USER MOD reduce.3.24.130724 H: found=0, std=0, add=880, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 883 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 90 ASN : amide:sc= -0.286 K(o=-0.28,f=-1.9) USER MOD Set 1.2: A 94 ASN : amide:sc= 0.00352 X(o=-0.28,f=-0.65) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 164:sc= -0.0994 (180deg=-0.367) USER MOD Single : A 73 LYS NZ :NH3+ -169:sc= -0.0234 (180deg=-0.209) USER MOD Single : A 74 SER OG : rot -29:sc= 1.25 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 SER OG : rot 180:sc= -0.15 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 GLN : amide:sc= -0.159 X(o=-0.16,f=-0.3) USER MOD Single : A 86 ASN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00215) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 CYS SG : rot 73:sc= 0.541 USER MOD Single : A 95 HIS : no HD1:sc= -0.41 X(o=-0.41,f=-0.012) USER MOD Single : A 97 SER OG : rot -23:sc= 1.25 USER MOD Single : A 100 TYR OH : rot -144:sc= -0.184 USER MOD Single : A 101 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ 172:sc= 1.03 (180deg=0.989) USER MOD Single : A 103 SER OG : rot 37:sc= 0.299 USER MOD Single : A 105 SER OG : rot -26:sc= 0.248 USER MOD Single : A 113 GLN : amide:sc= -0.0942 X(o=-0.094,f=-0.13) USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 ASN : amide:sc= -0.0396 X(o=-0.04,f=0) USER MOD Single : A 119 THR OG1 : rot 76:sc= 1.23 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 ASN : amide:sc= -0.368! X(o=-0.37!,f=-0.069) USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 ASN : amide:sc= 1.19 K(o=1.2,f=-0.034) USER MOD Single : A 132 THR OG1 : rot 82:sc= 1.26 USER MOD Single : A 134 SER OG : rot -5:sc= 0.977 USER MOD Single : A 135 GLN :FLIP amide:sc= -0.817 F(o=-2,f=-0.82) USER MOD Single : A 143 ASN : amide:sc= 1.1 K(o=1.1,f=-0.068) USER MOD Single : A 149 ASN : amide:sc= -0.394 K(o=-0.39,f=-5.3!) USER MOD Single : A 153 TYR OH : rot 180:sc= 0 USER MOD Single : A 158 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0338) USER MOD Single : A 163 HIS : no HE2:sc= 1.17 K(o=1.2,f=-6.1!) USER MOD Single : A 164 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 165 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 166 HIS : no HD1:sc= -1.81! X(o=-1.8!,f=-1.6) USER MOD Single : A 167 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 168 HIS : no HD1:sc= -0.339 X(o=-0.34,f=-0.18) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 61 -7.262 -5.203 15.041 1.00 0.00 N ATOM 2 CA ARG A 61 -5.837 -5.279 14.657 1.00 0.00 C ATOM 3 C ARG A 61 -5.622 -6.441 13.698 1.00 0.00 C ATOM 4 O ARG A 61 -5.454 -7.585 14.119 1.00 0.00 O ATOM 5 CB ARG A 61 -4.956 -5.449 15.897 1.00 0.00 C ATOM 6 CG ARG A 61 -3.468 -5.318 15.611 1.00 0.00 C ATOM 7 CD ARG A 61 -2.632 -5.661 16.833 1.00 0.00 C ATOM 8 NE ARG A 61 -2.937 -4.799 17.974 1.00 0.00 N ATOM 9 CZ ARG A 61 -2.939 -5.216 19.240 1.00 0.00 C ATOM 10 NH1 ARG A 61 -2.763 -6.503 19.518 1.00 0.00 N ATOM 11 NH2 ARG A 61 -3.147 -4.350 20.224 1.00 0.00 N ATOM 0 HA ARG A 61 -5.558 -4.350 14.160 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -5.241 -4.704 16.640 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -5.148 -6.428 16.337 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -3.196 -5.977 14.786 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -3.246 -4.300 15.292 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -2.806 -6.701 17.109 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -1.575 -5.570 16.584 1.00 0.00 H new ATOM 0 HE ARG A 61 -3.161 -3.821 17.790 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -2.626 -7.174 18.762 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -2.765 -6.820 20.487 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -3.305 -3.365 20.012 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -3.148 -4.669 21.193 1.00 0.00 H new ATOM 27 N ASP A 62 -5.653 -6.144 12.408 1.00 0.00 N ATOM 28 CA ASP A 62 -5.512 -7.171 11.381 1.00 0.00 C ATOM 29 C ASP A 62 -4.209 -6.999 10.622 1.00 0.00 C ATOM 30 O ASP A 62 -3.399 -6.123 10.943 1.00 0.00 O ATOM 31 CB ASP A 62 -6.686 -7.129 10.399 1.00 0.00 C ATOM 32 CG ASP A 62 -8.013 -7.429 11.061 1.00 0.00 C ATOM 33 OD1 ASP A 62 -8.652 -6.484 11.573 1.00 0.00 O ATOM 34 OD2 ASP A 62 -8.426 -8.609 11.072 1.00 0.00 O ATOM 0 H ASP A 62 -5.775 -5.199 12.044 1.00 0.00 H new ATOM 0 HA ASP A 62 -5.506 -8.139 11.882 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -6.731 -6.144 9.935 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -6.512 -7.850 9.600 1.00 0.00 H new ATOM 39 N SER A 63 -4.018 -7.829 9.609 1.00 0.00 N ATOM 40 CA SER A 63 -2.795 -7.811 8.834 1.00 0.00 C ATOM 41 C SER A 63 -2.938 -6.930 7.602 1.00 0.00 C ATOM 42 O SER A 63 -4.053 -6.656 7.128 1.00 0.00 O ATOM 43 CB SER A 63 -2.415 -9.233 8.424 1.00 0.00 C ATOM 44 OG SER A 63 -2.362 -10.088 9.555 1.00 0.00 O ATOM 0 H SER A 63 -4.699 -8.525 9.306 1.00 0.00 H new ATOM 0 HA SER A 63 -2.004 -7.394 9.457 1.00 0.00 H new ATOM 0 HB2 SER A 63 -3.142 -9.616 7.707 1.00 0.00 H new ATOM 0 HB3 SER A 63 -1.447 -9.225 7.923 1.00 0.00 H new ATOM 0 HG SER A 63 -2.119 -10.993 9.270 1.00 0.00 H new ATOM 50 N PHE A 64 -1.799 -6.491 7.087 1.00 0.00 N ATOM 51 CA PHE A 64 -1.762 -5.650 5.906 1.00 0.00 C ATOM 52 C PHE A 64 -2.395 -6.369 4.726 1.00 0.00 C ATOM 53 O PHE A 64 -3.085 -5.754 3.922 1.00 0.00 O ATOM 54 CB PHE A 64 -0.317 -5.261 5.585 1.00 0.00 C ATOM 55 CG PHE A 64 -0.178 -4.305 4.436 1.00 0.00 C ATOM 56 CD1 PHE A 64 -0.485 -2.963 4.597 1.00 0.00 C ATOM 57 CD2 PHE A 64 0.270 -4.744 3.201 1.00 0.00 C ATOM 58 CE1 PHE A 64 -0.348 -2.077 3.548 1.00 0.00 C ATOM 59 CE2 PHE A 64 0.406 -3.861 2.147 1.00 0.00 C ATOM 60 CZ PHE A 64 0.097 -2.526 2.322 1.00 0.00 C ATOM 0 H PHE A 64 -0.881 -6.708 7.475 1.00 0.00 H new ATOM 0 HA PHE A 64 -2.333 -4.742 6.101 1.00 0.00 H new ATOM 0 HB2 PHE A 64 0.133 -4.814 6.472 1.00 0.00 H new ATOM 0 HB3 PHE A 64 0.250 -6.165 5.362 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -0.835 -2.607 5.554 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.515 -5.786 3.061 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -0.589 -1.033 3.687 1.00 0.00 H new ATOM 0 HE2 PHE A 64 0.754 -4.214 1.187 1.00 0.00 H new ATOM 0 HZ PHE A 64 0.204 -1.834 1.499 1.00 0.00 H new ATOM 70 N GLY A 65 -2.171 -7.677 4.644 1.00 0.00 N ATOM 71 CA GLY A 65 -2.767 -8.476 3.589 1.00 0.00 C ATOM 72 C GLY A 65 -4.282 -8.401 3.583 1.00 0.00 C ATOM 73 O GLY A 65 -4.899 -8.309 2.521 1.00 0.00 O ATOM 0 H GLY A 65 -1.584 -8.200 5.294 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -2.387 -8.139 2.625 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -2.459 -9.515 3.708 1.00 0.00 H new ATOM 77 N ASP A 66 -4.879 -8.427 4.773 1.00 0.00 N ATOM 78 CA ASP A 66 -6.331 -8.341 4.911 1.00 0.00 C ATOM 79 C ASP A 66 -6.852 -7.042 4.320 1.00 0.00 C ATOM 80 O ASP A 66 -7.749 -7.036 3.470 1.00 0.00 O ATOM 81 CB ASP A 66 -6.747 -8.409 6.385 1.00 0.00 C ATOM 82 CG ASP A 66 -6.454 -9.746 7.027 1.00 0.00 C ATOM 83 OD1 ASP A 66 -5.324 -9.936 7.521 1.00 0.00 O ATOM 84 OD2 ASP A 66 -7.361 -10.605 7.062 1.00 0.00 O ATOM 0 H ASP A 66 -4.378 -8.507 5.658 1.00 0.00 H new ATOM 0 HA ASP A 66 -6.758 -9.187 4.373 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -6.228 -7.626 6.938 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -7.814 -8.202 6.464 1.00 0.00 H new ATOM 89 N TRP A 67 -6.275 -5.937 4.768 1.00 0.00 N ATOM 90 CA TRP A 67 -6.742 -4.623 4.351 1.00 0.00 C ATOM 91 C TRP A 67 -6.274 -4.272 2.942 1.00 0.00 C ATOM 92 O TRP A 67 -6.900 -3.460 2.264 1.00 0.00 O ATOM 93 CB TRP A 67 -6.313 -3.565 5.366 1.00 0.00 C ATOM 94 CG TRP A 67 -7.093 -3.670 6.639 1.00 0.00 C ATOM 95 CD1 TRP A 67 -6.792 -4.435 7.731 1.00 0.00 C ATOM 96 CD2 TRP A 67 -8.324 -3.004 6.939 1.00 0.00 C ATOM 97 NE1 TRP A 67 -7.767 -4.288 8.689 1.00 0.00 N ATOM 98 CE2 TRP A 67 -8.716 -3.415 8.226 1.00 0.00 C ATOM 99 CE3 TRP A 67 -9.133 -2.099 6.243 1.00 0.00 C ATOM 100 CZ2 TRP A 67 -9.884 -2.955 8.827 1.00 0.00 C ATOM 101 CZ3 TRP A 67 -10.291 -1.643 6.842 1.00 0.00 C ATOM 102 CH2 TRP A 67 -10.657 -2.072 8.123 1.00 0.00 C ATOM 0 H TRP A 67 -5.488 -5.923 5.416 1.00 0.00 H new ATOM 0 HA TRP A 67 -7.831 -4.647 4.318 1.00 0.00 H new ATOM 0 HB2 TRP A 67 -5.250 -3.676 5.580 1.00 0.00 H new ATOM 0 HB3 TRP A 67 -6.449 -2.572 4.937 1.00 0.00 H new ATOM 0 HD1 TRP A 67 -5.918 -5.062 7.827 1.00 0.00 H new ATOM 0 HE1 TRP A 67 -7.782 -4.753 9.597 1.00 0.00 H new ATOM 0 HE3 TRP A 67 -8.857 -1.763 5.255 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -10.171 -3.284 9.815 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 -10.924 -0.945 6.314 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -11.569 -1.698 8.565 1.00 0.00 H new ATOM 113 N ALA A 68 -5.194 -4.897 2.496 1.00 0.00 N ATOM 114 CA ALA A 68 -4.711 -4.702 1.134 1.00 0.00 C ATOM 115 C ALA A 68 -5.737 -5.198 0.127 1.00 0.00 C ATOM 116 O ALA A 68 -6.088 -4.491 -0.815 1.00 0.00 O ATOM 117 CB ALA A 68 -3.381 -5.412 0.925 1.00 0.00 C ATOM 0 H ALA A 68 -4.636 -5.542 3.055 1.00 0.00 H new ATOM 0 HA ALA A 68 -4.559 -3.634 0.979 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -3.040 -5.253 -0.098 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -2.642 -5.013 1.620 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -3.507 -6.480 1.103 1.00 0.00 H new ATOM 123 N GLU A 69 -6.239 -6.408 0.341 1.00 0.00 N ATOM 124 CA GLU A 69 -7.226 -6.977 -0.562 1.00 0.00 C ATOM 125 C GLU A 69 -8.584 -6.321 -0.366 1.00 0.00 C ATOM 126 O GLU A 69 -9.424 -6.343 -1.266 1.00 0.00 O ATOM 127 CB GLU A 69 -7.321 -8.492 -0.397 1.00 0.00 C ATOM 128 CG GLU A 69 -6.073 -9.214 -0.873 1.00 0.00 C ATOM 129 CD GLU A 69 -6.315 -10.677 -1.178 1.00 0.00 C ATOM 130 OE1 GLU A 69 -7.012 -10.965 -2.175 1.00 0.00 O ATOM 131 OE2 GLU A 69 -5.802 -11.542 -0.435 1.00 0.00 O ATOM 0 H GLU A 69 -5.981 -7.008 1.125 1.00 0.00 H new ATOM 0 HA GLU A 69 -6.898 -6.776 -1.582 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -7.494 -8.729 0.653 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.183 -8.860 -0.953 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -5.693 -8.720 -1.768 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -5.299 -9.131 -0.110 1.00 0.00 H new ATOM 138 N LYS A 70 -8.799 -5.729 0.801 1.00 0.00 N ATOM 139 CA LYS A 70 -10.001 -4.940 1.024 1.00 0.00 C ATOM 140 C LYS A 70 -9.950 -3.678 0.168 1.00 0.00 C ATOM 141 O LYS A 70 -10.946 -3.283 -0.443 1.00 0.00 O ATOM 142 CB LYS A 70 -10.157 -4.582 2.501 1.00 0.00 C ATOM 143 CG LYS A 70 -11.445 -3.837 2.805 1.00 0.00 C ATOM 144 CD LYS A 70 -11.656 -3.686 4.297 1.00 0.00 C ATOM 145 CE LYS A 70 -12.967 -2.986 4.605 1.00 0.00 C ATOM 146 NZ LYS A 70 -14.133 -3.712 4.036 1.00 0.00 N ATOM 0 H LYS A 70 -8.165 -5.779 1.598 1.00 0.00 H new ATOM 0 HA LYS A 70 -10.868 -5.534 0.735 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -10.125 -5.496 3.095 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -9.310 -3.970 2.811 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -11.417 -2.852 2.338 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -12.288 -4.372 2.369 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -11.648 -4.669 4.768 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -10.830 -3.119 4.727 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -13.086 -2.898 5.685 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -12.940 -1.973 4.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -15.007 -3.370 4.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -14.180 -3.544 3.011 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -14.029 -4.731 4.215 1.00 0.00 H new ATOM 160 N PHE A 71 -8.774 -3.058 0.111 1.00 0.00 N ATOM 161 CA PHE A 71 -8.553 -1.918 -0.764 1.00 0.00 C ATOM 162 C PHE A 71 -8.752 -2.332 -2.217 1.00 0.00 C ATOM 163 O PHE A 71 -9.401 -1.629 -2.991 1.00 0.00 O ATOM 164 CB PHE A 71 -7.146 -1.349 -0.564 1.00 0.00 C ATOM 165 CG PHE A 71 -6.790 -0.261 -1.538 1.00 0.00 C ATOM 166 CD1 PHE A 71 -7.442 0.961 -1.500 1.00 0.00 C ATOM 167 CD2 PHE A 71 -5.806 -0.462 -2.496 1.00 0.00 C ATOM 168 CE1 PHE A 71 -7.122 1.962 -2.397 1.00 0.00 C ATOM 169 CE2 PHE A 71 -5.482 0.536 -3.395 1.00 0.00 C ATOM 170 CZ PHE A 71 -6.141 1.750 -3.347 1.00 0.00 C ATOM 0 H PHE A 71 -7.960 -3.329 0.663 1.00 0.00 H new ATOM 0 HA PHE A 71 -9.276 -1.141 -0.513 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -7.063 -0.958 0.450 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -6.420 -2.157 -0.655 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -8.210 1.133 -0.760 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -5.288 -1.409 -2.539 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -7.638 2.910 -2.356 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -4.714 0.367 -4.135 1.00 0.00 H new ATOM 0 HZ PHE A 71 -5.890 2.531 -4.050 1.00 0.00 H new ATOM 180 N LEU A 72 -8.204 -3.486 -2.577 1.00 0.00 N ATOM 181 CA LEU A 72 -8.376 -4.032 -3.916 1.00 0.00 C ATOM 182 C LEU A 72 -9.858 -4.193 -4.237 1.00 0.00 C ATOM 183 O LEU A 72 -10.315 -3.833 -5.321 1.00 0.00 O ATOM 184 CB LEU A 72 -7.673 -5.386 -4.030 1.00 0.00 C ATOM 185 CG LEU A 72 -6.174 -5.366 -3.726 1.00 0.00 C ATOM 186 CD1 LEU A 72 -5.592 -6.767 -3.810 1.00 0.00 C ATOM 187 CD2 LEU A 72 -5.449 -4.426 -4.673 1.00 0.00 C ATOM 0 H LEU A 72 -7.635 -4.063 -1.958 1.00 0.00 H new ATOM 0 HA LEU A 72 -7.932 -3.339 -4.630 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -8.157 -6.087 -3.350 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -7.818 -5.769 -5.040 1.00 0.00 H new ATOM 0 HG LEU A 72 -6.036 -5.000 -2.709 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -4.525 -6.731 -3.591 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -6.090 -7.412 -3.086 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -5.743 -7.164 -4.814 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -4.384 -4.426 -4.441 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -5.596 -4.760 -5.700 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -5.846 -3.417 -4.559 1.00 0.00 H new ATOM 199 N LYS A 73 -10.604 -4.712 -3.271 1.00 0.00 N ATOM 200 CA LYS A 73 -12.032 -4.939 -3.434 1.00 0.00 C ATOM 201 C LYS A 73 -12.784 -3.621 -3.617 1.00 0.00 C ATOM 202 O LYS A 73 -13.739 -3.549 -4.395 1.00 0.00 O ATOM 203 CB LYS A 73 -12.586 -5.702 -2.231 1.00 0.00 C ATOM 204 CG LYS A 73 -14.058 -6.065 -2.358 1.00 0.00 C ATOM 205 CD LYS A 73 -14.523 -6.923 -1.194 1.00 0.00 C ATOM 206 CE LYS A 73 -13.762 -8.240 -1.128 1.00 0.00 C ATOM 207 NZ LYS A 73 -13.929 -9.047 -2.367 1.00 0.00 N ATOM 0 H LYS A 73 -10.239 -4.986 -2.359 1.00 0.00 H new ATOM 0 HA LYS A 73 -12.178 -5.538 -4.333 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -12.007 -6.615 -2.094 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -12.446 -5.098 -1.334 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -14.656 -5.155 -2.402 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -14.222 -6.599 -3.294 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -14.386 -6.376 -0.261 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -15.590 -7.123 -1.293 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -12.703 -8.038 -0.968 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -14.110 -8.817 -0.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -13.555 -10.005 -2.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -14.939 -9.105 -2.610 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -13.410 -8.596 -3.148 1.00 0.00 H new ATOM 221 N SER A 74 -12.354 -2.576 -2.911 1.00 0.00 N ATOM 222 CA SER A 74 -13.004 -1.278 -3.037 1.00 0.00 C ATOM 223 C SER A 74 -12.734 -0.677 -4.416 1.00 0.00 C ATOM 224 O SER A 74 -13.594 -0.013 -4.983 1.00 0.00 O ATOM 225 CB SER A 74 -12.562 -0.320 -1.920 1.00 0.00 C ATOM 226 OG SER A 74 -11.191 0.026 -2.023 1.00 0.00 O ATOM 0 H SER A 74 -11.572 -2.603 -2.257 1.00 0.00 H new ATOM 0 HA SER A 74 -14.079 -1.427 -2.932 1.00 0.00 H new ATOM 0 HB2 SER A 74 -13.167 0.585 -1.960 1.00 0.00 H new ATOM 0 HB3 SER A 74 -12.746 -0.785 -0.951 1.00 0.00 H new ATOM 0 HG SER A 74 -10.700 -0.707 -2.450 1.00 0.00 H new ATOM 232 N LYS A 75 -11.546 -0.935 -4.961 1.00 0.00 N ATOM 233 CA LYS A 75 -11.210 -0.495 -6.313 1.00 0.00 C ATOM 234 C LYS A 75 -12.011 -1.292 -7.334 1.00 0.00 C ATOM 235 O LYS A 75 -12.488 -0.750 -8.333 1.00 0.00 O ATOM 236 CB LYS A 75 -9.710 -0.670 -6.588 1.00 0.00 C ATOM 237 CG LYS A 75 -8.785 0.116 -5.662 1.00 0.00 C ATOM 238 CD LYS A 75 -8.881 1.623 -5.878 1.00 0.00 C ATOM 239 CE LYS A 75 -10.015 2.245 -5.077 1.00 0.00 C ATOM 240 NZ LYS A 75 -10.101 3.713 -5.281 1.00 0.00 N ATOM 0 H LYS A 75 -10.801 -1.446 -4.487 1.00 0.00 H new ATOM 0 HA LYS A 75 -11.459 0.563 -6.398 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -9.463 -1.729 -6.509 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -9.508 -0.371 -7.617 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -9.032 -0.115 -4.626 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -7.756 -0.206 -5.824 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -7.938 2.090 -5.594 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -9.032 1.828 -6.938 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -10.959 1.783 -5.366 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -9.868 2.034 -4.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -10.886 4.096 -4.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -9.210 4.158 -4.981 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -10.267 3.914 -6.288 1.00 0.00 H new ATOM 254 N GLU A 76 -12.155 -2.579 -7.058 1.00 0.00 N ATOM 255 CA GLU A 76 -12.938 -3.477 -7.897 1.00 0.00 C ATOM 256 C GLU A 76 -14.374 -2.976 -8.038 1.00 0.00 C ATOM 257 O GLU A 76 -14.929 -2.937 -9.136 1.00 0.00 O ATOM 258 CB GLU A 76 -12.931 -4.874 -7.279 1.00 0.00 C ATOM 259 CG GLU A 76 -13.689 -5.909 -8.084 1.00 0.00 C ATOM 260 CD GLU A 76 -13.766 -7.240 -7.376 1.00 0.00 C ATOM 261 OE1 GLU A 76 -12.748 -7.959 -7.339 1.00 0.00 O ATOM 262 OE2 GLU A 76 -14.843 -7.564 -6.835 1.00 0.00 O ATOM 0 H GLU A 76 -11.733 -3.031 -6.247 1.00 0.00 H new ATOM 0 HA GLU A 76 -12.492 -3.510 -8.891 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -11.898 -5.204 -7.164 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -13.362 -4.820 -6.279 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -14.698 -5.546 -8.281 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -13.203 -6.042 -9.051 1.00 0.00 H new ATOM 269 N ALA A 77 -14.961 -2.590 -6.917 1.00 0.00 N ATOM 270 CA ALA A 77 -16.326 -2.082 -6.899 1.00 0.00 C ATOM 271 C ALA A 77 -16.384 -0.615 -7.325 1.00 0.00 C ATOM 272 O ALA A 77 -17.437 -0.112 -7.715 1.00 0.00 O ATOM 273 CB ALA A 77 -16.929 -2.250 -5.514 1.00 0.00 C ATOM 0 H ALA A 77 -14.512 -2.619 -6.002 1.00 0.00 H new ATOM 0 HA ALA A 77 -16.907 -2.661 -7.617 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -17.949 -1.867 -5.513 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -16.938 -3.307 -5.247 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -16.333 -1.697 -4.788 1.00 0.00 H new ATOM 279 N ASP A 78 -15.250 0.069 -7.238 1.00 0.00 N ATOM 280 CA ASP A 78 -15.171 1.476 -7.611 1.00 0.00 C ATOM 281 C ASP A 78 -15.352 1.643 -9.114 1.00 0.00 C ATOM 282 O ASP A 78 -16.208 2.401 -9.569 1.00 0.00 O ATOM 283 CB ASP A 78 -13.827 2.070 -7.175 1.00 0.00 C ATOM 284 CG ASP A 78 -13.706 3.546 -7.490 1.00 0.00 C ATOM 285 OD1 ASP A 78 -14.130 4.374 -6.655 1.00 0.00 O ATOM 286 OD2 ASP A 78 -13.170 3.887 -8.568 1.00 0.00 O ATOM 0 H ASP A 78 -14.370 -0.329 -6.911 1.00 0.00 H new ATOM 0 HA ASP A 78 -15.974 2.010 -7.102 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -13.700 1.921 -6.103 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -13.019 1.531 -7.670 1.00 0.00 H new ATOM 291 N GLY A 79 -14.554 0.917 -9.878 1.00 0.00 N ATOM 292 CA GLY A 79 -14.649 0.992 -11.320 1.00 0.00 C ATOM 293 C GLY A 79 -13.294 1.034 -11.985 1.00 0.00 C ATOM 294 O GLY A 79 -12.919 2.039 -12.592 1.00 0.00 O ATOM 0 H GLY A 79 -13.842 0.277 -9.526 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -15.206 0.131 -11.690 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -15.215 1.881 -11.598 1.00 0.00 H new ATOM 298 N VAL A 80 -12.548 -0.052 -11.863 1.00 0.00 N ATOM 299 CA VAL A 80 -11.249 -0.160 -12.506 1.00 0.00 C ATOM 300 C VAL A 80 -11.218 -1.361 -13.442 1.00 0.00 C ATOM 301 O VAL A 80 -11.917 -2.352 -13.219 1.00 0.00 O ATOM 302 CB VAL A 80 -10.099 -0.275 -11.478 1.00 0.00 C ATOM 303 CG1 VAL A 80 -10.017 0.975 -10.613 1.00 0.00 C ATOM 304 CG2 VAL A 80 -10.260 -1.517 -10.610 1.00 0.00 C ATOM 0 H VAL A 80 -12.821 -0.873 -11.323 1.00 0.00 H new ATOM 0 HA VAL A 80 -11.098 0.756 -13.078 1.00 0.00 H new ATOM 0 HB VAL A 80 -9.166 -0.369 -12.033 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -9.201 0.870 -9.898 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -9.836 1.844 -11.246 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -10.956 1.107 -10.075 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -9.437 -1.572 -9.897 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -11.205 -1.463 -10.070 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -10.253 -2.406 -11.241 1.00 0.00 H new ATOM 314 N SER A 81 -10.423 -1.265 -14.497 1.00 0.00 N ATOM 315 CA SER A 81 -10.287 -2.349 -15.455 1.00 0.00 C ATOM 316 C SER A 81 -9.409 -3.459 -14.877 1.00 0.00 C ATOM 317 O SER A 81 -8.750 -3.266 -13.851 1.00 0.00 O ATOM 318 CB SER A 81 -9.691 -1.818 -16.763 1.00 0.00 C ATOM 319 OG SER A 81 -9.557 -2.846 -17.725 1.00 0.00 O ATOM 0 H SER A 81 -9.860 -0.442 -14.711 1.00 0.00 H new ATOM 0 HA SER A 81 -11.273 -2.764 -15.663 1.00 0.00 H new ATOM 0 HB2 SER A 81 -10.328 -1.027 -17.160 1.00 0.00 H new ATOM 0 HB3 SER A 81 -8.716 -1.373 -16.566 1.00 0.00 H new ATOM 0 HG SER A 81 -9.176 -2.476 -18.548 1.00 0.00 H new ATOM 325 N VAL A 82 -9.392 -4.609 -15.547 1.00 0.00 N ATOM 326 CA VAL A 82 -8.621 -5.759 -15.092 1.00 0.00 C ATOM 327 C VAL A 82 -7.152 -5.397 -14.938 1.00 0.00 C ATOM 328 O VAL A 82 -6.560 -5.631 -13.891 1.00 0.00 O ATOM 329 CB VAL A 82 -8.744 -6.950 -16.063 1.00 0.00 C ATOM 330 CG1 VAL A 82 -7.922 -8.137 -15.574 1.00 0.00 C ATOM 331 CG2 VAL A 82 -10.203 -7.345 -16.245 1.00 0.00 C ATOM 0 H VAL A 82 -9.908 -4.768 -16.413 1.00 0.00 H new ATOM 0 HA VAL A 82 -9.032 -6.052 -14.126 1.00 0.00 H new ATOM 0 HB VAL A 82 -8.349 -6.641 -17.031 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -8.025 -8.965 -16.276 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -6.873 -7.849 -15.504 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -8.279 -8.447 -14.592 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -10.269 -8.187 -16.934 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -10.626 -7.630 -15.282 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -10.761 -6.501 -16.650 1.00 0.00 H new ATOM 341 N SER A 83 -6.579 -4.804 -15.978 1.00 0.00 N ATOM 342 CA SER A 83 -5.171 -4.426 -15.970 1.00 0.00 C ATOM 343 C SER A 83 -4.864 -3.442 -14.837 1.00 0.00 C ATOM 344 O SER A 83 -3.750 -3.407 -14.318 1.00 0.00 O ATOM 345 CB SER A 83 -4.798 -3.819 -17.322 1.00 0.00 C ATOM 346 OG SER A 83 -5.207 -4.673 -18.377 1.00 0.00 O ATOM 0 H SER A 83 -7.070 -4.574 -16.842 1.00 0.00 H new ATOM 0 HA SER A 83 -4.573 -5.321 -15.797 1.00 0.00 H new ATOM 0 HB2 SER A 83 -5.270 -2.843 -17.432 1.00 0.00 H new ATOM 0 HB3 SER A 83 -3.721 -3.660 -17.371 1.00 0.00 H new ATOM 0 HG SER A 83 -4.963 -4.271 -19.237 1.00 0.00 H new ATOM 352 N GLN A 84 -5.863 -2.662 -14.443 1.00 0.00 N ATOM 353 CA GLN A 84 -5.690 -1.677 -13.385 1.00 0.00 C ATOM 354 C GLN A 84 -5.775 -2.345 -12.015 1.00 0.00 C ATOM 355 O GLN A 84 -4.921 -2.130 -11.154 1.00 0.00 O ATOM 356 CB GLN A 84 -6.746 -0.577 -13.501 1.00 0.00 C ATOM 357 CG GLN A 84 -6.516 0.591 -12.556 1.00 0.00 C ATOM 358 CD GLN A 84 -5.202 1.299 -12.827 1.00 0.00 C ATOM 359 OE1 GLN A 84 -4.168 0.952 -12.259 1.00 0.00 O ATOM 360 NE2 GLN A 84 -5.231 2.288 -13.705 1.00 0.00 N ATOM 0 H GLN A 84 -6.802 -2.693 -14.841 1.00 0.00 H new ATOM 0 HA GLN A 84 -4.703 -1.227 -13.493 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -6.761 -0.206 -14.526 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -7.728 -1.006 -13.303 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -7.336 1.302 -12.654 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -6.527 0.231 -11.527 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -6.110 2.545 -14.155 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -4.375 2.793 -13.932 1.00 0.00 H new ATOM 369 N LEU A 85 -6.802 -3.166 -11.825 1.00 0.00 N ATOM 370 CA LEU A 85 -6.982 -3.887 -10.570 1.00 0.00 C ATOM 371 C LEU A 85 -5.836 -4.871 -10.358 1.00 0.00 C ATOM 372 O LEU A 85 -5.293 -4.989 -9.257 1.00 0.00 O ATOM 373 CB LEU A 85 -8.320 -4.631 -10.569 1.00 0.00 C ATOM 374 CG LEU A 85 -8.661 -5.354 -9.265 1.00 0.00 C ATOM 375 CD1 LEU A 85 -8.753 -4.362 -8.114 1.00 0.00 C ATOM 376 CD2 LEU A 85 -9.964 -6.119 -9.411 1.00 0.00 C ATOM 0 H LEU A 85 -7.522 -3.349 -12.524 1.00 0.00 H new ATOM 0 HA LEU A 85 -6.983 -3.165 -9.753 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -9.114 -3.918 -10.789 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -8.313 -5.360 -11.379 1.00 0.00 H new ATOM 0 HG LEU A 85 -7.864 -6.064 -9.044 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -8.996 -4.894 -7.194 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -7.797 -3.852 -7.996 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -9.532 -3.629 -8.326 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -10.194 -6.628 -8.475 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -10.768 -5.425 -9.653 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -9.867 -6.854 -10.210 1.00 0.00 H new ATOM 388 N ASN A 86 -5.462 -5.555 -11.430 1.00 0.00 N ATOM 389 CA ASN A 86 -4.351 -6.494 -11.401 1.00 0.00 C ATOM 390 C ASN A 86 -3.052 -5.758 -11.091 1.00 0.00 C ATOM 391 O ASN A 86 -2.170 -6.287 -10.415 1.00 0.00 O ATOM 392 CB ASN A 86 -4.255 -7.224 -12.745 1.00 0.00 C ATOM 393 CG ASN A 86 -3.156 -8.269 -12.788 1.00 0.00 C ATOM 394 OD1 ASN A 86 -2.809 -8.877 -11.776 1.00 0.00 O ATOM 395 ND2 ASN A 86 -2.618 -8.498 -13.974 1.00 0.00 N ATOM 0 H ASN A 86 -5.917 -5.475 -12.339 1.00 0.00 H new ATOM 0 HA ASN A 86 -4.522 -7.231 -10.616 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -5.210 -7.704 -12.958 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -4.082 -6.493 -13.535 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -1.886 -9.201 -14.075 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -2.935 -7.971 -14.788 1.00 0.00 H new ATOM 402 N SER A 87 -2.950 -4.522 -11.570 1.00 0.00 N ATOM 403 CA SER A 87 -1.802 -3.683 -11.266 1.00 0.00 C ATOM 404 C SER A 87 -1.749 -3.410 -9.763 1.00 0.00 C ATOM 405 O SER A 87 -0.689 -3.520 -9.146 1.00 0.00 O ATOM 406 CB SER A 87 -1.871 -2.365 -12.046 1.00 0.00 C ATOM 407 OG SER A 87 -0.632 -1.669 -11.998 1.00 0.00 O ATOM 0 H SER A 87 -3.649 -4.082 -12.169 1.00 0.00 H new ATOM 0 HA SER A 87 -0.895 -4.206 -11.567 1.00 0.00 H new ATOM 0 HB2 SER A 87 -2.136 -2.568 -13.084 1.00 0.00 H new ATOM 0 HB3 SER A 87 -2.660 -1.736 -11.632 1.00 0.00 H new ATOM 0 HG SER A 87 -0.706 -0.834 -12.505 1.00 0.00 H new ATOM 413 N TYR A 88 -2.900 -3.074 -9.179 1.00 0.00 N ATOM 414 CA TYR A 88 -2.997 -2.857 -7.737 1.00 0.00 C ATOM 415 C TYR A 88 -2.577 -4.113 -6.977 1.00 0.00 C ATOM 416 O TYR A 88 -1.845 -4.035 -5.986 1.00 0.00 O ATOM 417 CB TYR A 88 -4.422 -2.463 -7.331 1.00 0.00 C ATOM 418 CG TYR A 88 -4.830 -1.063 -7.740 1.00 0.00 C ATOM 419 CD1 TYR A 88 -3.992 0.024 -7.519 1.00 0.00 C ATOM 420 CD2 TYR A 88 -6.065 -0.828 -8.336 1.00 0.00 C ATOM 421 CE1 TYR A 88 -4.371 1.304 -7.882 1.00 0.00 C ATOM 422 CE2 TYR A 88 -6.452 0.449 -8.698 1.00 0.00 C ATOM 423 CZ TYR A 88 -5.602 1.510 -8.471 1.00 0.00 C ATOM 424 OH TYR A 88 -5.987 2.784 -8.830 1.00 0.00 O ATOM 0 H TYR A 88 -3.777 -2.946 -9.683 1.00 0.00 H new ATOM 0 HA TYR A 88 -2.324 -2.039 -7.480 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -5.121 -3.174 -7.771 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -4.515 -2.553 -6.249 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -3.029 -0.133 -7.056 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -6.733 -1.657 -8.519 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -3.707 2.137 -7.705 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -7.416 0.614 -9.156 1.00 0.00 H new ATOM 0 HH TYR A 88 -6.880 2.755 -9.233 1.00 0.00 H new ATOM 434 N LYS A 89 -3.045 -5.268 -7.448 1.00 0.00 N ATOM 435 CA LYS A 89 -2.671 -6.552 -6.858 1.00 0.00 C ATOM 436 C LYS A 89 -1.160 -6.762 -6.953 1.00 0.00 C ATOM 437 O LYS A 89 -0.526 -7.215 -6.002 1.00 0.00 O ATOM 438 CB LYS A 89 -3.407 -7.703 -7.556 1.00 0.00 C ATOM 439 CG LYS A 89 -4.914 -7.686 -7.345 1.00 0.00 C ATOM 440 CD LYS A 89 -5.610 -8.788 -8.134 1.00 0.00 C ATOM 441 CE LYS A 89 -7.120 -8.755 -7.935 1.00 0.00 C ATOM 442 NZ LYS A 89 -7.527 -9.200 -6.571 1.00 0.00 N ATOM 0 H LYS A 89 -3.685 -5.341 -8.239 1.00 0.00 H new ATOM 0 HA LYS A 89 -2.960 -6.541 -5.807 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -3.199 -7.660 -8.625 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -3.009 -8.650 -7.192 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -5.133 -7.805 -6.284 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -5.312 -6.717 -7.646 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -5.380 -8.678 -9.194 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -5.223 -9.758 -7.823 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -7.484 -7.742 -8.106 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -7.595 -9.394 -8.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -8.564 -9.175 -6.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -7.190 -10.170 -6.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -7.111 -8.565 -5.860 1.00 0.00 H new ATOM 456 N ASN A 90 -0.595 -6.416 -8.105 1.00 0.00 N ATOM 457 CA ASN A 90 0.846 -6.520 -8.335 1.00 0.00 C ATOM 458 C ASN A 90 1.631 -5.719 -7.294 1.00 0.00 C ATOM 459 O ASN A 90 2.612 -6.208 -6.737 1.00 0.00 O ATOM 460 CB ASN A 90 1.185 -6.039 -9.752 1.00 0.00 C ATOM 461 CG ASN A 90 2.677 -5.978 -10.035 1.00 0.00 C ATOM 462 OD1 ASN A 90 3.471 -6.732 -9.471 1.00 0.00 O ATOM 463 ND2 ASN A 90 3.065 -5.080 -10.926 1.00 0.00 N ATOM 0 H ASN A 90 -1.118 -6.057 -8.904 1.00 0.00 H new ATOM 0 HA ASN A 90 1.135 -7.566 -8.236 1.00 0.00 H new ATOM 0 HB2 ASN A 90 0.714 -6.705 -10.475 1.00 0.00 H new ATOM 0 HB3 ASN A 90 0.755 -5.049 -9.903 1.00 0.00 H new ATOM 0 HD21 ASN A 90 4.052 -4.994 -11.167 1.00 0.00 H new ATOM 0 HD22 ASN A 90 2.377 -4.473 -11.372 1.00 0.00 H new ATOM 470 N TYR A 91 1.191 -4.500 -7.016 1.00 0.00 N ATOM 471 CA TYR A 91 1.867 -3.667 -6.027 1.00 0.00 C ATOM 472 C TYR A 91 1.795 -4.296 -4.637 1.00 0.00 C ATOM 473 O TYR A 91 2.813 -4.433 -3.964 1.00 0.00 O ATOM 474 CB TYR A 91 1.279 -2.254 -5.999 1.00 0.00 C ATOM 475 CG TYR A 91 1.656 -1.418 -7.202 1.00 0.00 C ATOM 476 CD1 TYR A 91 2.936 -0.894 -7.331 1.00 0.00 C ATOM 477 CD2 TYR A 91 0.739 -1.163 -8.211 1.00 0.00 C ATOM 478 CE1 TYR A 91 3.289 -0.139 -8.431 1.00 0.00 C ATOM 479 CE2 TYR A 91 1.084 -0.410 -9.313 1.00 0.00 C ATOM 480 CZ TYR A 91 2.358 0.099 -9.419 1.00 0.00 C ATOM 481 OH TYR A 91 2.703 0.841 -10.522 1.00 0.00 O ATOM 0 H TYR A 91 0.378 -4.068 -7.455 1.00 0.00 H new ATOM 0 HA TYR A 91 2.914 -3.597 -6.320 1.00 0.00 H new ATOM 0 HB2 TYR A 91 0.193 -2.322 -5.940 1.00 0.00 H new ATOM 0 HB3 TYR A 91 1.616 -1.747 -5.095 1.00 0.00 H new ATOM 0 HD1 TYR A 91 3.667 -1.080 -6.558 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -0.262 -1.561 -8.132 1.00 0.00 H new ATOM 0 HE1 TYR A 91 4.288 0.263 -8.517 1.00 0.00 H new ATOM 0 HE2 TYR A 91 0.358 -0.220 -10.090 1.00 0.00 H new ATOM 0 HH TYR A 91 1.932 0.913 -11.122 1.00 0.00 H new ATOM 491 N CYS A 92 0.601 -4.702 -4.228 1.00 0.00 N ATOM 492 CA CYS A 92 0.396 -5.266 -2.895 1.00 0.00 C ATOM 493 C CYS A 92 1.127 -6.600 -2.730 1.00 0.00 C ATOM 494 O CYS A 92 1.756 -6.855 -1.708 1.00 0.00 O ATOM 495 CB CYS A 92 -1.099 -5.459 -2.637 1.00 0.00 C ATOM 496 SG CYS A 92 -2.086 -3.960 -2.860 1.00 0.00 S ATOM 0 H CYS A 92 -0.243 -4.653 -4.799 1.00 0.00 H new ATOM 0 HA CYS A 92 0.807 -4.566 -2.168 1.00 0.00 H new ATOM 0 HB2 CYS A 92 -1.476 -6.232 -3.307 1.00 0.00 H new ATOM 0 HB3 CYS A 92 -1.237 -5.824 -1.619 1.00 0.00 H new ATOM 0 HG CYS A 92 -2.186 -3.691 -4.128 1.00 0.00 H new ATOM 502 N ARG A 93 1.052 -7.436 -3.753 1.00 0.00 N ATOM 503 CA ARG A 93 1.596 -8.787 -3.690 1.00 0.00 C ATOM 504 C ARG A 93 3.102 -8.824 -3.965 1.00 0.00 C ATOM 505 O ARG A 93 3.861 -9.396 -3.188 1.00 0.00 O ATOM 506 CB ARG A 93 0.844 -9.680 -4.683 1.00 0.00 C ATOM 507 CG ARG A 93 1.577 -10.951 -5.078 1.00 0.00 C ATOM 508 CD ARG A 93 0.730 -11.795 -6.014 1.00 0.00 C ATOM 509 NE ARG A 93 1.539 -12.628 -6.901 1.00 0.00 N ATOM 510 CZ ARG A 93 1.203 -13.861 -7.283 1.00 0.00 C ATOM 511 NH1 ARG A 93 0.158 -14.476 -6.742 1.00 0.00 N ATOM 512 NH2 ARG A 93 1.940 -14.486 -8.188 1.00 0.00 N ATOM 0 H ARG A 93 0.616 -7.202 -4.645 1.00 0.00 H new ATOM 0 HA ARG A 93 1.457 -9.160 -2.675 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -0.118 -9.952 -4.249 1.00 0.00 H new ATOM 0 HB3 ARG A 93 0.636 -9.103 -5.584 1.00 0.00 H new ATOM 0 HG2 ARG A 93 2.519 -10.697 -5.563 1.00 0.00 H new ATOM 0 HG3 ARG A 93 1.823 -11.526 -4.185 1.00 0.00 H new ATOM 0 HD2 ARG A 93 0.069 -12.431 -5.426 1.00 0.00 H new ATOM 0 HD3 ARG A 93 0.095 -11.142 -6.613 1.00 0.00 H new ATOM 0 HE ARG A 93 2.416 -12.242 -7.250 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -0.397 -14.005 -6.027 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -0.090 -15.419 -7.042 1.00 0.00 H new ATOM 0 HH21 ARG A 93 2.757 -14.024 -8.587 1.00 0.00 H new ATOM 0 HH22 ARG A 93 1.690 -15.429 -8.486 1.00 0.00 H new ATOM 526 N ASN A 94 3.526 -8.210 -5.060 1.00 0.00 N ATOM 527 CA ASN A 94 4.912 -8.324 -5.515 1.00 0.00 C ATOM 528 C ASN A 94 5.806 -7.240 -4.914 1.00 0.00 C ATOM 529 O ASN A 94 6.944 -7.503 -4.535 1.00 0.00 O ATOM 530 CB ASN A 94 4.961 -8.263 -7.047 1.00 0.00 C ATOM 531 CG ASN A 94 6.375 -8.285 -7.606 1.00 0.00 C ATOM 532 OD1 ASN A 94 7.281 -8.890 -7.035 1.00 0.00 O ATOM 533 ND2 ASN A 94 6.563 -7.630 -8.744 1.00 0.00 N ATOM 0 H ASN A 94 2.934 -7.627 -5.652 1.00 0.00 H new ATOM 0 HA ASN A 94 5.296 -9.285 -5.173 1.00 0.00 H new ATOM 0 HB2 ASN A 94 4.404 -9.106 -7.455 1.00 0.00 H new ATOM 0 HB3 ASN A 94 4.459 -7.356 -7.384 1.00 0.00 H new ATOM 0 HD21 ASN A 94 7.486 -7.616 -9.178 1.00 0.00 H new ATOM 0 HD22 ASN A 94 5.784 -7.141 -9.185 1.00 0.00 H new ATOM 540 N HIS A 95 5.301 -6.022 -4.825 1.00 0.00 N ATOM 541 CA HIS A 95 6.111 -4.914 -4.329 1.00 0.00 C ATOM 542 C HIS A 95 6.076 -4.836 -2.807 1.00 0.00 C ATOM 543 O HIS A 95 7.069 -4.486 -2.171 1.00 0.00 O ATOM 544 CB HIS A 95 5.656 -3.589 -4.942 1.00 0.00 C ATOM 545 CG HIS A 95 5.984 -3.462 -6.398 1.00 0.00 C ATOM 546 ND1 HIS A 95 7.134 -2.858 -6.856 1.00 0.00 N ATOM 547 CD2 HIS A 95 5.310 -3.865 -7.503 1.00 0.00 C ATOM 548 CE1 HIS A 95 7.156 -2.893 -8.175 1.00 0.00 C ATOM 549 NE2 HIS A 95 6.061 -3.498 -8.593 1.00 0.00 N ATOM 0 H HIS A 95 4.347 -5.773 -5.085 1.00 0.00 H new ATOM 0 HA HIS A 95 7.141 -5.100 -4.632 1.00 0.00 H new ATOM 0 HB2 HIS A 95 4.579 -3.487 -4.810 1.00 0.00 H new ATOM 0 HB3 HIS A 95 6.123 -2.767 -4.399 1.00 0.00 H new ATOM 0 HD2 HIS A 95 4.360 -4.379 -7.523 1.00 0.00 H new ATOM 0 HE1 HIS A 95 7.937 -2.494 -8.805 1.00 0.00 H new ATOM 0 HE2 HIS A 95 5.812 -3.666 -9.568 1.00 0.00 H new ATOM 558 N LEU A 96 4.938 -5.180 -2.227 1.00 0.00 N ATOM 559 CA LEU A 96 4.753 -5.080 -0.785 1.00 0.00 C ATOM 560 C LEU A 96 4.768 -6.460 -0.130 1.00 0.00 C ATOM 561 O LEU A 96 4.187 -6.648 0.938 1.00 0.00 O ATOM 562 CB LEU A 96 3.436 -4.358 -0.479 1.00 0.00 C ATOM 563 CG LEU A 96 3.338 -2.930 -1.021 1.00 0.00 C ATOM 564 CD1 LEU A 96 1.948 -2.364 -0.784 1.00 0.00 C ATOM 565 CD2 LEU A 96 4.394 -2.043 -0.377 1.00 0.00 C ATOM 0 H LEU A 96 4.125 -5.532 -2.733 1.00 0.00 H new ATOM 0 HA LEU A 96 5.582 -4.505 -0.371 1.00 0.00 H new ATOM 0 HB2 LEU A 96 2.614 -4.944 -0.891 1.00 0.00 H new ATOM 0 HB3 LEU A 96 3.297 -4.330 0.602 1.00 0.00 H new ATOM 0 HG LEU A 96 3.519 -2.956 -2.096 1.00 0.00 H new ATOM 0 HD11 LEU A 96 1.897 -1.348 -1.176 1.00 0.00 H new ATOM 0 HD12 LEU A 96 1.211 -2.986 -1.291 1.00 0.00 H new ATOM 0 HD13 LEU A 96 1.738 -2.351 0.285 1.00 0.00 H new ATOM 0 HD21 LEU A 96 4.310 -1.031 -0.774 1.00 0.00 H new ATOM 0 HD22 LEU A 96 4.244 -2.023 0.702 1.00 0.00 H new ATOM 0 HD23 LEU A 96 5.385 -2.438 -0.598 1.00 0.00 H new ATOM 577 N SER A 97 5.463 -7.410 -0.764 1.00 0.00 N ATOM 578 CA SER A 97 5.550 -8.787 -0.267 1.00 0.00 C ATOM 579 C SER A 97 5.868 -8.857 1.239 1.00 0.00 C ATOM 580 O SER A 97 5.141 -9.512 1.989 1.00 0.00 O ATOM 581 CB SER A 97 6.608 -9.573 -1.053 1.00 0.00 C ATOM 582 OG SER A 97 6.400 -9.462 -2.449 1.00 0.00 O ATOM 0 H SER A 97 5.978 -7.248 -1.630 1.00 0.00 H new ATOM 0 HA SER A 97 4.567 -9.235 -0.415 1.00 0.00 H new ATOM 0 HB2 SER A 97 7.601 -9.202 -0.801 1.00 0.00 H new ATOM 0 HB3 SER A 97 6.576 -10.623 -0.761 1.00 0.00 H new ATOM 0 HG SER A 97 5.462 -9.238 -2.623 1.00 0.00 H new ATOM 588 N PRO A 98 6.946 -8.188 1.718 1.00 0.00 N ATOM 589 CA PRO A 98 7.329 -8.244 3.137 1.00 0.00 C ATOM 590 C PRO A 98 6.308 -7.582 4.066 1.00 0.00 C ATOM 591 O PRO A 98 6.273 -7.870 5.261 1.00 0.00 O ATOM 592 CB PRO A 98 8.659 -7.486 3.182 1.00 0.00 C ATOM 593 CG PRO A 98 8.638 -6.600 1.988 1.00 0.00 C ATOM 594 CD PRO A 98 7.885 -7.354 0.934 1.00 0.00 C ATOM 0 HA PRO A 98 7.392 -9.274 3.488 1.00 0.00 H new ATOM 0 HB2 PRO A 98 8.753 -6.907 4.101 1.00 0.00 H new ATOM 0 HB3 PRO A 98 9.505 -8.172 3.150 1.00 0.00 H new ATOM 0 HG2 PRO A 98 8.151 -5.651 2.213 1.00 0.00 H new ATOM 0 HG3 PRO A 98 9.650 -6.368 1.655 1.00 0.00 H new ATOM 0 HD2 PRO A 98 7.357 -6.681 0.258 1.00 0.00 H new ATOM 0 HD3 PRO A 98 8.550 -7.964 0.323 1.00 0.00 H new ATOM 602 N LEU A 99 5.477 -6.703 3.519 1.00 0.00 N ATOM 603 CA LEU A 99 4.469 -6.005 4.316 1.00 0.00 C ATOM 604 C LEU A 99 3.181 -6.808 4.365 1.00 0.00 C ATOM 605 O LEU A 99 2.424 -6.728 5.329 1.00 0.00 O ATOM 606 CB LEU A 99 4.176 -4.612 3.744 1.00 0.00 C ATOM 607 CG LEU A 99 5.143 -3.497 4.158 1.00 0.00 C ATOM 608 CD1 LEU A 99 6.558 -3.796 3.697 1.00 0.00 C ATOM 609 CD2 LEU A 99 4.674 -2.165 3.599 1.00 0.00 C ATOM 0 H LEU A 99 5.479 -6.455 2.530 1.00 0.00 H new ATOM 0 HA LEU A 99 4.867 -5.893 5.324 1.00 0.00 H new ATOM 0 HB2 LEU A 99 4.177 -4.681 2.656 1.00 0.00 H new ATOM 0 HB3 LEU A 99 3.169 -4.322 4.045 1.00 0.00 H new ATOM 0 HG LEU A 99 5.152 -3.442 5.247 1.00 0.00 H new ATOM 0 HD11 LEU A 99 7.220 -2.987 4.006 1.00 0.00 H new ATOM 0 HD12 LEU A 99 6.896 -4.731 4.143 1.00 0.00 H new ATOM 0 HD13 LEU A 99 6.576 -3.885 2.611 1.00 0.00 H new ATOM 0 HD21 LEU A 99 5.368 -1.380 3.899 1.00 0.00 H new ATOM 0 HD22 LEU A 99 4.637 -2.220 2.511 1.00 0.00 H new ATOM 0 HD23 LEU A 99 3.680 -1.938 3.985 1.00 0.00 H new ATOM 621 N TYR A 100 2.959 -7.596 3.323 1.00 0.00 N ATOM 622 CA TYR A 100 1.726 -8.352 3.157 1.00 0.00 C ATOM 623 C TYR A 100 1.479 -9.284 4.344 1.00 0.00 C ATOM 624 O TYR A 100 0.332 -9.545 4.716 1.00 0.00 O ATOM 625 CB TYR A 100 1.806 -9.159 1.862 1.00 0.00 C ATOM 626 CG TYR A 100 0.467 -9.437 1.225 1.00 0.00 C ATOM 627 CD1 TYR A 100 -0.164 -8.461 0.465 1.00 0.00 C ATOM 628 CD2 TYR A 100 -0.155 -10.670 1.364 1.00 0.00 C ATOM 629 CE1 TYR A 100 -1.380 -8.702 -0.136 1.00 0.00 C ATOM 630 CE2 TYR A 100 -1.374 -10.922 0.760 1.00 0.00 C ATOM 631 CZ TYR A 100 -1.979 -9.933 0.012 1.00 0.00 C ATOM 632 OH TYR A 100 -3.187 -10.175 -0.600 1.00 0.00 O ATOM 0 H TYR A 100 3.631 -7.729 2.567 1.00 0.00 H new ATOM 0 HA TYR A 100 0.891 -7.653 3.109 1.00 0.00 H new ATOM 0 HB2 TYR A 100 2.431 -8.621 1.149 1.00 0.00 H new ATOM 0 HB3 TYR A 100 2.302 -10.107 2.068 1.00 0.00 H new ATOM 0 HD1 TYR A 100 0.307 -7.497 0.343 1.00 0.00 H new ATOM 0 HD2 TYR A 100 0.319 -11.443 1.951 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -1.860 -7.930 -0.719 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -1.848 -11.886 0.873 1.00 0.00 H new ATOM 0 HH TYR A 100 -3.736 -10.749 -0.025 1.00 0.00 H new ATOM 642 N MET A 101 2.559 -9.773 4.940 1.00 0.00 N ATOM 643 CA MET A 101 2.461 -10.700 6.063 1.00 0.00 C ATOM 644 C MET A 101 2.720 -9.993 7.391 1.00 0.00 C ATOM 645 O MET A 101 2.933 -10.638 8.420 1.00 0.00 O ATOM 646 CB MET A 101 3.442 -11.859 5.880 1.00 0.00 C ATOM 647 CG MET A 101 3.112 -12.748 4.691 1.00 0.00 C ATOM 648 SD MET A 101 4.285 -14.099 4.476 1.00 0.00 S ATOM 649 CE MET A 101 3.571 -14.950 3.069 1.00 0.00 C ATOM 0 H MET A 101 3.514 -9.544 4.665 1.00 0.00 H new ATOM 0 HA MET A 101 1.445 -11.094 6.085 1.00 0.00 H new ATOM 0 HB2 MET A 101 4.448 -11.458 5.756 1.00 0.00 H new ATOM 0 HB3 MET A 101 3.450 -12.465 6.786 1.00 0.00 H new ATOM 0 HG2 MET A 101 2.111 -13.160 4.819 1.00 0.00 H new ATOM 0 HG3 MET A 101 3.094 -12.142 3.785 1.00 0.00 H new ATOM 0 HE1 MET A 101 4.187 -15.813 2.815 1.00 0.00 H new ATOM 0 HE2 MET A 101 2.564 -15.284 3.318 1.00 0.00 H new ATOM 0 HE3 MET A 101 3.528 -14.272 2.217 1.00 0.00 H new ATOM 659 N LYS A 102 2.699 -8.667 7.372 1.00 0.00 N ATOM 660 CA LYS A 102 2.865 -7.890 8.592 1.00 0.00 C ATOM 661 C LYS A 102 1.519 -7.352 9.058 1.00 0.00 C ATOM 662 O LYS A 102 0.617 -7.130 8.248 1.00 0.00 O ATOM 663 CB LYS A 102 3.830 -6.716 8.383 1.00 0.00 C ATOM 664 CG LYS A 102 5.284 -7.113 8.184 1.00 0.00 C ATOM 665 CD LYS A 102 6.187 -5.884 8.144 1.00 0.00 C ATOM 666 CE LYS A 102 7.649 -6.262 7.958 1.00 0.00 C ATOM 667 NZ LYS A 102 8.548 -5.076 8.033 1.00 0.00 N ATOM 0 H LYS A 102 2.569 -8.109 6.528 1.00 0.00 H new ATOM 0 HA LYS A 102 3.283 -8.553 9.349 1.00 0.00 H new ATOM 0 HB2 LYS A 102 3.502 -6.145 7.515 1.00 0.00 H new ATOM 0 HB3 LYS A 102 3.764 -6.052 9.245 1.00 0.00 H new ATOM 0 HG2 LYS A 102 5.598 -7.773 8.993 1.00 0.00 H new ATOM 0 HG3 LYS A 102 5.387 -7.675 7.256 1.00 0.00 H new ATOM 0 HD2 LYS A 102 5.874 -5.230 7.330 1.00 0.00 H new ATOM 0 HD3 LYS A 102 6.073 -5.319 9.069 1.00 0.00 H new ATOM 0 HE2 LYS A 102 7.937 -6.983 8.723 1.00 0.00 H new ATOM 0 HE3 LYS A 102 7.776 -6.753 6.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 9.539 -5.391 8.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 8.383 -4.463 7.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 8.350 -4.545 8.905 1.00 0.00 H new ATOM 681 N SER A 103 1.378 -7.161 10.359 1.00 0.00 N ATOM 682 CA SER A 103 0.215 -6.481 10.895 1.00 0.00 C ATOM 683 C SER A 103 0.354 -4.986 10.646 1.00 0.00 C ATOM 684 O SER A 103 1.457 -4.497 10.397 1.00 0.00 O ATOM 685 CB SER A 103 0.071 -6.758 12.393 1.00 0.00 C ATOM 686 OG SER A 103 -1.069 -6.110 12.935 1.00 0.00 O ATOM 0 H SER A 103 2.053 -7.467 11.060 1.00 0.00 H new ATOM 0 HA SER A 103 -0.680 -6.853 10.396 1.00 0.00 H new ATOM 0 HB2 SER A 103 -0.007 -7.832 12.559 1.00 0.00 H new ATOM 0 HB3 SER A 103 0.966 -6.418 12.914 1.00 0.00 H new ATOM 0 HG SER A 103 -1.797 -6.126 12.279 1.00 0.00 H new ATOM 692 N LEU A 104 -0.753 -4.265 10.719 1.00 0.00 N ATOM 693 CA LEU A 104 -0.739 -2.822 10.516 1.00 0.00 C ATOM 694 C LEU A 104 0.184 -2.145 11.529 1.00 0.00 C ATOM 695 O LEU A 104 0.775 -1.104 11.251 1.00 0.00 O ATOM 696 CB LEU A 104 -2.157 -2.259 10.633 1.00 0.00 C ATOM 697 CG LEU A 104 -3.163 -2.818 9.624 1.00 0.00 C ATOM 698 CD1 LEU A 104 -4.538 -2.214 9.857 1.00 0.00 C ATOM 699 CD2 LEU A 104 -2.700 -2.559 8.195 1.00 0.00 C ATOM 0 H LEU A 104 -1.675 -4.654 10.917 1.00 0.00 H new ATOM 0 HA LEU A 104 -0.360 -2.618 9.515 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -2.527 -2.456 11.639 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -2.112 -1.176 10.516 1.00 0.00 H new ATOM 0 HG LEU A 104 -3.228 -3.896 9.768 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -5.242 -2.622 9.132 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -4.875 -2.455 10.865 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -4.484 -1.131 9.742 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -3.431 -2.965 7.496 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -2.601 -1.486 8.033 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -1.736 -3.041 8.032 1.00 0.00 H new ATOM 711 N SER A 105 0.319 -2.763 12.697 1.00 0.00 N ATOM 712 CA SER A 105 1.154 -2.223 13.760 1.00 0.00 C ATOM 713 C SER A 105 2.607 -2.698 13.629 1.00 0.00 C ATOM 714 O SER A 105 3.489 -2.226 14.351 1.00 0.00 O ATOM 715 CB SER A 105 0.583 -2.627 15.124 1.00 0.00 C ATOM 716 OG SER A 105 1.295 -2.012 16.185 1.00 0.00 O ATOM 0 H SER A 105 -0.142 -3.642 12.931 1.00 0.00 H new ATOM 0 HA SER A 105 1.153 -1.136 13.675 1.00 0.00 H new ATOM 0 HB2 SER A 105 -0.469 -2.345 15.178 1.00 0.00 H new ATOM 0 HB3 SER A 105 0.629 -3.711 15.233 1.00 0.00 H new ATOM 0 HG SER A 105 2.211 -1.817 15.895 1.00 0.00 H new ATOM 722 N GLU A 106 2.858 -3.619 12.706 1.00 0.00 N ATOM 723 CA GLU A 106 4.196 -4.180 12.532 1.00 0.00 C ATOM 724 C GLU A 106 4.944 -3.471 11.416 1.00 0.00 C ATOM 725 O GLU A 106 6.124 -3.727 11.188 1.00 0.00 O ATOM 726 CB GLU A 106 4.132 -5.672 12.217 1.00 0.00 C ATOM 727 CG GLU A 106 3.638 -6.531 13.366 1.00 0.00 C ATOM 728 CD GLU A 106 3.710 -8.004 13.035 1.00 0.00 C ATOM 729 OE1 GLU A 106 4.775 -8.616 13.258 1.00 0.00 O ATOM 730 OE2 GLU A 106 2.710 -8.558 12.531 1.00 0.00 O ATOM 0 H GLU A 106 2.156 -3.993 12.067 1.00 0.00 H new ATOM 0 HA GLU A 106 4.728 -4.035 13.472 1.00 0.00 H new ATOM 0 HB2 GLU A 106 3.478 -5.823 11.358 1.00 0.00 H new ATOM 0 HB3 GLU A 106 5.125 -6.013 11.925 1.00 0.00 H new ATOM 0 HG2 GLU A 106 4.236 -6.328 14.255 1.00 0.00 H new ATOM 0 HG3 GLU A 106 2.609 -6.262 13.605 1.00 0.00 H new ATOM 737 N ILE A 107 4.252 -2.588 10.716 1.00 0.00 N ATOM 738 CA ILE A 107 4.843 -1.897 9.584 1.00 0.00 C ATOM 739 C ILE A 107 5.427 -0.555 10.014 1.00 0.00 C ATOM 740 O ILE A 107 4.727 0.292 10.567 1.00 0.00 O ATOM 741 CB ILE A 107 3.807 -1.693 8.459 1.00 0.00 C ATOM 742 CG1 ILE A 107 3.253 -3.052 8.028 1.00 0.00 C ATOM 743 CG2 ILE A 107 4.434 -0.966 7.273 1.00 0.00 C ATOM 744 CD1 ILE A 107 2.143 -2.968 7.008 1.00 0.00 C ATOM 0 H ILE A 107 3.284 -2.334 10.911 1.00 0.00 H new ATOM 0 HA ILE A 107 5.650 -2.519 9.198 1.00 0.00 H new ATOM 0 HB ILE A 107 2.990 -1.076 8.833 1.00 0.00 H new ATOM 0 HG12 ILE A 107 4.066 -3.650 7.616 1.00 0.00 H new ATOM 0 HG13 ILE A 107 2.884 -3.578 8.908 1.00 0.00 H new ATOM 0 HG21 ILE A 107 3.686 -0.833 6.491 1.00 0.00 H new ATOM 0 HG22 ILE A 107 4.799 0.009 7.596 1.00 0.00 H new ATOM 0 HG23 ILE A 107 5.265 -1.554 6.884 1.00 0.00 H new ATOM 0 HD11 ILE A 107 1.805 -3.973 6.755 1.00 0.00 H new ATOM 0 HD12 ILE A 107 1.311 -2.399 7.422 1.00 0.00 H new ATOM 0 HD13 ILE A 107 2.511 -2.472 6.110 1.00 0.00 H new ATOM 756 N LEU A 108 6.718 -0.379 9.769 1.00 0.00 N ATOM 757 CA LEU A 108 7.413 0.843 10.147 1.00 0.00 C ATOM 758 C LEU A 108 7.495 1.803 8.964 1.00 0.00 C ATOM 759 O LEU A 108 7.645 1.372 7.820 1.00 0.00 O ATOM 760 CB LEU A 108 8.825 0.513 10.641 1.00 0.00 C ATOM 761 CG LEU A 108 8.895 -0.437 11.839 1.00 0.00 C ATOM 762 CD1 LEU A 108 10.342 -0.752 12.181 1.00 0.00 C ATOM 763 CD2 LEU A 108 8.185 0.167 13.041 1.00 0.00 C ATOM 0 H LEU A 108 7.308 -1.071 9.307 1.00 0.00 H new ATOM 0 HA LEU A 108 6.852 1.322 10.949 1.00 0.00 H new ATOM 0 HB2 LEU A 108 9.387 0.073 9.817 1.00 0.00 H new ATOM 0 HB3 LEU A 108 9.326 1.444 10.907 1.00 0.00 H new ATOM 0 HG LEU A 108 8.391 -1.366 11.572 1.00 0.00 H new ATOM 0 HD11 LEU A 108 10.375 -1.429 13.035 1.00 0.00 H new ATOM 0 HD12 LEU A 108 10.824 -1.224 11.325 1.00 0.00 H new ATOM 0 HD13 LEU A 108 10.866 0.171 12.429 1.00 0.00 H new ATOM 0 HD21 LEU A 108 8.245 -0.522 13.883 1.00 0.00 H new ATOM 0 HD22 LEU A 108 8.662 1.110 13.309 1.00 0.00 H new ATOM 0 HD23 LEU A 108 7.139 0.347 12.793 1.00 0.00 H new ATOM 775 N PRO A 109 7.387 3.115 9.222 1.00 0.00 N ATOM 776 CA PRO A 109 7.517 4.143 8.183 1.00 0.00 C ATOM 777 C PRO A 109 8.838 4.033 7.416 1.00 0.00 C ATOM 778 O PRO A 109 8.859 4.096 6.185 1.00 0.00 O ATOM 779 CB PRO A 109 7.464 5.456 8.970 1.00 0.00 C ATOM 780 CG PRO A 109 6.726 5.119 10.218 1.00 0.00 C ATOM 781 CD PRO A 109 7.102 3.702 10.546 1.00 0.00 C ATOM 0 HA PRO A 109 6.739 4.054 7.425 1.00 0.00 H new ATOM 0 HB2 PRO A 109 8.465 5.827 9.190 1.00 0.00 H new ATOM 0 HB3 PRO A 109 6.952 6.236 8.406 1.00 0.00 H new ATOM 0 HG2 PRO A 109 7.000 5.794 11.029 1.00 0.00 H new ATOM 0 HG3 PRO A 109 5.650 5.215 10.074 1.00 0.00 H new ATOM 0 HD2 PRO A 109 7.971 3.657 11.202 1.00 0.00 H new ATOM 0 HD3 PRO A 109 6.292 3.177 11.053 1.00 0.00 H new ATOM 789 N ALA A 110 9.936 3.850 8.147 1.00 0.00 N ATOM 790 CA ALA A 110 11.256 3.742 7.529 1.00 0.00 C ATOM 791 C ALA A 110 11.391 2.442 6.745 1.00 0.00 C ATOM 792 O ALA A 110 12.172 2.357 5.798 1.00 0.00 O ATOM 793 CB ALA A 110 12.348 3.839 8.584 1.00 0.00 C ATOM 0 H ALA A 110 9.938 3.774 9.164 1.00 0.00 H new ATOM 0 HA ALA A 110 11.368 4.572 6.831 1.00 0.00 H new ATOM 0 HB1 ALA A 110 13.324 3.757 8.106 1.00 0.00 H new ATOM 0 HB2 ALA A 110 12.275 4.798 9.096 1.00 0.00 H new ATOM 0 HB3 ALA A 110 12.229 3.032 9.307 1.00 0.00 H new ATOM 799 N ASP A 111 10.611 1.442 7.132 1.00 0.00 N ATOM 800 CA ASP A 111 10.628 0.147 6.459 1.00 0.00 C ATOM 801 C ASP A 111 10.106 0.299 5.033 1.00 0.00 C ATOM 802 O ASP A 111 10.702 -0.207 4.078 1.00 0.00 O ATOM 803 CB ASP A 111 9.782 -0.862 7.245 1.00 0.00 C ATOM 804 CG ASP A 111 9.911 -2.279 6.723 1.00 0.00 C ATOM 805 OD1 ASP A 111 11.044 -2.801 6.680 1.00 0.00 O ATOM 806 OD2 ASP A 111 8.877 -2.897 6.385 1.00 0.00 O ATOM 0 H ASP A 111 9.956 1.502 7.911 1.00 0.00 H new ATOM 0 HA ASP A 111 11.652 -0.225 6.415 1.00 0.00 H new ATOM 0 HB2 ASP A 111 10.080 -0.839 8.293 1.00 0.00 H new ATOM 0 HB3 ASP A 111 8.736 -0.560 7.204 1.00 0.00 H new ATOM 811 N ILE A 112 9.005 1.031 4.896 1.00 0.00 N ATOM 812 CA ILE A 112 8.438 1.321 3.584 1.00 0.00 C ATOM 813 C ILE A 112 9.356 2.267 2.814 1.00 0.00 C ATOM 814 O ILE A 112 9.561 2.109 1.610 1.00 0.00 O ATOM 815 CB ILE A 112 7.039 1.965 3.693 1.00 0.00 C ATOM 816 CG1 ILE A 112 6.171 1.212 4.706 1.00 0.00 C ATOM 817 CG2 ILE A 112 6.363 1.987 2.326 1.00 0.00 C ATOM 818 CD1 ILE A 112 4.805 1.832 4.920 1.00 0.00 C ATOM 0 H ILE A 112 8.488 1.434 5.677 1.00 0.00 H new ATOM 0 HA ILE A 112 8.343 0.372 3.056 1.00 0.00 H new ATOM 0 HB ILE A 112 7.158 2.990 4.043 1.00 0.00 H new ATOM 0 HG12 ILE A 112 6.044 0.183 4.368 1.00 0.00 H new ATOM 0 HG13 ILE A 112 6.695 1.172 5.661 1.00 0.00 H new ATOM 0 HG21 ILE A 112 5.377 2.443 2.415 1.00 0.00 H new ATOM 0 HG22 ILE A 112 6.969 2.566 1.630 1.00 0.00 H new ATOM 0 HG23 ILE A 112 6.259 0.967 1.955 1.00 0.00 H new ATOM 0 HD11 ILE A 112 4.249 1.244 5.650 1.00 0.00 H new ATOM 0 HD12 ILE A 112 4.922 2.851 5.288 1.00 0.00 H new ATOM 0 HD13 ILE A 112 4.261 1.848 3.976 1.00 0.00 H new ATOM 830 N GLN A 113 9.913 3.244 3.526 1.00 0.00 N ATOM 831 CA GLN A 113 10.832 4.212 2.936 1.00 0.00 C ATOM 832 C GLN A 113 12.028 3.485 2.319 1.00 0.00 C ATOM 833 O GLN A 113 12.450 3.799 1.208 1.00 0.00 O ATOM 834 CB GLN A 113 11.302 5.198 4.012 1.00 0.00 C ATOM 835 CG GLN A 113 11.607 6.612 3.516 1.00 0.00 C ATOM 836 CD GLN A 113 12.761 6.686 2.534 1.00 0.00 C ATOM 837 OE1 GLN A 113 13.923 6.750 2.933 1.00 0.00 O ATOM 838 NE2 GLN A 113 12.450 6.733 1.249 1.00 0.00 N ATOM 0 H GLN A 113 9.741 3.386 4.521 1.00 0.00 H new ATOM 0 HA GLN A 113 10.319 4.766 2.150 1.00 0.00 H new ATOM 0 HB2 GLN A 113 10.535 5.259 4.785 1.00 0.00 H new ATOM 0 HB3 GLN A 113 12.198 4.795 4.484 1.00 0.00 H new ATOM 0 HG2 GLN A 113 10.714 7.020 3.043 1.00 0.00 H new ATOM 0 HG3 GLN A 113 11.832 7.246 4.374 1.00 0.00 H new ATOM 0 HE21 GLN A 113 11.474 6.677 0.958 1.00 0.00 H new ATOM 0 HE22 GLN A 113 13.186 6.825 0.549 1.00 0.00 H new ATOM 847 N SER A 114 12.548 2.497 3.043 1.00 0.00 N ATOM 848 CA SER A 114 13.648 1.678 2.553 1.00 0.00 C ATOM 849 C SER A 114 13.276 1.039 1.217 1.00 0.00 C ATOM 850 O SER A 114 14.017 1.148 0.241 1.00 0.00 O ATOM 851 CB SER A 114 14.004 0.599 3.582 1.00 0.00 C ATOM 852 OG SER A 114 15.094 -0.196 3.145 1.00 0.00 O ATOM 0 H SER A 114 12.221 2.245 3.976 1.00 0.00 H new ATOM 0 HA SER A 114 14.520 2.315 2.402 1.00 0.00 H new ATOM 0 HB2 SER A 114 14.254 1.070 4.533 1.00 0.00 H new ATOM 0 HB3 SER A 114 13.137 -0.037 3.759 1.00 0.00 H new ATOM 0 HG SER A 114 15.298 -0.873 3.823 1.00 0.00 H new ATOM 858 N ILE A 115 12.106 0.405 1.170 1.00 0.00 N ATOM 859 CA ILE A 115 11.631 -0.234 -0.055 1.00 0.00 C ATOM 860 C ILE A 115 11.533 0.777 -1.198 1.00 0.00 C ATOM 861 O ILE A 115 11.954 0.498 -2.318 1.00 0.00 O ATOM 862 CB ILE A 115 10.254 -0.904 0.152 1.00 0.00 C ATOM 863 CG1 ILE A 115 10.344 -1.970 1.247 1.00 0.00 C ATOM 864 CG2 ILE A 115 9.746 -1.512 -1.152 1.00 0.00 C ATOM 865 CD1 ILE A 115 9.027 -2.654 1.537 1.00 0.00 C ATOM 0 H ILE A 115 11.471 0.320 1.964 1.00 0.00 H new ATOM 0 HA ILE A 115 12.359 -1.002 -0.315 1.00 0.00 H new ATOM 0 HB ILE A 115 9.542 -0.141 0.467 1.00 0.00 H new ATOM 0 HG12 ILE A 115 11.076 -2.721 0.952 1.00 0.00 H new ATOM 0 HG13 ILE A 115 10.713 -1.508 2.163 1.00 0.00 H new ATOM 0 HG21 ILE A 115 8.775 -1.978 -0.982 1.00 0.00 H new ATOM 0 HG22 ILE A 115 9.646 -0.729 -1.904 1.00 0.00 H new ATOM 0 HG23 ILE A 115 10.453 -2.264 -1.503 1.00 0.00 H new ATOM 0 HD11 ILE A 115 9.168 -3.396 2.323 1.00 0.00 H new ATOM 0 HD12 ILE A 115 8.297 -1.914 1.864 1.00 0.00 H new ATOM 0 HD13 ILE A 115 8.666 -3.146 0.634 1.00 0.00 H new ATOM 877 N ILE A 116 10.984 1.951 -0.906 1.00 0.00 N ATOM 878 CA ILE A 116 10.832 3.000 -1.911 1.00 0.00 C ATOM 879 C ILE A 116 12.192 3.466 -2.430 1.00 0.00 C ATOM 880 O ILE A 116 12.371 3.675 -3.628 1.00 0.00 O ATOM 881 CB ILE A 116 10.046 4.209 -1.352 1.00 0.00 C ATOM 882 CG1 ILE A 116 8.636 3.779 -0.930 1.00 0.00 C ATOM 883 CG2 ILE A 116 9.973 5.335 -2.377 1.00 0.00 C ATOM 884 CD1 ILE A 116 7.808 3.205 -2.060 1.00 0.00 C ATOM 0 H ILE A 116 10.636 2.202 0.019 1.00 0.00 H new ATOM 0 HA ILE A 116 10.266 2.571 -2.738 1.00 0.00 H new ATOM 0 HB ILE A 116 10.576 4.583 -0.476 1.00 0.00 H new ATOM 0 HG12 ILE A 116 8.715 3.036 -0.136 1.00 0.00 H new ATOM 0 HG13 ILE A 116 8.114 4.639 -0.510 1.00 0.00 H new ATOM 0 HG21 ILE A 116 9.415 6.173 -1.958 1.00 0.00 H new ATOM 0 HG22 ILE A 116 10.981 5.662 -2.631 1.00 0.00 H new ATOM 0 HG23 ILE A 116 9.470 4.977 -3.275 1.00 0.00 H new ATOM 0 HD11 ILE A 116 6.824 2.924 -1.684 1.00 0.00 H new ATOM 0 HD12 ILE A 116 7.696 3.953 -2.845 1.00 0.00 H new ATOM 0 HD13 ILE A 116 8.306 2.325 -2.465 1.00 0.00 H new ATOM 896 N ASN A 117 13.152 3.609 -1.524 1.00 0.00 N ATOM 897 CA ASN A 117 14.491 4.064 -1.892 1.00 0.00 C ATOM 898 C ASN A 117 15.233 3.000 -2.695 1.00 0.00 C ATOM 899 O ASN A 117 16.020 3.318 -3.589 1.00 0.00 O ATOM 900 CB ASN A 117 15.292 4.433 -0.641 1.00 0.00 C ATOM 901 CG ASN A 117 16.663 4.999 -0.968 1.00 0.00 C ATOM 902 OD1 ASN A 117 16.818 6.203 -1.172 1.00 0.00 O ATOM 903 ND2 ASN A 117 17.669 4.139 -1.012 1.00 0.00 N ATOM 0 H ASN A 117 13.030 3.417 -0.530 1.00 0.00 H new ATOM 0 HA ASN A 117 14.383 4.950 -2.518 1.00 0.00 H new ATOM 0 HB2 ASN A 117 14.731 5.164 -0.058 1.00 0.00 H new ATOM 0 HB3 ASN A 117 15.409 3.548 -0.015 1.00 0.00 H new ATOM 0 HD21 ASN A 117 18.612 4.467 -1.221 1.00 0.00 H new ATOM 0 HD22 ASN A 117 17.501 3.148 -0.837 1.00 0.00 H new ATOM 910 N GLU A 118 14.972 1.738 -2.379 1.00 0.00 N ATOM 911 CA GLU A 118 15.607 0.631 -3.079 1.00 0.00 C ATOM 912 C GLU A 118 14.914 0.362 -4.411 1.00 0.00 C ATOM 913 O GLU A 118 15.498 -0.231 -5.319 1.00 0.00 O ATOM 914 CB GLU A 118 15.596 -0.626 -2.209 1.00 0.00 C ATOM 915 CG GLU A 118 16.516 -0.537 -1.002 1.00 0.00 C ATOM 916 CD GLU A 118 17.969 -0.394 -1.403 1.00 0.00 C ATOM 917 OE1 GLU A 118 18.594 -1.424 -1.735 1.00 0.00 O ATOM 918 OE2 GLU A 118 18.487 0.741 -1.396 1.00 0.00 O ATOM 0 H GLU A 118 14.325 1.456 -1.642 1.00 0.00 H new ATOM 0 HA GLU A 118 16.642 0.905 -3.283 1.00 0.00 H new ATOM 0 HB2 GLU A 118 14.578 -0.812 -1.867 1.00 0.00 H new ATOM 0 HB3 GLU A 118 15.890 -1.482 -2.817 1.00 0.00 H new ATOM 0 HG2 GLU A 118 16.225 0.314 -0.387 1.00 0.00 H new ATOM 0 HG3 GLU A 118 16.396 -1.430 -0.388 1.00 0.00 H new ATOM 925 N THR A 119 13.668 0.794 -4.528 1.00 0.00 N ATOM 926 CA THR A 119 12.966 0.707 -5.792 1.00 0.00 C ATOM 927 C THR A 119 13.438 1.838 -6.699 1.00 0.00 C ATOM 928 O THR A 119 13.171 3.011 -6.444 1.00 0.00 O ATOM 929 CB THR A 119 11.437 0.790 -5.592 1.00 0.00 C ATOM 930 OG1 THR A 119 11.011 -0.237 -4.685 1.00 0.00 O ATOM 931 CG2 THR A 119 10.700 0.636 -6.913 1.00 0.00 C ATOM 0 H THR A 119 13.128 1.205 -3.767 1.00 0.00 H new ATOM 0 HA THR A 119 13.187 -0.257 -6.251 1.00 0.00 H new ATOM 0 HB THR A 119 11.202 1.771 -5.179 1.00 0.00 H new ATOM 0 HG1 THR A 119 11.246 0.018 -3.768 1.00 0.00 H new ATOM 0 HG21 THR A 119 9.626 0.699 -6.740 1.00 0.00 H new ATOM 0 HG22 THR A 119 11.005 1.430 -7.594 1.00 0.00 H new ATOM 0 HG23 THR A 119 10.941 -0.332 -7.353 1.00 0.00 H new ATOM 939 N LYS A 120 14.154 1.487 -7.751 1.00 0.00 N ATOM 940 CA LYS A 120 14.777 2.489 -8.591 1.00 0.00 C ATOM 941 C LYS A 120 14.124 2.532 -9.963 1.00 0.00 C ATOM 942 O LYS A 120 14.619 1.966 -10.940 1.00 0.00 O ATOM 943 CB LYS A 120 16.287 2.237 -8.660 1.00 0.00 C ATOM 944 CG LYS A 120 16.929 2.307 -7.278 1.00 0.00 C ATOM 945 CD LYS A 120 18.400 1.932 -7.282 1.00 0.00 C ATOM 946 CE LYS A 120 18.948 1.911 -5.858 1.00 0.00 C ATOM 947 NZ LYS A 120 20.385 1.535 -5.808 1.00 0.00 N ATOM 0 H LYS A 120 14.317 0.523 -8.042 1.00 0.00 H new ATOM 0 HA LYS A 120 14.627 3.476 -8.153 1.00 0.00 H new ATOM 0 HB2 LYS A 120 16.474 1.257 -9.100 1.00 0.00 H new ATOM 0 HB3 LYS A 120 16.750 2.974 -9.315 1.00 0.00 H new ATOM 0 HG2 LYS A 120 16.819 3.318 -6.884 1.00 0.00 H new ATOM 0 HG3 LYS A 120 16.393 1.642 -6.601 1.00 0.00 H new ATOM 0 HD2 LYS A 120 18.531 0.953 -7.743 1.00 0.00 H new ATOM 0 HD3 LYS A 120 18.962 2.646 -7.884 1.00 0.00 H new ATOM 0 HE2 LYS A 120 18.817 2.895 -5.407 1.00 0.00 H new ATOM 0 HE3 LYS A 120 18.370 1.206 -5.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 20.710 1.535 -4.820 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 20.510 0.585 -6.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 20.943 2.221 -6.356 1.00 0.00 H new ATOM 961 N LEU A 121 12.965 3.176 -9.991 1.00 0.00 N ATOM 962 CA LEU A 121 12.186 3.365 -11.206 1.00 0.00 C ATOM 963 C LEU A 121 11.778 4.827 -11.305 1.00 0.00 C ATOM 964 O LEU A 121 12.205 5.647 -10.489 1.00 0.00 O ATOM 965 CB LEU A 121 10.927 2.480 -11.213 1.00 0.00 C ATOM 966 CG LEU A 121 11.134 0.988 -11.519 1.00 0.00 C ATOM 967 CD1 LEU A 121 11.755 0.256 -10.340 1.00 0.00 C ATOM 968 CD2 LEU A 121 9.812 0.345 -11.900 1.00 0.00 C ATOM 0 H LEU A 121 12.535 3.586 -9.162 1.00 0.00 H new ATOM 0 HA LEU A 121 12.801 3.079 -12.059 1.00 0.00 H new ATOM 0 HB2 LEU A 121 10.447 2.564 -10.238 1.00 0.00 H new ATOM 0 HB3 LEU A 121 10.231 2.885 -11.947 1.00 0.00 H new ATOM 0 HG LEU A 121 11.826 0.912 -12.358 1.00 0.00 H new ATOM 0 HD11 LEU A 121 11.886 -0.796 -10.593 1.00 0.00 H new ATOM 0 HD12 LEU A 121 12.724 0.697 -10.108 1.00 0.00 H new ATOM 0 HD13 LEU A 121 11.100 0.341 -9.473 1.00 0.00 H new ATOM 0 HD21 LEU A 121 9.970 -0.712 -12.115 1.00 0.00 H new ATOM 0 HD22 LEU A 121 9.107 0.446 -11.075 1.00 0.00 H new ATOM 0 HD23 LEU A 121 9.409 0.839 -12.784 1.00 0.00 H new ATOM 980 N ALA A 122 10.963 5.153 -12.299 1.00 0.00 N ATOM 981 CA ALA A 122 10.461 6.512 -12.456 1.00 0.00 C ATOM 982 C ALA A 122 9.666 6.937 -11.221 1.00 0.00 C ATOM 983 O ALA A 122 9.023 6.109 -10.573 1.00 0.00 O ATOM 984 CB ALA A 122 9.601 6.616 -13.707 1.00 0.00 C ATOM 0 H ALA A 122 10.636 4.497 -13.008 1.00 0.00 H new ATOM 0 HA ALA A 122 11.311 7.185 -12.563 1.00 0.00 H new ATOM 0 HB1 ALA A 122 9.233 7.637 -13.812 1.00 0.00 H new ATOM 0 HB2 ALA A 122 10.197 6.354 -14.581 1.00 0.00 H new ATOM 0 HB3 ALA A 122 8.756 5.932 -13.626 1.00 0.00 H new ATOM 990 N LYS A 123 9.704 8.230 -10.911 1.00 0.00 N ATOM 991 CA LYS A 123 9.047 8.757 -9.717 1.00 0.00 C ATOM 992 C LYS A 123 7.543 8.505 -9.757 1.00 0.00 C ATOM 993 O LYS A 123 6.902 8.353 -8.717 1.00 0.00 O ATOM 994 CB LYS A 123 9.325 10.256 -9.558 1.00 0.00 C ATOM 995 CG LYS A 123 10.793 10.582 -9.314 1.00 0.00 C ATOM 996 CD LYS A 123 11.002 12.062 -9.017 1.00 0.00 C ATOM 997 CE LYS A 123 10.611 12.941 -10.196 1.00 0.00 C ATOM 998 NZ LYS A 123 10.737 14.389 -9.877 1.00 0.00 N ATOM 0 H LYS A 123 10.184 8.934 -11.471 1.00 0.00 H new ATOM 0 HA LYS A 123 9.460 8.231 -8.856 1.00 0.00 H new ATOM 0 HB2 LYS A 123 8.990 10.776 -10.456 1.00 0.00 H new ATOM 0 HB3 LYS A 123 8.733 10.641 -8.727 1.00 0.00 H new ATOM 0 HG2 LYS A 123 11.163 9.988 -8.479 1.00 0.00 H new ATOM 0 HG3 LYS A 123 11.378 10.301 -10.189 1.00 0.00 H new ATOM 0 HD2 LYS A 123 10.413 12.343 -8.144 1.00 0.00 H new ATOM 0 HD3 LYS A 123 12.048 12.237 -8.766 1.00 0.00 H new ATOM 0 HE2 LYS A 123 11.242 12.702 -11.052 1.00 0.00 H new ATOM 0 HE3 LYS A 123 9.584 12.722 -10.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 10.461 14.952 -10.706 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 10.115 14.624 -9.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 11.723 14.604 -9.624 1.00 0.00 H new ATOM 1012 N ASN A 124 6.989 8.454 -10.963 1.00 0.00 N ATOM 1013 CA ASN A 124 5.572 8.155 -11.148 1.00 0.00 C ATOM 1014 C ASN A 124 5.252 6.776 -10.571 1.00 0.00 C ATOM 1015 O ASN A 124 4.204 6.575 -9.956 1.00 0.00 O ATOM 1016 CB ASN A 124 5.212 8.202 -12.639 1.00 0.00 C ATOM 1017 CG ASN A 124 3.722 8.398 -12.909 1.00 0.00 C ATOM 1018 OD1 ASN A 124 3.343 8.988 -13.925 1.00 0.00 O ATOM 1019 ND2 ASN A 124 2.864 7.907 -12.024 1.00 0.00 N ATOM 0 H ASN A 124 7.501 8.616 -11.830 1.00 0.00 H new ATOM 0 HA ASN A 124 4.980 8.904 -10.623 1.00 0.00 H new ATOM 0 HB2 ASN A 124 5.767 9.013 -13.111 1.00 0.00 H new ATOM 0 HB3 ASN A 124 5.538 7.275 -13.111 1.00 0.00 H new ATOM 0 HD21 ASN A 124 1.861 8.012 -12.174 1.00 0.00 H new ATOM 0 HD22 ASN A 124 3.208 7.424 -11.194 1.00 0.00 H new ATOM 1026 N THR A 125 6.180 5.844 -10.747 1.00 0.00 N ATOM 1027 CA THR A 125 6.022 4.488 -10.245 1.00 0.00 C ATOM 1028 C THR A 125 6.153 4.466 -8.723 1.00 0.00 C ATOM 1029 O THR A 125 5.406 3.769 -8.032 1.00 0.00 O ATOM 1030 CB THR A 125 7.071 3.550 -10.871 1.00 0.00 C ATOM 1031 OG1 THR A 125 7.092 3.730 -12.296 1.00 0.00 O ATOM 1032 CG2 THR A 125 6.766 2.096 -10.546 1.00 0.00 C ATOM 0 H THR A 125 7.058 6.007 -11.239 1.00 0.00 H new ATOM 0 HA THR A 125 5.028 4.137 -10.523 1.00 0.00 H new ATOM 0 HB THR A 125 8.046 3.799 -10.453 1.00 0.00 H new ATOM 0 HG1 THR A 125 7.761 3.133 -12.691 1.00 0.00 H new ATOM 0 HG21 THR A 125 7.522 1.455 -11.000 1.00 0.00 H new ATOM 0 HG22 THR A 125 6.773 1.956 -9.465 1.00 0.00 H new ATOM 0 HG23 THR A 125 5.784 1.833 -10.940 1.00 0.00 H new ATOM 1040 N LEU A 126 7.088 5.254 -8.207 1.00 0.00 N ATOM 1041 CA LEU A 126 7.288 5.365 -6.766 1.00 0.00 C ATOM 1042 C LEU A 126 6.034 5.915 -6.098 1.00 0.00 C ATOM 1043 O LEU A 126 5.624 5.447 -5.033 1.00 0.00 O ATOM 1044 CB LEU A 126 8.484 6.270 -6.462 1.00 0.00 C ATOM 1045 CG LEU A 126 9.824 5.783 -7.019 1.00 0.00 C ATOM 1046 CD1 LEU A 126 10.927 6.778 -6.693 1.00 0.00 C ATOM 1047 CD2 LEU A 126 10.163 4.412 -6.459 1.00 0.00 C ATOM 0 H LEU A 126 7.721 5.827 -8.765 1.00 0.00 H new ATOM 0 HA LEU A 126 7.491 4.371 -6.368 1.00 0.00 H new ATOM 0 HB2 LEU A 126 8.280 7.263 -6.864 1.00 0.00 H new ATOM 0 HB3 LEU A 126 8.574 6.376 -5.381 1.00 0.00 H new ATOM 0 HG LEU A 126 9.740 5.703 -8.103 1.00 0.00 H new ATOM 0 HD11 LEU A 126 11.873 6.417 -7.096 1.00 0.00 H new ATOM 0 HD12 LEU A 126 10.688 7.744 -7.137 1.00 0.00 H new ATOM 0 HD13 LEU A 126 11.011 6.887 -5.612 1.00 0.00 H new ATOM 0 HD21 LEU A 126 11.119 4.079 -6.865 1.00 0.00 H new ATOM 0 HD22 LEU A 126 10.230 4.469 -5.373 1.00 0.00 H new ATOM 0 HD23 LEU A 126 9.384 3.702 -6.738 1.00 0.00 H new ATOM 1059 N LYS A 127 5.417 6.900 -6.739 1.00 0.00 N ATOM 1060 CA LYS A 127 4.184 7.486 -6.233 1.00 0.00 C ATOM 1061 C LYS A 127 3.039 6.484 -6.265 1.00 0.00 C ATOM 1062 O LYS A 127 2.145 6.536 -5.423 1.00 0.00 O ATOM 1063 CB LYS A 127 3.797 8.721 -7.039 1.00 0.00 C ATOM 1064 CG LYS A 127 4.603 9.962 -6.703 1.00 0.00 C ATOM 1065 CD LYS A 127 4.100 11.149 -7.499 1.00 0.00 C ATOM 1066 CE LYS A 127 4.722 12.452 -7.034 1.00 0.00 C ATOM 1067 NZ LYS A 127 4.157 13.613 -7.771 1.00 0.00 N ATOM 0 H LYS A 127 5.752 7.310 -7.611 1.00 0.00 H new ATOM 0 HA LYS A 127 4.368 7.775 -5.198 1.00 0.00 H new ATOM 0 HB2 LYS A 127 3.916 8.501 -8.100 1.00 0.00 H new ATOM 0 HB3 LYS A 127 2.740 8.932 -6.874 1.00 0.00 H new ATOM 0 HG2 LYS A 127 4.529 10.174 -5.636 1.00 0.00 H new ATOM 0 HG3 LYS A 127 5.657 9.789 -6.922 1.00 0.00 H new ATOM 0 HD2 LYS A 127 4.323 10.998 -8.555 1.00 0.00 H new ATOM 0 HD3 LYS A 127 3.016 11.213 -7.408 1.00 0.00 H new ATOM 0 HE2 LYS A 127 4.550 12.578 -5.965 1.00 0.00 H new ATOM 0 HE3 LYS A 127 5.801 12.415 -7.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 4.602 14.490 -7.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 4.343 13.502 -8.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 3.131 13.660 -7.610 1.00 0.00 H new ATOM 1081 N ALA A 128 3.058 5.583 -7.237 1.00 0.00 N ATOM 1082 CA ALA A 128 2.024 4.562 -7.349 1.00 0.00 C ATOM 1083 C ALA A 128 2.027 3.657 -6.119 1.00 0.00 C ATOM 1084 O ALA A 128 0.972 3.344 -5.564 1.00 0.00 O ATOM 1085 CB ALA A 128 2.216 3.745 -8.616 1.00 0.00 C ATOM 0 H ALA A 128 3.777 5.538 -7.959 1.00 0.00 H new ATOM 0 HA ALA A 128 1.055 5.059 -7.405 1.00 0.00 H new ATOM 0 HB1 ALA A 128 1.435 2.988 -8.683 1.00 0.00 H new ATOM 0 HB2 ALA A 128 2.160 4.402 -9.484 1.00 0.00 H new ATOM 0 HB3 ALA A 128 3.191 3.259 -8.591 1.00 0.00 H new ATOM 1091 N ILE A 129 3.219 3.256 -5.690 1.00 0.00 N ATOM 1092 CA ILE A 129 3.361 2.437 -4.490 1.00 0.00 C ATOM 1093 C ILE A 129 2.961 3.251 -3.259 1.00 0.00 C ATOM 1094 O ILE A 129 2.241 2.767 -2.382 1.00 0.00 O ATOM 1095 CB ILE A 129 4.811 1.929 -4.320 1.00 0.00 C ATOM 1096 CG1 ILE A 129 5.312 1.303 -5.626 1.00 0.00 C ATOM 1097 CG2 ILE A 129 4.888 0.913 -3.184 1.00 0.00 C ATOM 1098 CD1 ILE A 129 6.762 0.865 -5.578 1.00 0.00 C ATOM 0 H ILE A 129 4.099 3.484 -6.153 1.00 0.00 H new ATOM 0 HA ILE A 129 2.706 1.572 -4.595 1.00 0.00 H new ATOM 0 HB ILE A 129 5.449 2.777 -4.072 1.00 0.00 H new ATOM 0 HG12 ILE A 129 4.690 0.441 -5.867 1.00 0.00 H new ATOM 0 HG13 ILE A 129 5.186 2.023 -6.435 1.00 0.00 H new ATOM 0 HG21 ILE A 129 5.915 0.564 -3.077 1.00 0.00 H new ATOM 0 HG22 ILE A 129 4.565 1.381 -2.254 1.00 0.00 H new ATOM 0 HG23 ILE A 129 4.239 0.066 -3.408 1.00 0.00 H new ATOM 0 HD11 ILE A 129 7.043 0.432 -6.538 1.00 0.00 H new ATOM 0 HD12 ILE A 129 7.396 1.727 -5.369 1.00 0.00 H new ATOM 0 HD13 ILE A 129 6.891 0.120 -4.792 1.00 0.00 H new ATOM 1110 N ARG A 130 3.425 4.498 -3.225 1.00 0.00 N ATOM 1111 CA ARG A 130 3.112 5.434 -2.145 1.00 0.00 C ATOM 1112 C ARG A 130 1.602 5.591 -1.977 1.00 0.00 C ATOM 1113 O ARG A 130 1.076 5.434 -0.874 1.00 0.00 O ATOM 1114 CB ARG A 130 3.763 6.791 -2.448 1.00 0.00 C ATOM 1115 CG ARG A 130 3.504 7.881 -1.413 1.00 0.00 C ATOM 1116 CD ARG A 130 3.964 7.471 -0.022 1.00 0.00 C ATOM 1117 NE ARG A 130 4.316 8.624 0.816 1.00 0.00 N ATOM 1118 CZ ARG A 130 3.437 9.480 1.350 1.00 0.00 C ATOM 1119 NH1 ARG A 130 2.139 9.378 1.080 1.00 0.00 N ATOM 1120 NH2 ARG A 130 3.871 10.450 2.146 1.00 0.00 N ATOM 0 H ARG A 130 4.030 4.890 -3.947 1.00 0.00 H new ATOM 0 HA ARG A 130 3.509 5.041 -1.209 1.00 0.00 H new ATOM 0 HB2 ARG A 130 4.840 6.647 -2.539 1.00 0.00 H new ATOM 0 HB3 ARG A 130 3.405 7.140 -3.417 1.00 0.00 H new ATOM 0 HG2 ARG A 130 4.021 8.793 -1.711 1.00 0.00 H new ATOM 0 HG3 ARG A 130 2.439 8.111 -1.389 1.00 0.00 H new ATOM 0 HD2 ARG A 130 3.174 6.900 0.465 1.00 0.00 H new ATOM 0 HD3 ARG A 130 4.827 6.811 -0.108 1.00 0.00 H new ATOM 0 HE ARG A 130 5.305 8.785 1.005 1.00 0.00 H new ATOM 0 HH11 ARG A 130 1.803 8.641 0.460 1.00 0.00 H new ATOM 0 HH12 ARG A 130 1.479 10.037 1.493 1.00 0.00 H new ATOM 0 HH21 ARG A 130 4.867 10.538 2.346 1.00 0.00 H new ATOM 0 HH22 ARG A 130 3.208 11.107 2.557 1.00 0.00 H new ATOM 1134 N ASN A 131 0.916 5.883 -3.078 1.00 0.00 N ATOM 1135 CA ASN A 131 -0.535 6.061 -3.063 1.00 0.00 C ATOM 1136 C ASN A 131 -1.235 4.811 -2.552 1.00 0.00 C ATOM 1137 O ASN A 131 -2.003 4.875 -1.594 1.00 0.00 O ATOM 1138 CB ASN A 131 -1.058 6.411 -4.459 1.00 0.00 C ATOM 1139 CG ASN A 131 -1.007 7.900 -4.755 1.00 0.00 C ATOM 1140 OD1 ASN A 131 -1.974 8.624 -4.520 1.00 0.00 O ATOM 1141 ND2 ASN A 131 0.117 8.371 -5.276 1.00 0.00 N ATOM 0 H ASN A 131 1.343 6.002 -3.997 1.00 0.00 H new ATOM 0 HA ASN A 131 -0.755 6.887 -2.386 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -0.470 5.877 -5.206 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -2.086 6.062 -4.554 1.00 0.00 H new ATOM 0 HD21 ASN A 131 0.201 9.364 -5.496 1.00 0.00 H new ATOM 0 HD22 ASN A 131 0.898 7.741 -5.457 1.00 0.00 H new ATOM 1148 N THR A 132 -0.940 3.676 -3.180 1.00 0.00 N ATOM 1149 CA THR A 132 -1.560 2.405 -2.818 1.00 0.00 C ATOM 1150 C THR A 132 -1.414 2.123 -1.321 1.00 0.00 C ATOM 1151 O THR A 132 -2.399 1.854 -0.630 1.00 0.00 O ATOM 1152 CB THR A 132 -0.942 1.245 -3.624 1.00 0.00 C ATOM 1153 OG1 THR A 132 -1.005 1.539 -5.026 1.00 0.00 O ATOM 1154 CG2 THR A 132 -1.672 -0.061 -3.349 1.00 0.00 C ATOM 0 H THR A 132 -0.271 3.611 -3.947 1.00 0.00 H new ATOM 0 HA THR A 132 -2.621 2.481 -3.057 1.00 0.00 H new ATOM 0 HB THR A 132 0.098 1.134 -3.316 1.00 0.00 H new ATOM 0 HG1 THR A 132 -0.259 2.125 -5.271 1.00 0.00 H new ATOM 0 HG21 THR A 132 -1.216 -0.862 -3.930 1.00 0.00 H new ATOM 0 HG22 THR A 132 -1.605 -0.299 -2.287 1.00 0.00 H new ATOM 0 HG23 THR A 132 -2.720 0.041 -3.632 1.00 0.00 H new ATOM 1162 N ALA A 133 -0.188 2.231 -0.818 1.00 0.00 N ATOM 1163 CA ALA A 133 0.092 1.953 0.583 1.00 0.00 C ATOM 1164 C ALA A 133 -0.677 2.897 1.502 1.00 0.00 C ATOM 1165 O ALA A 133 -1.329 2.457 2.450 1.00 0.00 O ATOM 1166 CB ALA A 133 1.585 2.045 0.850 1.00 0.00 C ATOM 0 H ALA A 133 0.628 2.510 -1.363 1.00 0.00 H new ATOM 0 HA ALA A 133 -0.242 0.938 0.798 1.00 0.00 H new ATOM 0 HB1 ALA A 133 1.780 1.835 1.902 1.00 0.00 H new ATOM 0 HB2 ALA A 133 2.111 1.318 0.231 1.00 0.00 H new ATOM 0 HB3 ALA A 133 1.937 3.048 0.609 1.00 0.00 H new ATOM 1172 N SER A 134 -0.616 4.194 1.209 1.00 0.00 N ATOM 1173 CA SER A 134 -1.275 5.193 2.044 1.00 0.00 C ATOM 1174 C SER A 134 -2.789 4.985 2.062 1.00 0.00 C ATOM 1175 O SER A 134 -3.430 5.165 3.097 1.00 0.00 O ATOM 1176 CB SER A 134 -0.931 6.610 1.569 1.00 0.00 C ATOM 1177 OG SER A 134 -1.237 6.789 0.197 1.00 0.00 O ATOM 0 H SER A 134 -0.120 4.576 0.404 1.00 0.00 H new ATOM 0 HA SER A 134 -0.907 5.072 3.063 1.00 0.00 H new ATOM 0 HB2 SER A 134 -1.483 7.338 2.163 1.00 0.00 H new ATOM 0 HB3 SER A 134 0.129 6.802 1.734 1.00 0.00 H new ATOM 0 HG SER A 134 -1.526 5.935 -0.188 1.00 0.00 H new ATOM 1183 N GLN A 135 -3.348 4.574 0.924 1.00 0.00 N ATOM 1184 CA GLN A 135 -4.787 4.365 0.803 1.00 0.00 C ATOM 1185 C GLN A 135 -5.252 3.205 1.674 1.00 0.00 C ATOM 1186 O GLN A 135 -6.342 3.247 2.242 1.00 0.00 O ATOM 1187 CB GLN A 135 -5.176 4.106 -0.652 1.00 0.00 C ATOM 1188 CG GLN A 135 -5.044 5.328 -1.550 1.00 0.00 C ATOM 1189 CD GLN A 135 -6.012 6.438 -1.181 1.00 0.00 C ATOM 1190 OE1 GLN A 135 -7.188 6.071 -0.692 1.00 0.00 O flip ATOM 1191 NE2 GLN A 135 -5.710 7.617 -1.348 1.00 0.00 N flip ATOM 0 H GLN A 135 -2.823 4.379 0.072 1.00 0.00 H new ATOM 0 HA GLN A 135 -5.279 5.275 1.146 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -4.551 3.306 -1.049 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -6.206 3.752 -0.685 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -4.024 5.708 -1.491 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -5.215 5.032 -2.585 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -4.795 7.860 -1.727 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -6.374 8.353 -1.108 1.00 0.00 H new ATOM 1200 N ILE A 136 -4.426 2.175 1.778 1.00 0.00 N ATOM 1201 CA ILE A 136 -4.760 1.014 2.589 1.00 0.00 C ATOM 1202 C ILE A 136 -4.805 1.384 4.070 1.00 0.00 C ATOM 1203 O ILE A 136 -5.752 1.036 4.779 1.00 0.00 O ATOM 1204 CB ILE A 136 -3.752 -0.136 2.367 1.00 0.00 C ATOM 1205 CG1 ILE A 136 -3.765 -0.564 0.897 1.00 0.00 C ATOM 1206 CG2 ILE A 136 -4.071 -1.316 3.274 1.00 0.00 C ATOM 1207 CD1 ILE A 136 -2.733 -1.615 0.554 1.00 0.00 C ATOM 0 H ILE A 136 -3.521 2.119 1.312 1.00 0.00 H new ATOM 0 HA ILE A 136 -5.747 0.671 2.278 1.00 0.00 H new ATOM 0 HB ILE A 136 -2.753 0.220 2.620 1.00 0.00 H new ATOM 0 HG12 ILE A 136 -4.755 -0.947 0.649 1.00 0.00 H new ATOM 0 HG13 ILE A 136 -3.597 0.313 0.272 1.00 0.00 H new ATOM 0 HG21 ILE A 136 -3.349 -2.114 3.101 1.00 0.00 H new ATOM 0 HG22 ILE A 136 -4.019 -0.999 4.316 1.00 0.00 H new ATOM 0 HG23 ILE A 136 -5.075 -1.681 3.056 1.00 0.00 H new ATOM 0 HD11 ILE A 136 -2.806 -1.865 -0.504 1.00 0.00 H new ATOM 0 HD12 ILE A 136 -1.736 -1.230 0.768 1.00 0.00 H new ATOM 0 HD13 ILE A 136 -2.912 -2.509 1.151 1.00 0.00 H new ATOM 1219 N PHE A 137 -3.800 2.125 4.524 1.00 0.00 N ATOM 1220 CA PHE A 137 -3.723 2.521 5.923 1.00 0.00 C ATOM 1221 C PHE A 137 -4.837 3.496 6.292 1.00 0.00 C ATOM 1222 O PHE A 137 -5.485 3.336 7.323 1.00 0.00 O ATOM 1223 CB PHE A 137 -2.357 3.132 6.245 1.00 0.00 C ATOM 1224 CG PHE A 137 -1.242 2.126 6.277 1.00 0.00 C ATOM 1225 CD1 PHE A 137 -1.196 1.161 7.268 1.00 0.00 C ATOM 1226 CD2 PHE A 137 -0.244 2.142 5.316 1.00 0.00 C ATOM 1227 CE1 PHE A 137 -0.176 0.231 7.303 1.00 0.00 C ATOM 1228 CE2 PHE A 137 0.779 1.214 5.344 1.00 0.00 C ATOM 1229 CZ PHE A 137 0.813 0.257 6.338 1.00 0.00 C ATOM 0 H PHE A 137 -3.031 2.462 3.945 1.00 0.00 H new ATOM 0 HA PHE A 137 -3.852 1.619 6.522 1.00 0.00 H new ATOM 0 HB2 PHE A 137 -2.125 3.895 5.502 1.00 0.00 H new ATOM 0 HB3 PHE A 137 -2.411 3.633 7.211 1.00 0.00 H new ATOM 0 HD1 PHE A 137 -1.967 1.135 8.023 1.00 0.00 H new ATOM 0 HD2 PHE A 137 -0.266 2.889 4.536 1.00 0.00 H new ATOM 0 HE1 PHE A 137 -0.151 -0.515 8.083 1.00 0.00 H new ATOM 0 HE2 PHE A 137 1.551 1.237 4.589 1.00 0.00 H new ATOM 0 HZ PHE A 137 1.611 -0.470 6.362 1.00 0.00 H new ATOM 1239 N ARG A 138 -5.074 4.498 5.446 1.00 0.00 N ATOM 1240 CA ARG A 138 -6.114 5.487 5.729 1.00 0.00 C ATOM 1241 C ARG A 138 -7.494 4.838 5.721 1.00 0.00 C ATOM 1242 O ARG A 138 -8.373 5.235 6.484 1.00 0.00 O ATOM 1243 CB ARG A 138 -6.068 6.658 4.742 1.00 0.00 C ATOM 1244 CG ARG A 138 -6.235 6.252 3.290 1.00 0.00 C ATOM 1245 CD ARG A 138 -6.152 7.448 2.359 1.00 0.00 C ATOM 1246 NE ARG A 138 -7.339 8.297 2.446 1.00 0.00 N ATOM 1247 CZ ARG A 138 -7.318 9.627 2.365 1.00 0.00 C ATOM 1248 NH1 ARG A 138 -6.158 10.270 2.242 1.00 0.00 N ATOM 1249 NH2 ARG A 138 -8.458 10.307 2.409 1.00 0.00 N ATOM 0 H ARG A 138 -4.569 4.646 4.572 1.00 0.00 H new ATOM 0 HA ARG A 138 -5.920 5.886 6.725 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -6.852 7.369 5.002 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -5.117 7.178 4.856 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -5.464 5.529 3.023 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -7.196 5.755 3.159 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -5.268 8.036 2.603 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -6.030 7.100 1.333 1.00 0.00 H new ATOM 0 HE ARG A 138 -8.242 7.842 2.577 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -5.284 9.744 2.210 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -6.143 11.288 2.180 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -9.344 9.811 2.504 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -8.447 11.325 2.347 1.00 0.00 H new ATOM 1263 N LEU A 139 -7.673 3.826 4.876 1.00 0.00 N ATOM 1264 CA LEU A 139 -8.924 3.083 4.832 1.00 0.00 C ATOM 1265 C LEU A 139 -9.148 2.364 6.159 1.00 0.00 C ATOM 1266 O LEU A 139 -10.260 2.333 6.683 1.00 0.00 O ATOM 1267 CB LEU A 139 -8.912 2.072 3.682 1.00 0.00 C ATOM 1268 CG LEU A 139 -10.205 1.276 3.494 1.00 0.00 C ATOM 1269 CD1 LEU A 139 -11.352 2.197 3.113 1.00 0.00 C ATOM 1270 CD2 LEU A 139 -10.013 0.197 2.440 1.00 0.00 C ATOM 0 H LEU A 139 -6.967 3.504 4.214 1.00 0.00 H new ATOM 0 HA LEU A 139 -9.740 3.786 4.663 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -8.695 2.604 2.756 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -8.094 1.370 3.846 1.00 0.00 H new ATOM 0 HG LEU A 139 -10.455 0.796 4.440 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -12.262 1.611 2.984 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -11.504 2.934 3.901 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -11.114 2.708 2.180 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -10.941 -0.361 2.317 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -9.739 0.659 1.492 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -9.220 -0.482 2.755 1.00 0.00 H new ATOM 1282 N ALA A 140 -8.079 1.796 6.701 1.00 0.00 N ATOM 1283 CA ALA A 140 -8.144 1.143 7.998 1.00 0.00 C ATOM 1284 C ALA A 140 -8.463 2.159 9.093 1.00 0.00 C ATOM 1285 O ALA A 140 -9.213 1.868 10.027 1.00 0.00 O ATOM 1286 CB ALA A 140 -6.836 0.428 8.292 1.00 0.00 C ATOM 0 H ALA A 140 -7.159 1.775 6.262 1.00 0.00 H new ATOM 0 HA ALA A 140 -8.944 0.403 7.977 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -6.897 -0.057 9.266 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -6.651 -0.323 7.524 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -6.020 1.150 8.297 1.00 0.00 H new ATOM 1292 N ILE A 141 -7.902 3.357 8.964 1.00 0.00 N ATOM 1293 CA ILE A 141 -8.172 4.439 9.906 1.00 0.00 C ATOM 1294 C ILE A 141 -9.645 4.838 9.853 1.00 0.00 C ATOM 1295 O ILE A 141 -10.287 5.019 10.889 1.00 0.00 O ATOM 1296 CB ILE A 141 -7.288 5.677 9.623 1.00 0.00 C ATOM 1297 CG1 ILE A 141 -5.808 5.302 9.728 1.00 0.00 C ATOM 1298 CG2 ILE A 141 -7.621 6.807 10.590 1.00 0.00 C ATOM 1299 CD1 ILE A 141 -4.871 6.425 9.350 1.00 0.00 C ATOM 0 H ILE A 141 -7.256 3.604 8.214 1.00 0.00 H new ATOM 0 HA ILE A 141 -7.931 4.069 10.903 1.00 0.00 H new ATOM 0 HB ILE A 141 -7.491 6.024 8.610 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -5.593 4.989 10.750 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -5.613 4.445 9.084 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -6.989 7.668 10.375 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -8.668 7.088 10.475 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -7.445 6.474 11.613 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -3.839 6.087 9.448 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -5.058 6.724 8.319 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -5.038 7.276 10.010 1.00 0.00 H new ATOM 1311 N GLU A 142 -10.187 4.930 8.640 1.00 0.00 N ATOM 1312 CA GLU A 142 -11.590 5.298 8.446 1.00 0.00 C ATOM 1313 C GLU A 142 -12.532 4.196 8.931 1.00 0.00 C ATOM 1314 O GLU A 142 -13.748 4.387 8.985 1.00 0.00 O ATOM 1315 CB GLU A 142 -11.869 5.601 6.971 1.00 0.00 C ATOM 1316 CG GLU A 142 -11.084 6.783 6.429 1.00 0.00 C ATOM 1317 CD GLU A 142 -11.480 7.149 5.012 1.00 0.00 C ATOM 1318 OE1 GLU A 142 -10.886 6.606 4.058 1.00 0.00 O ATOM 1319 OE2 GLU A 142 -12.388 7.987 4.845 1.00 0.00 O ATOM 0 H GLU A 142 -9.676 4.755 7.775 1.00 0.00 H new ATOM 0 HA GLU A 142 -11.775 6.193 9.039 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -11.634 4.718 6.377 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -12.934 5.795 6.845 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -11.238 7.645 7.079 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -10.020 6.550 6.456 1.00 0.00 H new ATOM 1326 N ASN A 143 -11.973 3.040 9.267 1.00 0.00 N ATOM 1327 CA ASN A 143 -12.763 1.932 9.792 1.00 0.00 C ATOM 1328 C ASN A 143 -12.395 1.622 11.240 1.00 0.00 C ATOM 1329 O ASN A 143 -12.760 0.565 11.760 1.00 0.00 O ATOM 1330 CB ASN A 143 -12.586 0.682 8.927 1.00 0.00 C ATOM 1331 CG ASN A 143 -13.371 0.754 7.633 1.00 0.00 C ATOM 1332 OD1 ASN A 143 -14.547 0.392 7.588 1.00 0.00 O ATOM 1333 ND2 ASN A 143 -12.733 1.209 6.569 1.00 0.00 N ATOM 0 H ASN A 143 -10.975 2.845 9.185 1.00 0.00 H new ATOM 0 HA ASN A 143 -13.810 2.235 9.764 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -11.528 0.549 8.699 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -12.903 -0.194 9.492 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -13.215 1.269 5.672 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -11.758 1.500 6.645 1.00 0.00 H new ATOM 1340 N ARG A 144 -11.677 2.548 11.881 1.00 0.00 N ATOM 1341 CA ARG A 144 -11.307 2.423 13.299 1.00 0.00 C ATOM 1342 C ARG A 144 -10.423 1.200 13.557 1.00 0.00 C ATOM 1343 O ARG A 144 -10.392 0.670 14.670 1.00 0.00 O ATOM 1344 CB ARG A 144 -12.559 2.346 14.182 1.00 0.00 C ATOM 1345 CG ARG A 144 -13.349 3.640 14.257 1.00 0.00 C ATOM 1346 CD ARG A 144 -14.592 3.468 15.112 1.00 0.00 C ATOM 1347 NE ARG A 144 -15.300 4.728 15.321 1.00 0.00 N ATOM 1348 CZ ARG A 144 -16.505 4.819 15.878 1.00 0.00 C ATOM 1349 NH1 ARG A 144 -17.183 3.722 16.188 1.00 0.00 N ATOM 1350 NH2 ARG A 144 -17.044 6.012 16.093 1.00 0.00 N ATOM 0 H ARG A 144 -11.336 3.401 11.438 1.00 0.00 H new ATOM 0 HA ARG A 144 -10.735 3.315 13.556 1.00 0.00 H new ATOM 0 HB2 ARG A 144 -13.209 1.558 13.802 1.00 0.00 H new ATOM 0 HB3 ARG A 144 -12.262 2.056 15.190 1.00 0.00 H new ATOM 0 HG2 ARG A 144 -12.723 4.429 14.673 1.00 0.00 H new ATOM 0 HG3 ARG A 144 -13.634 3.955 13.253 1.00 0.00 H new ATOM 0 HD2 ARG A 144 -15.262 2.752 14.635 1.00 0.00 H new ATOM 0 HD3 ARG A 144 -14.311 3.047 16.077 1.00 0.00 H new ATOM 0 HE ARG A 144 -14.844 5.590 15.022 1.00 0.00 H new ATOM 0 HH11 ARG A 144 -16.781 2.804 16.000 1.00 0.00 H new ATOM 0 HH12 ARG A 144 -18.106 3.797 16.615 1.00 0.00 H new ATOM 0 HH21 ARG A 144 -16.535 6.856 15.831 1.00 0.00 H new ATOM 0 HH22 ARG A 144 -17.968 6.085 16.520 1.00 0.00 H new ATOM 1364 N ALA A 145 -9.692 0.767 12.542 1.00 0.00 N ATOM 1365 CA ALA A 145 -8.827 -0.396 12.673 1.00 0.00 C ATOM 1366 C ALA A 145 -7.433 0.012 13.121 1.00 0.00 C ATOM 1367 O ALA A 145 -6.688 -0.795 13.681 1.00 0.00 O ATOM 1368 CB ALA A 145 -8.761 -1.153 11.359 1.00 0.00 C ATOM 0 H ALA A 145 -9.680 1.202 11.620 1.00 0.00 H new ATOM 0 HA ALA A 145 -9.249 -1.052 13.435 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -8.111 -2.020 11.471 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -9.761 -1.483 11.079 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -8.364 -0.500 10.582 1.00 0.00 H new ATOM 1374 N ILE A 146 -7.082 1.259 12.856 1.00 0.00 N ATOM 1375 CA ILE A 146 -5.797 1.800 13.260 1.00 0.00 C ATOM 1376 C ILE A 146 -5.875 3.326 13.273 1.00 0.00 C ATOM 1377 O ILE A 146 -6.745 3.905 12.622 1.00 0.00 O ATOM 1378 CB ILE A 146 -4.658 1.318 12.324 1.00 0.00 C ATOM 1379 CG1 ILE A 146 -3.285 1.611 12.943 1.00 0.00 C ATOM 1380 CG2 ILE A 146 -4.778 1.963 10.946 1.00 0.00 C ATOM 1381 CD1 ILE A 146 -2.123 1.113 12.112 1.00 0.00 C ATOM 0 H ILE A 146 -7.677 1.921 12.357 1.00 0.00 H new ATOM 0 HA ILE A 146 -5.565 1.438 14.262 1.00 0.00 H new ATOM 0 HB ILE A 146 -4.754 0.239 12.203 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -3.183 2.687 13.086 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -3.236 1.152 13.931 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -3.968 1.610 10.307 1.00 0.00 H new ATOM 0 HG22 ILE A 146 -5.736 1.694 10.500 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -4.716 3.047 11.045 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -1.186 1.357 12.613 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -2.199 0.032 11.990 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -2.145 1.591 11.133 1.00 0.00 H new ATOM 1393 N ASP A 147 -4.997 3.969 14.024 1.00 0.00 N ATOM 1394 CA ASP A 147 -4.996 5.425 14.114 1.00 0.00 C ATOM 1395 C ASP A 147 -3.605 5.973 13.790 1.00 0.00 C ATOM 1396 O ASP A 147 -3.211 7.053 14.236 1.00 0.00 O ATOM 1397 CB ASP A 147 -5.446 5.865 15.512 1.00 0.00 C ATOM 1398 CG ASP A 147 -5.691 7.358 15.604 1.00 0.00 C ATOM 1399 OD1 ASP A 147 -6.418 7.899 14.747 1.00 0.00 O ATOM 1400 OD2 ASP A 147 -5.150 7.994 16.534 1.00 0.00 O ATOM 0 H ASP A 147 -4.276 3.510 14.580 1.00 0.00 H new ATOM 0 HA ASP A 147 -5.699 5.828 13.385 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -6.360 5.334 15.779 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -4.687 5.580 16.240 1.00 0.00 H new ATOM 1405 N PHE A 148 -2.872 5.227 12.986 1.00 0.00 N ATOM 1406 CA PHE A 148 -1.529 5.616 12.590 1.00 0.00 C ATOM 1407 C PHE A 148 -1.304 5.257 11.130 1.00 0.00 C ATOM 1408 O PHE A 148 -1.637 4.153 10.700 1.00 0.00 O ATOM 1409 CB PHE A 148 -0.488 4.928 13.483 1.00 0.00 C ATOM 1410 CG PHE A 148 0.931 5.348 13.205 1.00 0.00 C ATOM 1411 CD1 PHE A 148 1.383 6.605 13.577 1.00 0.00 C ATOM 1412 CD2 PHE A 148 1.811 4.483 12.576 1.00 0.00 C ATOM 1413 CE1 PHE A 148 2.686 6.990 13.324 1.00 0.00 C ATOM 1414 CE2 PHE A 148 3.115 4.865 12.321 1.00 0.00 C ATOM 1415 CZ PHE A 148 3.553 6.120 12.695 1.00 0.00 C ATOM 0 H PHE A 148 -3.186 4.341 12.591 1.00 0.00 H new ATOM 0 HA PHE A 148 -1.418 6.694 12.710 1.00 0.00 H new ATOM 0 HB2 PHE A 148 -0.721 5.141 14.526 1.00 0.00 H new ATOM 0 HB3 PHE A 148 -0.569 3.849 13.353 1.00 0.00 H new ATOM 0 HD1 PHE A 148 0.710 7.291 14.070 1.00 0.00 H new ATOM 0 HD2 PHE A 148 1.475 3.500 12.282 1.00 0.00 H new ATOM 0 HE1 PHE A 148 3.026 7.972 13.619 1.00 0.00 H new ATOM 0 HE2 PHE A 148 3.791 4.182 11.829 1.00 0.00 H new ATOM 0 HZ PHE A 148 4.571 6.420 12.496 1.00 0.00 H new ATOM 1425 N ASN A 149 -0.768 6.195 10.368 1.00 0.00 N ATOM 1426 CA ASN A 149 -0.513 5.967 8.951 1.00 0.00 C ATOM 1427 C ASN A 149 0.986 5.997 8.671 1.00 0.00 C ATOM 1428 O ASN A 149 1.559 7.061 8.429 1.00 0.00 O ATOM 1429 CB ASN A 149 -1.233 7.021 8.101 1.00 0.00 C ATOM 1430 CG ASN A 149 -1.258 6.678 6.619 1.00 0.00 C ATOM 1431 OD1 ASN A 149 -0.378 5.988 6.102 1.00 0.00 O ATOM 1432 ND2 ASN A 149 -2.270 7.169 5.921 1.00 0.00 N ATOM 0 H ASN A 149 -0.501 7.120 10.703 1.00 0.00 H new ATOM 0 HA ASN A 149 -0.899 4.983 8.684 1.00 0.00 H new ATOM 0 HB2 ASN A 149 -2.256 7.131 8.460 1.00 0.00 H new ATOM 0 HB3 ASN A 149 -0.743 7.985 8.236 1.00 0.00 H new ATOM 0 HD21 ASN A 149 -2.339 6.980 4.921 1.00 0.00 H new ATOM 0 HD22 ASN A 149 -2.980 7.737 6.383 1.00 0.00 H new ATOM 1439 N PRO A 150 1.644 4.826 8.705 1.00 0.00 N ATOM 1440 CA PRO A 150 3.091 4.720 8.481 1.00 0.00 C ATOM 1441 C PRO A 150 3.487 5.124 7.065 1.00 0.00 C ATOM 1442 O PRO A 150 4.594 5.608 6.832 1.00 0.00 O ATOM 1443 CB PRO A 150 3.391 3.232 8.709 1.00 0.00 C ATOM 1444 CG PRO A 150 2.206 2.696 9.437 1.00 0.00 C ATOM 1445 CD PRO A 150 1.037 3.512 8.973 1.00 0.00 C ATOM 0 HA PRO A 150 3.649 5.385 9.141 1.00 0.00 H new ATOM 0 HB2 PRO A 150 3.539 2.712 7.763 1.00 0.00 H new ATOM 0 HB3 PRO A 150 4.303 3.100 9.292 1.00 0.00 H new ATOM 0 HG2 PRO A 150 2.057 1.639 9.216 1.00 0.00 H new ATOM 0 HG3 PRO A 150 2.339 2.781 10.516 1.00 0.00 H new ATOM 0 HD2 PRO A 150 0.577 3.089 8.080 1.00 0.00 H new ATOM 0 HD3 PRO A 150 0.259 3.573 9.734 1.00 0.00 H new ATOM 1453 N ALA A 151 2.563 4.947 6.127 1.00 0.00 N ATOM 1454 CA ALA A 151 2.832 5.232 4.726 1.00 0.00 C ATOM 1455 C ALA A 151 2.883 6.730 4.469 1.00 0.00 C ATOM 1456 O ALA A 151 3.478 7.178 3.491 1.00 0.00 O ATOM 1457 CB ALA A 151 1.783 4.581 3.844 1.00 0.00 C ATOM 0 H ALA A 151 1.620 4.607 6.314 1.00 0.00 H new ATOM 0 HA ALA A 151 3.808 4.815 4.480 1.00 0.00 H new ATOM 0 HB1 ALA A 151 1.998 4.803 2.799 1.00 0.00 H new ATOM 0 HB2 ALA A 151 1.799 3.502 3.996 1.00 0.00 H new ATOM 0 HB3 ALA A 151 0.798 4.970 4.103 1.00 0.00 H new ATOM 1463 N ASP A 152 2.275 7.505 5.356 1.00 0.00 N ATOM 1464 CA ASP A 152 2.259 8.957 5.207 1.00 0.00 C ATOM 1465 C ASP A 152 3.613 9.534 5.607 1.00 0.00 C ATOM 1466 O ASP A 152 3.953 10.667 5.265 1.00 0.00 O ATOM 1467 CB ASP A 152 1.147 9.576 6.059 1.00 0.00 C ATOM 1468 CG ASP A 152 0.670 10.912 5.519 1.00 0.00 C ATOM 1469 OD1 ASP A 152 1.288 11.951 5.828 1.00 0.00 O ATOM 1470 OD2 ASP A 152 -0.333 10.927 4.773 1.00 0.00 O ATOM 0 H ASP A 152 1.788 7.157 6.182 1.00 0.00 H new ATOM 0 HA ASP A 152 2.063 9.198 4.162 1.00 0.00 H new ATOM 0 HB2 ASP A 152 0.304 8.886 6.106 1.00 0.00 H new ATOM 0 HB3 ASP A 152 1.508 9.709 7.079 1.00 0.00 H new ATOM 1475 N TYR A 153 4.393 8.732 6.322 1.00 0.00 N ATOM 1476 CA TYR A 153 5.723 9.132 6.764 1.00 0.00 C ATOM 1477 C TYR A 153 6.785 8.677 5.767 1.00 0.00 C ATOM 1478 O TYR A 153 7.981 8.876 5.982 1.00 0.00 O ATOM 1479 CB TYR A 153 6.025 8.542 8.143 1.00 0.00 C ATOM 1480 CG TYR A 153 5.271 9.197 9.276 1.00 0.00 C ATOM 1481 CD1 TYR A 153 3.922 8.937 9.491 1.00 0.00 C ATOM 1482 CD2 TYR A 153 5.913 10.076 10.138 1.00 0.00 C ATOM 1483 CE1 TYR A 153 3.236 9.536 10.530 1.00 0.00 C ATOM 1484 CE2 TYR A 153 5.235 10.678 11.179 1.00 0.00 C ATOM 1485 CZ TYR A 153 3.897 10.405 11.373 1.00 0.00 C ATOM 1486 OH TYR A 153 3.222 11.008 12.410 1.00 0.00 O ATOM 0 H TYR A 153 4.123 7.791 6.610 1.00 0.00 H new ATOM 0 HA TYR A 153 5.745 10.220 6.827 1.00 0.00 H new ATOM 0 HB2 TYR A 153 5.787 7.478 8.131 1.00 0.00 H new ATOM 0 HB3 TYR A 153 7.094 8.627 8.336 1.00 0.00 H new ATOM 0 HD1 TYR A 153 3.402 8.255 8.835 1.00 0.00 H new ATOM 0 HD2 TYR A 153 6.961 10.292 9.992 1.00 0.00 H new ATOM 0 HE1 TYR A 153 2.188 9.325 10.681 1.00 0.00 H new ATOM 0 HE2 TYR A 153 5.750 11.360 11.839 1.00 0.00 H new ATOM 0 HH TYR A 153 3.836 11.589 12.906 1.00 0.00 H new ATOM 1496 N VAL A 154 6.344 8.063 4.679 1.00 0.00 N ATOM 1497 CA VAL A 154 7.257 7.562 3.666 1.00 0.00 C ATOM 1498 C VAL A 154 7.657 8.675 2.706 1.00 0.00 C ATOM 1499 O VAL A 154 6.815 9.227 1.990 1.00 0.00 O ATOM 1500 CB VAL A 154 6.636 6.393 2.874 1.00 0.00 C ATOM 1501 CG1 VAL A 154 7.588 5.903 1.790 1.00 0.00 C ATOM 1502 CG2 VAL A 154 6.266 5.262 3.819 1.00 0.00 C ATOM 0 H VAL A 154 5.358 7.900 4.476 1.00 0.00 H new ATOM 0 HA VAL A 154 8.145 7.195 4.182 1.00 0.00 H new ATOM 0 HB VAL A 154 5.730 6.749 2.384 1.00 0.00 H new ATOM 0 HG11 VAL A 154 7.127 5.079 1.246 1.00 0.00 H new ATOM 0 HG12 VAL A 154 7.803 6.718 1.099 1.00 0.00 H new ATOM 0 HG13 VAL A 154 8.516 5.561 2.248 1.00 0.00 H new ATOM 0 HG21 VAL A 154 5.828 4.441 3.251 1.00 0.00 H new ATOM 0 HG22 VAL A 154 7.160 4.911 4.334 1.00 0.00 H new ATOM 0 HG23 VAL A 154 5.544 5.622 4.552 1.00 0.00 H new ATOM 1512 N ARG A 155 8.937 9.004 2.708 1.00 0.00 N ATOM 1513 CA ARG A 155 9.466 10.039 1.836 1.00 0.00 C ATOM 1514 C ARG A 155 9.634 9.508 0.417 1.00 0.00 C ATOM 1515 O ARG A 155 10.158 8.410 0.210 1.00 0.00 O ATOM 1516 CB ARG A 155 10.813 10.539 2.360 1.00 0.00 C ATOM 1517 CG ARG A 155 11.385 11.698 1.553 1.00 0.00 C ATOM 1518 CD ARG A 155 12.775 12.092 2.031 1.00 0.00 C ATOM 1519 NE ARG A 155 12.813 12.330 3.472 1.00 0.00 N ATOM 1520 CZ ARG A 155 12.833 13.537 4.034 1.00 0.00 C ATOM 1521 NH1 ARG A 155 12.801 14.629 3.281 1.00 0.00 N ATOM 1522 NH2 ARG A 155 12.888 13.649 5.356 1.00 0.00 N ATOM 0 H ARG A 155 9.635 8.565 3.309 1.00 0.00 H new ATOM 0 HA ARG A 155 8.758 10.868 1.823 1.00 0.00 H new ATOM 0 HB2 ARG A 155 10.697 10.851 3.398 1.00 0.00 H new ATOM 0 HB3 ARG A 155 11.526 9.714 2.353 1.00 0.00 H new ATOM 0 HG2 ARG A 155 11.429 11.420 0.500 1.00 0.00 H new ATOM 0 HG3 ARG A 155 10.718 12.557 1.629 1.00 0.00 H new ATOM 0 HD2 ARG A 155 13.483 11.304 1.775 1.00 0.00 H new ATOM 0 HD3 ARG A 155 13.097 12.992 1.507 1.00 0.00 H new ATOM 0 HE ARG A 155 12.825 11.518 4.089 1.00 0.00 H new ATOM 0 HH11 ARG A 155 12.761 14.547 2.265 1.00 0.00 H new ATOM 0 HH12 ARG A 155 12.817 15.550 3.718 1.00 0.00 H new ATOM 0 HH21 ARG A 155 12.915 12.812 5.938 1.00 0.00 H new ATOM 0 HH22 ARG A 155 12.903 14.572 5.789 1.00 0.00 H new ATOM 1536 N ILE A 156 9.169 10.281 -0.550 1.00 0.00 N ATOM 1537 CA ILE A 156 9.361 9.955 -1.952 1.00 0.00 C ATOM 1538 C ILE A 156 10.566 10.715 -2.489 1.00 0.00 C ATOM 1539 O ILE A 156 10.607 11.944 -2.434 1.00 0.00 O ATOM 1540 CB ILE A 156 8.104 10.296 -2.786 1.00 0.00 C ATOM 1541 CG1 ILE A 156 6.919 9.464 -2.297 1.00 0.00 C ATOM 1542 CG2 ILE A 156 8.340 10.067 -4.276 1.00 0.00 C ATOM 1543 CD1 ILE A 156 7.162 7.969 -2.348 1.00 0.00 C ATOM 0 H ILE A 156 8.652 11.145 -0.387 1.00 0.00 H new ATOM 0 HA ILE A 156 9.535 8.882 -2.036 1.00 0.00 H new ATOM 0 HB ILE A 156 7.882 11.354 -2.650 1.00 0.00 H new ATOM 0 HG12 ILE A 156 6.684 9.750 -1.272 1.00 0.00 H new ATOM 0 HG13 ILE A 156 6.045 9.702 -2.903 1.00 0.00 H new ATOM 0 HG21 ILE A 156 7.435 10.317 -4.830 1.00 0.00 H new ATOM 0 HG22 ILE A 156 9.160 10.699 -4.616 1.00 0.00 H new ATOM 0 HG23 ILE A 156 8.593 9.021 -4.448 1.00 0.00 H new ATOM 0 HD11 ILE A 156 6.278 7.444 -1.986 1.00 0.00 H new ATOM 0 HD12 ILE A 156 7.367 7.669 -3.376 1.00 0.00 H new ATOM 0 HD13 ILE A 156 8.016 7.718 -1.719 1.00 0.00 H new ATOM 1555 N PRO A 157 11.575 9.990 -2.987 1.00 0.00 N ATOM 1556 CA PRO A 157 12.806 10.595 -3.495 1.00 0.00 C ATOM 1557 C PRO A 157 12.553 11.553 -4.651 1.00 0.00 C ATOM 1558 O PRO A 157 11.833 11.234 -5.598 1.00 0.00 O ATOM 1559 CB PRO A 157 13.635 9.397 -3.973 1.00 0.00 C ATOM 1560 CG PRO A 157 13.057 8.218 -3.269 1.00 0.00 C ATOM 1561 CD PRO A 157 11.600 8.523 -3.087 1.00 0.00 C ATOM 0 HA PRO A 157 13.300 11.193 -2.730 1.00 0.00 H new ATOM 0 HB2 PRO A 157 13.571 9.280 -5.055 1.00 0.00 H new ATOM 0 HB3 PRO A 157 14.689 9.524 -3.728 1.00 0.00 H new ATOM 0 HG2 PRO A 157 13.196 7.308 -3.852 1.00 0.00 H new ATOM 0 HG3 PRO A 157 13.546 8.058 -2.308 1.00 0.00 H new ATOM 0 HD2 PRO A 157 11.006 8.166 -3.928 1.00 0.00 H new ATOM 0 HD3 PRO A 157 11.199 8.051 -2.190 1.00 0.00 H new ATOM 1569 N LYS A 158 13.156 12.730 -4.569 1.00 0.00 N ATOM 1570 CA LYS A 158 13.078 13.712 -5.641 1.00 0.00 C ATOM 1571 C LYS A 158 14.261 13.519 -6.580 1.00 0.00 C ATOM 1572 O LYS A 158 14.609 14.399 -7.370 1.00 0.00 O ATOM 1573 CB LYS A 158 13.099 15.131 -5.066 1.00 0.00 C ATOM 1574 CG LYS A 158 12.043 15.390 -4.003 1.00 0.00 C ATOM 1575 CD LYS A 158 12.146 16.810 -3.468 1.00 0.00 C ATOM 1576 CE LYS A 158 11.212 17.049 -2.290 1.00 0.00 C ATOM 1577 NZ LYS A 158 9.784 16.850 -2.648 1.00 0.00 N ATOM 0 H LYS A 158 13.708 13.030 -3.766 1.00 0.00 H new ATOM 0 HA LYS A 158 12.145 13.573 -6.188 1.00 0.00 H new ATOM 0 HB2 LYS A 158 14.083 15.323 -4.638 1.00 0.00 H new ATOM 0 HB3 LYS A 158 12.961 15.843 -5.880 1.00 0.00 H new ATOM 0 HG2 LYS A 158 11.051 15.227 -4.424 1.00 0.00 H new ATOM 0 HG3 LYS A 158 12.163 14.680 -3.185 1.00 0.00 H new ATOM 0 HD2 LYS A 158 13.173 17.007 -3.161 1.00 0.00 H new ATOM 0 HD3 LYS A 158 11.910 17.515 -4.265 1.00 0.00 H new ATOM 0 HE2 LYS A 158 11.477 16.373 -1.477 1.00 0.00 H new ATOM 0 HE3 LYS A 158 11.352 18.064 -1.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 158 9.185 17.090 -1.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 158 9.538 17.464 -3.451 1.00 0.00 H new ATOM 0 HZ3 LYS A 158 9.628 15.856 -2.912 1.00 0.00 H new ATOM 1591 N ILE A 159 14.855 12.340 -6.492 1.00 0.00 N ATOM 1592 CA ILE A 159 16.069 12.023 -7.211 1.00 0.00 C ATOM 1593 C ILE A 159 15.758 11.670 -8.651 1.00 0.00 C ATOM 1594 O ILE A 159 15.191 10.615 -8.939 1.00 0.00 O ATOM 1595 CB ILE A 159 16.808 10.841 -6.555 1.00 0.00 C ATOM 1596 CG1 ILE A 159 17.079 11.140 -5.081 1.00 0.00 C ATOM 1597 CG2 ILE A 159 18.111 10.558 -7.289 1.00 0.00 C ATOM 1598 CD1 ILE A 159 17.694 9.982 -4.324 1.00 0.00 C ATOM 0 H ILE A 159 14.504 11.575 -5.916 1.00 0.00 H new ATOM 0 HA ILE A 159 16.708 12.906 -7.180 1.00 0.00 H new ATOM 0 HB ILE A 159 16.176 9.955 -6.619 1.00 0.00 H new ATOM 0 HG12 ILE A 159 17.744 12.001 -5.011 1.00 0.00 H new ATOM 0 HG13 ILE A 159 16.142 11.420 -4.599 1.00 0.00 H new ATOM 0 HG21 ILE A 159 18.622 9.720 -6.814 1.00 0.00 H new ATOM 0 HG22 ILE A 159 17.897 10.310 -8.328 1.00 0.00 H new ATOM 0 HG23 ILE A 159 18.749 11.441 -7.251 1.00 0.00 H new ATOM 0 HD11 ILE A 159 17.856 10.271 -3.286 1.00 0.00 H new ATOM 0 HD12 ILE A 159 17.022 9.125 -4.361 1.00 0.00 H new ATOM 0 HD13 ILE A 159 18.648 9.715 -4.780 1.00 0.00 H new ATOM 1610 N ALA A 160 16.102 12.568 -9.547 1.00 0.00 N ATOM 1611 CA ALA A 160 15.966 12.305 -10.957 1.00 0.00 C ATOM 1612 C ALA A 160 17.303 11.863 -11.523 1.00 0.00 C ATOM 1613 O ALA A 160 18.357 12.323 -11.075 1.00 0.00 O ATOM 1614 CB ALA A 160 15.456 13.540 -11.670 1.00 0.00 C ATOM 0 H ALA A 160 16.479 13.488 -9.321 1.00 0.00 H new ATOM 0 HA ALA A 160 15.242 11.504 -11.110 1.00 0.00 H new ATOM 0 HB1 ALA A 160 15.357 13.330 -12.735 1.00 0.00 H new ATOM 0 HB2 ALA A 160 14.484 13.820 -11.263 1.00 0.00 H new ATOM 0 HB3 ALA A 160 16.159 14.360 -11.526 1.00 0.00 H new ATOM 1620 N LEU A 161 17.261 10.978 -12.504 1.00 0.00 N ATOM 1621 CA LEU A 161 18.476 10.441 -13.098 1.00 0.00 C ATOM 1622 C LEU A 161 18.993 11.366 -14.193 1.00 0.00 C ATOM 1623 O LEU A 161 19.856 10.979 -14.983 1.00 0.00 O ATOM 1624 CB LEU A 161 18.221 9.042 -13.665 1.00 0.00 C ATOM 1625 CG LEU A 161 17.794 7.988 -12.638 1.00 0.00 C ATOM 1626 CD1 LEU A 161 17.564 6.644 -13.312 1.00 0.00 C ATOM 1627 CD2 LEU A 161 18.833 7.862 -11.534 1.00 0.00 C ATOM 0 H LEU A 161 16.398 10.615 -12.908 1.00 0.00 H new ATOM 0 HA LEU A 161 19.234 10.370 -12.318 1.00 0.00 H new ATOM 0 HB2 LEU A 161 17.449 9.113 -14.431 1.00 0.00 H new ATOM 0 HB3 LEU A 161 19.129 8.697 -14.159 1.00 0.00 H new ATOM 0 HG LEU A 161 16.855 8.311 -12.189 1.00 0.00 H new ATOM 0 HD11 LEU A 161 17.262 5.910 -12.565 1.00 0.00 H new ATOM 0 HD12 LEU A 161 16.780 6.743 -14.062 1.00 0.00 H new ATOM 0 HD13 LEU A 161 18.486 6.315 -13.792 1.00 0.00 H new ATOM 0 HD21 LEU A 161 18.511 7.109 -10.815 1.00 0.00 H new ATOM 0 HD22 LEU A 161 19.789 7.566 -11.966 1.00 0.00 H new ATOM 0 HD23 LEU A 161 18.945 8.821 -11.029 1.00 0.00 H new ATOM 1639 N GLU A 162 18.445 12.582 -14.229 1.00 0.00 N ATOM 1640 CA GLU A 162 18.847 13.603 -15.190 1.00 0.00 C ATOM 1641 C GLU A 162 18.496 13.153 -16.613 1.00 0.00 C ATOM 1642 O GLU A 162 17.863 12.110 -16.806 1.00 0.00 O ATOM 1643 CB GLU A 162 20.352 13.901 -15.026 1.00 0.00 C ATOM 1644 CG GLU A 162 20.849 15.137 -15.764 1.00 0.00 C ATOM 1645 CD GLU A 162 19.957 16.343 -15.565 1.00 0.00 C ATOM 1646 OE1 GLU A 162 20.064 17.014 -14.518 1.00 0.00 O ATOM 1647 OE2 GLU A 162 19.145 16.630 -16.468 1.00 0.00 O ATOM 0 H GLU A 162 17.709 12.884 -13.590 1.00 0.00 H new ATOM 0 HA GLU A 162 18.303 14.528 -15.002 1.00 0.00 H new ATOM 0 HB2 GLU A 162 20.570 14.018 -13.964 1.00 0.00 H new ATOM 0 HB3 GLU A 162 20.918 13.037 -15.374 1.00 0.00 H new ATOM 0 HG2 GLU A 162 21.856 15.377 -15.423 1.00 0.00 H new ATOM 0 HG3 GLU A 162 20.918 14.915 -16.829 1.00 0.00 H new ATOM 1654 N HIS A 163 18.876 13.945 -17.602 1.00 0.00 N ATOM 1655 CA HIS A 163 18.625 13.603 -18.993 1.00 0.00 C ATOM 1656 C HIS A 163 19.668 12.603 -19.482 1.00 0.00 C ATOM 1657 O HIS A 163 20.346 12.835 -20.484 1.00 0.00 O ATOM 1658 CB HIS A 163 18.645 14.861 -19.865 1.00 0.00 C ATOM 1659 CG HIS A 163 17.530 15.822 -19.570 1.00 0.00 C ATOM 1660 ND1 HIS A 163 17.524 16.665 -18.479 1.00 0.00 N ATOM 1661 CD2 HIS A 163 16.380 16.073 -20.237 1.00 0.00 C ATOM 1662 CE1 HIS A 163 16.423 17.388 -18.487 1.00 0.00 C ATOM 1663 NE2 HIS A 163 15.712 17.049 -19.543 1.00 0.00 N ATOM 0 H HIS A 163 19.361 14.832 -17.467 1.00 0.00 H new ATOM 0 HA HIS A 163 17.638 13.147 -19.068 1.00 0.00 H new ATOM 0 HB2 HIS A 163 19.598 15.372 -19.727 1.00 0.00 H new ATOM 0 HB3 HIS A 163 18.590 14.566 -20.913 1.00 0.00 H new ATOM 0 HD1 HIS A 163 18.259 16.720 -17.774 1.00 0.00 H new ATOM 0 HD2 HIS A 163 16.050 15.594 -21.147 1.00 0.00 H new ATOM 0 HE1 HIS A 163 16.150 18.132 -17.753 1.00 0.00 H new ATOM 1672 N HIS A 164 19.793 11.497 -18.763 1.00 0.00 N ATOM 1673 CA HIS A 164 20.738 10.449 -19.119 1.00 0.00 C ATOM 1674 C HIS A 164 20.123 9.554 -20.187 1.00 0.00 C ATOM 1675 O HIS A 164 20.727 9.313 -21.231 1.00 0.00 O ATOM 1676 CB HIS A 164 21.129 9.632 -17.876 1.00 0.00 C ATOM 1677 CG HIS A 164 22.223 8.635 -18.112 1.00 0.00 C ATOM 1678 ND1 HIS A 164 23.548 8.895 -17.838 1.00 0.00 N ATOM 1679 CD2 HIS A 164 22.186 7.365 -18.585 1.00 0.00 C ATOM 1680 CE1 HIS A 164 24.275 7.834 -18.130 1.00 0.00 C ATOM 1681 NE2 HIS A 164 23.474 6.891 -18.583 1.00 0.00 N ATOM 0 H HIS A 164 19.247 11.302 -17.924 1.00 0.00 H new ATOM 0 HA HIS A 164 21.645 10.902 -19.518 1.00 0.00 H new ATOM 0 HB2 HIS A 164 21.442 10.318 -17.089 1.00 0.00 H new ATOM 0 HB3 HIS A 164 20.247 9.106 -17.509 1.00 0.00 H new ATOM 0 HD2 HIS A 164 21.306 6.826 -18.904 1.00 0.00 H new ATOM 0 HE1 HIS A 164 25.346 7.752 -18.017 1.00 0.00 H new ATOM 0 HE2 HIS A 164 23.764 5.960 -18.883 1.00 0.00 H new ATOM 1690 N HIS A 165 18.919 9.068 -19.922 1.00 0.00 N ATOM 1691 CA HIS A 165 18.170 8.310 -20.910 1.00 0.00 C ATOM 1692 C HIS A 165 16.767 8.886 -21.030 1.00 0.00 C ATOM 1693 O HIS A 165 16.063 9.041 -20.032 1.00 0.00 O ATOM 1694 CB HIS A 165 18.110 6.827 -20.540 1.00 0.00 C ATOM 1695 CG HIS A 165 18.296 5.924 -21.717 1.00 0.00 C ATOM 1696 ND1 HIS A 165 17.253 5.429 -22.468 1.00 0.00 N ATOM 1697 CD2 HIS A 165 19.424 5.439 -22.285 1.00 0.00 C ATOM 1698 CE1 HIS A 165 17.732 4.681 -23.444 1.00 0.00 C ATOM 1699 NE2 HIS A 165 19.050 4.669 -23.360 1.00 0.00 N ATOM 0 H HIS A 165 18.440 9.186 -19.029 1.00 0.00 H new ATOM 0 HA HIS A 165 18.678 8.389 -21.871 1.00 0.00 H new ATOM 0 HB2 HIS A 165 18.879 6.612 -19.798 1.00 0.00 H new ATOM 0 HB3 HIS A 165 17.149 6.613 -20.073 1.00 0.00 H new ATOM 0 HD2 HIS A 165 20.435 5.624 -21.954 1.00 0.00 H new ATOM 0 HE1 HIS A 165 17.144 4.164 -24.188 1.00 0.00 H new ATOM 0 HE2 HIS A 165 19.683 4.172 -23.987 1.00 0.00 H new ATOM 1708 N HIS A 166 16.368 9.206 -22.248 1.00 0.00 N ATOM 1709 CA HIS A 166 15.116 9.910 -22.478 1.00 0.00 C ATOM 1710 C HIS A 166 13.934 8.948 -22.558 1.00 0.00 C ATOM 1711 O HIS A 166 13.691 8.324 -23.591 1.00 0.00 O ATOM 1712 CB HIS A 166 15.204 10.746 -23.760 1.00 0.00 C ATOM 1713 CG HIS A 166 13.969 11.550 -24.045 1.00 0.00 C ATOM 1714 ND1 HIS A 166 13.670 12.726 -23.396 1.00 0.00 N ATOM 1715 CD2 HIS A 166 12.953 11.333 -24.910 1.00 0.00 C ATOM 1716 CE1 HIS A 166 12.523 13.198 -23.846 1.00 0.00 C ATOM 1717 NE2 HIS A 166 12.066 12.372 -24.768 1.00 0.00 N ATOM 0 H HIS A 166 16.893 8.990 -23.095 1.00 0.00 H new ATOM 0 HA HIS A 166 14.949 10.572 -21.628 1.00 0.00 H new ATOM 0 HB2 HIS A 166 16.056 11.421 -23.685 1.00 0.00 H new ATOM 0 HB3 HIS A 166 15.397 10.082 -24.603 1.00 0.00 H new ATOM 0 HD2 HIS A 166 12.857 10.497 -25.587 1.00 0.00 H new ATOM 0 HE1 HIS A 166 12.040 14.106 -23.516 1.00 0.00 H new ATOM 0 HE2 HIS A 166 11.197 12.486 -25.290 1.00 0.00 H new ATOM 1726 N HIS A 167 13.213 8.820 -21.457 1.00 0.00 N ATOM 1727 CA HIS A 167 11.961 8.077 -21.452 1.00 0.00 C ATOM 1728 C HIS A 167 10.865 8.937 -22.066 1.00 0.00 C ATOM 1729 O HIS A 167 10.445 9.935 -21.481 1.00 0.00 O ATOM 1730 CB HIS A 167 11.583 7.658 -20.024 1.00 0.00 C ATOM 1731 CG HIS A 167 10.240 6.988 -19.912 1.00 0.00 C ATOM 1732 ND1 HIS A 167 10.045 5.638 -20.109 1.00 0.00 N ATOM 1733 CD2 HIS A 167 9.022 7.499 -19.613 1.00 0.00 C ATOM 1734 CE1 HIS A 167 8.766 5.351 -19.939 1.00 0.00 C ATOM 1735 NE2 HIS A 167 8.123 6.462 -19.633 1.00 0.00 N ATOM 0 H HIS A 167 13.471 9.220 -20.555 1.00 0.00 H new ATOM 0 HA HIS A 167 12.081 7.170 -22.044 1.00 0.00 H new ATOM 0 HB2 HIS A 167 12.347 6.981 -19.642 1.00 0.00 H new ATOM 0 HB3 HIS A 167 11.590 8.541 -19.385 1.00 0.00 H new ATOM 0 HD2 HIS A 167 8.799 8.534 -19.398 1.00 0.00 H new ATOM 0 HE1 HIS A 167 8.322 4.371 -20.035 1.00 0.00 H new ATOM 0 HE2 HIS A 167 7.124 6.538 -19.443 1.00 0.00 H new ATOM 1744 N HIS A 168 10.415 8.559 -23.246 1.00 0.00 N ATOM 1745 CA HIS A 168 9.406 9.330 -23.951 1.00 0.00 C ATOM 1746 C HIS A 168 8.087 8.570 -23.971 1.00 0.00 C ATOM 1747 O HIS A 168 7.112 9.074 -23.386 1.00 0.00 O ATOM 1748 CB HIS A 168 9.866 9.697 -25.375 1.00 0.00 C ATOM 1749 CG HIS A 168 10.123 8.534 -26.290 1.00 0.00 C ATOM 1750 ND1 HIS A 168 9.350 8.274 -27.398 1.00 0.00 N ATOM 1751 CD2 HIS A 168 11.087 7.583 -26.274 1.00 0.00 C ATOM 1752 CE1 HIS A 168 9.823 7.212 -28.023 1.00 0.00 C ATOM 1753 NE2 HIS A 168 10.877 6.775 -27.361 1.00 0.00 N ATOM 1754 OXT HIS A 168 8.056 7.451 -24.517 1.00 0.00 O ATOM 0 H HIS A 168 10.731 7.723 -23.738 1.00 0.00 H new ATOM 0 HA HIS A 168 9.256 10.268 -23.416 1.00 0.00 H new ATOM 0 HB2 HIS A 168 9.108 10.335 -25.830 1.00 0.00 H new ATOM 0 HB3 HIS A 168 10.779 10.289 -25.302 1.00 0.00 H new ATOM 0 HD2 HIS A 168 11.874 7.480 -25.542 1.00 0.00 H new ATOM 0 HE1 HIS A 168 9.416 6.775 -28.923 1.00 0.00 H new ATOM 0 HE2 HIS A 168 11.444 5.967 -27.617 1.00 0.00 H new TER 1763 HIS A 168