 17.998 3.981 1.00 0.00 H new ATOM 0 HB2 ASN A 54 25.890 18.458 6.505 1.00 0.00 H new ATOM 0 HB3 ASN A 54 27.433 17.661 6.735 1.00 0.00 H new ATOM 0 HD21 ASN A 54 28.814 20.918 6.577 1.00 0.00 H new ATOM 0 HD22 ASN A 54 28.395 19.547 7.609 1.00 0.00 H new ATOM 881 N PHE A 55 28.079 15.688 3.781 1.00 0.00 N ATOM 882 CA PHE A 55 29.390 15.306 3.256 1.00 0.00 C ATOM 883 C PHE A 55 29.430 14.090 2.439 1.00 0.00 C ATOM 884 O PHE A 55 30.091 14.114 1.421 1.00 0.00 O ATOM 885 CB PHE A 55 30.344 14.883 4.391 1.00 0.00 C ATOM 886 CG PHE A 55 29.984 15.530 5.694 1.00 0.00 C ATOM 887 CD1 PHE A 55 29.077 14.930 6.567 1.00 0.00 C ATOM 888 CD2 PHE A 55 30.566 16.757 6.038 1.00 0.00 C ATOM 889 CE1 PHE A 55 28.717 15.496 7.773 1.00 0.00 C ATOM 890 CE2 PHE A 55 30.225 17.366 7.255 1.00 0.00 C ATOM 891 CZ PHE A 55 29.311 16.727 8.097 1.00 0.00 C ATOM 0 H PHE A 55 27.376 14.949 3.789 1.00 0.00 H new ATOM 0 HA PHE A 55 29.655 16.198 2.687 1.00 0.00 H new ATOM 0 HB2 PHE A 55 30.316 13.799 4.504 1.00 0.00 H new ATOM 0 HB3 PHE A 55 31.367 15.149 4.124 1.00 0.00 H new ATOM 0 HD1 PHE A 55 28.638 13.983 6.288 1.00 0.00 H new ATOM 0 HD2 PHE A 55 31.272 17.230 5.371 1.00 0.00 H new ATOM 0 HE1 PHE A 55 28.012 15.016 8.436 1.00 0.00 H new ATOM 0 HE2 PHE A 55 30.662 18.313 7.536 1.00 0.00 H new ATOM 0 HZ PHE A 55 29.051 17.198 9.033 1.00 0.00 H new ATOM 901 N ARG A 56 28.724 13.074 2.917 1.00 0.00 N ATOM 902 CA ARG A 56 28.679 11.829 2.217 1.00 0.00 C ATOM 903 C ARG A 56 27.474 11.759 1.320 1.00 0.00 C ATOM 904 O ARG A 56 26.460 11.160 1.683 1.00 0.00 O ATOM 905 CB ARG A 56 28.528 10.678 3.222 1.00 0.00 C ATOM 906 CG ARG A 56 28.569 9.334 2.514 1.00 0.00 C ATOM 907 CD ARG A 56 29.431 8.332 3.288 1.00 0.00 C ATOM 908 NE ARG A 56 28.955 8.226 4.668 1.00 0.00 N ATOM 909 CZ ARG A 56 29.694 8.221 5.771 1.00 0.00 C ATOM 910 NH1 ARG A 56 31.003 8.316 5.797 1.00 0.00 N ATOM 911 NH2 ARG A 56 29.047 8.110 6.936 1.00 0.00 N ATOM 0 H ARG A 56 28.183 13.101 3.782 1.00 0.00 H new ATOM 0 HA ARG A 56 29.598 11.749 1.637 1.00 0.00 H new ATOM 0 HB2 ARG A 56 29.327 10.729 3.962 1.00 0.00 H new ATOM 0 HB3 ARG A 56 27.586 10.781 3.761 1.00 0.00 H new ATOM 0 HG2 ARG A 56 27.557 8.943 2.409 1.00 0.00 H new ATOM 0 HG3 ARG A 56 28.968 9.461 1.508 1.00 0.00 H new ATOM 0 HD2 ARG A 56 29.392 7.356 2.805 1.00 0.00 H new ATOM 0 HD3 ARG A 56 30.473 8.651 3.277 1.00 0.00 H new ATOM 0 HE ARG A 56 27.946 8.147 4.796 1.00 0.00 H new ATOM 0 HH11 ARG A 56 31.526 8.401 4.925 1.00 0.00 H new ATOM 0 HH12 ARG A 56 31.498 8.304 6.689 1.00 0.00 H new ATOM 0 HH21 ARG A 56 28.030 8.034 6.949 1.00 0.00 H new ATOM 0 HH22 ARG A 56 29.571 8.101 7.811 1.00 0.00 H new ATOM 925 N ASN A 57 27.681 12.383 0.203 1.00 0.00 N ATOM 926 CA ASN A 57 26.708 12.484 -0.852 1.00 0.00 C ATOM 927 C ASN A 57 26.552 11.023 -1.272 1.00 0.00 C ATOM 928 O ASN A 57 27.433 10.404 -1.849 1.00 0.00 O ATOM 929 CB ASN A 57 27.186 13.404 -1.975 1.00 0.00 C ATOM 930 CG ASN A 57 26.886 12.841 -3.356 1.00 0.00 C ATOM 931 OD1 ASN A 57 25.692 12.691 -3.712 1.00 0.00 O ATOM 932 ND2 ASN A 57 27.935 12.546 -4.079 1.00 0.00 N ATOM 0 H ASN A 57 28.560 12.854 -0.012 1.00 0.00 H new ATOM 0 HA ASN A 57 25.761 12.937 -0.557 1.00 0.00 H new ATOM 0 HB2 ASN A 57 26.707 14.378 -1.871 1.00 0.00 H new ATOM 0 HB3 ASN A 57 28.260 13.564 -1.877 1.00 0.00 H new ATOM 0 HD21 ASN A 57 27.817 12.160 -5.016 1.00 0.00 H new ATOM 0 HD22 ASN A 57 28.872 12.702 -3.706 1.00 0.00 H new ATOM 939 N ILE A 58 25.389 10.460 -0.973 1.00 0.00 N ATOM 940 CA ILE A 58 25.115 9.094 -1.316 1.00 0.00 C ATOM 941 C ILE A 58 23.682 8.755 -0.966 1.00 0.00 C ATOM 942 O ILE A 58 22.959 9.539 -0.351 1.00 0.00 O ATOM 943 CB ILE A 58 25.971 8.185 -0.464 1.00 0.00 C ATOM 944 CG1 ILE A 58 26.519 6.982 -1.231 1.00 0.00 C ATOM 945 CG2 ILE A 58 25.258 7.726 0.780 1.00 0.00 C ATOM 946 CD1 ILE A 58 27.961 7.210 -1.625 1.00 0.00 C ATOM 0 H ILE A 58 24.627 10.939 -0.493 1.00 0.00 H new ATOM 0 HA ILE A 58 25.310 8.964 -2.380 1.00 0.00 H new ATOM 0 HB ILE A 58 26.822 8.798 -0.165 1.00 0.00 H new ATOM 0 HG12 ILE A 58 26.443 6.086 -0.615 1.00 0.00 H new ATOM 0 HG13 ILE A 58 25.917 6.808 -2.123 1.00 0.00 H new ATOM 0 HG21 ILE A 58 25.915 7.076 1.357 1.00 0.00 H new ATOM 0 HG22 ILE A 58 24.984 8.592 1.383 1.00 0.00 H new ATOM 0 HG23 ILE A 58 24.358 7.177 0.502 1.00 0.00 H new ATOM 0 HD11 ILE A 58 28.331 6.341 -2.170 1.00 0.00 H new ATOM 0 HD12 ILE A 58 28.029 8.093 -2.260 1.00 0.00 H new ATOM 0 HD13 ILE A 58 28.564 7.360 -0.729 1.00 0.00 H new ATOM 958 N ASP A 59 23.338 7.557 -1.398 1.00 0.00 N ATOM 959 CA ASP A 59 21.984 7.087 -1.134 1.00 0.00 C ATOM 960 C ASP A 59 22.184 5.677 -0.626 1.00 0.00 C ATOM 961 O ASP A 59 23.146 5.053 -1.080 1.00 0.00 O ATOM 962 CB ASP A 59 21.114 7.041 -2.378 1.00 0.00 C ATOM 963 CG ASP A 59 21.820 6.563 -3.627 1.00 0.00 C ATOM 964 OD1 ASP A 59 22.092 5.395 -3.791 1.00 0.00 O ATOM 965 OD2 ASP A 59 22.093 7.517 -4.485 1.00 0.00 O ATOM 0 H ASP A 59 23.942 6.914 -1.910 1.00 0.00 H new ATOM 0 HA ASP A 59 21.474 7.756 -0.440 1.00 0.00 H new ATOM 0 HB2 ASP A 59 20.263 6.387 -2.186 1.00 0.00 H new ATOM 0 HB3 ASP A 59 20.715 8.038 -2.562 1.00 0.00 H new ATOM 970 N VAL A 60 21.315 5.224 0.264 1.00 0.00 N ATOM 971 CA VAL A 60 21.478 3.888 0.766 1.00 0.00 C ATOM 972 C VAL A 60 20.128 3.209 0.804 1.00 0.00 C ATOM 973 O VAL A 60 19.135 3.726 1.311 1.00 0.00 O ATOM 974 CB VAL A 60 22.151 3.876 2.139 1.00 0.00 C ATOM 975 CG1 VAL A 60 23.506 3.170 2.070 1.00 0.00 C ATOM 976 CG2 VAL A 60 22.400 5.256 2.680 1.00 0.00 C ATOM 0 H VAL A 60 20.522 5.746 0.636 1.00 0.00 H new ATOM 0 HA VAL A 60 22.139 3.336 0.097 1.00 0.00 H new ATOM 0 HB VAL A 60 21.460 3.351 2.798 1.00 0.00 H new ATOM 0 HG11 VAL A 60 23.968 3.172 3.057 1.00 0.00 H new ATOM 0 HG12 VAL A 60 23.364 2.141 1.738 1.00 0.00 H new ATOM 0 HG13 VAL A 60 24.153 3.692 1.365 1.00 0.00 H new ATOM 0 HG21 VAL A 60 22.879 5.183 3.656 1.00 0.00 H new ATOM 0 HG22 VAL A 60 23.050 5.803 1.997 1.00 0.00 H new ATOM 0 HG23 VAL A 60 21.452 5.784 2.780 1.00 0.00 H new ATOM 986 N VAL A 61 20.063 1.994 0.252 1.00 0.00 N ATOM 987 CA VAL A 61 18.817 1.217 0.221 1.00 0.00 C ATOM 988 C VAL A 61 18.893 -0.012 1.040 1.00 0.00 C ATOM 989 O VAL A 61 19.831 -0.795 0.817 1.00 0.00 O ATOM 990 CB VAL A 61 18.569 0.837 -1.241 1.00 0.00 C ATOM 991 CG1 VAL A 61 17.160 0.238 -1.433 1.00 0.00 C ATOM 992 CG2 VAL A 61 18.771 2.015 -2.171 1.00 0.00 C ATOM 0 H VAL A 61 20.859 1.525 -0.180 1.00 0.00 H new ATOM 0 HA VAL A 61 18.009 1.819 0.637 1.00 0.00 H new ATOM 0 HB VAL A 61 19.306 0.076 -1.499 1.00 0.00 H new ATOM 0 HG11 VAL A 61 17.015 -0.022 -2.482 1.00 0.00 H new ATOM 0 HG12 VAL A 61 17.059 -0.658 -0.820 1.00 0.00 H new ATOM 0 HG13 VAL A 61 16.410 0.970 -1.133 1.00 0.00 H new ATOM 0 HG21 VAL A 61 18.585 1.703 -3.199 1.00 0.00 H new ATOM 0 HG22 VAL A 61 18.078 2.813 -1.903 1.00 0.00 H new ATOM 0 HG23 VAL A 61 19.795 2.378 -2.081 1.00 0.00 H new ATOM 1002 N PHE A 62 17.983 -0.220 1.948 1.00 0.00 N ATOM 1003 CA PHE A 62 17.987 -1.384 2.777 1.00 0.00 C ATOM 1004 C PHE A 62 16.593 -1.719 3.302 1.00 0.00 C ATOM 1005 O PHE A 62 15.912 -0.803 3.777 1.00 0.00 O ATOM 1006 CB PHE A 62 18.874 -1.161 4.007 1.00 0.00 C ATOM 1007 CG PHE A 62 18.853 0.237 4.603 1.00 0.00 C ATOM 1008 CD1 PHE A 62 19.649 1.279 4.118 1.00 0.00 C ATOM 1009 CD2 PHE A 62 18.032 0.560 5.674 1.00 0.00 C ATOM 1010 CE1 PHE A 62 19.630 2.560 4.663 1.00 0.00 C ATOM 1011 CE2 PHE A 62 17.987 1.824 6.246 1.00 0.00 C ATOM 1012 CZ PHE A 62 18.793 2.837 5.737 1.00 0.00 C ATOM 0 H PHE A 62 17.212 0.421 2.133 1.00 0.00 H new ATOM 0 HA PHE A 62 18.358 -2.198 2.154 1.00 0.00 H new ATOM 0 HB2 PHE A 62 18.572 -1.868 4.780 1.00 0.00 H new ATOM 0 HB3 PHE A 62 19.902 -1.403 3.737 1.00 0.00 H new ATOM 0 HD1 PHE A 62 20.307 1.082 3.285 1.00 0.00 H new ATOM 0 HD2 PHE A 62 17.396 -0.211 6.083 1.00 0.00 H new ATOM 0 HE1 PHE A 62 20.262 3.334 4.253 1.00 0.00 H new ATOM 0 HE2 PHE A 62 17.330 2.020 7.081 1.00 0.00 H new ATOM 0 HZ PHE A 62 18.769 3.826 6.171 1.00 0.00 H new ATOM 1022 N GLU A 63 16.263 -2.975 3.188 1.00 0.00 N ATOM 1023 CA GLU A 63 15.023 -3.594 3.596 1.00 0.00 C ATOM 1024 C GLU A 63 14.743 -3.285 5.065 1.00 0.00 C ATOM 1025 O GLU A 63 14.881 -4.146 5.949 1.00 0.00 O ATOM 1026 CB GLU A 63 14.901 -5.121 3.342 1.00 0.00 C ATOM 1027 CG GLU A 63 15.107 -5.361 1.823 1.00 0.00 C ATOM 1028 CD GLU A 63 14.562 -6.663 1.352 1.00 0.00 C ATOM 1029 OE1 GLU A 63 15.350 -7.714 1.489 1.00 0.00 O ATOM 1030 OE2 GLU A 63 13.430 -6.713 0.866 1.00 0.00 O ATOM 0 H GLU A 63 16.904 -3.652 2.774 1.00 0.00 H new ATOM 0 HA GLU A 63 14.271 -3.149 2.945 1.00 0.00 H new ATOM 0 HB2 GLU A 63 15.647 -5.666 3.921 1.00 0.00 H new ATOM 0 HB3 GLU A 63 13.923 -5.485 3.658 1.00 0.00 H new ATOM 0 HG2 GLU A 63 14.631 -4.554 1.267 1.00 0.00 H new ATOM 0 HG3 GLU A 63 16.172 -5.318 1.597 1.00 0.00 H new ATOM 1037 N LEU A 64 14.341 -2.031 5.333 1.00 0.00 N ATOM 1038 CA LEU A 64 14.046 -1.647 6.694 1.00 0.00 C ATOM 1039 C LEU A 64 15.225 -1.871 7.647 1.00 0.00 C ATOM 1040 O LEU A 64 16.030 -0.966 7.825 1.00 0.00 O ATOM 1041 CB LEU A 64 12.800 -2.435 7.185 1.00 0.00 C ATOM 1042 CG LEU A 64 11.440 -1.810 6.807 1.00 0.00 C ATOM 1043 CD1 LEU A 64 10.969 -2.546 5.540 1.00 0.00 C ATOM 1044 CD2 LEU A 64 10.369 -2.068 7.869 1.00 0.00 C ATOM 0 H LEU A 64 14.220 -1.296 4.637 1.00 0.00 H new ATOM 0 HA LEU A 64 13.846 -0.576 6.699 1.00 0.00 H new ATOM 0 HB2 LEU A 64 12.844 -3.445 6.777 1.00 0.00 H new ATOM 0 HB3 LEU A 64 12.851 -2.527 8.270 1.00 0.00 H new ATOM 0 HG LEU A 64 11.568 -0.734 6.689 1.00 0.00 H new ATOM 0 HD11 LEU A 64 10.006 -2.145 5.223 1.00 0.00 H new ATOM 0 HD12 LEU A 64 11.701 -2.405 4.744 1.00 0.00 H new ATOM 0 HD13 LEU A 64 10.866 -3.610 5.754 1.00 0.00 H new ATOM 0 HD21 LEU A 64 9.430 -1.609 7.558 1.00 0.00 H new ATOM 0 HD22 LEU A 64 10.226 -3.142 7.988 1.00 0.00 H new ATOM 0 HD23 LEU A 64 10.687 -1.637 8.818 1.00 0.00 H new ATOM 1056 N GLY A 65 15.251 -3.061 8.207 1.00 0.00 N ATOM 1057 CA GLY A 65 16.343 -3.376 9.150 1.00 0.00 C ATOM 1058 C GLY A 65 17.235 -4.491 8.649 1.00 0.00 C ATOM 1059 O GLY A 65 16.872 -5.662 8.687 1.00 0.00 O ATOM 0 H GLY A 65 14.572 -3.805 8.048 1.00 0.00 H new ATOM 0 HA2 GLY A 65 16.943 -2.482 9.318 1.00 0.00 H new ATOM 0 HA3 GLY A 65 15.917 -3.660 10.113 1.00 0.00 H new ATOM 1063 N VAL A 66 18.430 -4.130 8.164 1.00 0.00 N ATOM 1064 CA VAL A 66 19.405 -5.084 7.643 1.00 0.00 C ATOM 1065 C VAL A 66 20.750 -4.971 8.333 1.00 0.00 C ATOM 1066 O VAL A 66 21.765 -5.426 7.824 1.00 0.00 O ATOM 1067 CB VAL A 66 19.516 -4.875 6.139 1.00 0.00 C ATOM 1068 CG1 VAL A 66 20.258 -3.580 5.818 1.00 0.00 C ATOM 1069 CG2 VAL A 66 20.214 -5.997 5.409 1.00 0.00 C ATOM 0 H VAL A 66 18.745 -3.161 8.124 1.00 0.00 H new ATOM 0 HA VAL A 66 19.062 -6.098 7.849 1.00 0.00 H new ATOM 0 HB VAL A 66 18.483 -4.837 5.792 1.00 0.00 H new ATOM 0 HG11 VAL A 66 20.323 -3.456 4.737 1.00 0.00 H new ATOM 0 HG12 VAL A 66 19.719 -2.736 6.248 1.00 0.00 H new ATOM 0 HG13 VAL A 66 21.262 -3.622 6.239 1.00 0.00 H new ATOM 0 HG21 VAL A 66 20.251 -5.770 4.344 1.00 0.00 H new ATOM 0 HG22 VAL A 66 21.229 -6.105 5.793 1.00 0.00 H new ATOM 0 HG23 VAL A 66 19.667 -6.927 5.563 1.00 0.00 H new ATOM 1079 N ASP A 67 20.742 -4.361 9.495 1.00 0.00 N ATOM 1080 CA ASP A 67 21.924 -4.169 10.287 1.00 0.00 C ATOM 1081 C ASP A 67 22.979 -3.322 9.684 1.00 0.00 C ATOM 1082 O ASP A 67 23.028 -3.123 8.450 1.00 0.00 O ATOM 1083 CB ASP A 67 22.400 -5.511 10.917 1.00 0.00 C ATOM 1084 CG ASP A 67 21.749 -6.733 10.376 1.00 0.00 C ATOM 1085 OD1 ASP A 67 20.593 -7.058 10.555 1.00 0.00 O ATOM 1086 OD2 ASP A 67 22.542 -7.489 9.644 1.00 0.00 O ATOM 0 H ASP A 67 19.897 -3.979 9.920 1.00 0.00 H new ATOM 0 HA ASP A 67 21.631 -3.531 11.121 1.00 0.00 H new ATOM 0 HB2 ASP A 67 23.477 -5.599 10.773 1.00 0.00 H new ATOM 0 HB3 ASP A 67 22.224 -5.471 11.992 1.00 0.00 H new ATOM 1091 N PHE A 68 23.885 -2.770 10.491 1.00 0.00 N ATOM 1092 CA PHE A 68 24.937 -1.929 9.935 1.00 0.00 C ATOM 1093 C PHE A 68 26.264 -2.086 10.672 1.00 0.00 C ATOM 1094 O PHE A 68 27.087 -2.870 10.195 1.00 0.00 O ATOM 1095 CB PHE A 68 24.515 -0.419 9.856 1.00 0.00 C ATOM 1096 CG PHE A 68 23.391 -0.194 8.905 1.00 0.00 C ATOM 1097 CD1 PHE A 68 23.599 -0.304 7.518 1.00 0.00 C ATOM 1098 CD2 PHE A 68 22.088 0.132 9.304 1.00 0.00 C ATOM 1099 CE1 PHE A 68 22.582 -0.106 6.582 1.00 0.00 C ATOM 1100 CE2 PHE A 68 21.046 0.338 8.392 1.00 0.00 C ATOM 1101 CZ PHE A 68 21.319 0.215 7.042 1.00 0.00 C ATOM 0 H PHE A 68 23.911 -2.887 11.504 1.00 0.00 H new ATOM 0 HA PHE A 68 25.089 -2.282 8.915 1.00 0.00 H new ATOM 0 HB2 PHE A 68 24.223 -0.073 10.848 1.00 0.00 H new ATOM 0 HB3 PHE A 68 25.373 0.180 9.549 1.00 0.00 H new ATOM 0 HD1 PHE A 68 24.588 -0.552 7.162 1.00 0.00 H new ATOM 0 HD2 PHE A 68 21.879 0.228 10.359 1.00 0.00 H new ATOM 0 HE1 PHE A 68 22.778 -0.201 5.524 1.00 0.00 H new ATOM 0 HE2 PHE A 68 20.053 0.587 8.735 1.00 0.00 H new ATOM 0 HZ PHE A 68 20.524 0.374 6.328 1.00 0.00 H new ATOM 1111 N ALA A 69 26.373 -1.351 11.750 1.00 0.00 N ATOM 1112 CA ALA A 69 27.512 -1.290 12.658 1.00 0.00 C ATOM 1113 C ALA A 69 28.504 -0.263 12.089 1.00 0.00 C ATOM 1114 O ALA A 69 29.717 -0.433 12.004 1.00 0.00 O ATOM 1115 CB ALA A 69 28.164 -2.632 12.811 1.00 0.00 C ATOM 0 H ALA A 69 25.618 -0.732 12.045 1.00 0.00 H new ATOM 0 HA ALA A 69 27.179 -0.991 13.652 1.00 0.00 H new ATOM 0 HB1 ALA A 69 29.009 -2.550 13.494 1.00 0.00 H new ATOM 0 HB2 ALA A 69 27.442 -3.344 13.211 1.00 0.00 H new ATOM 0 HB3 ALA A 69 28.516 -2.979 11.839 1.00 0.00 H new ATOM 1121 N TYR A 70 27.889 0.849 11.687 1.00 0.00 N ATOM 1122 CA TYR A 70 28.625 1.956 11.111 1.00 0.00 C ATOM 1123 C TYR A 70 28.223 3.180 11.859 1.00 0.00 C ATOM 1124 O TYR A 70 27.062 3.506 11.964 1.00 0.00 O ATOM 1125 CB TYR A 70 28.290 2.094 9.613 1.00 0.00 C ATOM 1126 CG TYR A 70 27.406 3.264 9.220 1.00 0.00 C ATOM 1127 CD1 TYR A 70 27.913 4.561 9.065 1.00 0.00 C ATOM 1128 CD2 TYR A 70 26.021 3.155 8.979 1.00 0.00 C ATOM 1129 CE1 TYR A 70 27.133 5.652 8.704 1.00 0.00 C ATOM 1130 CE2 TYR A 70 25.206 4.249 8.612 1.00 0.00 C ATOM 1131 CZ TYR A 70 25.773 5.523 8.472 1.00 0.00 C ATOM 1132 OH TYR A 70 24.999 6.589 8.118 1.00 0.00 O ATOM 0 H TYR A 70 26.882 1.000 11.753 1.00 0.00 H new ATOM 0 HA TYR A 70 29.701 1.797 11.189 1.00 0.00 H new ATOM 0 HB2 TYR A 70 29.226 2.173 9.060 1.00 0.00 H new ATOM 0 HB3 TYR A 70 27.804 1.175 9.286 1.00 0.00 H new ATOM 0 HD1 TYR A 70 28.967 4.721 9.235 1.00 0.00 H new ATOM 0 HD2 TYR A 70 25.559 2.184 9.080 1.00 0.00 H new ATOM 0 HE1 TYR A 70 27.597 6.622 8.602 1.00 0.00 H new ATOM 0 HE2 TYR A 70 24.150 4.104 8.440 1.00 0.00 H new ATOM 0 HH TYR A 70 24.072 6.295 7.999 1.00 0.00 H new ATOM 1142 N SER A 71 29.258 3.868 12.399 1.00 0.00 N ATOM 1143 CA SER A 71 29.032 5.064 13.154 1.00 0.00 C ATOM 1144 C SER A 71 28.120 6.061 12.442 1.00 0.00 C ATOM 1145 O SER A 71 28.310 6.357 11.273 1.00 0.00 O ATOM 1146 CB SER A 71 30.290 5.813 13.484 1.00 0.00 C ATOM 1147 OG SER A 71 30.463 6.942 12.645 1.00 0.00 O ATOM 0 H SER A 71 30.237 3.596 12.312 1.00 0.00 H new ATOM 0 HA SER A 71 28.563 4.691 14.064 1.00 0.00 H new ATOM 0 HB2 SER A 71 30.260 6.134 14.525 1.00 0.00 H new ATOM 0 HB3 SER A 71 31.147 5.148 13.381 1.00 0.00 H new ATOM 0 HG SER A 71 31.366 7.304 12.766 1.00 0.00 H new ATOM 1153 N LEU A 72 27.171 6.532 13.190 1.00 0.00 N ATOM 1154 CA LEU A 72 26.169 7.493 12.765 1.00 0.00 C ATOM 1155 C LEU A 72 26.991 8.766 12.496 1.00 0.00 C ATOM 1156 O LEU A 72 27.161 9.614 13.386 1.00 0.00 O ATOM 1157 CB LEU A 72 25.259 7.726 13.961 1.00 0.00 C ATOM 1158 CG LEU A 72 24.072 8.641 13.756 1.00 0.00 C ATOM 1159 CD1 LEU A 72 24.396 9.941 13.048 1.00 0.00 C ATOM 1160 CD2 LEU A 72 22.994 7.923 12.940 1.00 0.00 C ATOM 0 H LEU A 72 27.058 6.250 14.164 1.00 0.00 H new ATOM 0 HA LEU A 72 25.573 7.190 11.904 1.00 0.00 H new ATOM 0 HB2 LEU A 72 24.886 6.758 14.296 1.00 0.00 H new ATOM 0 HB3 LEU A 72 25.863 8.133 14.772 1.00 0.00 H new ATOM 0 HG LEU A 72 23.730 8.892 14.760 1.00 0.00 H new ATOM 0 HD11 LEU A 72 23.488 10.535 12.944 1.00 0.00 H new ATOM 0 HD12 LEU A 72 25.129 10.499 13.630 1.00 0.00 H new ATOM 0 HD13 LEU A 72 24.804 9.726 12.061 1.00 0.00 H new ATOM 0 HD21 LEU A 72 22.143 8.588 12.797 1.00 0.00 H new ATOM 0 HD22 LEU A 72 23.401 7.640 11.969 1.00 0.00 H new ATOM 0 HD23 LEU A 72 22.670 7.029 13.472 1.00 0.00 H new ATOM 1172 N ALA A 73 27.465 8.819 11.247 1.00 0.00 N ATOM 1173 CA ALA A 73 28.280 9.904 10.691 1.00 0.00 C ATOM 1174 C ALA A 73 29.205 10.514 11.725 1.00 0.00 C ATOM 1175 O ALA A 73 28.972 11.664 12.134 1.00 0.00 O ATOM 1176 CB ALA A 73 27.363 10.924 10.022 1.00 0.00 C ATOM 0 H ALA A 73 27.284 8.078 10.569 1.00 0.00 H new ATOM 0 HA ALA A 73 28.947 9.500 9.930 1.00 0.00 H new ATOM 0 HB1 ALA A 73 27.962 11.734 9.606 1.00 0.00 H new ATOM 0 HB2 ALA A 73 26.802 10.440 9.222 1.00 0.00 H new ATOM 0 HB3 ALA A 73 26.669 11.328 10.759 1.00 0.00 H new ATOM 1182 N ASP A 74 30.200 9.721 12.094 1.00 0.00 N ATOM 1183 CA ASP A 74 31.249 10.021 13.071 1.00 0.00 C ATOM 1184 C ASP A 74 30.925 9.397 14.425 1.00 0.00 C ATOM 1185 O ASP A 74 29.778 9.283 14.820 1.00 0.00 O ATOM 1186 CB ASP A 74 31.698 11.428 13.249 1.00 0.00 C ATOM 1187 CG ASP A 74 31.254 12.042 14.586 1.00 0.00 C ATOM 1188 OD1 ASP A 74 31.921 11.820 15.678 1.00 0.00 O ATOM 1189 OD2 ASP A 74 30.200 12.793 14.651 1.00 0.00 O ATOM 0 H ASP A 74 30.308 8.788 11.696 1.00 0.00 H new ATOM 0 HA ASP A 74 32.118 9.561 12.600 1.00 0.00 H new ATOM 0 HB2 ASP A 74 32.785 11.466 13.182 1.00 0.00 H new ATOM 0 HB3 ASP A 74 31.307 12.033 12.431 1.00 0.00 H new ATOM 1194 N GLY A 75 31.985 8.996 15.123 1.00 0.00 N ATOM 1195 CA GLY A 75 31.868 8.375 16.442 1.00 0.00 C ATOM 1196 C GLY A 75 32.482 6.956 16.463 1.00 0.00 C ATOM 1197 O GLY A 75 33.699 6.783 16.336 1.00 0.00 O ATOM 0 H GLY A 75 32.945 9.091 14.793 1.00 0.00 H new ATOM 0 HA2 GLY A 75 32.368 8.999 17.183 1.00 0.00 H new ATOM 0 HA3 GLY A 75 30.817 8.321 16.727 1.00 0.00 H new ATOM 1201 N THR A 76 31.646 5.976 16.619 1.00 0.00 N ATOM 1202 CA THR A 76 32.140 4.629 16.648 1.00 0.00 C ATOM 1203 C THR A 76 31.211 3.649 15.952 1.00 0.00 C ATOM 1204 O THR A 76 31.763 2.754 15.288 1.00 0.00 O ATOM 1205 CB THR A 76 32.349 4.201 18.127 1.00 0.00 C ATOM 1206 OG1 THR A 76 33.403 3.282 18.168 1.00 0.00 O ATOM 1207 CG2 THR A 76 31.159 3.569 18.804 1.00 0.00 C ATOM 0 H THR A 76 30.637 6.076 16.727 1.00 0.00 H new ATOM 0 HA THR A 76 33.084 4.608 16.104 1.00 0.00 H new ATOM 0 HB THR A 76 32.545 5.124 18.673 1.00 0.00 H new ATOM 0 HG1 THR A 76 33.072 2.393 17.921 1.00 0.00 H new ATOM 0 HG21 THR A 76 31.419 3.311 19.831 1.00 0.00 H new ATOM 0 HG22 THR A 76 30.326 4.272 18.806 1.00 0.00 H new ATOM 0 HG23 THR A 76 30.871 2.667 18.265 1.00 0.00 H new ATOM 1215 N GLU A 77 29.888 3.799 16.087 1.00 0.00 N ATOM 1216 CA GLU A 77 29.047 2.792 15.408 1.00 0.00 C ATOM 1217 C GLU A 77 27.546 2.991 15.600 1.00 0.00 C ATOM 1218 O GLU A 77 27.135 3.992 16.151 1.00 0.00 O ATOM 1219 CB GLU A 77 29.291 1.442 16.137 1.00 0.00 C ATOM 1220 CG GLU A 77 30.295 0.452 15.540 1.00 0.00 C ATOM 1221 CD GLU A 77 31.521 0.222 16.404 1.00 0.00 C ATOM 1222 OE1 GLU A 77 31.758 0.922 17.346 1.00 0.00 O ATOM 1223 OE2 GLU A 77 32.288 -0.770 16.059 1.00 0.00 O ATOM 0 H GLU A 77 29.406 4.532 16.607 1.00 0.00 H new ATOM 0 HA GLU A 77 29.305 2.849 14.350 1.00 0.00 H new ATOM 0 HB2 GLU A 77 29.616 1.669 17.152 1.00 0.00 H new ATOM 0 HB3 GLU A 77 28.331 0.931 16.216 1.00 0.00 H new ATOM 0 HG2 GLU A 77 29.795 -0.502 15.375 1.00 0.00 H new ATOM 0 HG3 GLU A 77 30.614 0.818 14.564 1.00 0.00 H new ATOM 1230 N LEU A 78 26.772 1.995 15.133 1.00 0.00 N ATOM 1231 CA LEU A 78 25.320 1.937 15.213 1.00 0.00 C ATOM 1232 C LEU A 78 24.843 0.706 14.384 1.00 0.00 C ATOM 1233 O LEU A 78 24.399 0.764 13.236 1.00 0.00 O ATOM 1234 CB LEU A 78 24.788 3.197 14.511 1.00 0.00 C ATOM 1235 CG LEU A 78 23.693 4.044 15.182 1.00 0.00 C ATOM 1236 CD1 LEU A 78 22.954 4.895 14.133 1.00 0.00 C ATOM 1237 CD2 LEU A 78 22.616 3.194 15.795 1.00 0.00 C ATOM 0 H LEU A 78 27.169 1.177 14.671 1.00 0.00 H new ATOM 0 HA LEU A 78 24.978 1.868 16.246 1.00 0.00 H new ATOM 0 HB2 LEU A 78 25.640 3.852 14.330 1.00 0.00 H new ATOM 0 HB3 LEU A 78 24.409 2.890 13.536 1.00 0.00 H new ATOM 0 HG LEU A 78 24.207 4.642 15.935 1.00 0.00 H new ATOM 0 HD11 LEU A 78 22.183 5.488 14.624 1.00 0.00 H new ATOM 0 HD12 LEU A 78 23.663 5.559 13.638 1.00 0.00 H new ATOM 0 HD13 LEU A 78 22.493 4.241 13.393 1.00 0.00 H new ATOM 0 HD21 LEU A 78 21.865 3.835 16.257 1.00 0.00 H new ATOM 0 HD22 LEU A 78 22.148 2.586 15.021 1.00 0.00 H new ATOM 0 HD23 LEU A 78 23.053 2.543 16.552 1.00 0.00 H new ATOM 1249 N THR A 79 24.963 -0.385 15.049 1.00 0.00 N ATOM 1250 CA THR A 79 24.574 -1.670 14.488 1.00 0.00 C ATOM 1251 C THR A 79 23.042 -1.616 14.308 1.00 0.00 C ATOM 1252 O THR A 79 22.603 -1.281 13.184 1.00 0.00 O ATOM 1253 CB THR A 79 24.921 -2.898 15.380 1.00 0.00 C ATOM 1254 OG1 THR A 79 26.256 -3.235 15.118 1.00 0.00 O ATOM 1255 CG2 THR A 79 24.008 -4.105 15.273 1.00 0.00 C ATOM 0 H THR A 79 25.331 -0.435 15.999 1.00 0.00 H new ATOM 0 HA THR A 79 25.128 -1.813 13.560 1.00 0.00 H new ATOM 0 HB THR A 79 24.762 -2.590 16.413 1.00 0.00 H new ATOM 0 HG1 THR A 79 26.512 -4.007 15.665 1.00 0.00 H new ATOM 0 HG21 THR A 79 24.360 -4.888 15.944 1.00 0.00 H new ATOM 0 HG22 THR A 79 22.993 -3.819 15.549 1.00 0.00 H new ATOM 0 HG23 THR A 79 24.014 -4.476 14.248 1.00 0.00 H new ATOM 1263 N GLY A 80 22.286 -1.924 15.341 1.00 0.00 N ATOM 1264 CA GLY A 80 20.852 -1.940 15.369 1.00 0.00 C ATOM 1265 C GLY A 80 20.387 -2.661 14.094 1.00 0.00 C ATOM 1266 O GLY A 80 20.647 -3.840 13.951 1.00 0.00 O ATOM 0 H GLY A 80 22.692 -2.186 16.239 1.00 0.00 H new ATOM 0 HA2 GLY A 80 20.489 -2.456 16.258 1.00 0.00 H new ATOM 0 HA3 GLY A 80 20.455 -0.925 15.405 1.00 0.00 H new ATOM 1270 N THR A 81 19.745 -1.850 13.293 1.00 0.00 N ATOM 1271 CA THR A 81 19.225 -2.324 12.003 1.00 0.00 C ATOM 1272 C THR A 81 18.372 -1.263 11.284 1.00 0.00 C ATOM 1273 O THR A 81 18.468 -0.954 10.096 1.00 0.00 O ATOM 1274 CB THR A 81 18.233 -3.479 12.222 1.00 0.00 C ATOM 1275 OG1 THR A 81 17.583 -3.300 13.488 1.00 0.00 O ATOM 1276 CG2 THR A 81 18.801 -4.894 12.158 1.00 0.00 C ATOM 0 H THR A 81 19.563 -0.867 13.493 1.00 0.00 H new ATOM 0 HA THR A 81 20.108 -2.597 11.425 1.00 0.00 H new ATOM 0 HB THR A 81 17.549 -3.417 11.375 1.00 0.00 H new ATOM 0 HG1 THR A 81 16.947 -4.031 13.636 1.00 0.00 H new ATOM 0 HG21 THR A 81 18.002 -5.615 12.328 1.00 0.00 H new ATOM 0 HG22 THR A 81 19.241 -5.065 11.176 1.00 0.00 H new ATOM 0 HG23 THR A 81 19.567 -5.014 12.924 1.00 0.00 H new ATOM 1284 N TRP A 82 17.566 -0.759 12.139 1.00 0.00 N ATOM 1285 CA TRP A 82 16.617 0.301 11.855 1.00 0.00 C ATOM 1286 C TRP A 82 15.383 -0.462 11.399 1.00 0.00 C ATOM 1287 O TRP A 82 15.355 -1.704 11.416 1.00 0.00 O ATOM 1288 CB TRP A 82 17.019 1.329 10.772 1.00 0.00 C ATOM 1289 CG TRP A 82 18.293 2.073 10.945 1.00 0.00 C ATOM 1290 CD1 TRP A 82 19.494 1.640 11.374 1.00 0.00 C ATOM 1291 CD2 TRP A 82 18.470 3.467 10.674 1.00 0.00 C ATOM 1292 NE1 TRP A 82 20.378 2.671 11.384 1.00 0.00 N ATOM 1293 CE2 TRP A 82 19.821 3.834 10.966 1.00 0.00 C ATOM 1294 CE3 TRP A 82 17.618 4.489 10.206 1.00 0.00 C ATOM 1295 CZ2 TRP A 82 20.285 5.139 10.801 1.00 0.00 C ATOM 1296 CZ3 TRP A 82 18.077 5.766 10.054 1.00 0.00 C ATOM 1297 CH2 TRP A 82 19.398 6.072 10.350 1.00 0.00 C ATOM 0 H TRP A 82 17.531 -1.074 13.108 1.00 0.00 H new ATOM 0 HA TRP A 82 16.504 0.926 12.741 1.00 0.00 H new ATOM 0 HB2 TRP A 82 17.067 0.805 9.818 1.00 0.00 H new ATOM 0 HB3 TRP A 82 16.215 2.061 10.693 1.00 0.00 H new ATOM 0 HD1 TRP A 82 19.720 0.625 11.666 1.00 0.00 H new ATOM 0 HE1 TRP A 82 21.352 2.580 11.674 1.00 0.00 H new ATOM 0 HE3 TRP A 82 16.591 4.259 9.965 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 21.309 5.401 11.022 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 17.411 6.540 9.703 1.00 0.00 H new ATOM 0 HH2 TRP A 82 19.737 7.089 10.218 1.00 0.00 H new ATOM 1308 N THR A 83 14.381 0.283 10.996 1.00 0.00 N ATOM 1309 CA THR A 83 13.104 -0.225 10.513 1.00 0.00 C ATOM 1310 C THR A 83 12.153 0.956 10.664 1.00 0.00 C ATOM 1311 O THR A 83 12.539 2.042 11.009 1.00 0.00 O ATOM 1312 CB THR A 83 12.500 -1.372 11.328 1.00 0.00 C ATOM 1313 OG1 THR A 83 13.083 -1.439 12.601 1.00 0.00 O ATOM 1314 CG2 THR A 83 12.643 -2.747 10.636 1.00 0.00 C ATOM 0 H THR A 83 14.428 1.302 10.993 1.00 0.00 H new ATOM 0 HA THR A 83 13.252 -0.617 9.507 1.00 0.00 H new ATOM 0 HB THR A 83 11.436 -1.150 11.413 1.00 0.00 H new ATOM 0 HG1 THR A 83 13.944 -1.904 12.543 1.00 0.00 H new ATOM 0 HG21 THR A 83 12.196 -3.518 11.263 1.00 0.00 H new ATOM 0 HG22 THR A 83 12.135 -2.724 9.672 1.00 0.00 H new ATOM 0 HG23 THR A 83 13.699 -2.970 10.484 1.00 0.00 H new ATOM 1322 N MET A 84 10.898 0.740 10.403 1.00 0.00 N ATOM 1323 CA MET A 84 9.896 1.784 10.532 1.00 0.00 C ATOM 1324 C MET A 84 8.600 1.032 10.757 1.00 0.00 C ATOM 1325 O MET A 84 8.702 -0.147 11.119 1.00 0.00 O ATOM 1326 CB MET A 84 9.976 2.525 9.192 1.00 0.00 C ATOM 1327 CG MET A 84 9.457 1.692 8.007 1.00 0.00 C ATOM 1328 SD MET A 84 8.995 2.595 6.526 1.00 0.00 S ATOM 1329 CE MET A 84 8.598 1.195 5.453 1.00 0.00 C ATOM 0 H MET A 84 10.529 -0.160 10.094 1.00 0.00 H new ATOM 0 HA MET A 84 10.008 2.509 11.338 1.00 0.00 H new ATOM 0 HB2 MET A 84 9.400 3.448 9.259 1.00 0.00 H new ATOM 0 HB3 MET A 84 11.011 2.809 9.002 1.00 0.00 H new ATOM 0 HG2 MET A 84 10.226 0.968 7.738 1.00 0.00 H new ATOM 0 HG3 MET A 84 8.589 1.125 8.344 1.00 0.00 H new ATOM 0 HE1 MET A 84 8.998 1.376 4.455 1.00 0.00 H new ATOM 0 HE2 MET A 84 9.040 0.286 5.862 1.00 0.00 H new ATOM 0 HE3 MET A 84 7.516 1.077 5.394 1.00 0.00 H new ATOM 1339 N GLU A 85 7.438 1.609 10.573 1.00 0.00 N ATOM 1340 CA GLU A 85 6.210 0.835 10.800 1.00 0.00 C ATOM 1341 C GLU A 85 5.052 1.523 10.190 1.00 0.00 C ATOM 1342 O GLU A 85 3.958 1.506 10.746 1.00 0.00 O ATOM 1343 CB GLU A 85 6.003 0.717 12.324 1.00 0.00 C ATOM 1344 CG GLU A 85 5.115 -0.514 12.571 1.00 0.00 C ATOM 1345 CD GLU A 85 3.766 -0.317 13.186 1.00 0.00 C ATOM 1346 OE1 GLU A 85 3.584 0.542 14.008 1.00 0.00 O ATOM 1347 OE2 GLU A 85 2.826 -1.133 12.770 1.00 0.00 O ATOM 0 H GLU A 85 7.301 2.576 10.278 1.00 0.00 H new ATOM 0 HA GLU A 85 6.298 -0.152 10.346 1.00 0.00 H new ATOM 0 HB2 GLU A 85 6.960 0.609 12.835 1.00 0.00 H new ATOM 0 HB3 GLU A 85 5.531 1.617 12.718 1.00 0.00 H new ATOM 0 HG2 GLU A 85 4.971 -1.015 11.614 1.00 0.00 H new ATOM 0 HG3 GLU A 85 5.672 -1.200 13.209 1.00 0.00 H new ATOM 1354 N GLY A 86 5.281 2.128 9.051 1.00 0.00 N ATOM 1355 CA GLY A 86 4.218 2.813 8.400 1.00 0.00 C ATOM 1356 C GLY A 86 4.146 4.161 9.097 1.00 0.00 C ATOM 1357 O GLY A 86 4.386 5.180 8.466 1.00 0.00 O ATOM 0 H GLY A 86 6.180 2.155 8.571 1.00 0.00 H new ATOM 0 HA2 GLY A 86 4.415 2.928 7.334 1.00 0.00 H new ATOM 0 HA3 GLY A 86 3.279 2.268 8.494 1.00 0.00 H new ATOM 1361 N ASN A 87 3.821 4.184 10.373 1.00 0.00 N ATOM 1362 CA ASN A 87 3.733 5.409 11.110 1.00 0.00 C ATOM 1363 C ASN A 87 5.053 5.953 11.651 1.00 0.00 C ATOM 1364 O ASN A 87 5.052 7.037 12.221 1.00 0.00 O ATOM 1365 CB ASN A 87 2.517 5.606 12.010 1.00 0.00 C ATOM 1366 CG ASN A 87 1.756 4.315 12.002 1.00 0.00 C ATOM 1367 OD1 ASN A 87 2.028 3.433 12.831 1.00 0.00 O ATOM 1368 ND2 ASN A 87 0.810 4.155 11.105 1.00 0.00 N ATOM 0 H ASN A 87 3.612 3.349 10.921 1.00 0.00 H new ATOM 0 HA ASN A 87 3.491 6.102 10.304 1.00 0.00 H new ATOM 0 HB2 ASN A 87 2.824 5.867 13.023 1.00 0.00 H new ATOM 0 HB3 ASN A 87 1.895 6.423 11.645 1.00 0.00 H new ATOM 0 HD21 ASN A 87 0.275 3.287 11.077 1.00 0.00 H new ATOM 0 HD22 ASN A 87 0.610 4.899 10.437 1.00 0.00 H new ATOM 1375 N LYS A 88 6.169 5.247 11.490 1.00 0.00 N ATOM 1376 CA LYS A 88 7.394 5.770 11.990 1.00 0.00 C ATOM 1377 C LYS A 88 8.582 4.806 11.839 1.00 0.00 C ATOM 1378 O LYS A 88 8.394 3.677 12.206 1.00 0.00 O ATOM 1379 CB LYS A 88 7.473 5.959 13.494 1.00 0.00 C ATOM 1380 CG LYS A 88 6.992 4.876 14.399 1.00 0.00 C ATOM 1381 CD LYS A 88 6.888 5.500 15.786 1.00 0.00 C ATOM 1382 CE LYS A 88 8.230 5.407 16.469 1.00 0.00 C ATOM 1383 NZ LYS A 88 8.098 5.722 17.885 1.00 0.00 N ATOM 0 H LYS A 88 6.231 4.340 11.028 1.00 0.00 H new ATOM 0 HA LYS A 88 7.433 6.695 11.415 1.00 0.00 H new ATOM 0 HB2 LYS A 88 8.516 6.153 13.744 1.00 0.00 H new ATOM 0 HB3 LYS A 88 6.913 6.861 13.739 1.00 0.00 H new ATOM 0 HG2 LYS A 88 6.026 4.494 14.070 1.00 0.00 H new ATOM 0 HG3 LYS A 88 7.684 4.034 14.401 1.00 0.00 H new ATOM 0 HD2 LYS A 88 6.577 6.542 15.708 1.00 0.00 H new ATOM 0 HD3 LYS A 88 6.129 4.984 16.375 1.00 0.00 H new ATOM 0 HE2 LYS A 88 8.638 4.403 16.349 1.00 0.00 H new ATOM 0 HE3 LYS A 88 8.933 6.095 16.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 9.029 5.654 18.344 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 7.728 6.688 17.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 7.443 5.049 18.331 1.00 0.00 H new ATOM 1397 N LEU A 89 9.664 5.369 11.336 1.00 0.00 N ATOM 1398 CA LEU A 89 10.939 4.748 11.132 1.00 0.00 C ATOM 1399 C LEU A 89 11.401 4.360 12.552 1.00 0.00 C ATOM 1400 O LEU A 89 10.699 4.473 13.539 1.00 0.00 O ATOM 1401 CB LEU A 89 11.942 5.782 10.532 1.00 0.00 C ATOM 1402 CG LEU A 89 12.607 5.437 9.201 1.00 0.00 C ATOM 1403 CD1 LEU A 89 13.157 6.708 8.539 1.00 0.00 C ATOM 1404 CD2 LEU A 89 13.845 4.558 9.434 1.00 0.00 C ATOM 0 H LEU A 89 9.664 6.345 11.041 1.00 0.00 H new ATOM 0 HA LEU A 89 10.886 3.899 10.450 1.00 0.00 H new ATOM 0 HB2 LEU A 89 11.414 6.728 10.408 1.00 0.00 H new ATOM 0 HB3 LEU A 89 12.730 5.950 11.267 1.00 0.00 H new ATOM 0 HG LEU A 89 11.854 4.939 8.590 1.00 0.00 H new ATOM 0 HD11 LEU A 89 13.629 6.450 7.591 1.00 0.00 H new ATOM 0 HD12 LEU A 89 12.340 7.407 8.359 1.00 0.00 H new ATOM 0 HD13 LEU A 89 13.893 7.171 9.196 1.00 0.00 H new ATOM 0 HD21 LEU A 89 14.308 4.320 8.476 1.00 0.00 H new ATOM 0 HD22 LEU A 89 14.559 5.094 10.059 1.00 0.00 H new ATOM 0 HD23 LEU A 89 13.548 3.635 9.932 1.00 0.00 H new ATOM 1416 N VAL A 90 12.628 3.904 12.590 1.00 0.00 N ATOM 1417 CA VAL A 90 13.314 3.535 13.782 1.00 0.00 C ATOM 1418 C VAL A 90 14.793 3.395 13.356 1.00 0.00 C ATOM 1419 O VAL A 90 15.065 2.410 12.687 1.00 0.00 O ATOM 1420 CB VAL A 90 12.825 2.227 14.407 1.00 0.00 C ATOM 1421 CG1 VAL A 90 12.847 2.306 15.930 1.00 0.00 C ATOM 1422 CG2 VAL A 90 11.432 1.837 13.971 1.00 0.00 C ATOM 0 H VAL A 90 13.192 3.778 11.749 1.00 0.00 H new ATOM 0 HA VAL A 90 13.144 4.286 14.553 1.00 0.00 H new ATOM 0 HB VAL A 90 13.517 1.463 14.052 1.00 0.00 H new ATOM 0 HG11 VAL A 90 12.495 1.363 16.348 1.00 0.00 H new ATOM 0 HG12 VAL A 90 13.865 2.496 16.270 1.00 0.00 H new ATOM 0 HG13 VAL A 90 12.197 3.116 16.262 1.00 0.00 H new ATOM 0 HG21 VAL A 90 11.149 0.901 14.452 1.00 0.00 H new ATOM 0 HG22 VAL A 90 10.729 2.619 14.257 1.00 0.00 H new ATOM 0 HG23 VAL A 90 11.412 1.710 12.889 1.00 0.00 H new ATOM 1432 N GLY A 91 15.587 4.374 13.756 1.00 0.00 N ATOM 1433 CA GLY A 91 17.003 4.458 13.496 1.00 0.00 C ATOM 1434 C GLY A 91 17.748 3.365 14.276 1.00 0.00 C ATOM 1435 O GLY A 91 18.911 3.094 13.985 1.00 0.00 O ATOM 0 H GLY A 91 15.239 5.166 14.296 1.00 0.00 H new ATOM 0 HA2 GLY A 91 17.192 4.347 12.428 1.00 0.00 H new ATOM 0 HA3 GLY A 91 17.376 5.441 13.785 1.00 0.00 H new ATOM 1439 N LYS A 92 17.005 2.816 15.179 1.00 0.00 N ATOM 1440 CA LYS A 92 17.413 1.723 16.045 1.00 0.00 C ATOM 1441 C LYS A 92 18.783 1.955 16.594 1.00 0.00 C ATOM 1442 O LYS A 92 19.114 3.130 16.694 1.00 0.00 O ATOM 1443 CB LYS A 92 17.213 0.360 15.445 1.00 0.00 C ATOM 1444 CG LYS A 92 15.732 0.007 15.645 1.00 0.00 C ATOM 1445 CD LYS A 92 15.578 -0.462 17.088 1.00 0.00 C ATOM 1446 CE LYS A 92 14.776 -1.711 17.176 1.00 0.00 C ATOM 1447 NZ LYS A 92 13.416 -1.466 16.646 1.00 0.00 N ATOM 0 H LYS A 92 16.048 3.121 15.354 1.00 0.00 H new ATOM 0 HA LYS A 92 16.731 1.722 16.896 1.00 0.00 H new ATOM 0 HB2 LYS A 92 17.472 0.361 14.386 1.00 0.00 H new ATOM 0 HB3 LYS A 92 17.856 -0.375 15.930 1.00 0.00 H new ATOM 0 HG2 LYS A 92 15.099 0.873 15.451 1.00 0.00 H new ATOM 0 HG3 LYS A 92 15.424 -0.775 14.950 1.00 0.00 H new ATOM 0 HD2 LYS A 92 16.563 -0.630 17.523 1.00 0.00 H new ATOM 0 HD3 LYS A 92 15.099 0.321 17.676 1.00 0.00 H new ATOM 0 HE2 LYS A 92 15.260 -2.507 16.610 1.00 0.00 H new ATOM 0 HE3 LYS A 92 14.719 -2.046 18.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 12.799 -2.266 16.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 13.033 -0.593 17.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 13.459 -1.366 15.612 1.00 0.00 H new ATOM 1461 N PHE A 93 19.511 0.904 16.965 1.00 0.00 N ATOM 1462 CA PHE A 93 20.791 1.138 17.602 1.00 0.00 C ATOM 1463 C PHE A 93 21.426 -0.087 18.256 1.00 0.00 C ATOM 1464 O PHE A 93 21.047 -1.233 18.022 1.00 0.00 O ATOM 1465 CB PHE A 93 20.350 1.913 18.893 1.00 0.00 C ATOM 1466 CG PHE A 93 19.038 1.410 19.406 1.00 0.00 C ATOM 1467 CD1 PHE A 93 19.006 0.073 19.830 1.00 0.00 C ATOM 1468 CD2 PHE A 93 17.870 2.122 19.507 1.00 0.00 C ATOM 1469 CE1 PHE A 93 17.881 -0.564 20.336 1.00 0.00 C ATOM 1470 CE2 PHE A 93 16.745 1.505 20.042 1.00 0.00 C ATOM 1471 CZ PHE A 93 16.726 0.166 20.449 1.00 0.00 C ATOM 0 H PHE A 93 19.248 -0.074 16.841 1.00 0.00 H new ATOM 0 HA PHE A 93 21.471 1.565 16.865 1.00 0.00 H new ATOM 0 HB2 PHE A 93 21.112 1.802 19.665 1.00 0.00 H new ATOM 0 HB3 PHE A 93 20.273 2.978 18.672 1.00 0.00 H new ATOM 0 HD1 PHE A 93 19.919 -0.500 19.758 1.00 0.00 H new ATOM 0 HD2 PHE A 93 17.825 3.149 19.175 1.00 0.00 H new ATOM 0 HE1 PHE A 93 17.915 -1.602 20.631 1.00 0.00 H new ATOM 0 HE2 PHE A 93 15.842 2.087 20.149 1.00 0.00 H new ATOM 0 HZ PHE A 93 15.825 -0.281 20.842 1.00 0.00 H new ATOM 1481 N LYS A 94 22.342 0.385 19.071 1.00 0.00 N ATOM 1482 CA LYS A 94 23.220 -0.231 20.043 1.00 0.00 C ATOM 1483 C LYS A 94 24.598 -0.068 19.475 1.00 0.00 C ATOM 1484 O LYS A 94 25.243 -1.067 19.283 1.00 0.00 O ATOM 1485 CB LYS A 94 22.949 -1.663 20.353 1.00 0.00 C ATOM 1486 CG LYS A 94 21.959 -1.413 21.487 1.00 0.00 C ATOM 1487 CD LYS A 94 21.360 -2.583 22.182 1.00 0.00 C ATOM 1488 CE LYS A 94 20.830 -2.331 23.583 1.00 0.00 C ATOM 1489 NZ LYS A 94 21.582 -3.101 24.587 1.00 0.00 N ATOM 0 H LYS A 94 22.516 1.390 19.062 1.00 0.00 H new ATOM 0 HA LYS A 94 23.071 0.257 21.006 1.00 0.00 H new ATOM 0 HB2 LYS A 94 22.516 -2.211 19.516 1.00 0.00 H new ATOM 0 HB3 LYS A 94 23.837 -2.211 20.668 1.00 0.00 H new ATOM 0 HG2 LYS A 94 22.463 -0.805 22.238 1.00 0.00 H new ATOM 0 HG3 LYS A 94 21.142 -0.813 21.086 1.00 0.00 H new ATOM 0 HD2 LYS A 94 20.543 -2.964 21.570 1.00 0.00 H new ATOM 0 HD3 LYS A 94 22.111 -3.371 22.236 1.00 0.00 H new ATOM 0 HE2 LYS A 94 20.896 -1.268 23.813 1.00 0.00 H new ATOM 0 HE3 LYS A 94 19.775 -2.602 23.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 21.196 -2.907 25.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 21.498 -4.117 24.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 22.584 -2.824 24.558 1.00 0.00 H new ATOM 1503 N ARG A 95 24.886 1.190 19.258 1.00 0.00 N ATOM 1504 CA ARG A 95 26.118 1.670 18.727 1.00 0.00 C ATOM 1505 C ARG A 95 27.135 0.511 18.688 1.00 0.00 C ATOM 1506 O ARG A 95 27.298 0.006 17.616 1.00 0.00 O ATOM 1507 CB ARG A 95 26.657 2.758 19.682 1.00 0.00 C ATOM 1508 CG ARG A 95 25.573 3.598 20.340 1.00 0.00 C ATOM 1509 CD ARG A 95 24.638 4.212 19.310 1.00 0.00 C ATOM 1510 NE ARG A 95 25.252 4.579 18.033 1.00 0.00 N ATOM 1511 CZ ARG A 95 25.283 5.846 17.597 1.00 0.00 C ATOM 1512 NH1 ARG A 95 24.773 6.908 18.213 1.00 0.00 N ATOM 1513 NH2 ARG A 95 25.878 6.117 16.417 1.00 0.00 N ATOM 0 H ARG A 95 24.226 1.940 19.461 1.00 0.00 H new ATOM 0 HA ARG A 95 25.969 2.069 17.724 1.00 0.00 H new ATOM 0 HB2 ARG A 95 27.254 2.281 20.459 1.00 0.00 H new ATOM 0 HB3 ARG A 95 27.325 3.416 19.126 1.00 0.00 H new ATOM 0 HG2 ARG A 95 24.999 2.978 21.029 1.00 0.00 H new ATOM 0 HG3 ARG A 95 26.034 4.389 20.931 1.00 0.00 H new ATOM 0 HD2 ARG A 95 23.830 3.507 19.114 1.00 0.00 H new ATOM 0 HD3 ARG A 95 24.185 5.104 19.744 1.00 0.00 H new ATOM 0 HE ARG A 95 25.669 3.848 17.457 1.00 0.00 H new ATOM 0 HH11 ARG A 95 24.301 6.799 19.110 1.00 0.00 H new ATOM 0 HH12 ARG A 95 24.854 7.832 17.788 1.00 0.00 H new ATOM 0 HH21 ARG A 95 26.295 5.363 15.871 1.00 0.00 H new ATOM 0 HH22 ARG A 95 25.910 7.076 16.070 1.00 0.00 H new ATOM 1527 N VAL A 96 27.634 0.192 19.812 1.00 0.00 N ATOM 1528 CA VAL A 96 28.672 -0.777 20.049 1.00 0.00 C ATOM 1529 C VAL A 96 29.562 -0.182 21.169 1.00 0.00 C ATOM 1530 O VAL A 96 30.023 -0.916 22.019 1.00 0.00 O ATOM 1531 CB VAL A 96 29.532 -0.857 18.825 1.00 0.00 C ATOM 1532 CG1 VAL A 96 31.015 -0.930 19.265 1.00 0.00 C ATOM 1533 CG2 VAL A 96 29.127 -1.974 17.877 1.00 0.00 C ATOM 0 H VAL A 96 27.314 0.627 20.677 1.00 0.00 H new ATOM 0 HA VAL A 96 28.256 -1.753 20.301 1.00 0.00 H new ATOM 0 HB VAL A 96 29.387 0.047 18.233 1.00 0.00 H new ATOM 0 HG11 VAL A 96 31.654 -0.989 18.384 1.00 0.00 H new ATOM 0 HG12 VAL A 96 31.269 -0.038 19.838 1.00 0.00 H new ATOM 0 HG13 VAL A 96 31.168 -1.814 19.883 1.00 0.00 H new ATOM 0 HG21 VAL A 96 29.790 -1.976 17.012 1.00 0.00 H new ATOM 0 HG22 VAL A 96 29.199 -2.932 18.392 1.00 0.00 H new ATOM 0 HG23 VAL A 96 28.100 -1.816 17.546 1.00 0.00 H new ATOM 1543 N ASP A 97 29.717 1.143 21.074 1.00 0.00 N ATOM 1544 CA ASP A 97 30.518 1.894 22.114 1.00 0.00 C ATOM 1545 C ASP A 97 30.106 1.401 23.499 1.00 0.00 C ATOM 1546 O ASP A 97 30.857 1.357 24.495 1.00 0.00 O ATOM 1547 CB ASP A 97 30.434 3.408 21.999 1.00 0.00 C ATOM 1548 CG ASP A 97 30.256 4.220 23.283 1.00 0.00 C ATOM 1549 OD1 ASP A 97 29.067 4.027 23.771 1.00 0.00 O ATOM 1550 OD2 ASP A 97 31.085 4.947 23.800 1.00 0.00 O ATOM 0 H ASP A 97 29.326 1.721 20.330 1.00 0.00 H new ATOM 0 HA ASP A 97 31.571 1.677 21.937 1.00 0.00 H new ATOM 0 HB2 ASP A 97 31.343 3.756 21.508 1.00 0.00 H new ATOM 0 HB3 ASP A 97 29.602 3.646 21.336 1.00 0.00 H new ATOM 1555 N ASN A 98 28.835 1.000 23.518 1.00 0.00 N ATOM 1556 CA ASN A 98 28.136 0.444 24.644 1.00 0.00 C ATOM 1557 C ASN A 98 26.714 -0.030 24.426 1.00 0.00 C ATOM 1558 O ASN A 98 26.247 -1.012 24.977 1.00 0.00 O ATOM 1559 CB ASN A 98 28.232 1.447 25.816 1.00 0.00 C ATOM 1560 CG ASN A 98 27.277 1.258 27.005 1.00 0.00 C ATOM 1561 OD1 ASN A 98 26.831 0.131 27.347 1.00 0.00 O ATOM 1562 ND2 ASN A 98 26.984 2.399 27.614 1.00 0.00 N ATOM 0 H ASN A 98 28.243 1.065 22.690 1.00 0.00 H new ATOM 0 HA ASN A 98 28.643 -0.495 24.864 1.00 0.00 H new ATOM 0 HB2 ASN A 98 29.252 1.417 26.199 1.00 0.00 H new ATOM 0 HB3 ASN A 98 28.071 2.447 25.414 1.00 0.00 H new ATOM 0 HD21 ASN A 98 26.357 2.401 28.419 1.00 0.00 H new ATOM 0 HD22 ASN A 98 27.385 3.274 27.278 1.00 0.00 H new ATOM 1569 N GLY A 99 26.019 0.716 23.589 1.00 0.00 N ATOM 1570 CA GLY A 99 24.657 0.521 23.208 1.00 0.00 C ATOM 1571 C GLY A 99 23.725 1.658 23.714 1.00 0.00 C ATOM 1572 O GLY A 99 23.488 1.818 24.911 1.00 0.00 O ATOM 0 H GLY A 99 26.432 1.529 23.132 1.00 0.00 H new ATOM 0 HA2 GLY A 99 24.593 0.460 22.122 1.00 0.00 H new ATOM 0 HA3 GLY A 99 24.307 -0.433 23.602 1.00 0.00 H new ATOM 1576 N LYS A 100 23.235 2.413 22.737 1.00 0.00 N ATOM 1577 CA LYS A 100 22.338 3.554 22.919 1.00 0.00 C ATOM 1578 C LYS A 100 21.022 3.293 22.206 1.00 0.00 C ATOM 1579 O LYS A 100 20.816 2.179 21.794 1.00 0.00 O ATOM 1580 CB LYS A 100 22.985 4.754 22.239 1.00 0.00 C ATOM 1581 CG LYS A 100 23.679 5.618 23.255 1.00 0.00 C ATOM 1582 CD LYS A 100 24.906 4.814 23.695 1.00 0.00 C ATOM 1583 CE LYS A 100 25.981 5.497 24.496 1.00 0.00 C ATOM 1584 NZ LYS A 100 26.131 4.892 25.825 1.00 0.00 N ATOM 0 H LYS A 100 23.459 2.242 21.757 1.00 0.00 H new ATOM 0 HA LYS A 100 22.163 3.722 23.982 1.00 0.00 H new ATOM 0 HB2 LYS A 100 23.701 4.414 21.491 1.00 0.00 H new ATOM 0 HB3 LYS A 100 22.227 5.335 21.714 1.00 0.00 H new ATOM 0 HG2 LYS A 100 23.970 6.576 22.824 1.00 0.00 H new ATOM 0 HG3 LYS A 100 23.026 5.834 24.100 1.00 0.00 H new ATOM 0 HD2 LYS A 100 24.550 3.965 24.279 1.00 0.00 H new ATOM 0 HD3 LYS A 100 25.373 4.409 22.797 1.00 0.00 H new ATOM 0 HE2 LYS A 100 26.928 5.438 23.960 1.00 0.00 H new ATOM 0 HE3 LYS A 100 25.740 6.555 24.602 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 27.036 5.190 26.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 25.349 5.200 26.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 26.115 3.856 25.739 1.00 0.00 H new ATOM 1598 N GLU A 101 20.235 4.331 22.094 1.00 0.00 N ATOM 1599 CA GLU A 101 19.020 4.135 21.317 1.00 0.00 C ATOM 1600 C GLU A 101 18.671 5.412 20.518 1.00 0.00 C ATOM 1601 O GLU A 101 17.601 5.901 20.735 1.00 0.00 O ATOM 1602 CB GLU A 101 17.837 3.493 22.013 1.00 0.00 C ATOM 1603 CG GLU A 101 17.999 2.006 22.430 1.00 0.00 C ATOM 1604 CD GLU A 101 16.816 1.396 23.154 1.00 0.00 C ATOM 1605 OE1 GLU A 101 15.635 1.759 23.108 1.00 0.00 O ATOM 1606 OE2 GLU A 101 17.239 0.389 23.864 1.00 0.00 O ATOM 0 H GLU A 101 20.385 5.257 22.493 1.00 0.00 H new ATOM 0 HA GLU A 101 19.273 3.342 20.613 1.00 0.00 H new ATOM 0 HB2 GLU A 101 17.611 4.075 22.907 1.00 0.00 H new ATOM 0 HB3 GLU A 101 16.972 3.570 21.355 1.00 0.00 H new ATOM 0 HG2 GLU A 101 18.198 1.416 21.535 1.00 0.00 H new ATOM 0 HG3 GLU A 101 18.877 1.920 23.070 1.00 0.00 H new ATOM 1613 N LEU A 102 19.648 5.766 19.716 1.00 0.00 N ATOM 1614 CA LEU A 102 19.538 6.939 18.846 1.00 0.00 C ATOM 1615 C LEU A 102 18.077 6.751 18.354 1.00 0.00 C ATOM 1616 O LEU A 102 17.322 7.645 18.610 1.00 0.00 O ATOM 1617 CB LEU A 102 20.390 6.904 17.554 1.00 0.00 C ATOM 1618 CG LEU A 102 21.882 7.007 17.810 1.00 0.00 C ATOM 1619 CD1 LEU A 102 22.547 5.855 17.033 1.00 0.00 C ATOM 1620 CD2 LEU A 102 22.299 8.341 17.211 1.00 0.00 C ATOM 0 H LEU A 102 20.533 5.265 19.640 1.00 0.00 H new ATOM 0 HA LEU A 102 19.839 7.841 19.378 1.00 0.00 H new ATOM 0 HB2 LEU A 102 20.185 5.978 17.018 1.00 0.00 H new ATOM 0 HB3 LEU A 102 20.084 7.723 16.904 1.00 0.00 H new ATOM 0 HG LEU A 102 22.156 6.946 18.863 1.00 0.00 H new ATOM 0 HD11 LEU A 102 23.626 5.887 17.187 1.00 0.00 H new ATOM 0 HD12 LEU A 102 22.158 4.902 17.391 1.00 0.00 H new ATOM 0 HD13 LEU A 102 22.329 5.959 15.970 1.00 0.00 H new ATOM 0 HD21 LEU A 102 23.369 8.487 17.358 1.00 0.00 H new ATOM 0 HD22 LEU A 102 22.075 8.347 16.144 1.00 0.00 H new ATOM 0 HD23 LEU A 102 21.752 9.147 17.701 1.00 0.00 H new ATOM 1632 N ILE A 103 17.873 5.613 17.745 1.00 0.00 N ATOM 1633 CA ILE A 103 16.549 5.248 17.260 1.00 0.00 C ATOM 1634 C ILE A 103 16.174 6.111 16.067 1.00 0.00 C ATOM 1635 O ILE A 103 15.004 5.981 15.674 1.00 0.00 O ATOM 1636 CB ILE A 103 15.564 5.408 18.418 1.00 0.00 C ATOM 1637 CG1 ILE A 103 15.343 4.048 19.067 1.00 0.00 C ATOM 1638 CG2 ILE A 103 14.287 6.128 18.127 1.00 0.00 C ATOM 1639 CD1 ILE A 103 15.035 2.878 18.138 1.00 0.00 C ATOM 0 H ILE A 103 18.598 4.918 17.569 1.00 0.00 H new ATOM 0 HA ILE A 103 16.529 4.213 16.918 1.00 0.00 H new ATOM 0 HB ILE A 103 16.037 6.095 19.119 1.00 0.00 H new ATOM 0 HG12 ILE A 103 16.235 3.798 19.642 1.00 0.00 H new ATOM 0 HG13 ILE A 103 14.522 4.141 19.778 1.00 0.00 H new ATOM 0 HG21 ILE A 103 13.680 6.172 19.031 1.00 0.00 H new ATOM 0 HG22 ILE A 103 14.509 7.140 17.789 1.00 0.00 H new ATOM 0 HG23 ILE A 103 13.740 5.597 17.348 1.00 0.00 H new ATOM 0 HD11 ILE A 103 14.900 1.971 18.727 1.00 0.00 H new ATOM 0 HD12 ILE A 103 14.122 3.087 17.580 1.00 0.00 H new ATOM 0 HD13 ILE A 103 15.862 2.739 17.442 1.00 0.00 H new ATOM 1651 N ALA A 104 17.098 6.872 15.530 1.00 0.00 N ATOM 1652 CA ALA A 104 16.964 7.724 14.370 1.00 0.00 C ATOM 1653 C ALA A 104 15.745 7.324 13.573 1.00 0.00 C ATOM 1654 O ALA A 104 15.771 6.675 12.545 1.00 0.00 O ATOM 1655 CB ALA A 104 18.144 7.636 13.381 1.00 0.00 C ATOM 0 H ALA A 104 18.038 6.915 15.924 1.00 0.00 H new ATOM 0 HA ALA A 104 16.908 8.734 14.776 1.00 0.00 H new ATOM 0 HB1 ALA A 104 17.964 8.306 12.540 1.00 0.00 H new ATOM 0 HB2 ALA A 104 19.065 7.927 13.886 1.00 0.00 H new ATOM 0 HB3 ALA A 104 18.238 6.613 13.017 1.00 0.00 H new ATOM 1661 N VAL A 105 14.614 7.720 14.080 1.00 0.00 N ATOM 1662 CA VAL A 105 13.345 7.386 13.475 1.00 0.00 C ATOM 1663 C VAL A 105 13.146 8.295 12.251 1.00 0.00 C ATOM 1664 O VAL A 105 13.928 8.083 11.324 1.00 0.00 O ATOM 1665 CB VAL A 105 12.217 7.556 14.473 1.00 0.00 C ATOM 1666 CG1 VAL A 105 10.820 7.156 13.974 1.00 0.00 C ATOM 1667 CG2 VAL A 105 12.437 6.811 15.787 1.00 0.00 C ATOM 0 H VAL A 105 14.539 8.285 14.926 1.00 0.00 H new ATOM 0 HA VAL A 105 13.340 6.342 13.161 1.00 0.00 H new ATOM 0 HB VAL A 105 12.243 8.635 14.626 1.00 0.00 H new ATOM 0 HG11 VAL A 105 10.090 7.318 14.767 1.00 0.00 H new ATOM 0 HG12 VAL A 105 10.555 7.763 13.108 1.00 0.00 H new ATOM 0 HG13 VAL A 105 10.822 6.103 13.692 1.00 0.00 H new ATOM 0 HG21 VAL A 105 11.588 6.981 16.449 1.00 0.00 H new ATOM 0 HG22 VAL A 105 12.534 5.744 15.588 1.00 0.00 H new ATOM 0 HG23 VAL A 105 13.347 7.175 16.264 1.00 0.00 H new ATOM 1677 N ARG A 106 12.194 9.183 12.277 1.00 0.00 N ATOM 1678 CA ARG A 106 11.795 10.084 11.199 1.00 0.00 C ATOM 1679 C ARG A 106 10.270 10.148 11.422 1.00 0.00 C ATOM 1680 O ARG A 106 9.769 11.200 11.149 1.00 0.00 O ATOM 1681 CB ARG A 106 12.052 9.624 9.825 1.00 0.00 C ATOM 1682 CG ARG A 106 12.836 10.701 9.088 1.00 0.00 C ATOM 1683 CD ARG A 106 14.217 10.340 8.631 1.00 0.00 C ATOM 1684 NE ARG A 106 15.059 10.184 9.814 1.00 0.00 N ATOM 1685 CZ ARG A 106 16.149 9.445 9.893 1.00 0.00 C ATOM 1686 NH1 ARG A 106 16.542 8.774 8.838 1.00 0.00 N ATOM 1687 NH2 ARG A 106 16.872 9.347 10.995 1.00 0.00 N ATOM 0 H ARG A 106 11.623 9.317 13.112 1.00 0.00 H new ATOM 0 HA ARG A 106 12.361 11.014 11.252 1.00 0.00 H new ATOM 0 HB2 ARG A 106 12.614 8.690 9.838 1.00 0.00 H new ATOM 0 HB3 ARG A 106 11.112 9.423 9.312 1.00 0.00 H new ATOM 0 HG2 ARG A 106 12.258 11.004 8.215 1.00 0.00 H new ATOM 0 HG3 ARG A 106 12.911 11.572 9.739 1.00 0.00 H new ATOM 0 HD2 ARG A 106 14.197 9.416 8.053 1.00 0.00 H new ATOM 0 HD3 ARG A 106 14.617 11.116 7.978 1.00 0.00 H new ATOM 0 HE ARG A 106 14.780 10.691 10.654 1.00 0.00 H new ATOM 0 HH11 ARG A 106 16.007 8.827 7.971 1.00 0.00 H new ATOM 0 HH12 ARG A 106 17.383 8.198 8.884 1.00 0.00 H new ATOM 0 HH21 ARG A 106 16.594 9.856 11.834 1.00 0.00 H new ATOM 0 HH22 ARG A 106 17.708 8.762 11.006 1.00 0.00 H new ATOM 1701 N GLU A 107 9.799 9.039 11.921 1.00 0.00 N ATOM 1702 CA GLU A 107 8.435 8.815 12.327 1.00 0.00 C ATOM 1703 C GLU A 107 7.444 9.272 11.229 1.00 0.00 C ATOM 1704 O GLU A 107 6.682 8.501 10.671 1.00 0.00 O ATOM 1705 CB GLU A 107 8.159 9.692 13.568 1.00 0.00 C ATOM 1706 CG GLU A 107 8.202 8.897 14.892 1.00 0.00 C ATOM 1707 CD GLU A 107 7.006 8.985 15.861 1.00 0.00 C ATOM 1708 OE1 GLU A 107 5.838 8.769 15.308 1.00 0.00 O ATOM 1709 OE2 GLU A 107 7.089 9.239 17.039 1.00 0.00 O ATOM 0 H GLU A 107 10.389 8.219 12.064 1.00 0.00 H new ATOM 0 HA GLU A 107 8.301 7.751 12.523 1.00 0.00 H new ATOM 0 HB2 GLU A 107 8.895 10.495 13.609 1.00 0.00 H new ATOM 0 HB3 GLU A 107 7.181 10.161 13.464 1.00 0.00 H new ATOM 0 HG2 GLU A 107 8.343 7.846 14.639 1.00 0.00 H new ATOM 0 HG3 GLU A 107 9.090 9.216 15.437 1.00 0.00 H new ATOM 1716 N ILE A 108 7.541 10.570 11.006 1.00 0.00 N ATOM 1717 CA ILE A 108 6.788 11.349 10.024 1.00 0.00 C ATOM 1718 C ILE A 108 5.328 11.402 10.411 1.00 0.00 C ATOM 1719 O ILE A 108 4.658 10.411 10.638 1.00 0.00 O ATOM 1720 CB ILE A 108 7.018 10.752 8.657 1.00 0.00 C ATOM 1721 CG1 ILE A 108 6.854 11.921 7.694 1.00 0.00 C ATOM 1722 CG2 ILE A 108 6.033 9.685 8.222 1.00 0.00 C ATOM 1723 CD1 ILE A 108 7.466 11.646 6.346 1.00 0.00 C ATOM 0 H ILE A 108 8.189 11.151 11.538 1.00 0.00 H new ATOM 0 HA ILE A 108 7.134 12.382 9.999 1.00 0.00 H new ATOM 0 HB ILE A 108 7.991 10.261 8.671 1.00 0.00 H new ATOM 0 HG12 ILE A 108 5.793 12.140 7.570 1.00 0.00 H new ATOM 0 HG13 ILE A 108 7.315 12.810 8.125 1.00 0.00 H new ATOM 0 HG21 ILE A 108 6.297 9.330 7.226 1.00 0.00 H new ATOM 0 HG22 ILE A 108 6.065 8.852 8.924 1.00 0.00 H new ATOM 0 HG23 ILE A 108 5.027 10.105 8.203 1.00 0.00 H new ATOM 0 HD11 ILE A 108 7.322 12.510 5.698 1.00 0.00 H new ATOM 0 HD12 ILE A 108 8.533 11.454 6.463 1.00 0.00 H new ATOM 0 HD13 ILE A 108 6.987 10.774 5.900 1.00 0.00 H new ATOM 1735 N SER A 109 4.848 12.642 10.513 1.00 0.00 N ATOM 1736 CA SER A 109 3.462 12.814 10.920 1.00 0.00 C ATOM 1737 C SER A 109 3.107 14.238 10.720 1.00 0.00 C ATOM 1738 O SER A 109 3.562 15.172 11.368 1.00 0.00 O ATOM 1739 CB SER A 109 3.335 12.386 12.379 1.00 0.00 C ATOM 1740 OG SER A 109 2.196 12.916 12.999 1.00 0.00 O ATOM 0 H SER A 109 5.370 13.499 10.329 1.00 0.00 H new ATOM 0 HA SER A 109 2.778 12.203 10.332 1.00 0.00 H new ATOM 0 HB2 SER A 109 3.300 11.298 12.433 1.00 0.00 H new ATOM 0 HB3 SER A 109 4.223 12.704 12.926 1.00 0.00 H new ATOM 0 HG SER A 109 2.159 12.612 13.930 1.00 0.00 H new ATOM 1746 N GLY A 110 2.201 14.410 9.754 1.00 0.00 N ATOM 1747 CA GLY A 110 1.655 15.666 9.363 1.00 0.00 C ATOM 1748 C GLY A 110 2.711 16.569 8.779 1.00 0.00 C ATOM 1749 O GLY A 110 3.066 17.553 9.445 1.00 0.00 O ATOM 0 H GLY A 110 1.827 13.630 9.214 1.00 0.00 H new ATOM 0 HA2 GLY A 110 0.864 15.508 8.630 1.00 0.00 H new ATOM 0 HA3 GLY A 110 1.198 16.150 10.226 1.00 0.00 H new ATOM 1753 N ASN A 111 3.189 16.264 7.589 1.00 0.00 N ATOM 1754 CA ASN A 111 4.191 17.065 6.949 1.00 0.00 C ATOM 1755 C ASN A 111 5.361 17.310 7.936 1.00 0.00 C ATOM 1756 O ASN A 111 5.669 18.426 8.353 1.00 0.00 O ATOM 1757 CB ASN A 111 3.721 18.406 6.353 1.00 0.00 C ATOM 1758 CG ASN A 111 3.240 18.350 4.900 1.00 0.00 C ATOM 1759 OD1 ASN A 111 4.025 18.283 3.954 1.00 0.00 O ATOM 1760 ND2 ASN A 111 1.952 18.374 4.689 1.00 0.00 N ATOM 0 H ASN A 111 2.889 15.454 7.047 1.00 0.00 H new ATOM 0 HA ASN A 111 4.501 16.481 6.083 1.00 0.00 H new ATOM 0 HB2 ASN A 111 2.911 18.794 6.971 1.00 0.00 H new ATOM 0 HB3 ASN A 111 4.542 19.120 6.418 1.00 0.00 H new ATOM 0 HD21 ASN A 111 1.591 18.337 3.736 1.00 0.00 H new ATOM 0 HD22 ASN A 111 1.307 18.430 5.477 1.00 0.00 H new ATOM 1767 N GLU A 112 5.981 16.201 8.280 1.00 0.00 N ATOM 1768 CA GLU A 112 7.081 16.196 9.200 1.00 0.00 C ATOM 1769 C GLU A 112 8.085 15.156 8.636 1.00 0.00 C ATOM 1770 O GLU A 112 7.945 14.745 7.507 1.00 0.00 O ATOM 1771 CB GLU A 112 6.578 15.593 10.559 1.00 0.00 C ATOM 1772 CG GLU A 112 6.561 16.590 11.727 1.00 0.00 C ATOM 1773 CD GLU A 112 6.140 18.008 11.356 1.00 0.00 C ATOM 1774 OE1 GLU A 112 4.971 18.289 11.293 1.00 0.00 O ATOM 1775 OE2 GLU A 112 7.094 18.861 11.127 1.00 0.00 O ATOM 0 H GLU A 112 5.730 15.279 7.924 1.00 0.00 H new ATOM 0 HA GLU A 112 7.499 17.194 9.332 1.00 0.00 H new ATOM 0 HB2 GLU A 112 5.571 15.200 10.418 1.00 0.00 H new ATOM 0 HB3 GLU A 112 7.215 14.750 10.826 1.00 0.00 H new ATOM 0 HG2 GLU A 112 5.885 16.215 12.495 1.00 0.00 H new ATOM 0 HG3 GLU A 112 7.557 16.626 12.169 1.00 0.00 H new ATOM 1782 N LEU A 113 8.998 14.827 9.528 1.00 0.00 N ATOM 1783 CA LEU A 113 10.028 13.837 9.426 1.00 0.00 C ATOM 1784 C LEU A 113 10.641 13.647 10.837 1.00 0.00 C ATOM 1785 O LEU A 113 11.763 13.196 10.882 1.00 0.00 O ATOM 1786 CB LEU A 113 11.144 14.052 8.417 1.00 0.00 C ATOM 1787 CG LEU A 113 10.843 13.571 6.986 1.00 0.00 C ATOM 1788 CD1 LEU A 113 12.196 13.665 6.290 1.00 0.00 C ATOM 1789 CD2 LEU A 113 10.510 12.102 6.921 1.00 0.00 C ATOM 0 H LEU A 113 9.032 15.301 10.431 1.00 0.00 H new ATOM 0 HA LEU A 113 9.519 12.957 9.032 1.00 0.00 H new ATOM 0 HB2 LEU A 113 11.379 15.116 8.382 1.00 0.00 H new ATOM 0 HB3 LEU A 113 12.037 13.539 8.774 1.00 0.00 H new ATOM 0 HG LEU A 113 10.015 14.147 6.573 1.00 0.00 H new ATOM 0 HD11 LEU A 113 12.095 13.342 5.254 1.00 0.00 H new ATOM 0 HD12 LEU A 113 12.548 14.696 6.316 1.00 0.00 H new ATOM 0 HD13 LEU A 113 12.914 13.024 6.802 1.00 0.00 H new ATOM 0 HD21 LEU A 113 10.307 11.820 5.888 1.00 0.00 H new ATOM 0 HD22 LEU A 113 11.352 11.521 7.297 1.00 0.00 H new ATOM 0 HD23 LEU A 113 9.630 11.901 7.531 1.00 0.00 H new ATOM 1801 N ILE A 114 9.948 13.953 11.868 1.00 0.00 N ATOM 1802 CA ILE A 114 10.375 13.720 13.228 1.00 0.00 C ATOM 1803 C ILE A 114 11.422 12.652 13.326 1.00 0.00 C ATOM 1804 O ILE A 114 11.243 11.460 13.551 1.00 0.00 O ATOM 1805 CB ILE A 114 9.144 13.144 13.946 1.00 0.00 C ATOM 1806 CG1 ILE A 114 7.870 12.883 13.121 1.00 0.00 C ATOM 1807 CG2 ILE A 114 8.951 13.924 15.230 1.00 0.00 C ATOM 1808 CD1 ILE A 114 6.674 13.806 13.422 1.00 0.00 C ATOM 0 H ILE A 114 9.029 14.391 11.804 1.00 0.00 H new ATOM 0 HA ILE A 114 10.774 14.648 13.638 1.00 0.00 H new ATOM 0 HB ILE A 114 9.367 12.101 14.171 1.00 0.00 H new ATOM 0 HG12 ILE A 114 8.119 12.976 12.064 1.00 0.00 H new ATOM 0 HG13 ILE A 114 7.559 11.851 13.285 1.00 0.00 H new ATOM 0 HG21 ILE A 114 8.083 13.538 15.763 1.00 0.00 H new ATOM 0 HG22 ILE A 114 9.837 13.820 15.856 1.00 0.00 H new ATOM 0 HG23 ILE A 114 8.794 14.977 14.996 1.00 0.00 H new ATOM 0 HD11 ILE A 114 5.834 13.532 12.784 1.00 0.00 H new ATOM 0 HD12 ILE A 114 6.386 13.699 14.468 1.00 0.00 H new ATOM 0 HD13 ILE A 114 6.955 14.841 13.227 1.00 0.00 H new ATOM 1820 N GLN A 115 12.660 13.135 13.146 1.00 0.00 N ATOM 1821 CA GLN A 115 13.875 12.392 13.181 1.00 0.00 C ATOM 1822 C GLN A 115 14.043 11.628 14.469 1.00 0.00 C ATOM 1823 O GLN A 115 14.882 10.723 14.485 1.00 0.00 O ATOM 1824 CB GLN A 115 14.970 13.445 12.936 1.00 0.00 C ATOM 1825 CG GLN A 115 14.945 13.841 11.444 1.00 0.00 C ATOM 1826 CD GLN A 115 15.972 13.029 10.702 1.00 0.00 C ATOM 1827 OE1 GLN A 115 15.677 12.610 9.575 1.00 0.00 O ATOM 1828 NE2 GLN A 115 17.155 12.774 11.237 1.00 0.00 N ATOM 0 H GLN A 115 12.822 14.125 12.961 1.00 0.00 H new ATOM 0 HA GLN A 115 13.908 11.606 12.426 1.00 0.00 H new ATOM 0 HB2 GLN A 115 14.801 14.320 13.563 1.00 0.00 H new ATOM 0 HB3 GLN A 115 15.947 13.045 13.205 1.00 0.00 H new ATOM 0 HG2 GLN A 115 13.954 13.667 11.025 1.00 0.00 H new ATOM 0 HG3 GLN A 115 15.155 14.905 11.334 1.00 0.00 H new ATOM 0 HE21 GLN A 115 17.381 13.127 12.167 1.00 0.00 H new ATOM 0 HE22 GLN A 115 17.841 12.224 10.720 1.00 0.00 H new ATOM 1837 N THR A 116 13.225 11.997 15.424 1.00 0.00 N ATOM 1838 CA THR A 116 13.064 11.403 16.732 1.00 0.00 C ATOM 1839 C THR A 116 14.123 10.434 17.120 1.00 0.00 C ATOM 1840 O THR A 116 13.768 9.269 17.315 1.00 0.00 O ATOM 1841 CB THR A 116 11.692 10.677 16.767 1.00 0.00 C ATOM 1842 OG1 THR A 116 10.714 11.701 16.550 1.00 0.00 O ATOM 1843 CG2 THR A 116 11.423 10.115 18.141 1.00 0.00 C ATOM 0 H THR A 116 12.598 12.792 15.296 1.00 0.00 H new ATOM 0 HA THR A 116 13.133 12.221 17.449 1.00 0.00 H new ATOM 0 HB THR A 116 11.669 9.871 16.034 1.00 0.00 H new ATOM 0 HG1 THR A 116 10.853 12.427 17.193 1.00 0.00 H new ATOM 0 HG21 THR A 116 10.457 9.610 18.145 1.00 0.00 H new ATOM 0 HG22 THR A 116 12.206 9.403 18.402 1.00 0.00 H new ATOM 0 HG23 THR A 116 11.412 10.925 18.870 1.00 0.00 H new ATOM 1851 N TYR A 117 15.376 10.867 17.269 1.00 0.00 N ATOM 1852 CA TYR A 117 16.328 9.919 17.736 1.00 0.00 C ATOM 1853 C TYR A 117 16.572 10.094 19.248 1.00 0.00 C ATOM 1854 O TYR A 117 17.265 11.053 19.589 1.00 0.00 O ATOM 1855 CB TYR A 117 17.740 10.125 17.174 1.00 0.00 C ATOM 1856 CG TYR A 117 18.153 11.045 16.045 1.00 0.00 C ATOM 1857 CD1 TYR A 117 18.189 12.413 16.208 1.00 0.00 C ATOM 1858 CD2 TYR A 117 18.555 10.617 14.764 1.00 0.00 C ATOM 1859 CE1 TYR A 117 18.585 13.297 15.191 1.00 0.00 C ATOM 1860 CE2 TYR A 117 18.952 11.467 13.738 1.00 0.00 C ATOM 1861 CZ TYR A 117 18.974 12.853 13.944 1.00 0.00 C ATOM 1862 OH TYR A 117 19.375 13.664 12.910 1.00 0.00 O ATOM 0 H TYR A 117 15.719 11.809 17.082 1.00 0.00 H new ATOM 0 HA TYR A 117 15.899 8.963 17.437 1.00 0.00 H new ATOM 0 HB2 TYR A 117 18.348 10.426 18.027 1.00 0.00 H new ATOM 0 HB3 TYR A 117 18.078 9.133 16.875 1.00 0.00 H new ATOM 0 HD1 TYR A 117 17.899 12.825 17.163 1.00 0.00 H new ATOM 0 HD2 TYR A 117 18.555 9.555 14.566 1.00 0.00 H new ATOM 0 HE1 TYR A 117 18.585 14.358 15.392 1.00 0.00 H new ATOM 0 HE2 TYR A 117 19.244 11.059 12.782 1.00 0.00 H new ATOM 0 HH TYR A 117 19.525 14.572 13.246 1.00 0.00 H new ATOM 1872 N THR A 118 16.025 9.167 19.979 1.00 0.00 N ATOM 1873 CA THR A 118 16.010 9.148 21.429 1.00 0.00 C ATOM 1874 C THR A 118 17.004 8.223 22.015 1.00 0.00 C ATOM 1875 O THR A 118 16.638 7.256 22.684 1.00 0.00 O ATOM 1876 CB THR A 118 14.637 8.794 22.050 1.00 0.00 C ATOM 1877 OG1 THR A 118 13.643 9.489 21.311 1.00 0.00 O ATOM 1878 CG2 THR A 118 14.716 9.254 23.470 1.00 0.00 C ATOM 0 H THR A 118 15.552 8.361 19.569 1.00 0.00 H new ATOM 0 HA THR A 118 16.261 10.179 21.677 1.00 0.00 H new ATOM 0 HB THR A 118 14.389 7.733 22.021 1.00 0.00 H new ATOM 0 HG1 THR A 118 12.758 9.284 21.679 1.00 0.00 H new ATOM 0 HG21 THR A 118 13.776 9.036 23.976 1.00 0.00 H new ATOM 0 HG22 THR A 118 15.529 8.734 23.976 1.00 0.00 H new ATOM 0 HG23 THR A 118 14.901 10.328 23.495 1.00 0.00 H new ATOM 1886 N TYR A 119 18.321 8.476 21.855 1.00 0.00 N ATOM 1887 CA TYR A 119 19.343 7.658 22.447 1.00 0.00 C ATOM 1888 C TYR A 119 19.212 7.801 23.969 1.00 0.00 C ATOM 1889 O TYR A 119 19.417 8.831 24.554 1.00 0.00 O ATOM 1890 CB TYR A 119 20.771 8.071 21.990 1.00 0.00 C ATOM 1891 CG TYR A 119 21.199 9.304 22.686 1.00 0.00 C ATOM 1892 CD1 TYR A 119 20.658 10.530 22.327 1.00 0.00 C ATOM 1893 CD2 TYR A 119 22.142 9.179 23.711 1.00 0.00 C ATOM 1894 CE1 TYR A 119 21.090 11.634 23.030 1.00 0.00 C ATOM 1895 CE2 TYR A 119 22.562 10.284 24.396 1.00 0.00 C ATOM 1896 CZ TYR A 119 22.019 11.516 24.038 1.00 0.00 C ATOM 1897 OH TYR A 119 22.399 12.660 24.683 1.00 0.00 O ATOM 0 H TYR A 119 18.681 9.258 21.308 1.00 0.00 H new ATOM 0 HA TYR A 119 19.208 6.624 22.128 1.00 0.00 H new ATOM 0 HB2 TYR A 119 21.474 7.265 22.200 1.00 0.00 H new ATOM 0 HB3 TYR A 119 20.782 8.232 20.912 1.00 0.00 H new ATOM 0 HD1 TYR A 119 19.931 10.615 21.533 1.00 0.00 H new ATOM 0 HD2 TYR A 119 22.539 8.207 23.962 1.00 0.00 H new ATOM 0 HE1 TYR A 119 20.693 12.608 22.786 1.00 0.00 H new ATOM 0 HE2 TYR A 119 23.291 10.205 25.189 1.00 0.00 H new ATOM 0 HH TYR A 119 21.809 12.814 25.450 1.00 0.00 H new ATOM 1907 N GLU A 120 18.843 6.673 24.605 1.00 0.00 N ATOM 1908 CA GLU A 120 18.712 6.691 26.066 1.00 0.00 C ATOM 1909 C GLU A 120 17.658 7.566 26.664 1.00 0.00 C ATOM 1910 O GLU A 120 17.493 7.750 27.858 1.00 0.00 O ATOM 1911 CB GLU A 120 20.149 6.995 26.589 1.00 0.00 C ATOM 1912 CG GLU A 120 20.220 8.161 27.576 1.00 0.00 C ATOM 1913 CD GLU A 120 20.192 7.753 29.050 1.00 0.00 C ATOM 1914 OE1 GLU A 120 19.642 6.783 29.538 1.00 0.00 O ATOM 1915 OE2 GLU A 120 20.855 8.621 29.728 1.00 0.00 O ATOM 0 H GLU A 120 18.640 5.781 24.154 1.00 0.00 H new ATOM 0 HA GLU A 120 18.327 5.725 26.393 1.00 0.00 H new ATOM 0 HB2 GLU A 120 20.546 6.101 27.070 1.00 0.00 H new ATOM 0 HB3 GLU A 120 20.795 7.213 25.739 1.00 0.00 H new ATOM 0 HG2 GLU A 120 21.133 8.725 27.386 1.00 0.00 H new ATOM 0 HG3 GLU A 120 19.384 8.834 27.383 1.00 0.00 H new ATOM 1922 N GLY A 121 16.867 8.164 25.802 1.00 0.00 N ATOM 1923 CA GLY A 121 15.807 9.046 26.226 1.00 0.00 C ATOM 1924 C GLY A 121 15.982 10.498 25.788 1.00 0.00 C ATOM 1925 O GLY A 121 15.285 11.350 26.335 1.00 0.00 O ATOM 0 H GLY A 121 16.941 8.052 24.791 1.00 0.00 H new ATOM 0 HA2 GLY A 121 14.861 8.672 25.834 1.00 0.00 H new ATOM 0 HA3 GLY A 121 15.736 9.013 27.313 1.00 0.00 H new ATOM 1929 N VAL A 122 16.894 10.777 24.821 1.00 0.00 N ATOM 1930 CA VAL A 122 17.092 12.127 24.396 1.00 0.00 C ATOM 1931 C VAL A 122 16.967 12.245 22.872 1.00 0.00 C ATOM 1932 O VAL A 122 17.962 12.272 22.181 1.00 0.00 O ATOM 1933 CB VAL A 122 18.460 12.673 24.898 1.00 0.00 C ATOM 1934 CG1 VAL A 122 18.688 14.127 24.492 1.00 0.00 C ATOM 1935 CG2 VAL A 122 18.539 12.648 26.409 1.00 0.00 C ATOM 0 H VAL A 122 17.475 10.083 24.350 1.00 0.00 H new ATOM 0 HA VAL A 122 16.309 12.741 24.840 1.00 0.00 H new ATOM 0 HB VAL A 122 19.210 12.025 24.444 1.00 0.00 H new ATOM 0 HG11 VAL A 122 19.656 14.462 24.866 1.00 0.00 H new ATOM 0 HG12 VAL A 122 18.671 14.208 23.405 1.00 0.00 H new ATOM 0 HG13 VAL A 122 17.900 14.751 24.915 1.00 0.00 H new ATOM 0 HG21 VAL A 122 19.506 13.035 26.729 1.00 0.00 H new ATOM 0 HG22 VAL A 122 17.744 13.267 26.825 1.00 0.00 H new ATOM 0 HG23 VAL A 122 18.423 11.623 26.762 1.00 0.00 H new ATOM 1945 N GLU A 123 15.754 12.334 22.417 1.00 0.00 N ATOM 1946 CA GLU A 123 15.343 12.503 21.056 1.00 0.00 C ATOM 1947 C GLU A 123 15.935 13.746 20.450 1.00 0.00 C ATOM 1948 O GLU A 123 16.043 14.757 21.135 1.00 0.00 O ATOM 1949 CB GLU A 123 13.817 12.882 21.103 1.00 0.00 C ATOM 1950 CG GLU A 123 13.113 12.571 19.748 1.00 0.00 C ATOM 1951 CD GLU A 123 11.617 12.606 19.648 1.00 0.00 C ATOM 1952 OE1 GLU A 123 10.874 11.821 20.240 1.00 0.00 O ATOM 1953 OE2 GLU A 123 11.103 13.526 18.910 1.00 0.00 O ATOM 0 H GLU A 123 14.954 12.286 23.047 1.00 0.00 H new ATOM 0 HA GLU A 123 15.618 11.602 20.508 1.00 0.00 H new ATOM 0 HB2 GLU A 123 13.328 12.329 21.905 1.00 0.00 H new ATOM 0 HB3 GLU A 123 13.710 13.942 21.336 1.00 0.00 H new ATOM 0 HG2 GLU A 123 13.502 13.275 19.013 1.00 0.00 H new ATOM 0 HG3 GLU A 123 13.434 11.577 19.438 1.00 0.00 H new ATOM 1960 N ALA A 124 16.281 13.597 19.165 1.00 0.00 N ATOM 1961 CA ALA A 124 16.854 14.754 18.463 1.00 0.00 C ATOM 1962 C ALA A 124 16.155 14.839 17.121 1.00 0.00 C ATOM 1963 O ALA A 124 16.114 13.990 16.280 1.00 0.00 O ATOM 1964 CB ALA A 124 18.347 14.755 18.327 1.00 0.00 C ATOM 0 H ALA A 124 16.184 12.743 18.616 1.00 0.00 H new ATOM 0 HA ALA A 124 16.678 15.643 19.069 1.00 0.00 H new ATOM 0 HB1 ALA A 124 18.663 15.652 17.794 1.00 0.00 H new ATOM 0 HB2 ALA A 124 18.803 14.741 19.317 1.00 0.00 H new ATOM 0 HB3 ALA A 124 18.662 13.872 17.770 1.00 0.00 H new ATOM 1970 N LYS A 125 15.508 15.996 16.927 1.00 0.00 N ATOM 1971 CA LYS A 125 14.754 16.124 15.684 1.00 0.00 C ATOM 1972 C LYS A 125 14.519 17.575 15.453 1.00 0.00 C ATOM 1973 O LYS A 125 15.099 18.394 16.188 1.00 0.00 O ATOM 1974 CB LYS A 125 13.399 15.355 15.780 1.00 0.00 C ATOM 1975 CG LYS A 125 13.259 14.648 17.120 1.00 0.00 C ATOM 1976 CD LYS A 125 13.034 15.661 18.279 1.00 0.00 C ATOM 1977 CE LYS A 125 12.047 16.797 18.006 1.00 0.00 C ATOM 1978 NZ LYS A 125 12.202 17.814 19.059 1.00 0.00 N ATOM 0 H LYS A 125 15.490 16.795 17.560 1.00 0.00 H new ATOM 0 HA LYS A 125 15.312 15.691 14.854 1.00 0.00 H new ATOM 0 HB2 LYS A 125 12.572 16.053 15.646 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.334 14.625 14.973 1.00 0.00 H new ATOM 0 HG2 LYS A 125 12.423 13.950 17.078 1.00 0.00 H new ATOM 0 HG3 LYS A 125 14.156 14.061 17.318 1.00 0.00 H new ATOM 0 HD2 LYS A 125 12.687 15.109 19.153 1.00 0.00 H new ATOM 0 HD3 LYS A 125 13.997 16.100 18.541 1.00 0.00 H new ATOM 0 HE2 LYS A 125 12.235 17.235 17.026 1.00 0.00 H new ATOM 0 HE3 LYS A 125 11.026 16.417 17.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 11.537 18.595 18.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 12.003 17.387 19.986 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 13.175 18.180 19.048 1.00 0.00 H new ATOM 1992 N ARG A 126 13.709 17.954 14.498 1.00 0.00 N ATOM 1993 CA ARG A 126 13.376 19.337 14.191 1.00 0.00 C ATOM 1994 C ARG A 126 12.595 19.209 12.901 1.00 0.00 C ATOM 1995 O ARG A 126 11.572 19.837 12.835 1.00 0.00 O ATOM 1996 CB ARG A 126 14.463 20.338 13.995 1.00 0.00 C ATOM 1997 CG ARG A 126 14.756 21.020 15.283 1.00 0.00 C ATOM 1998 CD ARG A 126 14.017 22.349 15.271 1.00 0.00 C ATOM 1999 NE ARG A 126 13.383 22.568 16.543 1.00 0.00 N ATOM 2000 CZ ARG A 126 13.153 23.755 17.055 1.00 0.00 C ATOM 2001 NH1 ARG A 126 13.474 24.900 16.467 1.00 0.00 N ATOM 2002 NH2 ARG A 126 12.561 23.812 18.239 1.00 0.00 N ATOM 0 H ARG A 126 13.241 17.288 13.884 1.00 0.00 H new ATOM 0 HA ARG A 126 12.875 19.749 15.067 1.00 0.00 H new ATOM 0 HB2 ARG A 126 15.361 19.846 13.621 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.165 21.070 13.245 1.00 0.00 H new ATOM 0 HG2 ARG A 126 14.431 20.408 16.124 1.00 0.00 H new ATOM 0 HG3 ARG A 126 15.828 21.178 15.399 1.00 0.00 H new ATOM 0 HD2 ARG A 126 14.713 23.160 15.057 1.00 0.00 H new ATOM 0 HD3 ARG A 126 13.270 22.353 14.477 1.00 0.00 H new ATOM 0 HE ARG A 126 13.094 21.751 17.081 1.00 0.00 H new ATOM 0 HH11 ARG A 126 13.931 24.894 15.555 1.00 0.00 H new ATOM 0 HH12 ARG A 126 13.263 25.786 16.927 1.00 0.00 H new ATOM 0 HH21 ARG A 126 12.300 22.952 18.721 1.00 0.00 H new ATOM 0 HH22 ARG A 126 12.366 24.716 18.669 1.00 0.00 H new ATOM 2016 N ILE A 127 13.116 18.393 11.972 1.00 0.00 N ATOM 2017 CA ILE A 127 12.521 18.030 10.727 1.00 0.00 C ATOM 2018 C ILE A 127 13.301 18.368 9.519 1.00 0.00 C ATOM 2019 O ILE A 127 14.172 19.230 9.539 1.00 0.00 O ATOM 2020 CB ILE A 127 11.064 18.550 10.541 1.00 0.00 C ATOM 2021 CG1 ILE A 127 10.168 17.764 11.476 1.00 0.00 C ATOM 2022 CG2 ILE A 127 10.474 18.474 9.129 1.00 0.00 C ATOM 2023 CD1 ILE A 127 10.758 17.192 12.760 1.00 0.00 C ATOM 0 H ILE A 127 14.027 17.952 12.103 1.00 0.00 H new ATOM 0 HA ILE A 127 12.508 16.943 10.813 1.00 0.00 H new ATOM 0 HB ILE A 127 11.113 19.617 10.760 1.00 0.00 H new ATOM 0 HG12 ILE A 127 9.337 18.411 11.756 1.00 0.00 H new ATOM 0 HG13 ILE A 127 9.748 16.933 10.908 1.00 0.00 H new ATOM 0 HG21 ILE A 127 9.457 18.867 9.138 1.00 0.00 H new ATOM 0 HG22 ILE A 127 11.085 19.065 8.447 1.00 0.00 H new ATOM 0 HG23 ILE A 127 10.459 17.436 8.796 1.00 0.00 H new ATOM 0 HD11 ILE A 127 9.983 16.660 13.311 1.00 0.00 H new ATOM 0 HD12 ILE A 127 11.566 16.503 12.514 1.00 0.00 H new ATOM 0 HD13 ILE A 127 11.148 18.004 13.374 1.00 0.00 H new ATOM 2035 N PHE A 128 12.869 17.613 8.480 1.00 0.00 N ATOM 2036 CA PHE A 128 13.237 17.584 7.148 1.00 0.00 C ATOM 2037 C PHE A 128 13.340 18.925 6.416 1.00 0.00 C ATOM 2038 O PHE A 128 12.695 19.891 6.783 1.00 0.00 O ATOM 2039 CB PHE A 128 12.157 16.855 6.297 1.00 0.00 C ATOM 2040 CG PHE A 128 10.801 17.567 6.130 1.00 0.00 C ATOM 2041 CD1 PHE A 128 10.642 18.751 5.429 1.00 0.00 C ATOM 2042 CD2 PHE A 128 9.623 17.056 6.666 1.00 0.00 C ATOM 2043 CE1 PHE A 128 9.467 19.441 5.222 1.00 0.00 C ATOM 2044 CE2 PHE A 128 8.425 17.717 6.486 1.00 0.00 C ATOM 2045 CZ PHE A 128 8.318 18.900 5.773 1.00 0.00 C ATOM 0 H PHE A 128 12.139 16.921 8.648 1.00 0.00 H new ATOM 0 HA PHE A 128 14.218 17.113 7.215 1.00 0.00 H new ATOM 0 HB2 PHE A 128 12.571 16.677 5.304 1.00 0.00 H new ATOM 0 HB3 PHE A 128 11.974 15.879 6.746 1.00 0.00 H new ATOM 0 HD1 PHE A 128 11.535 19.180 4.998 1.00 0.00 H new ATOM 0 HD2 PHE A 128 9.646 16.134 7.228 1.00 0.00 H new ATOM 0 HE1 PHE A 128 9.444 20.361 4.656 1.00 0.00 H new ATOM 0 HE2 PHE A 128 7.531 17.293 6.920 1.00 0.00 H new ATOM 0 HZ PHE A 128 7.362 19.388 5.650 1.00 0.00 H new ATOM 2055 N LYS A 129 14.119 18.753 5.348 1.00 0.00 N ATOM 2056 CA LYS A 129 14.376 19.779 4.396 1.00 0.00 C ATOM 2057 C LYS A 129 13.515 19.502 3.168 1.00 0.00 C ATOM 2058 O LYS A 129 13.354 20.453 2.431 1.00 0.00 O ATOM 2059 CB LYS A 129 15.739 20.306 4.103 1.00 0.00 C ATOM 2060 CG LYS A 129 16.372 21.034 5.298 1.00 0.00 C ATOM 2061 CD LYS A 129 17.692 21.681 4.951 1.00 0.00 C ATOM 2062 CE LYS A 129 17.517 22.717 3.830 1.00 0.00 C ATOM 2063 NZ LYS A 129 18.745 23.431 3.455 1.00 0.00 N ATOM 0 H LYS A 129 14.588 17.872 5.136 1.00 0.00 H new ATOM 0 HA LYS A 129 14.098 20.680 4.942 1.00 0.00 H new ATOM 0 HB2 LYS A 129 16.385 19.480 3.804 1.00 0.00 H new ATOM 0 HB3 LYS A 129 15.684 20.990 3.256 1.00 0.00 H new ATOM 0 HG2 LYS A 129 15.682 21.796 5.661 1.00 0.00 H new ATOM 0 HG3 LYS A 129 16.522 20.325 6.113 1.00 0.00 H new ATOM 0 HD2 LYS A 129 18.109 22.163 5.835 1.00 0.00 H new ATOM 0 HD3 LYS A 129 18.405 20.918 4.638 1.00 0.00 H new ATOM 0 HE2 LYS A 129 17.122 22.214 2.948 1.00 0.00 H new ATOM 0 HE3 LYS A 129 16.770 23.447 4.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 18.534 24.108 2.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 19.115 23.943 4.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 19.456 22.748 3.124 1.00 0.00 H new ATOM 2077 N LYS A 130 13.039 18.305 3.124 1.00 0.00 N ATOM 2078 CA LYS A 130 12.295 17.760 2.039 1.00 0.00 C ATOM 2079 C LYS A 130 12.817 18.325 0.735 1.00 0.00 C ATOM 2080 O LYS A 130 13.304 19.448 0.535 1.00 0.00 O ATOM 2081 CB LYS A 130 10.787 17.871 2.144 1.00 0.00 C ATOM 2082 CG LYS A 130 9.996 17.879 0.804 1.00 0.00 C ATOM 2083 CD LYS A 130 9.344 19.190 0.424 1.00 0.00 C ATOM 2084 CE LYS A 130 7.904 19.378 0.945 1.00 0.00 C ATOM 2085 NZ LYS A 130 7.679 20.755 1.379 1.00 0.00 N ATOM 0 H LYS A 130 13.166 17.642 3.888 1.00 0.00 H new ATOM 0 HA LYS A 130 12.461 16.683 2.078 1.00 0.00 H new ATOM 0 HB2 LYS A 130 10.425 17.039 2.749 1.00 0.00 H new ATOM 0 HB3 LYS A 130 10.549 18.786 2.686 1.00 0.00 H new ATOM 0 HG2 LYS A 130 10.676 17.589 0.003 1.00 0.00 H new ATOM 0 HG3 LYS A 130 9.222 17.114 0.858 1.00 0.00 H new ATOM 0 HD2 LYS A 130 9.960 20.007 0.800 1.00 0.00 H new ATOM 0 HD3 LYS A 130 9.335 19.272 -0.663 1.00 0.00 H new ATOM 0 HE2 LYS A 130 7.193 19.120 0.160 1.00 0.00 H new ATOM 0 HE3 LYS A 130 7.723 18.697 1.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 6.703 20.855 1.725 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 8.343 20.991 2.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 7.830 21.401 0.578 1.00 0.00 H new ATOM 2099 N GLU A 131 12.651 17.409 -0.245 1.00 0.00 N ATOM 2100 CA GLU A 131 13.097 17.731 -1.640 1.00 0.00 C ATOM 2101 C GLU A 131 12.385 17.089 -2.778 1.00 0.00 C ATOM 2102 O GLU A 131 12.863 16.897 -3.906 1.00 0.00 O ATOM 2103 CB GLU A 131 14.631 17.808 -1.490 1.00 0.00 C ATOM 2104 CG GLU A 131 15.600 18.528 -2.418 1.00 0.00 C ATOM 2105 CD GLU A 131 15.297 20.038 -2.552 1.00 0.00 C ATOM 2106 OE1 GLU A 131 14.903 20.754 -1.562 1.00 0.00 O ATOM 2107 OE2 GLU A 131 15.452 20.605 -3.704 1.00 0.00 O ATOM 2108 OXT GLU A 131 11.301 17.961 -2.079 1.00 0.00 O ATOM 0 H GLU A 131 12.236 16.486 -0.120 1.00 0.00 H new ATOM 0 HA GLU A 131 12.751 18.677 -2.057 1.00 0.00 H new ATOM 0 HB2 GLU A 131 14.806 18.232 -0.501 1.00 0.00 H new ATOM 0 HB3 GLU A 131 14.973 16.773 -1.458 1.00 0.00 H new ATOM 0 HG2 GLU A 131 16.616 18.398 -2.045 1.00 0.00 H new ATOM 0 HG3 GLU A 131 15.561 18.066 -3.405 1.00 0.00 H new