USER MOD reduce.3.24.130724 H: found=0, std=0, add=1367, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 317 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 110 GLN : amide:sc= 0.939 K(o=2.1,f=-4.3) USER MOD Set 1.2: A 111 LYS NZ :NH3+ -158:sc= 1.2 (180deg=0) USER MOD Set 2.1: A 95 LYS NZ :NH3+ -124:sc= 2.99 (180deg=-0.328) USER MOD Set 2.2: A 99 THR OG1 : rot 180:sc= 0.0502 USER MOD Set 2.3: A 102 GLN : amide:sc= 2.16 K(o=7.3,f=-4.6) USER MOD Set 2.4: B 97 ASN : amide:sc= 2.05 K(o=7.3,f=-4.4!) USER MOD Set 3.1: A 39 CYS SG : rot -150:sc= 1.36 USER MOD Set 3.2: A 63 ASN : amide:sc= 0.0744 K(o=1.4,f=-8.1!) USER MOD Set 4.1: A 36 MET CE :methyl -129:sc= -0.0323 (180deg=-0.921) USER MOD Set 4.2: A 52 TYR OH : rot 25:sc= -0.873! USER MOD Set 5.1: A 20 TYR OH : rot 30:sc= 0.966 USER MOD Set 5.2: A 43 HIS : no HE2:sc= 1.03 K(o=2,f=-7.3!) USER MOD Set 6.1: A 13 CYS SG : rot -37:sc= 0.674 USER MOD Set 6.2: A 17 THR OG1 : rot 63:sc= 1.17 USER MOD Set 7.1: A 7 ASN : amide:sc= 0.979 K(o=1.3,f=-12!) USER MOD Set 7.2: B 94 LYS NZ :NH3+ -173:sc= 0.336 (180deg=-0.844) USER MOD Single : A 5 SER OG : rot -123:sc= 0.123 USER MOD Single : A 6 LYS NZ :NH3+ 174:sc= 1.86 (180deg=1.75) USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 16 MET CE :methyl -172:sc= -1.75 (180deg=-1.92) USER MOD Single : A 19 ASN : amide:sc= -0.0315 X(o=-0.032,f=-0.17) USER MOD Single : A 22 HIS : no HE2:sc= 0.417 K(o=0.42,f=-2.9!) USER MOD Single : A 26 GLN : amide:sc= -0.165 K(o=-0.17,f=-1.5!) USER MOD Single : A 27 ASN : amide:sc= -0.0222 K(o=-0.022,f=-3.7!) USER MOD Single : A 29 SER OG : rot 180:sc= 0.0444 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 31 SER OG : rot 85:sc= 2.41 USER MOD Single : A 33 SER OG : rot 38:sc= 0.94 USER MOD Single : A 34 SER OG : rot 180:sc= 0.126 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ 164:sc= 1.25 (180deg=1.11) USER MOD Single : A 62 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 65 THR OG1 : rot 78:sc= -0.484! USER MOD Single : A 69 SER OG : rot -87:sc= 1.32 USER MOD Single : A 70 THR OG1 : rot 80:sc= 1.23 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 CYS SG : rot -170:sc= -1.9 USER MOD Single : A 79 GLN : amide:sc= 0.0909 K(o=0.091,f=-3.9!) USER MOD Single : A 86 MET CE :methyl -113:sc= -1.43 (180deg=-6.55!) USER MOD Single : A 94 SER OG : rot -47:sc= 0.265 USER MOD Single : A 96 CYS SG : rot 180:sc= -1 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : B 99 TYR OH : rot 180:sc= 0 USER MOD Single : B 101 SER OG : rot -45:sc= 1.17 USER MOD Single : B 107 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 109 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 110 THR OG1 : rot 48:sc= 0.689 USER MOD Single : B 111 ASN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : B 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 117 THR OG1 : rot 180:sc= 0.168 USER MOD Single : B 124 MET CE :methyl 178:sc= 0 (180deg=-0.00906) USER MOD Single : B 135 GLN : amide:sc= 0.688 K(o=0.69,f=-0.81) USER MOD Single : B 137 ASN : amide:sc= -0.434 K(o=-0.43,f=-5.2!) USER MOD Single : B 138 TYR OH : rot 180:sc= 0 USER MOD Single : B 143 GLN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : B 144 MET CE :methyl -172:sc= 0 (180deg=-0.0995) USER MOD Single : B 145 MET CE :methyl -167:sc= -0.142 (180deg=-0.521) USER MOD Single : B 146 THR OG1 : rot -77:sc= 1.13 USER MOD Single : B 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 24 N GLY A 4 17.895 5.863 -8.651 1.00 0.00 N ATOM 25 CA GLY A 4 16.459 5.715 -8.708 1.00 0.00 C ATOM 26 C GLY A 4 15.965 4.593 -7.821 1.00 0.00 C ATOM 27 O GLY A 4 15.284 3.681 -8.286 1.00 0.00 O ATOM 0 HA2 GLY A 4 15.987 6.650 -8.406 1.00 0.00 H new ATOM 0 HA3 GLY A 4 16.156 5.523 -9.737 1.00 0.00 H new ATOM 29 N SER A 5 16.313 4.659 -6.542 1.00 0.00 N ATOM 30 CA SER A 5 15.906 3.652 -5.573 1.00 0.00 C ATOM 31 C SER A 5 14.387 3.632 -5.423 1.00 0.00 C ATOM 32 O SER A 5 13.756 2.576 -5.490 1.00 0.00 O ATOM 33 CB SER A 5 16.575 3.957 -4.235 1.00 0.00 C ATOM 34 OG SER A 5 17.186 5.239 -4.283 1.00 0.00 O ATOM 0 H SER A 5 16.883 5.409 -6.150 1.00 0.00 H new ATOM 0 HA SER A 5 16.217 2.666 -5.920 1.00 0.00 H new ATOM 0 HB2 SER A 5 15.837 3.926 -3.434 1.00 0.00 H new ATOM 0 HB3 SER A 5 17.322 3.196 -4.010 1.00 0.00 H new ATOM 0 HG SER A 5 18.139 5.155 -4.070 1.00 0.00 H new ATOM 37 N LYS A 6 13.801 4.816 -5.254 1.00 0.00 N ATOM 38 CA LYS A 6 12.355 4.946 -5.105 1.00 0.00 C ATOM 39 C LYS A 6 11.645 4.535 -6.388 1.00 0.00 C ATOM 40 O LYS A 6 10.496 4.095 -6.362 1.00 0.00 O ATOM 41 CB LYS A 6 11.975 6.380 -4.728 1.00 0.00 C ATOM 42 CG LYS A 6 12.008 6.657 -3.235 1.00 0.00 C ATOM 43 CD LYS A 6 11.633 8.097 -2.922 1.00 0.00 C ATOM 44 CE LYS A 6 11.381 8.281 -1.435 1.00 0.00 C ATOM 45 NZ LYS A 6 11.606 9.682 -0.992 1.00 0.00 N ATOM 0 H LYS A 6 14.308 5.700 -5.217 1.00 0.00 H new ATOM 0 HA LYS A 6 12.037 4.281 -4.302 1.00 0.00 H new ATOM 0 HB2 LYS A 6 12.655 7.069 -5.230 1.00 0.00 H new ATOM 0 HB3 LYS A 6 10.974 6.590 -5.104 1.00 0.00 H new ATOM 0 HG2 LYS A 6 11.320 5.983 -2.724 1.00 0.00 H new ATOM 0 HG3 LYS A 6 13.005 6.448 -2.848 1.00 0.00 H new ATOM 0 HD2 LYS A 6 12.433 8.764 -3.245 1.00 0.00 H new ATOM 0 HD3 LYS A 6 10.741 8.375 -3.483 1.00 0.00 H new ATOM 0 HE2 LYS A 6 10.356 7.990 -1.204 1.00 0.00 H new ATOM 0 HE3 LYS A 6 12.036 7.615 -0.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 11.325 9.780 0.004 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 12.613 9.920 -1.093 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 11.038 10.327 -1.577 1.00 0.00 H new ATOM 50 N ASN A 7 12.346 4.671 -7.506 1.00 0.00 N ATOM 51 CA ASN A 7 11.797 4.314 -8.809 1.00 0.00 C ATOM 52 C ASN A 7 11.541 2.818 -8.889 1.00 0.00 C ATOM 53 O ASN A 7 10.602 2.379 -9.545 1.00 0.00 O ATOM 54 CB ASN A 7 12.742 4.745 -9.932 1.00 0.00 C ATOM 55 CG ASN A 7 12.852 6.249 -10.060 1.00 0.00 C ATOM 56 OD1 ASN A 7 13.545 6.901 -9.276 1.00 0.00 O ATOM 57 ND2 ASN A 7 12.186 6.808 -11.057 1.00 0.00 N ATOM 0 H ASN A 7 13.301 5.028 -7.537 1.00 0.00 H new ATOM 0 HA ASN A 7 10.850 4.839 -8.931 1.00 0.00 H new ATOM 0 HB2 ASN A 7 13.732 4.327 -9.748 1.00 0.00 H new ATOM 0 HB3 ASN A 7 12.391 4.329 -10.876 1.00 0.00 H new ATOM 0 HD21 ASN A 7 12.234 7.817 -11.200 1.00 0.00 H new ATOM 0 HD22 ASN A 7 11.624 6.230 -11.682 1.00 0.00 H new ATOM 61 N MET A 8 12.376 2.044 -8.208 1.00 0.00 N ATOM 62 CA MET A 8 12.241 0.591 -8.193 1.00 0.00 C ATOM 63 C MET A 8 10.887 0.177 -7.624 1.00 0.00 C ATOM 64 O MET A 8 10.144 -0.583 -8.251 1.00 0.00 O ATOM 65 CB MET A 8 13.383 -0.039 -7.385 1.00 0.00 C ATOM 66 CG MET A 8 13.134 -1.474 -6.939 1.00 0.00 C ATOM 67 SD MET A 8 12.799 -2.592 -8.314 1.00 0.00 S ATOM 68 CE MET A 8 12.316 -4.075 -7.430 1.00 0.00 C ATOM 0 H MET A 8 13.157 2.399 -7.656 1.00 0.00 H new ATOM 0 HA MET A 8 12.299 0.229 -9.219 1.00 0.00 H new ATOM 0 HB2 MET A 8 14.292 -0.013 -7.986 1.00 0.00 H new ATOM 0 HB3 MET A 8 13.566 0.574 -6.503 1.00 0.00 H new ATOM 0 HG2 MET A 8 14.004 -1.834 -6.389 1.00 0.00 H new ATOM 0 HG3 MET A 8 12.290 -1.493 -6.249 1.00 0.00 H new ATOM 0 HE1 MET A 8 12.076 -4.863 -8.144 1.00 0.00 H new ATOM 0 HE2 MET A 8 13.137 -4.402 -6.792 1.00 0.00 H new ATOM 0 HE3 MET A 8 11.441 -3.864 -6.816 1.00 0.00 H new ATOM 70 N LEU A 9 10.563 0.696 -6.445 1.00 0.00 N ATOM 71 CA LEU A 9 9.297 0.382 -5.795 1.00 0.00 C ATOM 72 C LEU A 9 8.126 0.960 -6.581 1.00 0.00 C ATOM 73 O LEU A 9 7.094 0.307 -6.742 1.00 0.00 O ATOM 74 CB LEU A 9 9.277 0.894 -4.353 1.00 0.00 C ATOM 75 CG LEU A 9 10.185 0.165 -3.360 1.00 0.00 C ATOM 76 CD1 LEU A 9 10.050 0.765 -1.970 1.00 0.00 C ATOM 77 CD2 LEU A 9 9.872 -1.325 -3.335 1.00 0.00 C ATOM 0 H LEU A 9 11.160 1.336 -5.920 1.00 0.00 H new ATOM 0 HA LEU A 9 9.195 -0.703 -5.772 1.00 0.00 H new ATOM 0 HB2 LEU A 9 9.555 1.948 -4.361 1.00 0.00 H new ATOM 0 HB3 LEU A 9 8.253 0.838 -3.984 1.00 0.00 H new ATOM 0 HG LEU A 9 11.217 0.290 -3.688 1.00 0.00 H new ATOM 0 HD11 LEU A 9 10.704 0.233 -1.279 1.00 0.00 H new ATOM 0 HD12 LEU A 9 10.333 1.817 -1.999 1.00 0.00 H new ATOM 0 HD13 LEU A 9 9.017 0.676 -1.634 1.00 0.00 H new ATOM 0 HD21 LEU A 9 10.529 -1.823 -2.622 1.00 0.00 H new ATOM 0 HD22 LEU A 9 8.834 -1.474 -3.037 1.00 0.00 H new ATOM 0 HD23 LEU A 9 10.028 -1.746 -4.328 1.00 0.00 H new ATOM 79 N LEU A 10 8.303 2.177 -7.078 1.00 0.00 N ATOM 80 CA LEU A 10 7.273 2.849 -7.853 1.00 0.00 C ATOM 81 C LEU A 10 6.941 2.069 -9.122 1.00 0.00 C ATOM 82 O LEU A 10 5.776 1.792 -9.402 1.00 0.00 O ATOM 83 CB LEU A 10 7.716 4.272 -8.205 1.00 0.00 C ATOM 84 CG LEU A 10 6.740 5.104 -9.042 1.00 0.00 C ATOM 85 CD1 LEU A 10 5.490 5.443 -8.242 1.00 0.00 C ATOM 86 CD2 LEU A 10 7.418 6.369 -9.546 1.00 0.00 C ATOM 0 H LEU A 10 9.157 2.721 -6.956 1.00 0.00 H new ATOM 0 HA LEU A 10 6.371 2.900 -7.243 1.00 0.00 H new ATOM 0 HB2 LEU A 10 7.912 4.808 -7.276 1.00 0.00 H new ATOM 0 HB3 LEU A 10 8.662 4.212 -8.744 1.00 0.00 H new ATOM 0 HG LEU A 10 6.435 4.510 -9.903 1.00 0.00 H new ATOM 0 HD11 LEU A 10 4.813 6.034 -8.858 1.00 0.00 H new ATOM 0 HD12 LEU A 10 4.993 4.522 -7.937 1.00 0.00 H new ATOM 0 HD13 LEU A 10 5.768 6.016 -7.357 1.00 0.00 H new ATOM 0 HD21 LEU A 10 6.711 6.949 -10.139 1.00 0.00 H new ATOM 0 HD22 LEU A 10 7.754 6.965 -8.697 1.00 0.00 H new ATOM 0 HD23 LEU A 10 8.275 6.101 -10.163 1.00 0.00 H new ATOM 88 N GLU A 11 7.976 1.704 -9.872 1.00 0.00 N ATOM 89 CA GLU A 11 7.811 0.959 -11.115 1.00 0.00 C ATOM 90 C GLU A 11 7.156 -0.396 -10.858 1.00 0.00 C ATOM 91 O GLU A 11 6.232 -0.795 -11.571 1.00 0.00 O ATOM 92 CB GLU A 11 9.171 0.774 -11.797 1.00 0.00 C ATOM 93 CG GLU A 11 9.098 0.402 -13.268 1.00 0.00 C ATOM 94 CD GLU A 11 9.545 -1.019 -13.534 1.00 0.00 C ATOM 95 OE1 GLU A 11 10.686 -1.367 -13.167 1.00 0.00 O ATOM 96 OE2 GLU A 11 8.758 -1.794 -14.120 1.00 0.00 O ATOM 0 H GLU A 11 8.946 1.914 -9.638 1.00 0.00 H new ATOM 0 HA GLU A 11 7.156 1.529 -11.774 1.00 0.00 H new ATOM 0 HB2 GLU A 11 9.741 1.698 -11.698 1.00 0.00 H new ATOM 0 HB3 GLU A 11 9.725 -0.001 -11.267 1.00 0.00 H new ATOM 0 HG2 GLU A 11 8.074 0.528 -13.620 1.00 0.00 H new ATOM 0 HG3 GLU A 11 9.720 1.088 -13.843 1.00 0.00 H new ATOM 98 N TRP A 12 7.634 -1.088 -9.830 1.00 0.00 N ATOM 99 CA TRP A 12 7.103 -2.395 -9.467 1.00 0.00 C ATOM 100 C TRP A 12 5.636 -2.292 -9.050 1.00 0.00 C ATOM 101 O TRP A 12 4.789 -3.047 -9.529 1.00 0.00 O ATOM 102 CB TRP A 12 7.951 -3.018 -8.345 1.00 0.00 C ATOM 103 CG TRP A 12 7.254 -4.088 -7.560 1.00 0.00 C ATOM 104 CD1 TRP A 12 6.963 -5.358 -7.972 1.00 0.00 C ATOM 105 CD2 TRP A 12 6.763 -3.978 -6.218 1.00 0.00 C ATOM 106 NE1 TRP A 12 6.312 -6.040 -6.971 1.00 0.00 N ATOM 107 CE2 TRP A 12 6.181 -5.215 -5.882 1.00 0.00 C ATOM 108 CE3 TRP A 12 6.759 -2.951 -5.271 1.00 0.00 C ATOM 109 CZ2 TRP A 12 5.602 -5.452 -4.638 1.00 0.00 C ATOM 110 CZ3 TRP A 12 6.182 -3.188 -4.038 1.00 0.00 C ATOM 111 CH2 TRP A 12 5.612 -4.427 -3.731 1.00 0.00 C ATOM 0 H TRP A 12 8.393 -0.763 -9.231 1.00 0.00 H new ATOM 0 HA TRP A 12 7.154 -3.044 -10.341 1.00 0.00 H new ATOM 0 HB2 TRP A 12 8.857 -3.438 -8.782 1.00 0.00 H new ATOM 0 HB3 TRP A 12 8.263 -2.228 -7.661 1.00 0.00 H new ATOM 0 HD1 TRP A 12 7.208 -5.766 -8.941 1.00 0.00 H new ATOM 0 HE1 TRP A 12 5.980 -7.003 -7.028 1.00 0.00 H new ATOM 0 HE3 TRP A 12 7.198 -1.991 -5.498 1.00 0.00 H new ATOM 0 HZ2 TRP A 12 5.162 -6.408 -4.398 1.00 0.00 H new ATOM 0 HZ3 TRP A 12 6.171 -2.402 -3.298 1.00 0.00 H new ATOM 0 HH2 TRP A 12 5.170 -4.579 -2.757 1.00 0.00 H new ATOM 114 N CYS A 13 5.342 -1.341 -8.175 1.00 0.00 N ATOM 115 CA CYS A 13 3.986 -1.146 -7.689 1.00 0.00 C ATOM 116 C CYS A 13 3.052 -0.704 -8.807 1.00 0.00 C ATOM 117 O CYS A 13 2.002 -1.307 -9.015 1.00 0.00 O ATOM 118 CB CYS A 13 3.953 -0.135 -6.539 1.00 0.00 C ATOM 119 SG CYS A 13 2.333 0.057 -5.757 1.00 0.00 S ATOM 0 H CYS A 13 6.027 -0.692 -7.787 1.00 0.00 H new ATOM 0 HA CYS A 13 3.635 -2.108 -7.315 1.00 0.00 H new ATOM 0 HB2 CYS A 13 4.674 -0.442 -5.781 1.00 0.00 H new ATOM 0 HB3 CYS A 13 4.278 0.835 -6.915 1.00 0.00 H new ATOM 0 HG CYS A 13 1.403 -0.014 -6.662 1.00 0.00 H new ATOM 122 N ARG A 14 3.454 0.330 -9.545 1.00 0.00 N ATOM 123 CA ARG A 14 2.644 0.868 -10.636 1.00 0.00 C ATOM 124 C ARG A 14 2.293 -0.203 -11.665 1.00 0.00 C ATOM 125 O ARG A 14 1.222 -0.167 -12.265 1.00 0.00 O ATOM 126 CB ARG A 14 3.344 2.057 -11.305 1.00 0.00 C ATOM 127 CG ARG A 14 2.506 2.768 -12.358 1.00 0.00 C ATOM 128 CD ARG A 14 3.281 3.899 -13.014 1.00 0.00 C ATOM 129 NE ARG A 14 3.179 5.156 -12.271 1.00 0.00 N ATOM 130 CZ ARG A 14 4.187 6.014 -12.112 1.00 0.00 C ATOM 131 NH1 ARG A 14 5.397 5.717 -12.574 1.00 0.00 N ATOM 132 NH2 ARG A 14 3.987 7.154 -11.465 1.00 0.00 N ATOM 0 H ARG A 14 4.341 0.814 -9.405 1.00 0.00 H new ATOM 0 HA ARG A 14 1.709 1.221 -10.200 1.00 0.00 H new ATOM 0 HB2 ARG A 14 3.626 2.776 -10.536 1.00 0.00 H new ATOM 0 HB3 ARG A 14 4.266 1.707 -11.768 1.00 0.00 H new ATOM 0 HG2 ARG A 14 2.191 2.053 -13.118 1.00 0.00 H new ATOM 0 HG3 ARG A 14 1.601 3.164 -11.898 1.00 0.00 H new ATOM 0 HD2 ARG A 14 4.330 3.615 -13.098 1.00 0.00 H new ATOM 0 HD3 ARG A 14 2.909 4.049 -14.028 1.00 0.00 H new ATOM 0 HE ARG A 14 2.281 5.390 -11.848 1.00 0.00 H new ATOM 0 HH11 ARG A 14 5.557 4.830 -13.052 1.00 0.00 H new ATOM 0 HH12 ARG A 14 6.166 6.376 -12.451 1.00 0.00 H new ATOM 0 HH21 ARG A 14 3.064 7.373 -11.090 1.00 0.00 H new ATOM 0 HH22 ARG A 14 4.756 7.812 -11.342 1.00 0.00 H new ATOM 139 N ALA A 15 3.194 -1.165 -11.850 1.00 0.00 N ATOM 140 CA ALA A 15 2.972 -2.251 -12.800 1.00 0.00 C ATOM 141 C ALA A 15 1.776 -3.101 -12.382 1.00 0.00 C ATOM 142 O ALA A 15 1.063 -3.650 -13.223 1.00 0.00 O ATOM 143 CB ALA A 15 4.220 -3.114 -12.916 1.00 0.00 C ATOM 0 H ALA A 15 4.084 -1.214 -11.355 1.00 0.00 H new ATOM 0 HA ALA A 15 2.756 -1.814 -13.775 1.00 0.00 H new ATOM 0 HB1 ALA A 15 4.040 -3.920 -13.628 1.00 0.00 H new ATOM 0 HB2 ALA A 15 5.054 -2.503 -13.262 1.00 0.00 H new ATOM 0 HB3 ALA A 15 4.461 -3.538 -11.941 1.00 0.00 H new ATOM 145 N MET A 16 1.556 -3.188 -11.076 1.00 0.00 N ATOM 146 CA MET A 16 0.452 -3.965 -10.531 1.00 0.00 C ATOM 147 C MET A 16 -0.773 -3.087 -10.316 1.00 0.00 C ATOM 148 O MET A 16 -1.899 -3.492 -10.607 1.00 0.00 O ATOM 149 CB MET A 16 0.856 -4.600 -9.198 1.00 0.00 C ATOM 150 CG MET A 16 2.089 -5.488 -9.261 1.00 0.00 C ATOM 151 SD MET A 16 2.493 -6.227 -7.665 1.00 0.00 S ATOM 152 CE MET A 16 2.617 -4.764 -6.642 1.00 0.00 C ATOM 0 H MET A 16 2.132 -2.727 -10.372 1.00 0.00 H new ATOM 0 HA MET A 16 0.207 -4.748 -11.249 1.00 0.00 H new ATOM 0 HB2 MET A 16 1.034 -3.806 -8.473 1.00 0.00 H new ATOM 0 HB3 MET A 16 0.019 -5.190 -8.825 1.00 0.00 H new ATOM 0 HG2 MET A 16 1.926 -6.279 -9.993 1.00 0.00 H new ATOM 0 HG3 MET A 16 2.938 -4.901 -9.611 1.00 0.00 H new ATOM 0 HE1 MET A 16 3.000 -5.039 -5.659 1.00 0.00 H new ATOM 0 HE2 MET A 16 3.295 -4.050 -7.109 1.00 0.00 H new ATOM 0 HE3 MET A 16 1.631 -4.311 -6.534 1.00 0.00 H new ATOM 154 N THR A 17 -0.545 -1.871 -9.823 1.00 0.00 N ATOM 155 CA THR A 17 -1.627 -0.934 -9.553 1.00 0.00 C ATOM 156 C THR A 17 -2.344 -0.501 -10.830 1.00 0.00 C ATOM 157 O THR A 17 -3.504 -0.105 -10.787 1.00 0.00 O ATOM 158 CB THR A 17 -1.122 0.307 -8.794 1.00 0.00 C ATOM 159 OG1 THR A 17 -0.123 -0.095 -7.846 1.00 0.00 O ATOM 160 CG2 THR A 17 -2.269 0.965 -8.044 1.00 0.00 C ATOM 0 H THR A 17 0.384 -1.513 -9.603 1.00 0.00 H new ATOM 0 HA THR A 17 -2.342 -1.465 -8.924 1.00 0.00 H new ATOM 0 HB THR A 17 -0.704 1.014 -9.510 1.00 0.00 H new ATOM 0 HG1 THR A 17 0.648 -0.470 -8.322 1.00 0.00 H new ATOM 0 HG21 THR A 17 -1.900 1.841 -7.511 1.00 0.00 H new ATOM 0 HG22 THR A 17 -3.040 1.269 -8.752 1.00 0.00 H new ATOM 0 HG23 THR A 17 -2.691 0.257 -7.330 1.00 0.00 H new ATOM 163 N ARG A 18 -1.659 -0.602 -11.968 1.00 0.00 N ATOM 164 CA ARG A 18 -2.252 -0.221 -13.249 1.00 0.00 C ATOM 165 C ARG A 18 -3.434 -1.126 -13.591 1.00 0.00 C ATOM 166 O ARG A 18 -4.290 -0.774 -14.404 1.00 0.00 O ATOM 167 CB ARG A 18 -1.209 -0.263 -14.370 1.00 0.00 C ATOM 168 CG ARG A 18 -1.671 0.395 -15.664 1.00 0.00 C ATOM 169 CD ARG A 18 -0.585 0.384 -16.730 1.00 0.00 C ATOM 170 NE ARG A 18 0.588 1.169 -16.334 1.00 0.00 N ATOM 171 CZ ARG A 18 0.773 2.456 -16.643 1.00 0.00 C ATOM 172 NH1 ARG A 18 -0.151 3.121 -17.326 1.00 0.00 N ATOM 173 NH2 ARG A 18 1.880 3.076 -16.252 1.00 0.00 N ATOM 0 H ARG A 18 -0.699 -0.942 -12.030 1.00 0.00 H new ATOM 0 HA ARG A 18 -2.615 0.802 -13.156 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -0.300 0.231 -14.027 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -0.950 -1.302 -14.574 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -2.553 -0.124 -16.040 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -1.969 1.424 -15.461 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -0.282 -0.644 -16.927 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -0.988 0.781 -17.661 1.00 0.00 H new ATOM 0 HE ARG A 18 1.311 0.702 -15.786 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -1.007 2.650 -17.618 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -0.005 4.103 -17.559 1.00 0.00 H new ATOM 0 HH21 ARG A 18 2.586 2.570 -15.717 1.00 0.00 H new ATOM 0 HH22 ARG A 18 2.024 4.058 -16.486 1.00 0.00 H new ATOM 180 N ASN A 19 -3.470 -2.298 -12.964 1.00 0.00 N ATOM 181 CA ASN A 19 -4.545 -3.255 -13.183 1.00 0.00 C ATOM 182 C ASN A 19 -5.779 -2.839 -12.391 1.00 0.00 C ATOM 183 O ASN A 19 -6.893 -3.266 -12.683 1.00 0.00 O ATOM 184 CB ASN A 19 -4.092 -4.656 -12.749 1.00 0.00 C ATOM 185 CG ASN A 19 -5.165 -5.719 -12.910 1.00 0.00 C ATOM 186 OD1 ASN A 19 -5.997 -5.921 -12.024 1.00 0.00 O ATOM 187 ND2 ASN A 19 -5.142 -6.424 -14.031 1.00 0.00 N ATOM 0 H ASN A 19 -2.763 -2.607 -12.297 1.00 0.00 H new ATOM 0 HA ASN A 19 -4.794 -3.275 -14.244 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -3.217 -4.943 -13.333 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -3.781 -4.621 -11.705 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -5.829 -7.163 -14.183 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -4.438 -6.228 -14.742 1.00 0.00 H new ATOM 191 N TYR A 20 -5.567 -1.998 -11.389 1.00 0.00 N ATOM 192 CA TYR A 20 -6.647 -1.520 -10.542 1.00 0.00 C ATOM 193 C TYR A 20 -7.183 -0.192 -11.054 1.00 0.00 C ATOM 194 O TYR A 20 -6.555 0.853 -10.871 1.00 0.00 O ATOM 195 CB TYR A 20 -6.164 -1.357 -9.097 1.00 0.00 C ATOM 196 CG TYR A 20 -6.310 -2.596 -8.242 1.00 0.00 C ATOM 197 CD1 TYR A 20 -5.440 -3.671 -8.381 1.00 0.00 C ATOM 198 CD2 TYR A 20 -7.319 -2.690 -7.292 1.00 0.00 C ATOM 199 CE1 TYR A 20 -5.573 -4.802 -7.595 1.00 0.00 C ATOM 200 CE2 TYR A 20 -7.459 -3.815 -6.503 1.00 0.00 C ATOM 201 CZ TYR A 20 -6.585 -4.869 -6.659 1.00 0.00 C ATOM 202 OH TYR A 20 -6.723 -5.997 -5.877 1.00 0.00 O ATOM 0 H TYR A 20 -4.648 -1.631 -11.142 1.00 0.00 H new ATOM 0 HA TYR A 20 -7.448 -2.259 -10.569 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -5.115 -1.061 -9.109 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -6.719 -0.543 -8.632 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -4.648 -3.623 -9.114 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -8.008 -1.867 -7.168 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -4.888 -5.629 -7.713 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -8.249 -3.868 -5.768 1.00 0.00 H new ATOM 0 HH TYR A 20 -5.845 -6.410 -5.741 1.00 0.00 H new ATOM 205 N GLU A 21 -8.339 -0.236 -11.697 1.00 0.00 N ATOM 206 CA GLU A 21 -8.961 0.962 -12.229 1.00 0.00 C ATOM 207 C GLU A 21 -9.297 1.924 -11.101 1.00 0.00 C ATOM 208 O GLU A 21 -9.579 1.493 -9.981 1.00 0.00 O ATOM 209 CB GLU A 21 -10.233 0.609 -13.003 1.00 0.00 C ATOM 210 CG GLU A 21 -9.996 -0.165 -14.290 1.00 0.00 C ATOM 211 CD GLU A 21 -9.690 -1.630 -14.056 1.00 0.00 C ATOM 212 OE1 GLU A 21 -10.019 -2.147 -12.969 1.00 0.00 O ATOM 213 OE2 GLU A 21 -9.121 -2.271 -14.965 1.00 0.00 O ATOM 0 H GLU A 21 -8.866 -1.093 -11.863 1.00 0.00 H new ATOM 0 HA GLU A 21 -8.257 1.440 -12.910 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -10.885 0.022 -12.356 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -10.765 1.530 -13.241 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -10.878 -0.081 -14.925 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -9.168 0.290 -14.833 1.00 0.00 H new ATOM 215 N HIS A 22 -9.244 3.225 -11.403 1.00 0.00 N ATOM 216 CA HIS A 22 -9.536 4.277 -10.426 1.00 0.00 C ATOM 217 C HIS A 22 -8.365 4.484 -9.458 1.00 0.00 C ATOM 218 O HIS A 22 -8.377 5.407 -8.643 1.00 0.00 O ATOM 219 CB HIS A 22 -10.846 3.991 -9.666 1.00 0.00 C ATOM 220 CG HIS A 22 -11.509 5.185 -9.043 1.00 0.00 C ATOM 221 ND1 HIS A 22 -10.922 5.956 -8.062 1.00 0.00 N ATOM 222 CD2 HIS A 22 -12.732 5.729 -9.256 1.00 0.00 C ATOM 223 CE1 HIS A 22 -11.752 6.916 -7.703 1.00 0.00 C ATOM 224 NE2 HIS A 22 -12.856 6.803 -8.411 1.00 0.00 N ATOM 0 H HIS A 22 -8.998 3.577 -12.328 1.00 0.00 H new ATOM 0 HA HIS A 22 -9.673 5.206 -10.979 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -11.550 3.525 -10.355 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -10.638 3.263 -8.882 1.00 0.00 H new ATOM 0 HD1 HIS A 22 -9.990 5.807 -7.674 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -13.473 5.381 -9.961 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -11.558 7.669 -6.953 1.00 0.00 H new ATOM 228 N VAL A 23 -7.350 3.634 -9.548 1.00 0.00 N ATOM 229 CA VAL A 23 -6.197 3.740 -8.668 1.00 0.00 C ATOM 230 C VAL A 23 -4.919 4.020 -9.456 1.00 0.00 C ATOM 231 O VAL A 23 -4.127 3.120 -9.718 1.00 0.00 O ATOM 232 CB VAL A 23 -6.001 2.472 -7.806 1.00 0.00 C ATOM 233 CG1 VAL A 23 -5.154 2.786 -6.582 1.00 0.00 C ATOM 234 CG2 VAL A 23 -7.339 1.880 -7.394 1.00 0.00 C ATOM 0 H VAL A 23 -7.303 2.867 -10.219 1.00 0.00 H new ATOM 0 HA VAL A 23 -6.399 4.579 -8.002 1.00 0.00 H new ATOM 0 HB VAL A 23 -5.477 1.730 -8.409 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -5.026 1.882 -5.986 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -4.178 3.153 -6.899 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -5.650 3.549 -5.982 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -7.172 0.989 -6.789 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -7.898 2.614 -6.813 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -7.908 1.612 -8.284 1.00 0.00 H new ATOM 236 N ASP A 24 -4.733 5.270 -9.852 1.00 0.00 N ATOM 237 CA ASP A 24 -3.540 5.661 -10.591 1.00 0.00 C ATOM 238 C ASP A 24 -2.546 6.358 -9.669 1.00 0.00 C ATOM 239 O ASP A 24 -2.866 7.366 -9.036 1.00 0.00 O ATOM 240 CB ASP A 24 -3.877 6.530 -11.811 1.00 0.00 C ATOM 241 CG ASP A 24 -4.691 7.764 -11.477 1.00 0.00 C ATOM 242 OD1 ASP A 24 -5.885 7.618 -11.128 1.00 0.00 O ATOM 243 OD2 ASP A 24 -4.154 8.885 -11.581 1.00 0.00 O ATOM 0 H ASP A 24 -5.390 6.030 -9.675 1.00 0.00 H new ATOM 0 HA ASP A 24 -3.075 4.752 -10.973 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -2.949 6.838 -12.294 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -4.428 5.928 -12.534 1.00 0.00 H new ATOM 245 N ILE A 25 -1.348 5.794 -9.579 1.00 0.00 N ATOM 246 CA ILE A 25 -0.304 6.345 -8.728 1.00 0.00 C ATOM 247 C ILE A 25 0.640 7.244 -9.520 1.00 0.00 C ATOM 248 O ILE A 25 1.401 6.781 -10.375 1.00 0.00 O ATOM 249 CB ILE A 25 0.505 5.242 -8.007 1.00 0.00 C ATOM 250 CG1 ILE A 25 -0.426 4.345 -7.185 1.00 0.00 C ATOM 251 CG2 ILE A 25 1.576 5.857 -7.114 1.00 0.00 C ATOM 252 CD1 ILE A 25 0.280 3.198 -6.490 1.00 0.00 C ATOM 0 H ILE A 25 -1.076 4.953 -10.087 1.00 0.00 H new ATOM 0 HA ILE A 25 -0.809 6.943 -7.969 1.00 0.00 H new ATOM 0 HB ILE A 25 0.998 4.630 -8.763 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -0.933 4.954 -6.436 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -1.197 3.940 -7.841 1.00 0.00 H new ATOM 0 HG21 ILE A 25 2.134 5.064 -6.616 1.00 0.00 H new ATOM 0 HG22 ILE A 25 2.257 6.454 -7.721 1.00 0.00 H new ATOM 0 HG23 ILE A 25 1.104 6.494 -6.366 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -0.446 2.610 -5.929 1.00 0.00 H new ATOM 0 HD12 ILE A 25 0.764 2.564 -7.233 1.00 0.00 H new ATOM 0 HD13 ILE A 25 1.031 3.594 -5.807 1.00 0.00 H new ATOM 254 N GLN A 26 0.573 8.531 -9.229 1.00 0.00 N ATOM 255 CA GLN A 26 1.417 9.517 -9.882 1.00 0.00 C ATOM 256 C GLN A 26 2.688 9.715 -9.064 1.00 0.00 C ATOM 257 O GLN A 26 3.801 9.654 -9.587 1.00 0.00 O ATOM 258 CB GLN A 26 0.664 10.845 -9.993 1.00 0.00 C ATOM 259 CG GLN A 26 1.467 11.973 -10.611 1.00 0.00 C ATOM 260 CD GLN A 26 1.057 13.333 -10.083 1.00 0.00 C ATOM 261 OE1 GLN A 26 0.652 13.467 -8.925 1.00 0.00 O ATOM 262 NE2 GLN A 26 1.150 14.346 -10.929 1.00 0.00 N ATOM 0 H GLN A 26 -0.065 8.922 -8.536 1.00 0.00 H new ATOM 0 HA GLN A 26 1.678 9.168 -10.881 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -0.237 10.689 -10.587 1.00 0.00 H new ATOM 0 HB3 GLN A 26 0.340 11.149 -8.998 1.00 0.00 H new ATOM 0 HG2 GLN A 26 2.526 11.813 -10.410 1.00 0.00 H new ATOM 0 HG3 GLN A 26 1.341 11.954 -11.694 1.00 0.00 H new ATOM 0 HE21 GLN A 26 1.490 14.189 -11.878 1.00 0.00 H new ATOM 0 HE22 GLN A 26 0.881 15.284 -10.633 1.00 0.00 H new ATOM 266 N ASN A 27 2.507 9.938 -7.771 1.00 0.00 N ATOM 267 CA ASN A 27 3.617 10.148 -6.854 1.00 0.00 C ATOM 268 C ASN A 27 3.201 9.728 -5.447 1.00 0.00 C ATOM 269 O ASN A 27 2.024 9.454 -5.200 1.00 0.00 O ATOM 270 CB ASN A 27 4.037 11.625 -6.878 1.00 0.00 C ATOM 271 CG ASN A 27 5.341 11.894 -6.147 1.00 0.00 C ATOM 272 OD1 ASN A 27 6.175 11.003 -5.988 1.00 0.00 O ATOM 273 ND2 ASN A 27 5.532 13.125 -5.717 1.00 0.00 N ATOM 0 H ASN A 27 1.589 9.978 -7.329 1.00 0.00 H new ATOM 0 HA ASN A 27 4.469 9.542 -7.163 1.00 0.00 H new ATOM 0 HB2 ASN A 27 4.136 11.950 -7.914 1.00 0.00 H new ATOM 0 HB3 ASN A 27 3.247 12.227 -6.429 1.00 0.00 H new ATOM 0 HD21 ASN A 27 6.396 13.368 -5.233 1.00 0.00 H new ATOM 0 HD22 ASN A 27 4.816 13.835 -5.869 1.00 0.00 H new ATOM 277 N PHE A 28 4.158 9.663 -4.534 1.00 0.00 N ATOM 278 CA PHE A 28 3.883 9.273 -3.156 1.00 0.00 C ATOM 279 C PHE A 28 3.323 10.449 -2.356 1.00 0.00 C ATOM 280 O PHE A 28 3.948 10.923 -1.404 1.00 0.00 O ATOM 281 CB PHE A 28 5.146 8.722 -2.484 1.00 0.00 C ATOM 282 CG PHE A 28 5.744 7.531 -3.177 1.00 0.00 C ATOM 283 CD1 PHE A 28 5.146 6.285 -3.086 1.00 0.00 C ATOM 284 CD2 PHE A 28 6.908 7.658 -3.918 1.00 0.00 C ATOM 285 CE1 PHE A 28 5.696 5.186 -3.718 1.00 0.00 C ATOM 286 CE2 PHE A 28 7.465 6.566 -4.554 1.00 0.00 C ATOM 287 CZ PHE A 28 6.859 5.327 -4.453 1.00 0.00 C ATOM 0 H PHE A 28 5.138 9.876 -4.722 1.00 0.00 H new ATOM 0 HA PHE A 28 3.131 8.484 -3.175 1.00 0.00 H new ATOM 0 HB2 PHE A 28 5.894 9.514 -2.437 1.00 0.00 H new ATOM 0 HB3 PHE A 28 4.907 8.448 -1.456 1.00 0.00 H new ATOM 0 HD1 PHE A 28 4.237 6.171 -2.513 1.00 0.00 H new ATOM 0 HD2 PHE A 28 7.386 8.623 -3.999 1.00 0.00 H new ATOM 0 HE1 PHE A 28 5.219 4.220 -3.638 1.00 0.00 H new ATOM 0 HE2 PHE A 28 8.372 6.679 -5.129 1.00 0.00 H new ATOM 0 HZ PHE A 28 7.293 4.471 -4.947 1.00 0.00 H new ATOM 289 N SER A 29 2.151 10.926 -2.764 1.00 0.00 N ATOM 290 CA SER A 29 1.498 12.043 -2.095 1.00 0.00 C ATOM 291 C SER A 29 0.008 12.121 -2.444 1.00 0.00 C ATOM 292 O SER A 29 -0.826 11.533 -1.755 1.00 0.00 O ATOM 293 CB SER A 29 2.211 13.358 -2.431 1.00 0.00 C ATOM 294 OG SER A 29 2.610 13.385 -3.792 1.00 0.00 O ATOM 0 H SER A 29 1.633 10.553 -3.559 1.00 0.00 H new ATOM 0 HA SER A 29 1.568 11.875 -1.020 1.00 0.00 H new ATOM 0 HB2 SER A 29 1.548 14.198 -2.226 1.00 0.00 H new ATOM 0 HB3 SER A 29 3.084 13.477 -1.790 1.00 0.00 H new ATOM 0 HG SER A 29 3.061 14.234 -3.984 1.00 0.00 H new ATOM 297 N SER A 30 -0.321 12.815 -3.533 1.00 0.00 N ATOM 298 CA SER A 30 -1.714 12.980 -3.958 1.00 0.00 C ATOM 299 C SER A 30 -2.394 11.655 -4.299 1.00 0.00 C ATOM 300 O SER A 30 -3.553 11.438 -3.943 1.00 0.00 O ATOM 301 CB SER A 30 -1.825 13.955 -5.133 1.00 0.00 C ATOM 302 OG SER A 30 -1.865 15.299 -4.682 1.00 0.00 O ATOM 0 H SER A 30 0.359 13.274 -4.139 1.00 0.00 H new ATOM 0 HA SER A 30 -2.243 13.399 -3.102 1.00 0.00 H new ATOM 0 HB2 SER A 30 -0.976 13.819 -5.803 1.00 0.00 H new ATOM 0 HB3 SER A 30 -2.724 13.735 -5.708 1.00 0.00 H new ATOM 0 HG SER A 30 -1.934 15.901 -5.452 1.00 0.00 H new ATOM 305 N SER A 31 -1.678 10.770 -4.983 1.00 0.00 N ATOM 306 CA SER A 31 -2.232 9.472 -5.367 1.00 0.00 C ATOM 307 C SER A 31 -2.562 8.601 -4.154 1.00 0.00 C ATOM 308 O SER A 31 -3.303 7.625 -4.264 1.00 0.00 O ATOM 309 CB SER A 31 -1.271 8.735 -6.298 1.00 0.00 C ATOM 310 OG SER A 31 -0.177 9.563 -6.658 1.00 0.00 O ATOM 0 H SER A 31 -0.716 10.924 -5.283 1.00 0.00 H new ATOM 0 HA SER A 31 -3.166 9.666 -5.893 1.00 0.00 H new ATOM 0 HB2 SER A 31 -0.904 7.834 -5.808 1.00 0.00 H new ATOM 0 HB3 SER A 31 -1.801 8.416 -7.195 1.00 0.00 H new ATOM 0 HG SER A 31 0.512 9.515 -5.963 1.00 0.00 H new ATOM 313 N TRP A 32 -2.018 8.956 -3.000 1.00 0.00 N ATOM 314 CA TRP A 32 -2.261 8.196 -1.785 1.00 0.00 C ATOM 315 C TRP A 32 -3.208 8.948 -0.857 1.00 0.00 C ATOM 316 O TRP A 32 -3.561 8.463 0.217 1.00 0.00 O ATOM 317 CB TRP A 32 -0.944 7.870 -1.073 1.00 0.00 C ATOM 318 CG TRP A 32 0.004 7.054 -1.905 1.00 0.00 C ATOM 319 CD1 TRP A 32 0.852 7.513 -2.870 1.00 0.00 C ATOM 320 CD2 TRP A 32 0.203 5.636 -1.842 1.00 0.00 C ATOM 321 NE1 TRP A 32 1.560 6.472 -3.415 1.00 0.00 N ATOM 322 CE2 TRP A 32 1.182 5.309 -2.800 1.00 0.00 C ATOM 323 CE3 TRP A 32 -0.352 4.613 -1.070 1.00 0.00 C ATOM 324 CZ2 TRP A 32 1.617 4.003 -3.006 1.00 0.00 C ATOM 325 CZ3 TRP A 32 0.080 3.317 -1.274 1.00 0.00 C ATOM 326 CH2 TRP A 32 1.056 3.023 -2.234 1.00 0.00 C ATOM 0 H TRP A 32 -1.407 9.764 -2.880 1.00 0.00 H new ATOM 0 HA TRP A 32 -2.736 7.255 -2.063 1.00 0.00 H new ATOM 0 HB2 TRP A 32 -0.455 8.801 -0.788 1.00 0.00 H new ATOM 0 HB3 TRP A 32 -1.163 7.330 -0.152 1.00 0.00 H new ATOM 0 HD1 TRP A 32 0.952 8.548 -3.163 1.00 0.00 H new ATOM 0 HE1 TRP A 32 2.255 6.552 -4.157 1.00 0.00 H new ATOM 0 HE3 TRP A 32 -1.105 4.831 -0.327 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 2.368 3.772 -3.747 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 -0.342 2.517 -0.683 1.00 0.00 H new ATOM 0 HH2 TRP A 32 1.373 1.999 -2.368 1.00 0.00 H new ATOM 329 N SER A 33 -3.643 10.122 -1.298 1.00 0.00 N ATOM 330 CA SER A 33 -4.551 10.950 -0.514 1.00 0.00 C ATOM 331 C SER A 33 -5.980 10.413 -0.602 1.00 0.00 C ATOM 332 O SER A 33 -6.856 10.796 0.177 1.00 0.00 O ATOM 333 CB SER A 33 -4.491 12.402 -1.008 1.00 0.00 C ATOM 334 OG SER A 33 -5.020 13.302 -0.050 1.00 0.00 O ATOM 0 H SER A 33 -3.380 10.523 -2.198 1.00 0.00 H new ATOM 0 HA SER A 33 -4.241 10.920 0.530 1.00 0.00 H new ATOM 0 HB2 SER A 33 -3.457 12.670 -1.227 1.00 0.00 H new ATOM 0 HB3 SER A 33 -5.049 12.493 -1.940 1.00 0.00 H new ATOM 0 HG SER A 33 -4.763 13.010 0.850 1.00 0.00 H new ATOM 337 N SER A 34 -6.204 9.519 -1.555 1.00 0.00 N ATOM 338 CA SER A 34 -7.513 8.920 -1.756 1.00 0.00 C ATOM 339 C SER A 34 -7.740 7.749 -0.800 1.00 0.00 C ATOM 340 O SER A 34 -8.874 7.312 -0.598 1.00 0.00 O ATOM 341 CB SER A 34 -7.635 8.452 -3.205 1.00 0.00 C ATOM 342 OG SER A 34 -6.396 8.610 -3.881 1.00 0.00 O ATOM 0 H SER A 34 -5.489 9.192 -2.205 1.00 0.00 H new ATOM 0 HA SER A 34 -8.276 9.670 -1.546 1.00 0.00 H new ATOM 0 HB2 SER A 34 -7.941 7.406 -3.232 1.00 0.00 H new ATOM 0 HB3 SER A 34 -8.410 9.024 -3.715 1.00 0.00 H new ATOM 0 HG SER A 34 -6.488 8.305 -4.808 1.00 0.00 H new ATOM 345 N GLY A 35 -6.655 7.240 -0.220 1.00 0.00 N ATOM 346 CA GLY A 35 -6.748 6.127 0.715 1.00 0.00 C ATOM 347 C GLY A 35 -6.913 4.779 0.032 1.00 0.00 C ATOM 348 O GLY A 35 -6.287 3.795 0.426 1.00 0.00 O ATOM 0 H GLY A 35 -5.707 7.580 -0.381 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -5.851 6.105 1.334 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -7.592 6.293 1.384 1.00 0.00 H new ATOM 350 N MET A 36 -7.747 4.753 -1.005 1.00 0.00 N ATOM 351 CA MET A 36 -8.034 3.538 -1.771 1.00 0.00 C ATOM 352 C MET A 36 -6.767 2.843 -2.276 1.00 0.00 C ATOM 353 O MET A 36 -6.766 1.633 -2.513 1.00 0.00 O ATOM 354 CB MET A 36 -8.949 3.864 -2.957 1.00 0.00 C ATOM 355 CG MET A 36 -10.266 4.533 -2.584 1.00 0.00 C ATOM 356 SD MET A 36 -11.448 3.405 -1.819 1.00 0.00 S ATOM 357 CE MET A 36 -11.898 2.376 -3.215 1.00 0.00 C ATOM 0 H MET A 36 -8.246 5.577 -1.341 1.00 0.00 H new ATOM 0 HA MET A 36 -8.534 2.849 -1.091 1.00 0.00 H new ATOM 0 HB2 MET A 36 -8.410 4.514 -3.646 1.00 0.00 H new ATOM 0 HB3 MET A 36 -9.166 2.941 -3.494 1.00 0.00 H new ATOM 0 HG2 MET A 36 -10.066 5.357 -1.900 1.00 0.00 H new ATOM 0 HG3 MET A 36 -10.713 4.964 -3.480 1.00 0.00 H new ATOM 0 HE1 MET A 36 -12.984 2.330 -3.298 1.00 0.00 H new ATOM 0 HE2 MET A 36 -11.481 2.800 -4.129 1.00 0.00 H new ATOM 0 HE3 MET A 36 -11.503 1.371 -3.068 1.00 0.00 H new ATOM 359 N ALA A 37 -5.695 3.612 -2.448 1.00 0.00 N ATOM 360 CA ALA A 37 -4.425 3.071 -2.926 1.00 0.00 C ATOM 361 C ALA A 37 -3.874 2.003 -1.981 1.00 0.00 C ATOM 362 O ALA A 37 -3.383 0.963 -2.425 1.00 0.00 O ATOM 363 CB ALA A 37 -3.412 4.188 -3.124 1.00 0.00 C ATOM 0 H ALA A 37 -5.680 4.615 -2.263 1.00 0.00 H new ATOM 0 HA ALA A 37 -4.610 2.592 -3.887 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -2.472 3.767 -3.480 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -3.793 4.899 -3.858 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -3.245 4.700 -2.176 1.00 0.00 H new ATOM 365 N PHE A 38 -3.984 2.255 -0.682 1.00 0.00 N ATOM 366 CA PHE A 38 -3.495 1.317 0.323 1.00 0.00 C ATOM 367 C PHE A 38 -4.292 0.019 0.283 1.00 0.00 C ATOM 368 O PHE A 38 -3.724 -1.073 0.254 1.00 0.00 O ATOM 369 CB PHE A 38 -3.584 1.934 1.721 1.00 0.00 C ATOM 370 CG PHE A 38 -2.545 2.985 2.002 1.00 0.00 C ATOM 371 CD1 PHE A 38 -1.305 2.630 2.504 1.00 0.00 C ATOM 372 CD2 PHE A 38 -2.811 4.326 1.770 1.00 0.00 C ATOM 373 CE1 PHE A 38 -0.349 3.590 2.767 1.00 0.00 C ATOM 374 CE2 PHE A 38 -1.859 5.290 2.033 1.00 0.00 C ATOM 375 CZ PHE A 38 -0.625 4.923 2.532 1.00 0.00 C ATOM 0 H PHE A 38 -4.407 3.100 -0.299 1.00 0.00 H new ATOM 0 HA PHE A 38 -2.452 1.096 0.097 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -4.573 2.374 1.849 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -3.491 1.140 2.462 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -1.083 1.590 2.692 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -3.774 4.619 1.379 1.00 0.00 H new ATOM 0 HE1 PHE A 38 0.615 3.299 3.157 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -2.079 6.331 1.849 1.00 0.00 H new ATOM 0 HZ PHE A 38 0.122 5.675 2.738 1.00 0.00 H new ATOM 377 N CYS A 39 -5.611 0.156 0.259 1.00 0.00 N ATOM 378 CA CYS A 39 -6.507 -0.991 0.226 1.00 0.00 C ATOM 379 C CYS A 39 -6.276 -1.850 -1.019 1.00 0.00 C ATOM 380 O CYS A 39 -6.354 -3.082 -0.961 1.00 0.00 O ATOM 381 CB CYS A 39 -7.953 -0.502 0.274 1.00 0.00 C ATOM 382 SG CYS A 39 -8.156 1.064 1.155 1.00 0.00 S ATOM 0 H CYS A 39 -6.087 1.058 0.262 1.00 0.00 H new ATOM 0 HA CYS A 39 -6.301 -1.616 1.095 1.00 0.00 H new ATOM 0 HB2 CYS A 39 -8.323 -0.387 -0.745 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -8.570 -1.262 0.754 1.00 0.00 H new ATOM 0 HG CYS A 39 -9.333 1.103 1.706 1.00 0.00 H new ATOM 385 N ALA A 40 -5.978 -1.194 -2.134 1.00 0.00 N ATOM 386 CA ALA A 40 -5.731 -1.887 -3.391 1.00 0.00 C ATOM 387 C ALA A 40 -4.500 -2.777 -3.282 1.00 0.00 C ATOM 388 O ALA A 40 -4.515 -3.930 -3.718 1.00 0.00 O ATOM 389 CB ALA A 40 -5.564 -0.884 -4.523 1.00 0.00 C ATOM 0 H ALA A 40 -5.901 -0.179 -2.192 1.00 0.00 H new ATOM 0 HA ALA A 40 -6.591 -2.520 -3.610 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -5.380 -1.416 -5.456 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -6.472 -0.288 -4.618 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -4.720 -0.228 -4.307 1.00 0.00 H new ATOM 391 N LEU A 41 -3.445 -2.241 -2.680 1.00 0.00 N ATOM 392 CA LEU A 41 -2.203 -2.977 -2.509 1.00 0.00 C ATOM 393 C LEU A 41 -2.396 -4.164 -1.570 1.00 0.00 C ATOM 394 O LEU A 41 -1.895 -5.258 -1.828 1.00 0.00 O ATOM 395 CB LEU A 41 -1.104 -2.050 -1.980 1.00 0.00 C ATOM 396 CG LEU A 41 0.325 -2.595 -2.039 1.00 0.00 C ATOM 397 CD1 LEU A 41 0.764 -2.788 -3.484 1.00 0.00 C ATOM 398 CD2 LEU A 41 1.281 -1.669 -1.304 1.00 0.00 C ATOM 0 H LEU A 41 -3.428 -1.294 -2.301 1.00 0.00 H new ATOM 0 HA LEU A 41 -1.899 -3.362 -3.482 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -1.139 -1.119 -2.546 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -1.334 -1.802 -0.944 1.00 0.00 H new ATOM 0 HG LEU A 41 0.344 -3.566 -1.544 1.00 0.00 H new ATOM 0 HD11 LEU A 41 1.782 -3.176 -3.506 1.00 0.00 H new ATOM 0 HD12 LEU A 41 0.096 -3.495 -3.976 1.00 0.00 H new ATOM 0 HD13 LEU A 41 0.729 -1.832 -4.006 1.00 0.00 H new ATOM 0 HD21 LEU A 41 2.292 -2.073 -1.357 1.00 0.00 H new ATOM 0 HD22 LEU A 41 1.260 -0.682 -1.767 1.00 0.00 H new ATOM 0 HD23 LEU A 41 0.977 -1.587 -0.260 1.00 0.00 H new ATOM 400 N ILE A 42 -3.139 -3.948 -0.489 1.00 0.00 N ATOM 401 CA ILE A 42 -3.397 -5.005 0.484 1.00 0.00 C ATOM 402 C ILE A 42 -4.176 -6.159 -0.149 1.00 0.00 C ATOM 403 O ILE A 42 -3.818 -7.327 0.012 1.00 0.00 O ATOM 404 CB ILE A 42 -4.160 -4.473 1.720 1.00 0.00 C ATOM 405 CG1 ILE A 42 -3.356 -3.371 2.426 1.00 0.00 C ATOM 406 CG2 ILE A 42 -4.478 -5.604 2.692 1.00 0.00 C ATOM 407 CD1 ILE A 42 -1.984 -3.807 2.898 1.00 0.00 C ATOM 0 H ILE A 42 -3.573 -3.052 -0.265 1.00 0.00 H new ATOM 0 HA ILE A 42 -2.426 -5.374 0.815 1.00 0.00 H new ATOM 0 HB ILE A 42 -5.100 -4.045 1.373 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -3.242 -2.527 1.745 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -3.926 -3.014 3.284 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -5.015 -5.204 3.552 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -5.097 -6.350 2.193 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -3.550 -6.068 3.027 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -1.484 -2.970 3.385 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -2.087 -4.630 3.606 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -1.393 -4.135 2.043 1.00 0.00 H new ATOM 409 N HIS A 43 -5.232 -5.825 -0.887 1.00 0.00 N ATOM 410 CA HIS A 43 -6.057 -6.838 -1.540 1.00 0.00 C ATOM 411 C HIS A 43 -5.279 -7.565 -2.633 1.00 0.00 C ATOM 412 O HIS A 43 -5.567 -8.723 -2.941 1.00 0.00 O ATOM 413 CB HIS A 43 -7.340 -6.228 -2.116 1.00 0.00 C ATOM 414 CG HIS A 43 -8.238 -7.231 -2.782 1.00 0.00 C ATOM 415 ND1 HIS A 43 -8.389 -7.313 -4.150 1.00 0.00 N ATOM 416 CD2 HIS A 43 -9.021 -8.206 -2.262 1.00 0.00 C ATOM 417 CE1 HIS A 43 -9.224 -8.295 -4.441 1.00 0.00 C ATOM 418 NE2 HIS A 43 -9.620 -8.852 -3.312 1.00 0.00 N ATOM 0 H HIS A 43 -5.536 -4.865 -1.047 1.00 0.00 H new ATOM 0 HA HIS A 43 -6.338 -7.565 -0.778 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -7.890 -5.737 -1.314 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -7.073 -5.456 -2.838 1.00 0.00 H new ATOM 0 HD1 HIS A 43 -7.928 -6.710 -4.831 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -9.150 -8.433 -1.214 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -9.530 -8.591 -5.433 1.00 0.00 H new ATOM 422 N LYS A 44 -4.301 -6.879 -3.214 1.00 0.00 N ATOM 423 CA LYS A 44 -3.485 -7.455 -4.271 1.00 0.00 C ATOM 424 C LYS A 44 -2.731 -8.686 -3.776 1.00 0.00 C ATOM 425 O LYS A 44 -2.617 -9.686 -4.488 1.00 0.00 O ATOM 426 CB LYS A 44 -2.505 -6.413 -4.824 1.00 0.00 C ATOM 427 CG LYS A 44 -1.746 -6.865 -6.060 1.00 0.00 C ATOM 428 CD LYS A 44 -2.703 -7.243 -7.176 1.00 0.00 C ATOM 429 CE LYS A 44 -2.081 -8.255 -8.120 1.00 0.00 C ATOM 430 NZ LYS A 44 -3.112 -9.118 -8.749 1.00 0.00 N ATOM 0 H LYS A 44 -4.055 -5.920 -2.968 1.00 0.00 H new ATOM 0 HA LYS A 44 -4.151 -7.768 -5.075 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -3.056 -5.503 -5.062 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -1.788 -6.156 -4.045 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -1.085 -6.067 -6.397 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -1.115 -7.718 -5.812 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -3.617 -7.655 -6.749 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -2.986 -6.350 -7.733 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -1.519 -7.734 -8.895 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -1.370 -8.875 -7.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -2.653 -9.798 -9.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -3.631 -9.634 -8.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -3.775 -8.528 -9.290 1.00 0.00 H new ATOM 435 N PHE A 45 -2.232 -8.615 -2.551 1.00 0.00 N ATOM 436 CA PHE A 45 -1.488 -9.726 -1.974 1.00 0.00 C ATOM 437 C PHE A 45 -2.387 -10.633 -1.142 1.00 0.00 C ATOM 438 O PHE A 45 -2.201 -11.850 -1.114 1.00 0.00 O ATOM 439 CB PHE A 45 -0.311 -9.215 -1.140 1.00 0.00 C ATOM 440 CG PHE A 45 0.653 -8.372 -1.930 1.00 0.00 C ATOM 441 CD1 PHE A 45 1.388 -8.925 -2.969 1.00 0.00 C ATOM 442 CD2 PHE A 45 0.821 -7.028 -1.638 1.00 0.00 C ATOM 443 CE1 PHE A 45 2.271 -8.151 -3.700 1.00 0.00 C ATOM 444 CE2 PHE A 45 1.702 -6.251 -2.364 1.00 0.00 C ATOM 445 CZ PHE A 45 2.428 -6.813 -3.397 1.00 0.00 C ATOM 0 H PHE A 45 -2.328 -7.804 -1.939 1.00 0.00 H new ATOM 0 HA PHE A 45 -1.095 -10.321 -2.798 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.694 -8.631 -0.303 1.00 0.00 H new ATOM 0 HB3 PHE A 45 0.223 -10.066 -0.717 1.00 0.00 H new ATOM 0 HD1 PHE A 45 1.269 -9.971 -3.209 1.00 0.00 H new ATOM 0 HD2 PHE A 45 0.256 -6.583 -0.833 1.00 0.00 H new ATOM 0 HE1 PHE A 45 2.837 -8.593 -4.507 1.00 0.00 H new ATOM 0 HE2 PHE A 45 1.824 -5.205 -2.125 1.00 0.00 H new ATOM 0 HZ PHE A 45 3.117 -6.207 -3.966 1.00 0.00 H new ATOM 447 N PHE A 46 -3.365 -10.040 -0.472 1.00 0.00 N ATOM 448 CA PHE A 46 -4.285 -10.798 0.363 1.00 0.00 C ATOM 449 C PHE A 46 -5.716 -10.702 -0.157 1.00 0.00 C ATOM 450 O PHE A 46 -6.399 -9.701 0.054 1.00 0.00 O ATOM 451 CB PHE A 46 -4.229 -10.310 1.814 1.00 0.00 C ATOM 452 CG PHE A 46 -2.895 -10.491 2.477 1.00 0.00 C ATOM 453 CD1 PHE A 46 -2.480 -11.746 2.894 1.00 0.00 C ATOM 454 CD2 PHE A 46 -2.060 -9.407 2.692 1.00 0.00 C ATOM 455 CE1 PHE A 46 -1.257 -11.917 3.514 1.00 0.00 C ATOM 456 CE2 PHE A 46 -0.834 -9.571 3.311 1.00 0.00 C ATOM 457 CZ PHE A 46 -0.432 -10.829 3.722 1.00 0.00 C ATOM 0 H PHE A 46 -3.542 -9.036 -0.491 1.00 0.00 H new ATOM 0 HA PHE A 46 -3.973 -11.842 0.325 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -4.494 -9.253 1.840 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -4.984 -10.842 2.393 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -3.120 -12.601 2.732 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -2.370 -8.423 2.373 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -0.947 -12.900 3.836 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -0.192 -8.718 3.473 1.00 0.00 H new ATOM 0 HZ PHE A 46 0.525 -10.960 4.205 1.00 0.00 H new ATOM 459 N PRO A 47 -6.183 -11.740 -0.861 1.00 0.00 N ATOM 460 CA PRO A 47 -7.547 -11.782 -1.402 1.00 0.00 C ATOM 461 C PRO A 47 -8.589 -11.915 -0.293 1.00 0.00 C ATOM 462 O PRO A 47 -9.729 -11.473 -0.441 1.00 0.00 O ATOM 463 CB PRO A 47 -7.558 -13.045 -2.276 1.00 0.00 C ATOM 464 CG PRO A 47 -6.124 -13.416 -2.451 1.00 0.00 C ATOM 465 CD PRO A 47 -5.421 -12.944 -1.213 1.00 0.00 C ATOM 0 HA PRO A 47 -7.795 -10.871 -1.946 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -8.117 -13.849 -1.798 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -8.035 -12.854 -3.237 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -6.012 -14.493 -2.577 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -5.705 -12.946 -3.341 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -5.450 -13.690 -0.419 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -4.371 -12.720 -1.402 1.00 0.00 H new ATOM 466 N GLU A 48 -8.184 -12.512 0.823 1.00 0.00 N ATOM 467 CA GLU A 48 -9.081 -12.710 1.956 1.00 0.00 C ATOM 468 C GLU A 48 -9.082 -11.487 2.873 1.00 0.00 C ATOM 469 O GLU A 48 -9.732 -11.480 3.918 1.00 0.00 O ATOM 470 CB GLU A 48 -8.689 -13.968 2.739 1.00 0.00 C ATOM 471 CG GLU A 48 -9.811 -14.562 3.577 1.00 0.00 C ATOM 472 CD GLU A 48 -9.338 -15.673 4.487 1.00 0.00 C ATOM 473 OE1 GLU A 48 -8.819 -15.372 5.580 1.00 0.00 O ATOM 474 OE2 GLU A 48 -9.491 -16.856 4.117 1.00 0.00 O ATOM 0 H GLU A 48 -7.239 -12.868 0.967 1.00 0.00 H new ATOM 0 HA GLU A 48 -10.091 -12.844 1.568 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -8.338 -14.724 2.036 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -7.851 -13.727 3.394 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -10.265 -13.774 4.178 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -10.588 -14.946 2.916 1.00 0.00 H new ATOM 476 N ALA A 49 -8.350 -10.454 2.472 1.00 0.00 N ATOM 477 CA ALA A 49 -8.268 -9.227 3.252 1.00 0.00 C ATOM 478 C ALA A 49 -9.638 -8.579 3.390 1.00 0.00 C ATOM 479 O ALA A 49 -10.184 -8.492 4.490 1.00 0.00 O ATOM 480 CB ALA A 49 -7.290 -8.254 2.616 1.00 0.00 C ATOM 0 H ALA A 49 -7.805 -10.443 1.610 1.00 0.00 H new ATOM 0 HA ALA A 49 -7.907 -9.485 4.248 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -7.242 -7.343 3.213 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -6.301 -8.710 2.570 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -7.624 -8.010 1.608 1.00 0.00 H new ATOM 482 N PHE A 50 -10.187 -8.140 2.264 1.00 0.00 N ATOM 483 CA PHE A 50 -11.491 -7.493 2.236 1.00 0.00 C ATOM 484 C PHE A 50 -11.955 -7.301 0.799 1.00 0.00 C ATOM 485 O PHE A 50 -11.194 -7.536 -0.144 1.00 0.00 O ATOM 486 CB PHE A 50 -11.451 -6.137 2.960 1.00 0.00 C ATOM 487 CG PHE A 50 -10.249 -5.290 2.634 1.00 0.00 C ATOM 488 CD1 PHE A 50 -10.143 -4.648 1.412 1.00 0.00 C ATOM 489 CD2 PHE A 50 -9.227 -5.137 3.556 1.00 0.00 C ATOM 490 CE1 PHE A 50 -9.039 -3.873 1.116 1.00 0.00 C ATOM 491 CE2 PHE A 50 -8.122 -4.364 3.269 1.00 0.00 C ATOM 492 CZ PHE A 50 -8.027 -3.732 2.046 1.00 0.00 C ATOM 0 H PHE A 50 -9.743 -8.222 1.349 1.00 0.00 H new ATOM 0 HA PHE A 50 -12.198 -8.139 2.756 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -12.352 -5.578 2.708 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -11.475 -6.313 4.035 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -10.932 -4.754 0.682 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -9.297 -5.631 4.514 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -8.967 -3.378 0.159 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -7.334 -4.254 3.999 1.00 0.00 H new ATOM 0 HZ PHE A 50 -7.162 -3.128 1.816 1.00 0.00 H new ATOM 494 N ASP A 51 -13.202 -6.884 0.637 1.00 0.00 N ATOM 495 CA ASP A 51 -13.772 -6.643 -0.686 1.00 0.00 C ATOM 496 C ASP A 51 -13.455 -5.219 -1.111 1.00 0.00 C ATOM 497 O ASP A 51 -13.877 -4.269 -0.455 1.00 0.00 O ATOM 498 CB ASP A 51 -15.294 -6.829 -0.677 1.00 0.00 C ATOM 499 CG ASP A 51 -15.793 -7.790 0.375 1.00 0.00 C ATOM 500 OD1 ASP A 51 -15.894 -7.383 1.554 1.00 0.00 O ATOM 501 OD2 ASP A 51 -16.103 -8.951 0.026 1.00 0.00 O ATOM 0 H ASP A 51 -13.844 -6.704 1.409 1.00 0.00 H new ATOM 0 HA ASP A 51 -13.338 -7.360 -1.383 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -15.767 -5.859 -0.521 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -15.611 -7.184 -1.657 1.00 0.00 H new ATOM 503 N TYR A 52 -12.718 -5.072 -2.203 1.00 0.00 N ATOM 504 CA TYR A 52 -12.338 -3.756 -2.692 1.00 0.00 C ATOM 505 C TYR A 52 -13.497 -3.054 -3.396 1.00 0.00 C ATOM 506 O TYR A 52 -13.659 -1.840 -3.278 1.00 0.00 O ATOM 507 CB TYR A 52 -11.126 -3.850 -3.615 1.00 0.00 C ATOM 508 CG TYR A 52 -10.477 -2.513 -3.880 1.00 0.00 C ATOM 509 CD1 TYR A 52 -9.839 -1.821 -2.859 1.00 0.00 C ATOM 510 CD2 TYR A 52 -10.508 -1.935 -5.143 1.00 0.00 C ATOM 511 CE1 TYR A 52 -9.248 -0.597 -3.086 1.00 0.00 C ATOM 512 CE2 TYR A 52 -9.916 -0.709 -5.381 1.00 0.00 C ATOM 513 CZ TYR A 52 -9.289 -0.044 -4.348 1.00 0.00 C ATOM 514 OH TYR A 52 -8.699 1.176 -4.575 1.00 0.00 O ATOM 0 H TYR A 52 -12.372 -5.848 -2.767 1.00 0.00 H new ATOM 0 HA TYR A 52 -12.069 -3.153 -1.824 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -10.391 -4.522 -3.172 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -11.432 -4.292 -4.563 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -9.805 -2.250 -1.868 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -11.003 -2.452 -5.952 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -8.755 -0.074 -2.280 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -9.944 -0.275 -6.369 1.00 0.00 H new ATOM 0 HH TYR A 52 -7.991 1.325 -3.914 1.00 0.00 H new ATOM 517 N ALA A 53 -14.317 -3.820 -4.101 1.00 0.00 N ATOM 518 CA ALA A 53 -15.454 -3.255 -4.825 1.00 0.00 C ATOM 519 C ALA A 53 -16.554 -2.793 -3.871 1.00 0.00 C ATOM 520 O ALA A 53 -17.398 -1.972 -4.229 1.00 0.00 O ATOM 521 CB ALA A 53 -15.995 -4.247 -5.846 1.00 0.00 C ATOM 0 H ALA A 53 -14.220 -4.832 -4.189 1.00 0.00 H new ATOM 0 HA ALA A 53 -15.098 -2.376 -5.362 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -16.841 -3.803 -6.372 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -15.212 -4.495 -6.562 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -16.320 -5.153 -5.336 1.00 0.00 H new ATOM 523 N GLU A 54 -16.529 -3.308 -2.651 1.00 0.00 N ATOM 524 CA GLU A 54 -17.528 -2.946 -1.654 1.00 0.00 C ATOM 525 C GLU A 54 -17.085 -1.741 -0.829 1.00 0.00 C ATOM 526 O GLU A 54 -17.805 -1.290 0.065 1.00 0.00 O ATOM 527 CB GLU A 54 -17.839 -4.131 -0.738 1.00 0.00 C ATOM 528 CG GLU A 54 -18.416 -5.338 -1.457 1.00 0.00 C ATOM 529 CD GLU A 54 -19.600 -4.982 -2.332 1.00 0.00 C ATOM 530 OE1 GLU A 54 -20.581 -4.410 -1.811 1.00 0.00 O ATOM 531 OE2 GLU A 54 -19.554 -5.273 -3.545 1.00 0.00 O ATOM 0 H GLU A 54 -15.830 -3.976 -2.327 1.00 0.00 H new ATOM 0 HA GLU A 54 -18.437 -2.671 -2.189 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -16.924 -4.430 -0.226 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -18.543 -3.808 0.029 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -17.640 -5.796 -2.070 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -18.723 -6.082 -0.722 1.00 0.00 H new ATOM 533 N LEU A 55 -15.910 -1.215 -1.141 1.00 0.00 N ATOM 534 CA LEU A 55 -15.376 -0.066 -0.426 1.00 0.00 C ATOM 535 C LEU A 55 -15.861 1.234 -1.048 1.00 0.00 C ATOM 536 O LEU A 55 -16.224 1.275 -2.224 1.00 0.00 O ATOM 537 CB LEU A 55 -13.844 -0.105 -0.396 1.00 0.00 C ATOM 538 CG LEU A 55 -13.223 -1.237 0.424 1.00 0.00 C ATOM 539 CD1 LEU A 55 -11.710 -1.246 0.273 1.00 0.00 C ATOM 540 CD2 LEU A 55 -13.617 -1.117 1.888 1.00 0.00 C ATOM 0 H LEU A 55 -15.308 -1.566 -1.885 1.00 0.00 H new ATOM 0 HA LEU A 55 -15.741 -0.112 0.600 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -13.481 -0.183 -1.421 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -13.483 0.845 -0.001 1.00 0.00 H new ATOM 0 HG LEU A 55 -13.607 -2.183 0.043 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -11.290 -2.059 0.865 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -11.450 -1.389 -0.776 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -11.304 -0.296 0.622 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -13.165 -1.931 2.454 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -13.267 -0.163 2.282 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -14.702 -1.170 1.978 1.00 0.00 H new ATOM 542 N ASP A 56 -15.870 2.291 -0.249 1.00 0.00 N ATOM 543 CA ASP A 56 -16.313 3.599 -0.715 1.00 0.00 C ATOM 544 C ASP A 56 -15.265 4.655 -0.395 1.00 0.00 C ATOM 545 O ASP A 56 -14.720 4.678 0.710 1.00 0.00 O ATOM 546 CB ASP A 56 -17.639 3.997 -0.054 1.00 0.00 C ATOM 547 CG ASP A 56 -18.843 3.246 -0.586 1.00 0.00 C ATOM 548 OD1 ASP A 56 -19.200 3.439 -1.766 1.00 0.00 O ATOM 549 OD2 ASP A 56 -19.461 2.485 0.190 1.00 0.00 O ATOM 0 H ASP A 56 -15.575 2.269 0.727 1.00 0.00 H new ATOM 0 HA ASP A 56 -16.457 3.536 -1.794 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -17.563 3.827 1.020 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -17.798 5.066 -0.197 1.00 0.00 H new ATOM 551 N PRO A 57 -14.975 5.549 -1.353 1.00 0.00 N ATOM 552 CA PRO A 57 -13.993 6.630 -1.165 1.00 0.00 C ATOM 553 C PRO A 57 -14.448 7.607 -0.085 1.00 0.00 C ATOM 554 O PRO A 57 -13.635 8.296 0.536 1.00 0.00 O ATOM 555 CB PRO A 57 -13.957 7.331 -2.530 1.00 0.00 C ATOM 556 CG PRO A 57 -14.535 6.342 -3.484 1.00 0.00 C ATOM 557 CD PRO A 57 -15.558 5.572 -2.702 1.00 0.00 C ATOM 0 HA PRO A 57 -13.021 6.255 -0.846 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -14.538 8.253 -2.516 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -12.938 7.601 -2.809 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -14.991 6.843 -4.338 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -13.763 5.680 -3.877 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -16.532 6.062 -2.715 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -15.701 4.567 -3.100 1.00 0.00 H new ATOM 558 N ALA A 58 -15.757 7.654 0.134 1.00 0.00 N ATOM 559 CA ALA A 58 -16.333 8.529 1.148 1.00 0.00 C ATOM 560 C ALA A 58 -16.066 7.979 2.548 1.00 0.00 C ATOM 561 O ALA A 58 -16.209 8.685 3.545 1.00 0.00 O ATOM 562 CB ALA A 58 -17.826 8.697 0.920 1.00 0.00 C ATOM 0 H ALA A 58 -16.440 7.096 -0.378 1.00 0.00 H new ATOM 0 HA ALA A 58 -15.858 9.507 1.066 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -18.239 9.353 1.686 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -17.997 9.135 -0.064 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -18.314 7.724 0.974 1.00 0.00 H new ATOM 564 N LYS A 59 -15.669 6.716 2.604 1.00 0.00 N ATOM 565 CA LYS A 59 -15.371 6.050 3.863 1.00 0.00 C ATOM 566 C LYS A 59 -13.863 5.902 4.013 1.00 0.00 C ATOM 567 O LYS A 59 -13.367 4.835 4.368 1.00 0.00 O ATOM 568 CB LYS A 59 -16.027 4.668 3.895 1.00 0.00 C ATOM 569 CG LYS A 59 -17.542 4.680 3.813 1.00 0.00 C ATOM 570 CD LYS A 59 -18.072 3.301 3.462 1.00 0.00 C ATOM 571 CE LYS A 59 -19.589 3.265 3.479 1.00 0.00 C ATOM 572 NZ LYS A 59 -20.117 2.079 2.759 1.00 0.00 N ATOM 0 H LYS A 59 -15.545 6.126 1.781 1.00 0.00 H new ATOM 0 HA LYS A 59 -15.764 6.648 4.685 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -15.637 4.077 3.066 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -15.731 4.162 4.814 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -17.960 5.004 4.766 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -17.865 5.401 3.062 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -17.712 3.012 2.475 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -17.682 2.570 4.170 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -19.941 3.252 4.510 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -19.980 4.173 3.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -21.115 1.934 3.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -20.040 2.233 1.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -19.567 1.238 3.025 1.00 0.00 H new ATOM 577 N ARG A 60 -13.138 6.979 3.739 1.00 0.00 N ATOM 578 CA ARG A 60 -11.681 6.973 3.821 1.00 0.00 C ATOM 579 C ARG A 60 -11.182 6.628 5.221 1.00 0.00 C ATOM 580 O ARG A 60 -10.173 5.937 5.371 1.00 0.00 O ATOM 581 CB ARG A 60 -11.098 8.307 3.354 1.00 0.00 C ATOM 582 CG ARG A 60 -10.684 8.311 1.893 1.00 0.00 C ATOM 583 CD ARG A 60 -10.416 9.719 1.395 1.00 0.00 C ATOM 584 NE ARG A 60 -11.651 10.482 1.218 1.00 0.00 N ATOM 585 CZ ARG A 60 -11.800 11.753 1.589 1.00 0.00 C ATOM 586 NH1 ARG A 60 -10.802 12.392 2.189 1.00 0.00 N ATOM 587 NH2 ARG A 60 -12.942 12.385 1.352 1.00 0.00 N ATOM 0 H ARG A 60 -13.537 7.874 3.456 1.00 0.00 H new ATOM 0 HA ARG A 60 -11.331 6.188 3.150 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -11.836 9.093 3.516 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -10.232 8.551 3.969 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -9.789 7.702 1.766 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -11.469 7.854 1.290 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -9.768 10.237 2.103 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -9.880 9.672 0.447 1.00 0.00 H new ATOM 0 HE ARG A 60 -12.446 10.013 0.784 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -9.921 11.910 2.366 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -10.917 13.365 2.473 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -13.707 11.898 0.885 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -13.055 13.358 1.636 1.00 0.00 H new ATOM 594 N ARG A 61 -11.890 7.101 6.239 1.00 0.00 N ATOM 595 CA ARG A 61 -11.513 6.826 7.620 1.00 0.00 C ATOM 596 C ARG A 61 -11.543 5.327 7.892 1.00 0.00 C ATOM 597 O ARG A 61 -10.597 4.760 8.445 1.00 0.00 O ATOM 598 CB ARG A 61 -12.442 7.551 8.593 1.00 0.00 C ATOM 599 CG ARG A 61 -12.324 9.067 8.556 1.00 0.00 C ATOM 600 CD ARG A 61 -13.343 9.723 9.474 1.00 0.00 C ATOM 601 NE ARG A 61 -14.714 9.382 9.098 1.00 0.00 N ATOM 602 CZ ARG A 61 -15.511 8.590 9.813 1.00 0.00 C ATOM 603 NH1 ARG A 61 -15.072 8.051 10.946 1.00 0.00 N ATOM 604 NH2 ARG A 61 -16.743 8.340 9.394 1.00 0.00 N ATOM 0 H ARG A 61 -12.726 7.675 6.135 1.00 0.00 H new ATOM 0 HA ARG A 61 -10.498 7.193 7.771 1.00 0.00 H new ATOM 0 HB2 ARG A 61 -13.472 7.272 8.370 1.00 0.00 H new ATOM 0 HB3 ARG A 61 -12.230 7.206 9.605 1.00 0.00 H new ATOM 0 HG2 ARG A 61 -11.318 9.363 8.855 1.00 0.00 H new ATOM 0 HG3 ARG A 61 -12.470 9.420 7.535 1.00 0.00 H new ATOM 0 HD2 ARG A 61 -13.160 9.410 10.502 1.00 0.00 H new ATOM 0 HD3 ARG A 61 -13.216 10.805 9.443 1.00 0.00 H new ATOM 0 HE ARG A 61 -15.084 9.776 8.233 1.00 0.00 H new ATOM 0 HH11 ARG A 61 -14.124 8.244 11.269 1.00 0.00 H new ATOM 0 HH12 ARG A 61 -15.683 7.445 11.493 1.00 0.00 H new ATOM 0 HH21 ARG A 61 -17.080 8.754 8.525 1.00 0.00 H new ATOM 0 HH22 ARG A 61 -17.354 7.734 9.941 1.00 0.00 H new ATOM 611 N HIS A 62 -12.630 4.684 7.486 1.00 0.00 N ATOM 612 CA HIS A 62 -12.769 3.247 7.673 1.00 0.00 C ATOM 613 C HIS A 62 -11.839 2.504 6.729 1.00 0.00 C ATOM 614 O HIS A 62 -11.361 1.420 7.043 1.00 0.00 O ATOM 615 CB HIS A 62 -14.211 2.793 7.461 1.00 0.00 C ATOM 616 CG HIS A 62 -15.086 2.971 8.661 1.00 0.00 C ATOM 617 ND1 HIS A 62 -15.144 2.062 9.694 1.00 0.00 N ATOM 618 CD2 HIS A 62 -15.937 3.968 8.994 1.00 0.00 C ATOM 619 CE1 HIS A 62 -15.992 2.493 10.608 1.00 0.00 C ATOM 620 NE2 HIS A 62 -16.487 3.647 10.207 1.00 0.00 N ATOM 0 H HIS A 62 -13.424 5.132 7.028 1.00 0.00 H new ATOM 0 HA HIS A 62 -12.495 3.015 8.702 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -14.638 3.350 6.627 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -14.212 1.741 7.176 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -16.145 4.853 8.411 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -16.239 1.986 11.529 1.00 0.00 H new ATOM 0 HE2 HIS A 62 -17.168 4.209 10.717 1.00 0.00 H new ATOM 624 N ASN A 63 -11.588 3.106 5.573 1.00 0.00 N ATOM 625 CA ASN A 63 -10.699 2.528 4.571 1.00 0.00 C ATOM 626 C ASN A 63 -9.294 2.377 5.135 1.00 0.00 C ATOM 627 O ASN A 63 -8.716 1.290 5.096 1.00 0.00 O ATOM 628 CB ASN A 63 -10.672 3.411 3.325 1.00 0.00 C ATOM 629 CG ASN A 63 -11.199 2.707 2.097 1.00 0.00 C ATOM 630 OD1 ASN A 63 -10.990 1.512 1.913 1.00 0.00 O ATOM 631 ND2 ASN A 63 -11.900 3.443 1.252 1.00 0.00 N ATOM 0 H ASN A 63 -11.992 4.003 5.304 1.00 0.00 H new ATOM 0 HA ASN A 63 -11.073 1.541 4.298 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -11.265 4.307 3.507 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -9.649 3.739 3.139 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -12.290 3.020 0.410 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -12.051 4.434 1.442 1.00 0.00 H new ATOM 635 N PHE A 64 -8.755 3.470 5.674 1.00 0.00 N ATOM 636 CA PHE A 64 -7.426 3.451 6.272 1.00 0.00 C ATOM 637 C PHE A 64 -7.391 2.443 7.413 1.00 0.00 C ATOM 638 O PHE A 64 -6.465 1.638 7.520 1.00 0.00 O ATOM 639 CB PHE A 64 -7.047 4.835 6.805 1.00 0.00 C ATOM 640 CG PHE A 64 -6.677 5.835 5.746 1.00 0.00 C ATOM 641 CD1 PHE A 64 -5.699 5.545 4.809 1.00 0.00 C ATOM 642 CD2 PHE A 64 -7.304 7.069 5.691 1.00 0.00 C ATOM 643 CE1 PHE A 64 -5.355 6.465 3.839 1.00 0.00 C ATOM 644 CE2 PHE A 64 -6.966 7.994 4.723 1.00 0.00 C ATOM 645 CZ PHE A 64 -5.989 7.691 3.794 1.00 0.00 C ATOM 0 H PHE A 64 -9.220 4.377 5.708 1.00 0.00 H new ATOM 0 HA PHE A 64 -6.708 3.165 5.503 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -7.884 5.229 7.381 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -6.208 4.727 7.493 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -5.200 4.588 4.838 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -8.068 7.311 6.415 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -4.590 6.226 3.115 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -7.464 8.952 4.692 1.00 0.00 H new ATOM 0 HZ PHE A 64 -5.722 8.411 3.035 1.00 0.00 H new ATOM 647 N THR A 65 -8.423 2.483 8.247 1.00 0.00 N ATOM 648 CA THR A 65 -8.530 1.579 9.379 1.00 0.00 C ATOM 649 C THR A 65 -8.516 0.127 8.915 1.00 0.00 C ATOM 650 O THR A 65 -7.745 -0.685 9.425 1.00 0.00 O ATOM 651 CB THR A 65 -9.817 1.845 10.182 1.00 0.00 C ATOM 652 OG1 THR A 65 -9.868 3.228 10.559 1.00 0.00 O ATOM 653 CG2 THR A 65 -9.860 0.980 11.431 1.00 0.00 C ATOM 0 H THR A 65 -9.201 3.137 8.157 1.00 0.00 H new ATOM 0 HA THR A 65 -7.669 1.759 10.022 1.00 0.00 H new ATOM 0 HB THR A 65 -10.675 1.598 9.556 1.00 0.00 H new ATOM 0 HG1 THR A 65 -10.146 3.767 9.789 1.00 0.00 H new ATOM 0 HG21 THR A 65 -10.777 1.184 11.983 1.00 0.00 H new ATOM 0 HG22 THR A 65 -9.834 -0.072 11.146 1.00 0.00 H new ATOM 0 HG23 THR A 65 -8.999 1.207 12.060 1.00 0.00 H new ATOM 656 N LEU A 66 -9.349 -0.182 7.925 1.00 0.00 N ATOM 657 CA LEU A 66 -9.451 -1.536 7.391 1.00 0.00 C ATOM 658 C LEU A 66 -8.120 -2.010 6.814 1.00 0.00 C ATOM 659 O LEU A 66 -7.680 -3.129 7.085 1.00 0.00 O ATOM 660 CB LEU A 66 -10.555 -1.611 6.330 1.00 0.00 C ATOM 661 CG LEU A 66 -10.966 -3.012 5.867 1.00 0.00 C ATOM 662 CD1 LEU A 66 -11.366 -3.879 7.051 1.00 0.00 C ATOM 663 CD2 LEU A 66 -12.106 -2.922 4.865 1.00 0.00 C ATOM 0 H LEU A 66 -9.967 0.493 7.474 1.00 0.00 H new ATOM 0 HA LEU A 66 -9.711 -2.201 8.215 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -11.439 -1.109 6.722 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -10.228 -1.046 5.457 1.00 0.00 H new ATOM 0 HG LEU A 66 -10.108 -3.477 5.381 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -11.654 -4.869 6.696 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -10.523 -3.970 7.737 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -12.208 -3.421 7.570 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -12.388 -3.925 4.544 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -12.963 -2.436 5.331 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -11.785 -2.341 4.000 1.00 0.00 H new ATOM 665 N ALA A 67 -7.484 -1.152 6.031 1.00 0.00 N ATOM 666 CA ALA A 67 -6.203 -1.480 5.417 1.00 0.00 C ATOM 667 C ALA A 67 -5.139 -1.771 6.471 1.00 0.00 C ATOM 668 O ALA A 67 -4.462 -2.800 6.411 1.00 0.00 O ATOM 669 CB ALA A 67 -5.750 -0.360 4.492 1.00 0.00 C ATOM 0 H ALA A 67 -7.834 -0.221 5.804 1.00 0.00 H new ATOM 0 HA ALA A 67 -6.340 -2.385 4.825 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -4.792 -0.624 4.043 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -6.491 -0.215 3.706 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -5.642 0.562 5.063 1.00 0.00 H new ATOM 671 N PHE A 68 -5.010 -0.873 7.446 1.00 0.00 N ATOM 672 CA PHE A 68 -4.019 -1.027 8.510 1.00 0.00 C ATOM 673 C PHE A 68 -4.298 -2.242 9.390 1.00 0.00 C ATOM 674 O PHE A 68 -3.397 -3.039 9.658 1.00 0.00 O ATOM 675 CB PHE A 68 -3.916 0.242 9.366 1.00 0.00 C ATOM 676 CG PHE A 68 -3.230 1.389 8.679 1.00 0.00 C ATOM 677 CD1 PHE A 68 -2.065 1.184 7.958 1.00 0.00 C ATOM 678 CD2 PHE A 68 -3.747 2.671 8.758 1.00 0.00 C ATOM 679 CE1 PHE A 68 -1.429 2.237 7.326 1.00 0.00 C ATOM 680 CE2 PHE A 68 -3.117 3.727 8.130 1.00 0.00 C ATOM 681 CZ PHE A 68 -1.957 3.511 7.413 1.00 0.00 C ATOM 0 H PHE A 68 -5.580 -0.030 7.521 1.00 0.00 H new ATOM 0 HA PHE A 68 -3.060 -1.192 8.018 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -4.919 0.554 9.657 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -3.377 0.006 10.283 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -1.648 0.190 7.889 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -4.654 2.847 9.317 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -0.522 2.064 6.766 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -3.532 4.722 8.200 1.00 0.00 H new ATOM 0 HZ PHE A 68 -1.463 4.336 6.921 1.00 0.00 H new ATOM 683 N SER A 69 -5.544 -2.396 9.826 1.00 0.00 N ATOM 684 CA SER A 69 -5.911 -3.519 10.683 1.00 0.00 C ATOM 685 C SER A 69 -5.643 -4.855 9.995 1.00 0.00 C ATOM 686 O SER A 69 -5.077 -5.769 10.592 1.00 0.00 O ATOM 687 CB SER A 69 -7.366 -3.420 11.153 1.00 0.00 C ATOM 688 OG SER A 69 -8.241 -3.164 10.068 1.00 0.00 O ATOM 0 H SER A 69 -6.312 -1.763 9.603 1.00 0.00 H new ATOM 0 HA SER A 69 -5.278 -3.469 11.569 1.00 0.00 H new ATOM 0 HB2 SER A 69 -7.655 -4.348 11.645 1.00 0.00 H new ATOM 0 HB3 SER A 69 -7.458 -2.625 11.893 1.00 0.00 H new ATOM 0 HG SER A 69 -8.299 -2.198 9.916 1.00 0.00 H new ATOM 691 N THR A 70 -6.029 -4.957 8.729 1.00 0.00 N ATOM 692 CA THR A 70 -5.822 -6.182 7.971 1.00 0.00 C ATOM 693 C THR A 70 -4.330 -6.459 7.771 1.00 0.00 C ATOM 694 O THR A 70 -3.878 -7.598 7.896 1.00 0.00 O ATOM 695 CB THR A 70 -6.542 -6.134 6.609 1.00 0.00 C ATOM 696 OG1 THR A 70 -7.911 -5.756 6.813 1.00 0.00 O ATOM 697 CG2 THR A 70 -6.497 -7.493 5.934 1.00 0.00 C ATOM 0 H THR A 70 -6.485 -4.208 8.208 1.00 0.00 H new ATOM 0 HA THR A 70 -6.253 -6.997 8.552 1.00 0.00 H new ATOM 0 HB THR A 70 -6.040 -5.406 5.971 1.00 0.00 H new ATOM 0 HG1 THR A 70 -7.968 -4.785 6.932 1.00 0.00 H new ATOM 0 HG21 THR A 70 -7.010 -7.440 4.974 1.00 0.00 H new ATOM 0 HG22 THR A 70 -5.459 -7.786 5.775 1.00 0.00 H new ATOM 0 HG23 THR A 70 -6.989 -8.231 6.568 1.00 0.00 H new ATOM 700 N ALA A 71 -3.565 -5.410 7.485 1.00 0.00 N ATOM 701 CA ALA A 71 -2.128 -5.543 7.282 1.00 0.00 C ATOM 702 C ALA A 71 -1.456 -6.010 8.567 1.00 0.00 C ATOM 703 O ALA A 71 -0.574 -6.866 8.549 1.00 0.00 O ATOM 704 CB ALA A 71 -1.538 -4.220 6.818 1.00 0.00 C ATOM 0 H ALA A 71 -3.918 -4.458 7.389 1.00 0.00 H new ATOM 0 HA ALA A 71 -1.949 -6.290 6.509 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -0.464 -4.333 6.670 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -2.005 -3.923 5.879 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -1.722 -3.455 7.572 1.00 0.00 H new ATOM 706 N GLU A 72 -1.898 -5.454 9.684 1.00 0.00 N ATOM 707 CA GLU A 72 -1.354 -5.806 10.987 1.00 0.00 C ATOM 708 C GLU A 72 -1.775 -7.220 11.391 1.00 0.00 C ATOM 709 O GLU A 72 -1.021 -7.937 12.048 1.00 0.00 O ATOM 710 CB GLU A 72 -1.832 -4.797 12.033 1.00 0.00 C ATOM 711 CG GLU A 72 -1.234 -4.984 13.416 1.00 0.00 C ATOM 712 CD GLU A 72 -1.846 -4.051 14.439 1.00 0.00 C ATOM 713 OE1 GLU A 72 -1.716 -2.821 14.280 1.00 0.00 O ATOM 714 OE2 GLU A 72 -2.455 -4.540 15.413 1.00 0.00 O ATOM 0 H GLU A 72 -2.637 -4.752 9.714 1.00 0.00 H new ATOM 0 HA GLU A 72 -0.266 -5.780 10.928 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -1.596 -3.792 11.683 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -2.917 -4.861 12.110 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -1.380 -6.016 13.736 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -0.158 -4.814 13.370 1.00 0.00 H new ATOM 716 N LYS A 73 -2.969 -7.621 10.976 1.00 0.00 N ATOM 717 CA LYS A 73 -3.500 -8.936 11.314 1.00 0.00 C ATOM 718 C LYS A 73 -2.948 -10.056 10.430 1.00 0.00 C ATOM 719 O LYS A 73 -2.675 -11.153 10.916 1.00 0.00 O ATOM 720 CB LYS A 73 -5.030 -8.917 11.232 1.00 0.00 C ATOM 721 CG LYS A 73 -5.717 -10.022 12.017 1.00 0.00 C ATOM 722 CD LYS A 73 -5.465 -9.871 13.506 1.00 0.00 C ATOM 723 CE LYS A 73 -6.136 -10.981 14.295 1.00 0.00 C ATOM 724 NZ LYS A 73 -5.784 -10.917 15.736 1.00 0.00 N ATOM 0 H LYS A 73 -3.591 -7.052 10.402 1.00 0.00 H new ATOM 0 HA LYS A 73 -3.177 -9.151 12.333 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -5.389 -7.954 11.595 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -5.326 -8.994 10.186 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -6.789 -9.998 11.822 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -5.353 -10.992 11.680 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -4.392 -9.883 13.698 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -5.839 -8.905 13.844 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -7.217 -10.907 14.180 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -5.838 -11.948 13.890 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -6.260 -11.690 16.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -4.754 -11.012 15.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -6.091 -10.004 16.128 1.00 0.00 H new ATOM 729 N LEU A 74 -2.787 -9.788 9.139 1.00 0.00 N ATOM 730 CA LEU A 74 -2.309 -10.808 8.208 1.00 0.00 C ATOM 731 C LEU A 74 -0.807 -10.759 7.936 1.00 0.00 C ATOM 732 O LEU A 74 -0.198 -11.794 7.664 1.00 0.00 O ATOM 733 CB LEU A 74 -3.095 -10.760 6.894 1.00 0.00 C ATOM 734 CG LEU A 74 -4.539 -11.271 6.954 1.00 0.00 C ATOM 735 CD1 LEU A 74 -5.244 -11.043 5.627 1.00 0.00 C ATOM 736 CD2 LEU A 74 -4.575 -12.744 7.332 1.00 0.00 C ATOM 0 H LEU A 74 -2.978 -8.881 8.714 1.00 0.00 H new ATOM 0 HA LEU A 74 -2.488 -11.760 8.707 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -3.110 -9.729 6.541 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -2.555 -11.344 6.149 1.00 0.00 H new ATOM 0 HG LEU A 74 -5.066 -10.708 7.724 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -6.267 -11.413 5.691 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -5.257 -9.977 5.400 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -4.714 -11.576 4.837 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -5.610 -13.085 7.369 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -4.028 -13.324 6.589 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -4.113 -12.880 8.310 1.00 0.00 H new ATOM 738 N ALA A 75 -0.203 -9.579 7.994 1.00 0.00 N ATOM 739 CA ALA A 75 1.228 -9.463 7.721 1.00 0.00 C ATOM 740 C ALA A 75 2.006 -8.899 8.904 1.00 0.00 C ATOM 741 O ALA A 75 3.231 -8.790 8.848 1.00 0.00 O ATOM 742 CB ALA A 75 1.471 -8.634 6.469 1.00 0.00 C ATOM 0 H ALA A 75 -0.670 -8.701 8.223 1.00 0.00 H new ATOM 0 HA ALA A 75 1.601 -10.473 7.552 1.00 0.00 H new ATOM 0 HB1 ALA A 75 2.543 -8.560 6.284 1.00 0.00 H new ATOM 0 HB2 ALA A 75 0.988 -9.112 5.617 1.00 0.00 H new ATOM 0 HB3 ALA A 75 1.057 -7.635 6.608 1.00 0.00 H new ATOM 744 N ASP A 76 1.290 -8.547 9.967 1.00 0.00 N ATOM 745 CA ASP A 76 1.897 -7.988 11.174 1.00 0.00 C ATOM 746 C ASP A 76 2.724 -6.744 10.869 1.00 0.00 C ATOM 747 O ASP A 76 3.821 -6.567 11.398 1.00 0.00 O ATOM 748 CB ASP A 76 2.741 -9.035 11.910 1.00 0.00 C ATOM 749 CG ASP A 76 2.222 -9.318 13.302 1.00 0.00 C ATOM 750 OD1 ASP A 76 2.192 -8.390 14.133 1.00 0.00 O ATOM 751 OD2 ASP A 76 1.832 -10.475 13.575 1.00 0.00 O ATOM 0 H ASP A 76 0.276 -8.640 10.018 1.00 0.00 H new ATOM 0 HA ASP A 76 1.081 -7.688 11.831 1.00 0.00 H new ATOM 0 HB2 ASP A 76 2.751 -9.960 11.334 1.00 0.00 H new ATOM 0 HB3 ASP A 76 3.772 -8.688 11.973 1.00 0.00 H new ATOM 753 N CYS A 77 2.195 -5.886 10.009 1.00 0.00 N ATOM 754 CA CYS A 77 2.885 -4.659 9.629 1.00 0.00 C ATOM 755 C CYS A 77 2.985 -3.688 10.803 1.00 0.00 C ATOM 756 O CYS A 77 2.044 -3.550 11.587 1.00 0.00 O ATOM 757 CB CYS A 77 2.176 -3.997 8.450 1.00 0.00 C ATOM 758 SG CYS A 77 1.987 -5.079 7.015 1.00 0.00 S ATOM 0 H CYS A 77 1.289 -6.016 9.560 1.00 0.00 H new ATOM 0 HA CYS A 77 3.899 -4.924 9.330 1.00 0.00 H new ATOM 0 HB2 CYS A 77 1.191 -3.661 8.772 1.00 0.00 H new ATOM 0 HB3 CYS A 77 2.735 -3.109 8.153 1.00 0.00 H new ATOM 0 HG CYS A 77 1.570 -4.383 5.999 1.00 0.00 H new ATOM 761 N ALA A 78 4.136 -3.038 10.925 1.00 0.00 N ATOM 762 CA ALA A 78 4.369 -2.078 11.995 1.00 0.00 C ATOM 763 C ALA A 78 3.541 -0.815 11.780 1.00 0.00 C ATOM 764 O ALA A 78 3.283 -0.410 10.643 1.00 0.00 O ATOM 765 CB ALA A 78 5.849 -1.736 12.087 1.00 0.00 C ATOM 0 H ALA A 78 4.926 -3.160 10.292 1.00 0.00 H new ATOM 0 HA ALA A 78 4.058 -2.532 12.936 1.00 0.00 H new ATOM 0 HB1 ALA A 78 6.007 -1.017 12.891 1.00 0.00 H new ATOM 0 HB2 ALA A 78 6.420 -2.642 12.292 1.00 0.00 H new ATOM 0 HB3 ALA A 78 6.182 -1.304 11.143 1.00 0.00 H new ATOM 767 N GLN A 79 3.136 -0.190 12.876 1.00 0.00 N ATOM 768 CA GLN A 79 2.330 1.021 12.812 1.00 0.00 C ATOM 769 C GLN A 79 3.206 2.234 12.527 1.00 0.00 C ATOM 770 O GLN A 79 3.703 2.886 13.446 1.00 0.00 O ATOM 771 CB GLN A 79 1.537 1.228 14.110 1.00 0.00 C ATOM 772 CG GLN A 79 0.638 0.060 14.502 1.00 0.00 C ATOM 773 CD GLN A 79 1.414 -1.116 15.070 1.00 0.00 C ATOM 774 OE1 GLN A 79 2.494 -0.948 15.633 1.00 0.00 O ATOM 775 NE2 GLN A 79 0.872 -2.313 14.930 1.00 0.00 N ATOM 0 H GLN A 79 3.353 -0.502 13.823 1.00 0.00 H new ATOM 0 HA GLN A 79 1.618 0.905 11.995 1.00 0.00 H new ATOM 0 HB2 GLN A 79 2.239 1.417 14.922 1.00 0.00 H new ATOM 0 HB3 GLN A 79 0.923 2.122 14.005 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -0.090 0.399 15.239 1.00 0.00 H new ATOM 0 HG3 GLN A 79 0.076 -0.269 13.628 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -0.026 -2.414 14.457 1.00 0.00 H new ATOM 0 HE22 GLN A 79 1.352 -3.136 15.295 1.00 0.00 H new ATOM 779 N LEU A 80 3.421 2.512 11.248 1.00 0.00 N ATOM 780 CA LEU A 80 4.240 3.644 10.839 1.00 0.00 C ATOM 781 C LEU A 80 3.378 4.847 10.467 1.00 0.00 C ATOM 782 O LEU A 80 3.886 5.953 10.292 1.00 0.00 O ATOM 783 CB LEU A 80 5.144 3.253 9.664 1.00 0.00 C ATOM 784 CG LEU A 80 6.166 2.146 9.938 1.00 0.00 C ATOM 785 CD1 LEU A 80 6.909 1.778 8.663 1.00 0.00 C ATOM 786 CD2 LEU A 80 7.142 2.576 11.019 1.00 0.00 C ATOM 0 H LEU A 80 3.039 1.968 10.475 1.00 0.00 H new ATOM 0 HA LEU A 80 4.865 3.928 11.686 1.00 0.00 H new ATOM 0 HB2 LEU A 80 4.511 2.938 8.835 1.00 0.00 H new ATOM 0 HB3 LEU A 80 5.682 4.142 9.334 1.00 0.00 H new ATOM 0 HG LEU A 80 5.631 1.264 10.290 1.00 0.00 H new ATOM 0 HD11 LEU A 80 7.631 0.990 8.877 1.00 0.00 H new ATOM 0 HD12 LEU A 80 6.198 1.425 7.916 1.00 0.00 H new ATOM 0 HD13 LEU A 80 7.432 2.655 8.281 1.00 0.00 H new ATOM 0 HD21 LEU A 80 7.860 1.776 11.200 1.00 0.00 H new ATOM 0 HD22 LEU A 80 7.671 3.473 10.696 1.00 0.00 H new ATOM 0 HD23 LEU A 80 6.596 2.788 11.938 1.00 0.00 H new ATOM 788 N LEU A 81 2.073 4.623 10.360 1.00 0.00 N ATOM 789 CA LEU A 81 1.137 5.679 10.006 1.00 0.00 C ATOM 790 C LEU A 81 -0.131 5.560 10.835 1.00 0.00 C ATOM 791 O LEU A 81 -0.558 4.454 11.167 1.00 0.00 O ATOM 792 CB LEU A 81 0.788 5.612 8.516 1.00 0.00 C ATOM 793 CG LEU A 81 1.847 6.146 7.548 1.00 0.00 C ATOM 794 CD1 LEU A 81 1.548 5.694 6.127 1.00 0.00 C ATOM 795 CD2 LEU A 81 1.924 7.663 7.624 1.00 0.00 C ATOM 0 H LEU A 81 1.639 3.713 10.515 1.00 0.00 H new ATOM 0 HA LEU A 81 1.611 6.638 10.214 1.00 0.00 H new ATOM 0 HB2 LEU A 81 0.582 4.573 8.259 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -0.135 6.169 8.355 1.00 0.00 H new ATOM 0 HG LEU A 81 2.816 5.740 7.839 1.00 0.00 H new ATOM 0 HD11 LEU A 81 2.311 6.083 5.453 1.00 0.00 H new ATOM 0 HD12 LEU A 81 1.547 4.605 6.084 1.00 0.00 H new ATOM 0 HD13 LEU A 81 0.571 6.070 5.824 1.00 0.00 H new ATOM 0 HD21 LEU A 81 2.682 8.024 6.929 1.00 0.00 H new ATOM 0 HD22 LEU A 81 0.957 8.090 7.360 1.00 0.00 H new ATOM 0 HD23 LEU A 81 2.189 7.964 8.638 1.00 0.00 H new ATOM 797 N GLU A 82 -0.715 6.699 11.182 1.00 0.00 N ATOM 798 CA GLU A 82 -1.940 6.722 11.968 1.00 0.00 C ATOM 799 C GLU A 82 -3.140 6.959 11.062 1.00 0.00 C ATOM 800 O GLU A 82 -3.070 7.760 10.128 1.00 0.00 O ATOM 801 CB GLU A 82 -1.883 7.826 13.024 1.00 0.00 C ATOM 802 CG GLU A 82 -0.571 7.913 13.784 1.00 0.00 C ATOM 803 CD GLU A 82 -0.624 8.939 14.897 1.00 0.00 C ATOM 804 OE1 GLU A 82 -1.149 8.609 15.983 1.00 0.00 O ATOM 805 OE2 GLU A 82 -0.145 10.076 14.694 1.00 0.00 O ATOM 0 H GLU A 82 -0.359 7.621 10.931 1.00 0.00 H new ATOM 0 HA GLU A 82 -2.041 5.757 12.465 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -2.070 8.784 12.538 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -2.691 7.668 13.739 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -0.330 6.936 14.203 1.00 0.00 H new ATOM 0 HG3 GLU A 82 0.232 8.170 13.093 1.00 0.00 H new ATOM 807 N VAL A 83 -4.241 6.283 11.356 1.00 0.00 N ATOM 808 CA VAL A 83 -5.459 6.412 10.562 1.00 0.00 C ATOM 809 C VAL A 83 -5.992 7.842 10.605 1.00 0.00 C ATOM 810 O VAL A 83 -6.163 8.486 9.566 1.00 0.00 O ATOM 811 CB VAL A 83 -6.565 5.457 11.058 1.00 0.00 C ATOM 812 CG1 VAL A 83 -7.822 5.613 10.215 1.00 0.00 C ATOM 813 CG2 VAL A 83 -6.083 4.013 11.054 1.00 0.00 C ATOM 0 H VAL A 83 -4.318 5.637 12.141 1.00 0.00 H new ATOM 0 HA VAL A 83 -5.194 6.149 9.538 1.00 0.00 H new ATOM 0 HB VAL A 83 -6.808 5.723 12.087 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -8.591 4.932 10.579 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -8.183 6.639 10.286 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -7.594 5.380 9.175 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -6.882 3.362 11.408 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -5.803 3.726 10.041 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -5.218 3.916 11.711 1.00 0.00 H new ATOM 815 N ASP A 84 -6.230 8.338 11.812 1.00 0.00 N ATOM 816 CA ASP A 84 -6.754 9.688 12.000 1.00 0.00 C ATOM 817 C ASP A 84 -5.780 10.737 11.484 1.00 0.00 C ATOM 818 O ASP A 84 -6.188 11.762 10.932 1.00 0.00 O ATOM 819 CB ASP A 84 -7.084 9.953 13.473 1.00 0.00 C ATOM 820 CG ASP A 84 -5.861 10.037 14.369 1.00 0.00 C ATOM 821 OD1 ASP A 84 -5.433 8.988 14.896 1.00 0.00 O ATOM 822 OD2 ASP A 84 -5.330 11.147 14.557 1.00 0.00 O ATOM 0 H ASP A 84 -6.069 7.825 12.679 1.00 0.00 H new ATOM 0 HA ASP A 84 -7.674 9.761 11.421 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -7.643 10.886 13.548 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -7.737 9.160 13.838 1.00 0.00 H new ATOM 824 N ASP A 85 -4.493 10.458 11.645 1.00 0.00 N ATOM 825 CA ASP A 85 -3.448 11.375 11.207 1.00 0.00 C ATOM 826 C ASP A 85 -3.454 11.521 9.696 1.00 0.00 C ATOM 827 O ASP A 85 -3.333 12.626 9.168 1.00 0.00 O ATOM 828 CB ASP A 85 -2.076 10.901 11.682 1.00 0.00 C ATOM 829 CG ASP A 85 -1.001 11.948 11.488 1.00 0.00 C ATOM 830 OD1 ASP A 85 -1.182 13.081 11.973 1.00 0.00 O ATOM 831 OD2 ASP A 85 0.037 11.635 10.873 1.00 0.00 O ATOM 0 H ASP A 85 -4.147 9.601 12.077 1.00 0.00 H new ATOM 0 HA ASP A 85 -3.653 12.349 11.651 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -2.133 10.635 12.737 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -1.800 9.997 11.140 1.00 0.00 H new ATOM 833 N MET A 86 -3.615 10.402 9.003 1.00 0.00 N ATOM 834 CA MET A 86 -3.643 10.408 7.547 1.00 0.00 C ATOM 835 C MET A 86 -4.829 11.206 7.025 1.00 0.00 C ATOM 836 O MET A 86 -4.716 11.916 6.029 1.00 0.00 O ATOM 837 CB MET A 86 -3.648 8.990 6.979 1.00 0.00 C ATOM 838 CG MET A 86 -2.304 8.290 7.080 1.00 0.00 C ATOM 839 SD MET A 86 -2.093 6.991 5.850 1.00 0.00 S ATOM 840 CE MET A 86 -2.100 7.958 4.345 1.00 0.00 C ATOM 0 H MET A 86 -3.728 9.480 9.425 1.00 0.00 H new ATOM 0 HA MET A 86 -2.730 10.896 7.206 1.00 0.00 H new ATOM 0 HB2 MET A 86 -4.397 8.399 7.506 1.00 0.00 H new ATOM 0 HB3 MET A 86 -3.951 9.028 5.933 1.00 0.00 H new ATOM 0 HG2 MET A 86 -1.508 9.025 6.964 1.00 0.00 H new ATOM 0 HG3 MET A 86 -2.198 7.860 8.076 1.00 0.00 H new ATOM 0 HE1 MET A 86 -2.992 7.722 3.765 1.00 0.00 H new ATOM 0 HE2 MET A 86 -2.099 9.019 4.594 1.00 0.00 H new ATOM 0 HE3 MET A 86 -1.213 7.723 3.757 1.00 0.00 H new ATOM 842 N VAL A 87 -5.960 11.103 7.714 1.00 0.00 N ATOM 843 CA VAL A 87 -7.159 11.836 7.320 1.00 0.00 C ATOM 844 C VAL A 87 -6.969 13.329 7.575 1.00 0.00 C ATOM 845 O VAL A 87 -7.388 14.168 6.777 1.00 0.00 O ATOM 846 CB VAL A 87 -8.418 11.338 8.065 1.00 0.00 C ATOM 847 CG1 VAL A 87 -9.663 12.047 7.553 1.00 0.00 C ATOM 848 CG2 VAL A 87 -8.569 9.832 7.915 1.00 0.00 C ATOM 0 H VAL A 87 -6.073 10.522 8.545 1.00 0.00 H new ATOM 0 HA VAL A 87 -7.311 11.658 6.255 1.00 0.00 H new ATOM 0 HB VAL A 87 -8.299 11.571 9.123 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -10.537 11.681 8.091 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -9.562 13.121 7.712 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -9.783 11.848 6.488 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -9.461 9.501 8.447 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -8.661 9.579 6.859 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -7.693 9.335 8.332 1.00 0.00 H new ATOM 850 N ARG A 88 -6.316 13.649 8.687 1.00 0.00 N ATOM 851 CA ARG A 88 -6.049 15.033 9.056 1.00 0.00 C ATOM 852 C ARG A 88 -5.067 15.666 8.076 1.00 0.00 C ATOM 853 O ARG A 88 -5.337 16.722 7.501 1.00 0.00 O ATOM 854 CB ARG A 88 -5.488 15.105 10.476 1.00 0.00 C ATOM 855 CG ARG A 88 -5.143 16.510 10.938 1.00 0.00 C ATOM 856 CD ARG A 88 -4.396 16.488 12.261 1.00 0.00 C ATOM 857 NE ARG A 88 -3.118 15.782 12.168 1.00 0.00 N ATOM 858 CZ ARG A 88 -1.928 16.385 12.124 1.00 0.00 C ATOM 859 NH1 ARG A 88 -1.840 17.706 12.197 1.00 0.00 N ATOM 860 NH2 ARG A 88 -0.826 15.659 12.034 1.00 0.00 N ATOM 0 H ARG A 88 -5.960 12.963 9.352 1.00 0.00 H new ATOM 0 HA ARG A 88 -6.988 15.586 9.018 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -6.216 14.677 11.165 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -4.593 14.486 10.533 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -4.533 17.004 10.182 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -6.057 17.095 11.043 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -4.219 17.511 12.593 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -5.018 16.010 13.018 1.00 0.00 H new ATOM 0 HE ARG A 88 -3.138 14.763 12.135 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -2.686 18.269 12.288 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -0.927 18.159 12.163 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -0.887 14.641 11.998 1.00 0.00 H new ATOM 0 HH22 ARG A 88 0.085 16.117 12.000 1.00 0.00 H new ATOM 867 N LEU A 89 -3.931 15.005 7.876 1.00 0.00 N ATOM 868 CA LEU A 89 -2.906 15.496 6.964 1.00 0.00 C ATOM 869 C LEU A 89 -3.408 15.513 5.526 1.00 0.00 C ATOM 870 O LEU A 89 -2.991 16.362 4.731 1.00 0.00 O ATOM 871 CB LEU A 89 -1.645 14.633 7.055 1.00 0.00 C ATOM 872 CG LEU A 89 -0.840 14.737 8.353 1.00 0.00 C ATOM 873 CD1 LEU A 89 0.338 13.777 8.321 1.00 0.00 C ATOM 874 CD2 LEU A 89 -0.360 16.163 8.574 1.00 0.00 C ATOM 0 H LEU A 89 -3.697 14.125 8.336 1.00 0.00 H new ATOM 0 HA LEU A 89 -2.666 16.517 7.261 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -1.933 13.591 6.915 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -0.990 14.897 6.225 1.00 0.00 H new ATOM 0 HG LEU A 89 -1.489 14.463 9.185 1.00 0.00 H new ATOM 0 HD11 LEU A 89 0.902 13.862 9.250 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -0.027 12.756 8.210 1.00 0.00 H new ATOM 0 HD13 LEU A 89 0.986 14.024 7.480 1.00 0.00 H new ATOM 0 HD21 LEU A 89 0.210 16.215 9.502 1.00 0.00 H new ATOM 0 HD22 LEU A 89 0.274 16.467 7.741 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -1.219 16.830 8.638 1.00 0.00 H new ATOM 876 N ALA A 90 -4.305 14.572 5.213 1.00 0.00 N ATOM 877 CA ALA A 90 -4.885 14.423 3.876 1.00 0.00 C ATOM 878 C ALA A 90 -3.852 13.864 2.903 1.00 0.00 C ATOM 879 O ALA A 90 -3.998 12.751 2.395 1.00 0.00 O ATOM 880 CB ALA A 90 -5.515 15.712 3.362 1.00 0.00 C ATOM 0 H ALA A 90 -4.651 13.888 5.886 1.00 0.00 H new ATOM 0 HA ALA A 90 -5.701 13.704 3.953 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -5.929 15.543 2.368 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -6.311 16.023 4.039 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -4.756 16.493 3.312 1.00 0.00 H new ATOM 882 N VAL A 91 -2.808 14.632 2.660 1.00 0.00 N ATOM 883 CA VAL A 91 -1.737 14.215 1.778 1.00 0.00 C ATOM 884 C VAL A 91 -0.626 13.606 2.627 1.00 0.00 C ATOM 885 O VAL A 91 -0.027 14.292 3.459 1.00 0.00 O ATOM 886 CB VAL A 91 -1.183 15.408 0.973 1.00 0.00 C ATOM 887 CG1 VAL A 91 -0.102 14.960 0.003 1.00 0.00 C ATOM 888 CG2 VAL A 91 -2.306 16.115 0.235 1.00 0.00 C ATOM 0 H VAL A 91 -2.679 15.558 3.067 1.00 0.00 H new ATOM 0 HA VAL A 91 -2.122 13.484 1.067 1.00 0.00 H new ATOM 0 HB VAL A 91 -0.732 16.110 1.674 1.00 0.00 H new ATOM 0 HG11 VAL A 91 0.270 15.822 -0.551 1.00 0.00 H new ATOM 0 HG12 VAL A 91 0.718 14.504 0.557 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -0.518 14.233 -0.694 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -1.899 16.955 -0.328 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -2.787 15.417 -0.450 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -3.039 16.482 0.953 1.00 0.00 H new ATOM 890 N PRO A 92 -0.358 12.308 2.456 1.00 0.00 N ATOM 891 CA PRO A 92 0.679 11.612 3.223 1.00 0.00 C ATOM 892 C PRO A 92 2.087 12.029 2.810 1.00 0.00 C ATOM 893 O PRO A 92 2.295 12.588 1.731 1.00 0.00 O ATOM 894 CB PRO A 92 0.440 10.140 2.880 1.00 0.00 C ATOM 895 CG PRO A 92 -0.196 10.171 1.535 1.00 0.00 C ATOM 896 CD PRO A 92 -1.037 11.415 1.500 1.00 0.00 C ATOM 0 HA PRO A 92 0.617 11.836 4.288 1.00 0.00 H new ATOM 0 HB2 PRO A 92 1.374 9.579 2.865 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -0.207 9.661 3.615 1.00 0.00 H new ATOM 0 HG2 PRO A 92 0.558 10.188 0.748 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -0.807 9.283 1.372 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -1.073 11.848 0.500 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -2.066 11.214 1.798 1.00 0.00 H new ATOM 897 N ASP A 93 3.047 11.762 3.683 1.00 0.00 N ATOM 898 CA ASP A 93 4.438 12.093 3.417 1.00 0.00 C ATOM 899 C ASP A 93 5.096 10.981 2.624 1.00 0.00 C ATOM 900 O ASP A 93 4.866 9.799 2.890 1.00 0.00 O ATOM 901 CB ASP A 93 5.199 12.332 4.720 1.00 0.00 C ATOM 902 CG ASP A 93 5.069 13.757 5.213 1.00 0.00 C ATOM 903 OD1 ASP A 93 3.939 14.172 5.547 1.00 0.00 O ATOM 904 OD2 ASP A 93 6.095 14.472 5.259 1.00 0.00 O ATOM 0 H ASP A 93 2.886 11.315 4.586 1.00 0.00 H new ATOM 0 HA ASP A 93 4.466 13.012 2.831 1.00 0.00 H new ATOM 0 HB2 ASP A 93 4.826 11.651 5.485 1.00 0.00 H new ATOM 0 HB3 ASP A 93 6.253 12.097 4.570 1.00 0.00 H new ATOM 906 N SER A 94 5.910 11.366 1.660 1.00 0.00 N ATOM 907 CA SER A 94 6.599 10.416 0.801 1.00 0.00 C ATOM 908 C SER A 94 7.473 9.453 1.600 1.00 0.00 C ATOM 909 O SER A 94 7.522 8.263 1.297 1.00 0.00 O ATOM 910 CB SER A 94 7.427 11.168 -0.238 1.00 0.00 C ATOM 911 OG SER A 94 6.682 12.247 -0.784 1.00 0.00 O ATOM 0 H SER A 94 6.113 12.343 1.449 1.00 0.00 H new ATOM 0 HA SER A 94 5.847 9.812 0.293 1.00 0.00 H new ATOM 0 HB2 SER A 94 8.341 11.545 0.221 1.00 0.00 H new ATOM 0 HB3 SER A 94 7.728 10.487 -1.034 1.00 0.00 H new ATOM 0 HG SER A 94 5.783 11.937 -1.022 1.00 0.00 H new ATOM 914 N LYS A 95 8.147 9.968 2.627 1.00 0.00 N ATOM 915 CA LYS A 95 9.009 9.141 3.461 1.00 0.00 C ATOM 916 C LYS A 95 8.211 8.078 4.213 1.00 0.00 C ATOM 917 O LYS A 95 8.586 6.906 4.231 1.00 0.00 O ATOM 918 CB LYS A 95 9.814 9.995 4.447 1.00 0.00 C ATOM 919 CG LYS A 95 10.717 9.180 5.358 1.00 0.00 C ATOM 920 CD LYS A 95 11.686 10.058 6.129 1.00 0.00 C ATOM 921 CE LYS A 95 12.771 9.223 6.794 1.00 0.00 C ATOM 922 NZ LYS A 95 13.691 8.610 5.800 1.00 0.00 N ATOM 0 H LYS A 95 8.111 10.951 2.899 1.00 0.00 H new ATOM 0 HA LYS A 95 9.706 8.634 2.794 1.00 0.00 H new ATOM 0 HB2 LYS A 95 10.422 10.706 3.887 1.00 0.00 H new ATOM 0 HB3 LYS A 95 9.124 10.577 5.058 1.00 0.00 H new ATOM 0 HG2 LYS A 95 10.107 8.611 6.059 1.00 0.00 H new ATOM 0 HG3 LYS A 95 11.276 8.458 4.763 1.00 0.00 H new ATOM 0 HD2 LYS A 95 12.142 10.782 5.454 1.00 0.00 H new ATOM 0 HD3 LYS A 95 11.144 10.626 6.886 1.00 0.00 H new ATOM 0 HE2 LYS A 95 13.343 9.850 7.478 1.00 0.00 H new ATOM 0 HE3 LYS A 95 12.309 8.438 7.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 13.710 7.579 5.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 13.358 8.827 4.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 14.649 8.994 5.930 1.00 0.00 H new ATOM 927 N CYS A 96 7.104 8.493 4.821 1.00 0.00 N ATOM 928 CA CYS A 96 6.251 7.583 5.577 1.00 0.00 C ATOM 929 C CYS A 96 5.731 6.449 4.699 1.00 0.00 C ATOM 930 O CYS A 96 5.695 5.293 5.120 1.00 0.00 O ATOM 931 CB CYS A 96 5.091 8.350 6.210 1.00 0.00 C ATOM 932 SG CYS A 96 5.605 9.781 7.189 1.00 0.00 S ATOM 0 H CYS A 96 6.776 9.459 4.804 1.00 0.00 H new ATOM 0 HA CYS A 96 6.852 7.137 6.370 1.00 0.00 H new ATOM 0 HB2 CYS A 96 4.417 8.685 5.422 1.00 0.00 H new ATOM 0 HB3 CYS A 96 4.524 7.671 6.847 1.00 0.00 H new ATOM 0 HG CYS A 96 4.556 10.368 7.683 1.00 0.00 H new ATOM 935 N VAL A 97 5.341 6.782 3.476 1.00 0.00 N ATOM 936 CA VAL A 97 4.839 5.784 2.544 1.00 0.00 C ATOM 937 C VAL A 97 5.984 4.896 2.056 1.00 0.00 C ATOM 938 O VAL A 97 5.853 3.672 1.980 1.00 0.00 O ATOM 939 CB VAL A 97 4.138 6.439 1.333 1.00 0.00 C ATOM 940 CG1 VAL A 97 3.609 5.378 0.381 1.00 0.00 C ATOM 941 CG2 VAL A 97 3.006 7.348 1.791 1.00 0.00 C ATOM 0 H VAL A 97 5.363 7.733 3.108 1.00 0.00 H new ATOM 0 HA VAL A 97 4.105 5.177 3.074 1.00 0.00 H new ATOM 0 HB VAL A 97 4.874 7.044 0.804 1.00 0.00 H new ATOM 0 HG11 VAL A 97 3.119 5.860 -0.465 1.00 0.00 H new ATOM 0 HG12 VAL A 97 4.437 4.767 0.021 1.00 0.00 H new ATOM 0 HG13 VAL A 97 2.892 4.745 0.904 1.00 0.00 H new ATOM 0 HG21 VAL A 97 2.527 7.798 0.922 1.00 0.00 H new ATOM 0 HG22 VAL A 97 2.273 6.764 2.348 1.00 0.00 H new ATOM 0 HG23 VAL A 97 3.407 8.133 2.432 1.00 0.00 H new ATOM 943 N TYR A 98 7.113 5.524 1.747 1.00 0.00 N ATOM 944 CA TYR A 98 8.288 4.808 1.265 1.00 0.00 C ATOM 945 C TYR A 98 8.762 3.760 2.263 1.00 0.00 C ATOM 946 O TYR A 98 8.904 2.592 1.914 1.00 0.00 O ATOM 947 CB TYR A 98 9.426 5.778 0.942 1.00 0.00 C ATOM 948 CG TYR A 98 10.718 5.102 0.534 1.00 0.00 C ATOM 949 CD1 TYR A 98 10.823 4.433 -0.679 1.00 0.00 C ATOM 950 CD2 TYR A 98 11.835 5.135 1.361 1.00 0.00 C ATOM 951 CE1 TYR A 98 12.001 3.819 -1.056 1.00 0.00 C ATOM 952 CE2 TYR A 98 13.019 4.526 0.991 1.00 0.00 C ATOM 953 CZ TYR A 98 13.097 3.869 -0.219 1.00 0.00 C ATOM 954 OH TYR A 98 14.272 3.265 -0.597 1.00 0.00 O ATOM 0 H TYR A 98 7.239 6.533 1.822 1.00 0.00 H new ATOM 0 HA TYR A 98 7.994 4.292 0.351 1.00 0.00 H new ATOM 0 HB2 TYR A 98 9.106 6.442 0.139 1.00 0.00 H new ATOM 0 HB3 TYR A 98 9.615 6.403 1.815 1.00 0.00 H new ATOM 0 HD1 TYR A 98 9.969 4.392 -1.338 1.00 0.00 H new ATOM 0 HD2 TYR A 98 11.776 5.646 2.311 1.00 0.00 H new ATOM 0 HE1 TYR A 98 12.064 3.302 -2.002 1.00 0.00 H new ATOM 0 HE2 TYR A 98 13.878 4.564 1.645 1.00 0.00 H new ATOM 0 HH TYR A 98 14.946 3.393 0.103 1.00 0.00 H new ATOM 957 N THR A 99 8.982 4.175 3.506 1.00 0.00 N ATOM 958 CA THR A 99 9.454 3.261 4.536 1.00 0.00 C ATOM 959 C THR A 99 8.428 2.173 4.854 1.00 0.00 C ATOM 960 O THR A 99 8.787 1.095 5.330 1.00 0.00 O ATOM 961 CB THR A 99 9.905 3.988 5.827 1.00 0.00 C ATOM 962 OG1 THR A 99 10.565 3.056 6.697 1.00 0.00 O ATOM 963 CG2 THR A 99 8.723 4.607 6.557 1.00 0.00 C ATOM 0 H THR A 99 8.841 5.134 3.822 1.00 0.00 H new ATOM 0 HA THR A 99 10.337 2.778 4.117 1.00 0.00 H new ATOM 0 HB THR A 99 10.589 4.788 5.543 1.00 0.00 H new ATOM 0 HG1 THR A 99 10.852 3.517 7.513 1.00 0.00 H new ATOM 0 HG21 THR A 99 9.074 5.109 7.458 1.00 0.00 H new ATOM 0 HG22 THR A 99 8.232 5.331 5.906 1.00 0.00 H new ATOM 0 HG23 THR A 99 8.014 3.825 6.830 1.00 0.00 H new ATOM 966 N TYR A 100 7.157 2.450 4.579 1.00 0.00 N ATOM 967 CA TYR A 100 6.101 1.485 4.836 1.00 0.00 C ATOM 968 C TYR A 100 6.171 0.351 3.819 1.00 0.00 C ATOM 969 O TYR A 100 6.188 -0.825 4.182 1.00 0.00 O ATOM 970 CB TYR A 100 4.727 2.163 4.789 1.00 0.00 C ATOM 971 CG TYR A 100 3.600 1.325 5.350 1.00 0.00 C ATOM 972 CD1 TYR A 100 3.515 1.066 6.712 1.00 0.00 C ATOM 973 CD2 TYR A 100 2.621 0.794 4.520 1.00 0.00 C ATOM 974 CE1 TYR A 100 2.486 0.302 7.231 1.00 0.00 C ATOM 975 CE2 TYR A 100 1.589 0.029 5.030 1.00 0.00 C ATOM 976 CZ TYR A 100 1.527 -0.214 6.386 1.00 0.00 C ATOM 977 OH TYR A 100 0.502 -0.976 6.899 1.00 0.00 O ATOM 0 H TYR A 100 6.837 3.332 4.180 1.00 0.00 H new ATOM 0 HA TYR A 100 6.242 1.071 5.834 1.00 0.00 H new ATOM 0 HB2 TYR A 100 4.778 3.100 5.343 1.00 0.00 H new ATOM 0 HB3 TYR A 100 4.495 2.417 3.755 1.00 0.00 H new ATOM 0 HD1 TYR A 100 4.265 1.468 7.377 1.00 0.00 H new ATOM 0 HD2 TYR A 100 2.667 0.982 3.458 1.00 0.00 H new ATOM 0 HE1 TYR A 100 2.434 0.111 8.293 1.00 0.00 H new ATOM 0 HE2 TYR A 100 0.836 -0.376 4.371 1.00 0.00 H new ATOM 0 HH TYR A 100 -0.089 -1.262 6.171 1.00 0.00 H new ATOM 980 N ILE A 101 6.233 0.719 2.544 1.00 0.00 N ATOM 981 CA ILE A 101 6.308 -0.264 1.466 1.00 0.00 C ATOM 982 C ILE A 101 7.693 -0.916 1.434 1.00 0.00 C ATOM 983 O ILE A 101 7.846 -2.064 1.013 1.00 0.00 O ATOM 984 CB ILE A 101 6.013 0.382 0.092 1.00 0.00 C ATOM 985 CG1 ILE A 101 4.761 1.269 0.161 1.00 0.00 C ATOM 986 CG2 ILE A 101 5.853 -0.687 -0.983 1.00 0.00 C ATOM 987 CD1 ILE A 101 3.509 0.551 0.623 1.00 0.00 C ATOM 0 H ILE A 101 6.233 1.690 2.230 1.00 0.00 H new ATOM 0 HA ILE A 101 5.551 -1.024 1.662 1.00 0.00 H new ATOM 0 HB ILE A 101 6.862 1.012 -0.173 1.00 0.00 H new ATOM 0 HG12 ILE A 101 4.958 2.102 0.836 1.00 0.00 H new ATOM 0 HG13 ILE A 101 4.578 1.695 -0.825 1.00 0.00 H new ATOM 0 HG21 ILE A 101 5.646 -0.211 -1.941 1.00 0.00 H new ATOM 0 HG22 ILE A 101 6.772 -1.268 -1.058 1.00 0.00 H new ATOM 0 HG23 ILE A 101 5.026 -1.347 -0.720 1.00 0.00 H new ATOM 0 HD11 ILE A 101 2.674 1.251 0.642 1.00 0.00 H new ATOM 0 HD12 ILE A 101 3.283 -0.264 -0.064 1.00 0.00 H new ATOM 0 HD13 ILE A 101 3.668 0.149 1.623 1.00 0.00 H new ATOM 989 N GLN A 102 8.689 -0.169 1.900 1.00 0.00 N ATOM 990 CA GLN A 102 10.074 -0.630 1.952 1.00 0.00 C ATOM 991 C GLN A 102 10.190 -1.973 2.669 1.00 0.00 C ATOM 992 O GLN A 102 10.583 -2.978 2.070 1.00 0.00 O ATOM 993 CB GLN A 102 10.926 0.418 2.677 1.00 0.00 C ATOM 994 CG GLN A 102 12.396 0.072 2.815 1.00 0.00 C ATOM 995 CD GLN A 102 13.067 0.878 3.911 1.00 0.00 C ATOM 996 OE1 GLN A 102 13.513 2.003 3.690 1.00 0.00 O ATOM 997 NE2 GLN A 102 13.159 0.307 5.100 1.00 0.00 N ATOM 0 H GLN A 102 8.558 0.778 2.254 1.00 0.00 H new ATOM 0 HA GLN A 102 10.430 -0.765 0.931 1.00 0.00 H new ATOM 0 HB2 GLN A 102 10.841 1.365 2.143 1.00 0.00 H new ATOM 0 HB3 GLN A 102 10.511 0.575 3.673 1.00 0.00 H new ATOM 0 HG2 GLN A 102 12.500 -0.991 3.031 1.00 0.00 H new ATOM 0 HG3 GLN A 102 12.903 0.256 1.867 1.00 0.00 H new ATOM 0 HE21 GLN A 102 12.778 -0.628 5.248 1.00 0.00 H new ATOM 0 HE22 GLN A 102 13.611 0.801 5.869 1.00 0.00 H new ATOM 1001 N GLU A 103 9.823 -1.988 3.945 1.00 0.00 N ATOM 1002 CA GLU A 103 9.899 -3.203 4.742 1.00 0.00 C ATOM 1003 C GLU A 103 8.793 -4.185 4.371 1.00 0.00 C ATOM 1004 O GLU A 103 8.919 -5.387 4.600 1.00 0.00 O ATOM 1005 CB GLU A 103 9.886 -2.882 6.237 1.00 0.00 C ATOM 1006 CG GLU A 103 11.044 -3.502 7.010 1.00 0.00 C ATOM 1007 CD GLU A 103 12.383 -3.330 6.309 1.00 0.00 C ATOM 1008 OE1 GLU A 103 12.656 -2.225 5.802 1.00 0.00 O ATOM 1009 OE2 GLU A 103 13.165 -4.308 6.270 1.00 0.00 O ATOM 0 H GLU A 103 9.471 -1.173 4.448 1.00 0.00 H new ATOM 0 HA GLU A 103 10.849 -3.688 4.516 1.00 0.00 H new ATOM 0 HB2 GLU A 103 9.913 -1.800 6.367 1.00 0.00 H new ATOM 0 HB3 GLU A 103 8.947 -3.231 6.666 1.00 0.00 H new ATOM 0 HG2 GLU A 103 11.097 -3.049 8.000 1.00 0.00 H new ATOM 0 HG3 GLU A 103 10.850 -4.565 7.155 1.00 0.00 H new ATOM 1011 N LEU A 104 7.712 -3.670 3.791 1.00 0.00 N ATOM 1012 CA LEU A 104 6.605 -4.518 3.368 1.00 0.00 C ATOM 1013 C LEU A 104 7.092 -5.472 2.283 1.00 0.00 C ATOM 1014 O LEU A 104 6.720 -6.643 2.253 1.00 0.00 O ATOM 1015 CB LEU A 104 5.440 -3.673 2.845 1.00 0.00 C ATOM 1016 CG LEU A 104 4.206 -4.439 2.362 1.00 0.00 C ATOM 1017 CD1 LEU A 104 3.519 -5.151 3.519 1.00 0.00 C ATOM 1018 CD2 LEU A 104 3.241 -3.507 1.649 1.00 0.00 C ATOM 0 H LEU A 104 7.581 -2.676 3.605 1.00 0.00 H new ATOM 0 HA LEU A 104 6.247 -5.089 4.225 1.00 0.00 H new ATOM 0 HB2 LEU A 104 5.130 -2.991 3.637 1.00 0.00 H new ATOM 0 HB3 LEU A 104 5.806 -3.060 2.021 1.00 0.00 H new ATOM 0 HG LEU A 104 4.535 -5.197 1.651 1.00 0.00 H new ATOM 0 HD11 LEU A 104 2.645 -5.688 3.149 1.00 0.00 H new ATOM 0 HD12 LEU A 104 4.213 -5.858 3.975 1.00 0.00 H new ATOM 0 HD13 LEU A 104 3.206 -4.418 4.263 1.00 0.00 H new ATOM 0 HD21 LEU A 104 2.371 -4.071 1.314 1.00 0.00 H new ATOM 0 HD22 LEU A 104 2.922 -2.721 2.333 1.00 0.00 H new ATOM 0 HD23 LEU A 104 3.737 -3.059 0.788 1.00 0.00 H new ATOM 1020 N TYR A 105 7.951 -4.960 1.407 1.00 0.00 N ATOM 1021 CA TYR A 105 8.519 -5.754 0.326 1.00 0.00 C ATOM 1022 C TYR A 105 9.331 -6.920 0.894 1.00 0.00 C ATOM 1023 O TYR A 105 9.393 -7.998 0.302 1.00 0.00 O ATOM 1024 CB TYR A 105 9.393 -4.871 -0.571 1.00 0.00 C ATOM 1025 CG TYR A 105 9.714 -5.470 -1.922 1.00 0.00 C ATOM 1026 CD1 TYR A 105 8.727 -6.072 -2.692 1.00 0.00 C ATOM 1027 CD2 TYR A 105 11.006 -5.426 -2.430 1.00 0.00 C ATOM 1028 CE1 TYR A 105 9.018 -6.611 -3.931 1.00 0.00 C ATOM 1029 CE2 TYR A 105 11.306 -5.963 -3.667 1.00 0.00 C ATOM 1030 CZ TYR A 105 10.309 -6.554 -4.415 1.00 0.00 C ATOM 1031 OH TYR A 105 10.602 -7.088 -5.649 1.00 0.00 O ATOM 0 H TYR A 105 8.270 -3.991 1.427 1.00 0.00 H new ATOM 0 HA TYR A 105 7.708 -6.164 -0.276 1.00 0.00 H new ATOM 0 HB2 TYR A 105 8.888 -3.917 -0.722 1.00 0.00 H new ATOM 0 HB3 TYR A 105 10.327 -4.659 -0.051 1.00 0.00 H new ATOM 0 HD1 TYR A 105 7.716 -6.120 -2.316 1.00 0.00 H new ATOM 0 HD2 TYR A 105 11.790 -4.964 -1.848 1.00 0.00 H new ATOM 0 HE1 TYR A 105 8.239 -7.075 -4.518 1.00 0.00 H new ATOM 0 HE2 TYR A 105 12.316 -5.920 -4.047 1.00 0.00 H new ATOM 0 HH TYR A 105 11.555 -6.964 -5.841 1.00 0.00 H new ATOM 1034 N ARG A 106 9.919 -6.703 2.068 1.00 0.00 N ATOM 1035 CA ARG A 106 10.718 -7.724 2.739 1.00 0.00 C ATOM 1036 C ARG A 106 9.821 -8.860 3.216 1.00 0.00 C ATOM 1037 O ARG A 106 10.273 -9.981 3.451 1.00 0.00 O ATOM 1038 CB ARG A 106 11.456 -7.108 3.929 1.00 0.00 C ATOM 1039 CG ARG A 106 12.493 -8.012 4.571 1.00 0.00 C ATOM 1040 CD ARG A 106 13.195 -7.304 5.712 1.00 0.00 C ATOM 1041 NE ARG A 106 14.535 -7.831 5.951 1.00 0.00 N ATOM 1042 CZ ARG A 106 15.584 -7.075 6.269 1.00 0.00 C ATOM 1043 NH1 ARG A 106 15.453 -5.753 6.361 1.00 0.00 N ATOM 1044 NH2 ARG A 106 16.762 -7.635 6.507 1.00 0.00 N ATOM 0 H ARG A 106 9.856 -5.822 2.577 1.00 0.00 H new ATOM 0 HA ARG A 106 11.448 -8.122 2.034 1.00 0.00 H new ATOM 0 HB2 ARG A 106 11.947 -6.192 3.600 1.00 0.00 H new ATOM 0 HB3 ARG A 106 10.724 -6.824 4.685 1.00 0.00 H new ATOM 0 HG2 ARG A 106 12.013 -8.918 4.940 1.00 0.00 H new ATOM 0 HG3 ARG A 106 13.224 -8.321 3.824 1.00 0.00 H new ATOM 0 HD2 ARG A 106 13.260 -6.239 5.490 1.00 0.00 H new ATOM 0 HD3 ARG A 106 12.600 -7.405 6.620 1.00 0.00 H new ATOM 0 HE ARG A 106 14.676 -8.838 5.870 1.00 0.00 H new ATOM 0 HH11 ARG A 106 14.547 -5.317 6.188 1.00 0.00 H new ATOM 0 HH12 ARG A 106 16.258 -5.176 6.605 1.00 0.00 H new ATOM 0 HH21 ARG A 106 16.867 -8.648 6.447 1.00 0.00 H new ATOM 0 HH22 ARG A 106 17.564 -7.053 6.750 1.00 0.00 H new ATOM 1051 N SER A 107 8.539 -8.562 3.356 1.00 0.00 N ATOM 1052 CA SER A 107 7.573 -9.552 3.794 1.00 0.00 C ATOM 1053 C SER A 107 6.906 -10.210 2.590 1.00 0.00 C ATOM 1054 O SER A 107 6.068 -11.098 2.735 1.00 0.00 O ATOM 1055 CB SER A 107 6.527 -8.897 4.696 1.00 0.00 C ATOM 1056 OG SER A 107 7.152 -8.060 5.654 1.00 0.00 O ATOM 0 H SER A 107 8.144 -7.640 3.172 1.00 0.00 H new ATOM 0 HA SER A 107 8.091 -10.324 4.363 1.00 0.00 H new ATOM 0 HB2 SER A 107 5.832 -8.313 4.092 1.00 0.00 H new ATOM 0 HB3 SER A 107 5.942 -9.665 5.202 1.00 0.00 H new ATOM 0 HG SER A 107 6.469 -7.647 6.223 1.00 0.00 H new ATOM 1059 N LEU A 108 7.295 -9.772 1.398 1.00 0.00 N ATOM 1060 CA LEU A 108 6.738 -10.304 0.162 1.00 0.00 C ATOM 1061 C LEU A 108 7.751 -11.187 -0.559 1.00 0.00 C ATOM 1062 O LEU A 108 7.400 -12.242 -1.096 1.00 0.00 O ATOM 1063 CB LEU A 108 6.295 -9.161 -0.754 1.00 0.00 C ATOM 1064 CG LEU A 108 5.319 -8.149 -0.145 1.00 0.00 C ATOM 1065 CD1 LEU A 108 5.158 -6.949 -1.063 1.00 0.00 C ATOM 1066 CD2 LEU A 108 3.973 -8.798 0.137 1.00 0.00 C ATOM 0 H LEU A 108 7.998 -9.046 1.262 1.00 0.00 H new ATOM 0 HA LEU A 108 5.871 -10.914 0.417 1.00 0.00 H new ATOM 0 HB2 LEU A 108 7.183 -8.624 -1.086 1.00 0.00 H new ATOM 0 HB3 LEU A 108 5.832 -9.592 -1.642 1.00 0.00 H new ATOM 0 HG LEU A 108 5.730 -7.803 0.803 1.00 0.00 H new ATOM 0 HD11 LEU A 108 4.462 -6.240 -0.616 1.00 0.00 H new ATOM 0 HD12 LEU A 108 6.125 -6.467 -1.205 1.00 0.00 H new ATOM 0 HD13 LEU A 108 4.771 -7.278 -2.028 1.00 0.00 H new ATOM 0 HD21 LEU A 108 3.297 -8.060 0.569 1.00 0.00 H new ATOM 0 HD22 LEU A 108 3.550 -9.177 -0.793 1.00 0.00 H new ATOM 0 HD23 LEU A 108 4.106 -9.622 0.838 1.00 0.00 H new ATOM 1068 N VAL A 109 9.009 -10.750 -0.569 1.00 0.00 N ATOM 1069 CA VAL A 109 10.082 -11.503 -1.221 1.00 0.00 C ATOM 1070 C VAL A 109 10.230 -12.880 -0.582 1.00 0.00 C ATOM 1071 O VAL A 109 10.355 -13.885 -1.277 1.00 0.00 O ATOM 1072 CB VAL A 109 11.436 -10.756 -1.151 1.00 0.00 C ATOM 1073 CG1 VAL A 109 12.548 -11.580 -1.789 1.00 0.00 C ATOM 1074 CG2 VAL A 109 11.336 -9.396 -1.827 1.00 0.00 C ATOM 0 H VAL A 109 9.312 -9.879 -0.133 1.00 0.00 H new ATOM 0 HA VAL A 109 9.807 -11.612 -2.270 1.00 0.00 H new ATOM 0 HB VAL A 109 11.680 -10.606 -0.099 1.00 0.00 H new ATOM 0 HG11 VAL A 109 13.488 -11.032 -1.726 1.00 0.00 H new ATOM 0 HG12 VAL A 109 12.645 -12.529 -1.262 1.00 0.00 H new ATOM 0 HG13 VAL A 109 12.307 -11.768 -2.835 1.00 0.00 H new ATOM 0 HG21 VAL A 109 12.298 -8.888 -1.766 1.00 0.00 H new ATOM 0 HG22 VAL A 109 11.061 -9.529 -2.873 1.00 0.00 H new ATOM 0 HG23 VAL A 109 10.577 -8.796 -1.326 1.00 0.00 H new ATOM 1076 N GLN A 110 10.177 -12.910 0.745 1.00 0.00 N ATOM 1077 CA GLN A 110 10.305 -14.153 1.503 1.00 0.00 C ATOM 1078 C GLN A 110 9.214 -15.164 1.144 1.00 0.00 C ATOM 1079 O GLN A 110 9.439 -16.374 1.185 1.00 0.00 O ATOM 1080 CB GLN A 110 10.278 -13.863 3.006 1.00 0.00 C ATOM 1081 CG GLN A 110 9.053 -13.085 3.460 1.00 0.00 C ATOM 1082 CD GLN A 110 8.933 -13.002 4.966 1.00 0.00 C ATOM 1083 OE1 GLN A 110 8.303 -13.850 5.599 1.00 0.00 O ATOM 1084 NE2 GLN A 110 9.529 -11.975 5.548 1.00 0.00 N ATOM 0 H GLN A 110 10.045 -12.081 1.324 1.00 0.00 H new ATOM 0 HA GLN A 110 11.264 -14.597 1.235 1.00 0.00 H new ATOM 0 HB2 GLN A 110 10.319 -14.807 3.549 1.00 0.00 H new ATOM 0 HB3 GLN A 110 11.173 -13.302 3.274 1.00 0.00 H new ATOM 0 HG2 GLN A 110 9.096 -12.077 3.048 1.00 0.00 H new ATOM 0 HG3 GLN A 110 8.158 -13.557 3.055 1.00 0.00 H new ATOM 0 HE21 GLN A 110 10.041 -11.296 4.985 1.00 0.00 H new ATOM 0 HE22 GLN A 110 9.477 -11.862 6.560 1.00 0.00 H new ATOM 1088 N LYS A 111 8.035 -14.667 0.780 1.00 0.00 N ATOM 1089 CA LYS A 111 6.915 -15.536 0.426 1.00 0.00 C ATOM 1090 C LYS A 111 7.047 -16.036 -1.008 1.00 0.00 C ATOM 1091 O LYS A 111 6.276 -16.882 -1.456 1.00 0.00 O ATOM 1092 CB LYS A 111 5.576 -14.807 0.592 1.00 0.00 C ATOM 1093 CG LYS A 111 5.435 -13.984 1.865 1.00 0.00 C ATOM 1094 CD LYS A 111 5.590 -14.830 3.120 1.00 0.00 C ATOM 1095 CE LYS A 111 5.153 -14.059 4.357 1.00 0.00 C ATOM 1096 NZ LYS A 111 5.629 -14.699 5.614 1.00 0.00 N ATOM 0 H LYS A 111 7.830 -13.669 0.722 1.00 0.00 H new ATOM 0 HA LYS A 111 6.938 -16.389 1.104 1.00 0.00 H new ATOM 0 HB2 LYS A 111 5.431 -14.148 -0.264 1.00 0.00 H new ATOM 0 HB3 LYS A 111 4.774 -15.545 0.566 1.00 0.00 H new ATOM 0 HG2 LYS A 111 6.185 -13.193 1.868 1.00 0.00 H new ATOM 0 HG3 LYS A 111 4.459 -13.499 1.875 1.00 0.00 H new ATOM 0 HD2 LYS A 111 4.996 -15.739 3.025 1.00 0.00 H new ATOM 0 HD3 LYS A 111 6.630 -15.139 3.228 1.00 0.00 H new ATOM 0 HE2 LYS A 111 5.536 -13.040 4.302 1.00 0.00 H new ATOM 0 HE3 LYS A 111 4.065 -13.990 4.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 5.032 -14.391 6.408 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 5.574 -15.733 5.520 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 6.615 -14.420 5.794 1.00 0.00 H new ATOM 1101 N GLY A 112 8.024 -15.498 -1.729 1.00 0.00 N ATOM 1102 CA GLY A 112 8.243 -15.894 -3.107 1.00 0.00 C ATOM 1103 C GLY A 112 7.151 -15.399 -4.037 1.00 0.00 C ATOM 1104 O GLY A 112 6.945 -15.955 -5.114 1.00 0.00 O ATOM 0 H GLY A 112 8.671 -14.791 -1.381 1.00 0.00 H new ATOM 0 HA2 GLY A 112 9.205 -15.507 -3.444 1.00 0.00 H new ATOM 0 HA3 GLY A 112 8.299 -16.981 -3.164 1.00 0.00 H new ATOM 1106 N LEU A 113 6.454 -14.350 -3.618 1.00 0.00 N ATOM 1107 CA LEU A 113 5.377 -13.776 -4.417 1.00 0.00 C ATOM 1108 C LEU A 113 5.939 -13.123 -5.673 1.00 0.00 C ATOM 1109 O LEU A 113 5.341 -13.195 -6.748 1.00 0.00 O ATOM 1110 CB LEU A 113 4.590 -12.751 -3.595 1.00 0.00 C ATOM 1111 CG LEU A 113 3.948 -13.273 -2.306 1.00 0.00 C ATOM 1112 CD1 LEU A 113 3.250 -12.144 -1.561 1.00 0.00 C ATOM 1113 CD2 LEU A 113 2.969 -14.401 -2.609 1.00 0.00 C ATOM 0 H LEU A 113 6.615 -13.878 -2.728 1.00 0.00 H new ATOM 0 HA LEU A 113 4.701 -14.578 -4.713 1.00 0.00 H new ATOM 0 HB2 LEU A 113 5.260 -11.931 -3.337 1.00 0.00 H new ATOM 0 HB3 LEU A 113 3.804 -12.335 -4.226 1.00 0.00 H new ATOM 0 HG LEU A 113 4.738 -13.670 -1.668 1.00 0.00 H new ATOM 0 HD11 LEU A 113 2.800 -12.534 -0.648 1.00 0.00 H new ATOM 0 HD12 LEU A 113 3.976 -11.372 -1.306 1.00 0.00 H new ATOM 0 HD13 LEU A 113 2.473 -11.716 -2.194 1.00 0.00 H new ATOM 0 HD21 LEU A 113 2.525 -14.757 -1.679 1.00 0.00 H new ATOM 0 HD22 LEU A 113 2.183 -14.033 -3.269 1.00 0.00 H new ATOM 0 HD23 LEU A 113 3.498 -15.221 -3.095 1.00 0.00 H new ATOM 1186 N GLU B 82 35.185 7.204 7.610 1.00 0.00 N ATOM 1187 CA GLU B 82 33.891 6.474 7.589 1.00 0.00 C ATOM 1188 C GLU B 82 32.764 7.353 7.044 1.00 0.00 C ATOM 1189 O GLU B 82 31.854 6.869 6.367 1.00 0.00 O ATOM 1190 CB GLU B 82 33.533 5.985 8.994 1.00 0.00 C ATOM 1191 CG GLU B 82 32.327 5.059 9.046 1.00 0.00 C ATOM 1192 CD GLU B 82 31.685 5.015 10.415 1.00 0.00 C ATOM 1193 OE1 GLU B 82 32.385 4.689 11.393 1.00 0.00 O ATOM 1194 OE2 GLU B 82 30.475 5.310 10.518 1.00 0.00 O ATOM 0 HA GLU B 82 34.006 5.616 6.927 1.00 0.00 H new ATOM 0 HB2 GLU B 82 34.394 5.466 9.416 1.00 0.00 H new ATOM 0 HB3 GLU B 82 33.340 6.850 9.629 1.00 0.00 H new ATOM 0 HG2 GLU B 82 31.590 5.388 8.314 1.00 0.00 H new ATOM 0 HG3 GLU B 82 32.634 4.053 8.760 1.00 0.00 H new ATOM 1198 N GLU B 83 32.839 8.647 7.333 1.00 0.00 N ATOM 1199 CA GLU B 83 31.832 9.617 6.909 1.00 0.00 C ATOM 1200 C GLU B 83 31.590 9.576 5.400 1.00 0.00 C ATOM 1201 O GLU B 83 30.443 9.533 4.952 1.00 0.00 O ATOM 1202 CB GLU B 83 32.238 11.033 7.340 1.00 0.00 C ATOM 1203 CG GLU B 83 32.310 11.250 8.851 1.00 0.00 C ATOM 1204 CD GLU B 83 33.484 10.548 9.513 1.00 0.00 C ATOM 1205 OE1 GLU B 83 34.437 10.151 8.804 1.00 0.00 O ATOM 1206 OE2 GLU B 83 33.461 10.385 10.748 1.00 0.00 O ATOM 0 H GLU B 83 33.603 9.056 7.871 1.00 0.00 H new ATOM 0 HA GLU B 83 30.897 9.344 7.398 1.00 0.00 H new ATOM 0 HB2 GLU B 83 33.212 11.263 6.908 1.00 0.00 H new ATOM 0 HB3 GLU B 83 31.526 11.743 6.919 1.00 0.00 H new ATOM 0 HG2 GLU B 83 32.376 12.319 9.053 1.00 0.00 H new ATOM 0 HG3 GLU B 83 31.384 10.897 9.305 1.00 0.00 H new ATOM 1208 N GLU B 84 32.669 9.570 4.624 1.00 0.00 N ATOM 1209 CA GLU B 84 32.566 9.535 3.171 1.00 0.00 C ATOM 1210 C GLU B 84 31.867 8.261 2.708 1.00 0.00 C ATOM 1211 O GLU B 84 31.035 8.297 1.805 1.00 0.00 O ATOM 1212 CB GLU B 84 33.944 9.660 2.519 1.00 0.00 C ATOM 1213 CG GLU B 84 33.891 9.939 1.027 1.00 0.00 C ATOM 1214 CD GLU B 84 35.165 10.561 0.508 1.00 0.00 C ATOM 1215 OE1 GLU B 84 35.365 11.777 0.716 1.00 0.00 O ATOM 1216 OE2 GLU B 84 35.976 9.840 -0.104 1.00 0.00 O ATOM 0 H GLU B 84 33.625 9.589 4.978 1.00 0.00 H new ATOM 0 HA GLU B 84 31.965 10.389 2.858 1.00 0.00 H new ATOM 0 HB2 GLU B 84 34.497 10.461 3.010 1.00 0.00 H new ATOM 0 HB3 GLU B 84 34.501 8.738 2.688 1.00 0.00 H new ATOM 0 HG2 GLU B 84 33.702 9.008 0.493 1.00 0.00 H new ATOM 0 HG3 GLU B 84 33.054 10.604 0.815 1.00 0.00 H new ATOM 1218 N ILE B 85 32.201 7.142 3.342 1.00 0.00 N ATOM 1219 CA ILE B 85 31.591 5.860 3.005 1.00 0.00 C ATOM 1220 C ILE B 85 30.084 5.919 3.248 1.00 0.00 C ATOM 1221 O ILE B 85 29.290 5.509 2.401 1.00 0.00 O ATOM 1222 CB ILE B 85 32.197 4.704 3.832 1.00 0.00 C ATOM 1223 CG1 ILE B 85 33.712 4.633 3.626 1.00 0.00 C ATOM 1224 CG2 ILE B 85 31.550 3.376 3.461 1.00 0.00 C ATOM 1225 CD1 ILE B 85 34.418 3.693 4.580 1.00 0.00 C ATOM 0 H ILE B 85 32.891 7.096 4.092 1.00 0.00 H new ATOM 0 HA ILE B 85 31.792 5.667 1.951 1.00 0.00 H new ATOM 0 HB ILE B 85 31.998 4.900 4.885 1.00 0.00 H new ATOM 0 HG12 ILE B 85 33.915 4.317 2.603 1.00 0.00 H new ATOM 0 HG13 ILE B 85 34.131 5.633 3.740 1.00 0.00 H new ATOM 0 HG21 ILE B 85 31.992 2.577 4.056 1.00 0.00 H new ATOM 0 HG22 ILE B 85 30.479 3.425 3.659 1.00 0.00 H new ATOM 0 HG23 ILE B 85 31.715 3.174 2.403 1.00 0.00 H new ATOM 0 HD11 ILE B 85 35.488 3.698 4.371 1.00 0.00 H new ATOM 0 HD12 ILE B 85 34.247 4.020 5.606 1.00 0.00 H new ATOM 0 HD13 ILE B 85 34.028 2.683 4.451 1.00 0.00 H new ATOM 1227 N ARG B 86 29.703 6.463 4.400 1.00 0.00 N ATOM 1228 CA ARG B 86 28.298 6.591 4.765 1.00 0.00 C ATOM 1229 C ARG B 86 27.570 7.522 3.801 1.00 0.00 C ATOM 1230 O ARG B 86 26.436 7.255 3.395 1.00 0.00 O ATOM 1231 CB ARG B 86 28.160 7.108 6.199 1.00 0.00 C ATOM 1232 CG ARG B 86 28.819 6.223 7.245 1.00 0.00 C ATOM 1233 CD ARG B 86 28.604 6.766 8.646 1.00 0.00 C ATOM 1234 NE ARG B 86 27.227 6.591 9.094 1.00 0.00 N ATOM 1235 CZ ARG B 86 26.852 5.757 10.066 1.00 0.00 C ATOM 1236 NH1 ARG B 86 27.759 5.042 10.729 1.00 0.00 N ATOM 1237 NH2 ARG B 86 25.570 5.661 10.395 1.00 0.00 N ATOM 0 H ARG B 86 30.352 6.824 5.099 1.00 0.00 H new ATOM 0 HA ARG B 86 27.842 5.603 4.703 1.00 0.00 H new ATOM 0 HB2 ARG B 86 28.595 8.106 6.257 1.00 0.00 H new ATOM 0 HB3 ARG B 86 27.101 7.207 6.438 1.00 0.00 H new ATOM 0 HG2 ARG B 86 28.413 5.214 7.178 1.00 0.00 H new ATOM 0 HG3 ARG B 86 29.887 6.150 7.041 1.00 0.00 H new ATOM 0 HD2 ARG B 86 29.278 6.261 9.338 1.00 0.00 H new ATOM 0 HD3 ARG B 86 28.861 7.825 8.668 1.00 0.00 H new ATOM 0 HE ARG B 86 26.503 7.143 8.634 1.00 0.00 H new ATOM 0 HH11 ARG B 86 28.748 5.130 10.495 1.00 0.00 H new ATOM 0 HH12 ARG B 86 27.465 4.407 11.471 1.00 0.00 H new ATOM 0 HH21 ARG B 86 24.874 6.224 9.905 1.00 0.00 H new ATOM 0 HH22 ARG B 86 25.280 5.024 11.137 1.00 0.00 H new ATOM 1244 N GLU B 87 28.232 8.611 3.427 1.00 0.00 N ATOM 1245 CA GLU B 87 27.655 9.580 2.506 1.00 0.00 C ATOM 1246 C GLU B 87 27.473 8.961 1.125 1.00 0.00 C ATOM 1247 O GLU B 87 26.477 9.217 0.450 1.00 0.00 O ATOM 1248 CB GLU B 87 28.529 10.832 2.418 1.00 0.00 C ATOM 1249 CG GLU B 87 28.005 11.881 1.453 1.00 0.00 C ATOM 1250 CD GLU B 87 27.908 13.254 2.079 1.00 0.00 C ATOM 1251 OE1 GLU B 87 26.910 13.523 2.782 1.00 0.00 O ATOM 1252 OE2 GLU B 87 28.824 14.074 1.861 1.00 0.00 O ATOM 0 H GLU B 87 29.171 8.844 3.749 1.00 0.00 H new ATOM 0 HA GLU B 87 26.677 9.872 2.888 1.00 0.00 H new ATOM 0 HB2 GLU B 87 28.613 11.275 3.410 1.00 0.00 H new ATOM 0 HB3 GLU B 87 29.534 10.541 2.112 1.00 0.00 H new ATOM 0 HG2 GLU B 87 28.660 11.928 0.583 1.00 0.00 H new ATOM 0 HG3 GLU B 87 27.021 11.579 1.094 1.00 0.00 H new ATOM 1254 N ALA B 88 28.438 8.138 0.717 1.00 0.00 N ATOM 1255 CA ALA B 88 28.386 7.465 -0.578 1.00 0.00 C ATOM 1256 C ALA B 88 27.143 6.590 -0.675 1.00 0.00 C ATOM 1257 O ALA B 88 26.468 6.561 -1.703 1.00 0.00 O ATOM 1258 CB ALA B 88 29.641 6.633 -0.808 1.00 0.00 C ATOM 0 H ALA B 88 29.268 7.921 1.268 1.00 0.00 H new ATOM 0 HA ALA B 88 28.336 8.228 -1.355 1.00 0.00 H new ATOM 0 HB1 ALA B 88 29.579 6.141 -1.779 1.00 0.00 H new ATOM 0 HB2 ALA B 88 30.517 7.282 -0.785 1.00 0.00 H new ATOM 0 HB3 ALA B 88 29.727 5.880 -0.025 1.00 0.00 H new ATOM 1260 N PHE B 89 26.836 5.891 0.412 1.00 0.00 N ATOM 1261 CA PHE B 89 25.664 5.031 0.456 1.00 0.00 C ATOM 1262 C PHE B 89 24.393 5.871 0.402 1.00 0.00 C ATOM 1263 O PHE B 89 23.387 5.463 -0.175 1.00 0.00 O ATOM 1264 CB PHE B 89 25.669 4.175 1.723 1.00 0.00 C ATOM 1265 CG PHE B 89 26.465 2.908 1.604 1.00 0.00 C ATOM 1266 CD1 PHE B 89 25.977 1.836 0.878 1.00 0.00 C ATOM 1267 CD2 PHE B 89 27.697 2.787 2.223 1.00 0.00 C ATOM 1268 CE1 PHE B 89 26.705 0.666 0.770 1.00 0.00 C ATOM 1269 CE2 PHE B 89 28.431 1.620 2.121 1.00 0.00 C ATOM 1270 CZ PHE B 89 27.934 0.558 1.392 1.00 0.00 C ATOM 0 H PHE B 89 27.383 5.904 1.273 1.00 0.00 H new ATOM 0 HA PHE B 89 25.692 4.370 -0.410 1.00 0.00 H new ATOM 0 HB2 PHE B 89 26.069 4.767 2.547 1.00 0.00 H new ATOM 0 HB3 PHE B 89 24.641 3.922 1.982 1.00 0.00 H new ATOM 0 HD1 PHE B 89 25.017 1.914 0.390 1.00 0.00 H new ATOM 0 HD2 PHE B 89 28.090 3.615 2.793 1.00 0.00 H new ATOM 0 HE1 PHE B 89 26.313 -0.163 0.200 1.00 0.00 H new ATOM 0 HE2 PHE B 89 29.390 1.539 2.610 1.00 0.00 H new ATOM 0 HZ PHE B 89 28.505 -0.355 1.308 1.00 0.00 H new ATOM 1272 N ARG B 90 24.463 7.061 0.990 1.00 0.00 N ATOM 1273 CA ARG B 90 23.329 7.978 1.012 1.00 0.00 C ATOM 1274 C ARG B 90 23.041 8.533 -0.381 1.00 0.00 C ATOM 1275 O ARG B 90 21.929 8.968 -0.663 1.00 0.00 O ATOM 1276 CB ARG B 90 23.569 9.120 2.003 1.00 0.00 C ATOM 1277 CG ARG B 90 22.333 9.954 2.297 1.00 0.00 C ATOM 1278 CD ARG B 90 22.649 11.092 3.250 1.00 0.00 C ATOM 1279 NE ARG B 90 21.476 11.922 3.509 1.00 0.00 N ATOM 1280 CZ ARG B 90 21.488 13.015 4.272 1.00 0.00 C ATOM 1281 NH1 ARG B 90 22.610 13.411 4.862 1.00 0.00 N ATOM 1282 NH2 ARG B 90 20.372 13.706 4.445 1.00 0.00 N ATOM 0 H ARG B 90 25.297 7.414 1.459 1.00 0.00 H new ATOM 0 HA ARG B 90 22.455 7.415 1.340 1.00 0.00 H new ATOM 0 HB2 ARG B 90 23.944 8.703 2.938 1.00 0.00 H new ATOM 0 HB3 ARG B 90 24.349 9.771 1.609 1.00 0.00 H new ATOM 0 HG2 ARG B 90 21.934 10.357 1.366 1.00 0.00 H new ATOM 0 HG3 ARG B 90 21.558 9.320 2.728 1.00 0.00 H new ATOM 0 HD2 ARG B 90 23.022 10.686 4.190 1.00 0.00 H new ATOM 0 HD3 ARG B 90 23.445 11.708 2.830 1.00 0.00 H new ATOM 0 HE ARG B 90 20.592 11.648 3.079 1.00 0.00 H new ATOM 0 HH11 ARG B 90 23.470 12.878 4.733 1.00 0.00 H new ATOM 0 HH12 ARG B 90 22.612 14.248 5.444 1.00 0.00 H new ATOM 0 HH21 ARG B 90 19.509 13.401 3.995 1.00 0.00 H new ATOM 0 HH22 ARG B 90 20.376 14.543 5.028 1.00 0.00 H new ATOM 1289 N VAL B 91 24.046 8.517 -1.248 1.00 0.00 N ATOM 1290 CA VAL B 91 23.878 9.008 -2.612 1.00 0.00 C ATOM 1291 C VAL B 91 22.916 8.099 -3.373 1.00 0.00 C ATOM 1292 O VAL B 91 22.112 8.557 -4.186 1.00 0.00 O ATOM 1293 CB VAL B 91 25.228 9.073 -3.366 1.00 0.00 C ATOM 1294 CG1 VAL B 91 25.046 9.612 -4.776 1.00 0.00 C ATOM 1295 CG2 VAL B 91 26.235 9.920 -2.603 1.00 0.00 C ATOM 0 H VAL B 91 24.981 8.172 -1.034 1.00 0.00 H new ATOM 0 HA VAL B 91 23.472 10.018 -2.554 1.00 0.00 H new ATOM 0 HB VAL B 91 25.614 8.056 -3.438 1.00 0.00 H new ATOM 0 HG11 VAL B 91 26.012 9.646 -5.280 1.00 0.00 H new ATOM 0 HG12 VAL B 91 24.370 8.961 -5.330 1.00 0.00 H new ATOM 0 HG13 VAL B 91 24.625 10.617 -4.730 1.00 0.00 H new ATOM 0 HG21 VAL B 91 27.176 9.950 -3.153 1.00 0.00 H new ATOM 0 HG22 VAL B 91 25.848 10.933 -2.490 1.00 0.00 H new ATOM 0 HG23 VAL B 91 26.404 9.485 -1.618 1.00 0.00 H new ATOM 1297 N PHE B 92 22.987 6.808 -3.071 1.00 0.00 N ATOM 1298 CA PHE B 92 22.134 5.820 -3.711 1.00 0.00 C ATOM 1299 C PHE B 92 20.739 5.822 -3.089 1.00 0.00 C ATOM 1300 O PHE B 92 19.796 5.257 -3.648 1.00 0.00 O ATOM 1301 CB PHE B 92 22.767 4.427 -3.636 1.00 0.00 C ATOM 1302 CG PHE B 92 23.912 4.225 -4.595 1.00 0.00 C ATOM 1303 CD1 PHE B 92 25.138 4.832 -4.375 1.00 0.00 C ATOM 1304 CD2 PHE B 92 23.759 3.426 -5.718 1.00 0.00 C ATOM 1305 CE1 PHE B 92 26.190 4.649 -5.255 1.00 0.00 C ATOM 1306 CE2 PHE B 92 24.806 3.240 -6.601 1.00 0.00 C ATOM 1307 CZ PHE B 92 26.024 3.851 -6.370 1.00 0.00 C ATOM 0 H PHE B 92 23.632 6.421 -2.382 1.00 0.00 H new ATOM 0 HA PHE B 92 22.032 6.088 -4.763 1.00 0.00 H new ATOM 0 HB2 PHE B 92 23.122 4.254 -2.620 1.00 0.00 H new ATOM 0 HB3 PHE B 92 22.000 3.679 -3.838 1.00 0.00 H new ATOM 0 HD1 PHE B 92 25.274 5.457 -3.505 1.00 0.00 H new ATOM 0 HD2 PHE B 92 22.811 2.944 -5.905 1.00 0.00 H new ATOM 0 HE1 PHE B 92 27.139 5.129 -5.070 1.00 0.00 H new ATOM 0 HE2 PHE B 92 24.672 2.616 -7.473 1.00 0.00 H new ATOM 0 HZ PHE B 92 26.843 3.705 -7.059 1.00 0.00 H new ATOM 1309 N ASP B 93 20.615 6.470 -1.934 1.00 0.00 N ATOM 1310 CA ASP B 93 19.334 6.565 -1.239 1.00 0.00 C ATOM 1311 C ASP B 93 18.536 7.721 -1.833 1.00 0.00 C ATOM 1312 O ASP B 93 19.090 8.781 -2.127 1.00 0.00 O ATOM 1313 CB ASP B 93 19.557 6.785 0.264 1.00 0.00 C ATOM 1314 CG ASP B 93 18.328 6.484 1.108 1.00 0.00 C ATOM 1315 OD1 ASP B 93 17.212 6.867 0.705 1.00 0.00 O ATOM 1316 OD2 ASP B 93 18.478 5.889 2.196 1.00 0.00 O ATOM 0 H ASP B 93 21.387 6.938 -1.459 1.00 0.00 H new ATOM 0 HA ASP B 93 18.779 5.635 -1.365 1.00 0.00 H new ATOM 0 HB2 ASP B 93 20.381 6.154 0.598 1.00 0.00 H new ATOM 0 HB3 ASP B 93 19.859 7.819 0.431 1.00 0.00 H new ATOM 1318 N LYS B 94 17.241 7.523 -2.016 1.00 0.00 N ATOM 1319 CA LYS B 94 16.391 8.550 -2.601 1.00 0.00 C ATOM 1320 C LYS B 94 15.390 9.080 -1.584 1.00 0.00 C ATOM 1321 O LYS B 94 14.362 9.654 -1.947 1.00 0.00 O ATOM 1322 CB LYS B 94 15.662 7.997 -3.828 1.00 0.00 C ATOM 1323 CG LYS B 94 15.343 9.040 -4.884 1.00 0.00 C ATOM 1324 CD LYS B 94 15.075 8.393 -6.232 1.00 0.00 C ATOM 1325 CE LYS B 94 14.862 9.443 -7.308 1.00 0.00 C ATOM 1326 NZ LYS B 94 15.258 8.950 -8.655 1.00 0.00 N ATOM 0 H LYS B 94 16.754 6.661 -1.768 1.00 0.00 H new ATOM 0 HA LYS B 94 17.026 9.380 -2.911 1.00 0.00 H new ATOM 0 HB2 LYS B 94 16.274 7.215 -4.278 1.00 0.00 H new ATOM 0 HB3 LYS B 94 14.733 7.528 -3.504 1.00 0.00 H new ATOM 0 HG2 LYS B 94 14.472 9.619 -4.576 1.00 0.00 H new ATOM 0 HG3 LYS B 94 16.175 9.739 -4.972 1.00 0.00 H new ATOM 0 HD2 LYS B 94 15.914 7.753 -6.505 1.00 0.00 H new ATOM 0 HD3 LYS B 94 14.195 7.754 -6.164 1.00 0.00 H new ATOM 0 HE2 LYS B 94 13.813 9.738 -7.324 1.00 0.00 H new ATOM 0 HE3 LYS B 94 15.440 10.334 -7.064 1.00 0.00 H new ATOM 0 HZ1 LYS B 94 15.209 9.732 -9.339 1.00 0.00 H new ATOM 0 HZ2 LYS B 94 16.230 8.582 -8.618 1.00 0.00 H new ATOM 0 HZ3 LYS B 94 14.612 8.191 -8.951 1.00 0.00 H new ATOM 1331 N ASP B 95 15.683 8.872 -0.313 1.00 0.00 N ATOM 1332 CA ASP B 95 14.806 9.335 0.754 1.00 0.00 C ATOM 1333 C ASP B 95 15.604 9.698 1.994 1.00 0.00 C ATOM 1334 O ASP B 95 15.378 10.737 2.621 1.00 0.00 O ATOM 1335 CB ASP B 95 13.797 8.242 1.112 1.00 0.00 C ATOM 1336 CG ASP B 95 12.747 8.716 2.095 1.00 0.00 C ATOM 1337 OD1 ASP B 95 11.765 9.347 1.648 1.00 0.00 O ATOM 1338 OD2 ASP B 95 12.900 8.453 3.308 1.00 0.00 O ATOM 0 H ASP B 95 16.520 8.386 0.008 1.00 0.00 H new ATOM 0 HA ASP B 95 14.282 10.222 0.398 1.00 0.00 H new ATOM 0 HB2 ASP B 95 13.307 7.894 0.203 1.00 0.00 H new ATOM 0 HB3 ASP B 95 14.327 7.389 1.536 1.00 0.00 H new ATOM 1340 N GLY B 96 16.543 8.838 2.338 1.00 0.00 N ATOM 1341 CA GLY B 96 17.357 9.047 3.511 1.00 0.00 C ATOM 1342 C GLY B 96 16.943 8.098 4.609 1.00 0.00 C ATOM 1343 O GLY B 96 16.552 8.522 5.698 1.00 0.00 O ATOM 0 H GLY B 96 16.758 7.987 1.818 1.00 0.00 H new ATOM 0 HA2 GLY B 96 18.408 8.894 3.265 1.00 0.00 H new ATOM 0 HA3 GLY B 96 17.256 10.077 3.853 1.00 0.00 H new ATOM 1345 N ASN B 97 17.002 6.809 4.309 1.00 0.00 N ATOM 1346 CA ASN B 97 16.616 5.779 5.263 1.00 0.00 C ATOM 1347 C ASN B 97 17.777 4.840 5.551 1.00 0.00 C ATOM 1348 O ASN B 97 17.856 4.248 6.626 1.00 0.00 O ATOM 1349 CB ASN B 97 15.415 4.984 4.740 1.00 0.00 C ATOM 1350 CG ASN B 97 14.258 4.964 5.720 1.00 0.00 C ATOM 1351 OD1 ASN B 97 14.056 5.911 6.482 1.00 0.00 O ATOM 1352 ND2 ASN B 97 13.474 3.896 5.694 1.00 0.00 N ATOM 0 H ASN B 97 17.315 6.450 3.407 1.00 0.00 H new ATOM 0 HA ASN B 97 16.334 6.273 6.193 1.00 0.00 H new ATOM 0 HB2 ASN B 97 15.080 5.417 3.797 1.00 0.00 H new ATOM 0 HB3 ASN B 97 15.725 3.961 4.529 1.00 0.00 H new ATOM 0 HD21 ASN B 97 12.670 3.838 6.319 1.00 0.00 H new ATOM 0 HD22 ASN B 97 13.674 3.132 5.049 1.00 0.00 H new ATOM 1356 N GLY B 98 18.678 4.702 4.584 1.00 0.00 N ATOM 1357 CA GLY B 98 19.827 3.836 4.755 1.00 0.00 C ATOM 1358 C GLY B 98 19.514 2.395 4.409 1.00 0.00 C ATOM 1359 O GLY B 98 20.177 1.473 4.891 1.00 0.00 O ATOM 0 H GLY B 98 18.631 5.177 3.682 1.00 0.00 H new ATOM 0 HA2 GLY B 98 20.643 4.190 4.125 1.00 0.00 H new ATOM 0 HA3 GLY B 98 20.173 3.893 5.787 1.00 0.00 H new ATOM 1361 N TYR B 99 18.510 2.205 3.566 1.00 0.00 N ATOM 1362 CA TYR B 99 18.098 0.874 3.152 1.00 0.00 C ATOM 1363 C TYR B 99 18.163 0.739 1.638 1.00 0.00 C ATOM 1364 O TYR B 99 17.516 1.493 0.913 1.00 0.00 O ATOM 1365 CB TYR B 99 16.677 0.579 3.636 1.00 0.00 C ATOM 1366 CG TYR B 99 16.593 -0.009 5.026 1.00 0.00 C ATOM 1367 CD1 TYR B 99 16.802 -1.364 5.237 1.00 0.00 C ATOM 1368 CD2 TYR B 99 16.290 0.785 6.126 1.00 0.00 C ATOM 1369 CE1 TYR B 99 16.716 -1.915 6.500 1.00 0.00 C ATOM 1370 CE2 TYR B 99 16.197 0.244 7.394 1.00 0.00 C ATOM 1371 CZ TYR B 99 16.411 -1.108 7.575 1.00 0.00 C ATOM 1372 OH TYR B 99 16.317 -1.655 8.835 1.00 0.00 O ATOM 0 H TYR B 99 17.963 2.961 3.154 1.00 0.00 H new ATOM 0 HA TYR B 99 18.783 0.154 3.600 1.00 0.00 H new ATOM 0 HB2 TYR B 99 16.100 1.504 3.612 1.00 0.00 H new ATOM 0 HB3 TYR B 99 16.205 -0.110 2.936 1.00 0.00 H new ATOM 0 HD1 TYR B 99 17.037 -2.001 4.397 1.00 0.00 H new ATOM 0 HD2 TYR B 99 16.124 1.843 5.987 1.00 0.00 H new ATOM 0 HE1 TYR B 99 16.887 -2.972 6.645 1.00 0.00 H new ATOM 0 HE2 TYR B 99 15.959 0.874 8.238 1.00 0.00 H new ATOM 0 HH TYR B 99 16.096 -0.952 9.481 1.00 0.00 H new ATOM 1375 N ILE B 100 18.954 -0.216 1.173 1.00 0.00 N ATOM 1376 CA ILE B 100 19.114 -0.468 -0.255 1.00 0.00 C ATOM 1377 C ILE B 100 19.106 -1.969 -0.513 1.00 0.00 C ATOM 1378 O ILE B 100 18.880 -2.756 0.404 1.00 0.00 O ATOM 1379 CB ILE B 100 20.427 0.130 -0.806 1.00 0.00 C ATOM 1380 CG1 ILE B 100 21.621 -0.275 0.068 1.00 0.00 C ATOM 1381 CG2 ILE B 100 20.324 1.643 -0.930 1.00 0.00 C ATOM 1382 CD1 ILE B 100 22.969 0.046 -0.541 1.00 0.00 C ATOM 0 H ILE B 100 19.501 -0.836 1.770 1.00 0.00 H new ATOM 0 HA ILE B 100 18.281 0.014 -0.768 1.00 0.00 H new ATOM 0 HB ILE B 100 20.592 -0.275 -1.804 1.00 0.00 H new ATOM 0 HG12 ILE B 100 21.540 0.229 1.031 1.00 0.00 H new ATOM 0 HG13 ILE B 100 21.568 -1.346 0.263 1.00 0.00 H new ATOM 0 HG21 ILE B 100 21.261 2.041 -1.320 1.00 0.00 H new ATOM 0 HG22 ILE B 100 19.511 1.898 -1.610 1.00 0.00 H new ATOM 0 HG23 ILE B 100 20.126 2.076 0.051 1.00 0.00 H new ATOM 0 HD11 ILE B 100 23.760 -0.271 0.138 1.00 0.00 H new ATOM 0 HD12 ILE B 100 23.074 -0.479 -1.490 1.00 0.00 H new ATOM 0 HD13 ILE B 100 23.045 1.120 -0.710 1.00 0.00 H new ATOM 1384 N SER B 101 19.347 -2.372 -1.750 1.00 0.00 N ATOM 1385 CA SER B 101 19.369 -3.784 -2.084 1.00 0.00 C ATOM 1386 C SER B 101 20.780 -4.223 -2.467 1.00 0.00 C ATOM 1387 O SER B 101 21.711 -3.414 -2.475 1.00 0.00 O ATOM 1388 CB SER B 101 18.368 -4.100 -3.203 1.00 0.00 C ATOM 1389 OG SER B 101 18.820 -3.619 -4.459 1.00 0.00 O ATOM 0 H SER B 101 19.529 -1.745 -2.534 1.00 0.00 H new ATOM 0 HA SER B 101 19.067 -4.348 -1.202 1.00 0.00 H new ATOM 0 HB2 SER B 101 18.213 -5.177 -3.260 1.00 0.00 H new ATOM 0 HB3 SER B 101 17.403 -3.651 -2.967 1.00 0.00 H new ATOM 0 HG SER B 101 19.158 -2.705 -4.357 1.00 0.00 H new ATOM 1392 N ALA B 102 20.934 -5.504 -2.788 1.00 0.00 N ATOM 1393 CA ALA B 102 22.231 -6.052 -3.169 1.00 0.00 C ATOM 1394 C ALA B 102 22.739 -5.434 -4.467 1.00 0.00 C ATOM 1395 O ALA B 102 23.945 -5.391 -4.712 1.00 0.00 O ATOM 1396 CB ALA B 102 22.149 -7.564 -3.303 1.00 0.00 C ATOM 0 H ALA B 102 20.174 -6.184 -2.792 1.00 0.00 H new ATOM 0 HA ALA B 102 22.941 -5.803 -2.380 1.00 0.00 H new ATOM 0 HB1 ALA B 102 23.125 -7.957 -3.588 1.00 0.00 H new ATOM 0 HB2 ALA B 102 21.847 -7.998 -2.350 1.00 0.00 H new ATOM 0 HB3 ALA B 102 21.416 -7.822 -4.068 1.00 0.00 H new ATOM 1398 N ALA B 103 21.815 -4.952 -5.289 1.00 0.00 N ATOM 1399 CA ALA B 103 22.169 -4.336 -6.564 1.00 0.00 C ATOM 1400 C ALA B 103 22.995 -3.076 -6.346 1.00 0.00 C ATOM 1401 O ALA B 103 24.069 -2.916 -6.933 1.00 0.00 O ATOM 1402 CB ALA B 103 20.920 -4.024 -7.373 1.00 0.00 C ATOM 0 H ALA B 103 20.814 -4.975 -5.096 1.00 0.00 H new ATOM 0 HA ALA B 103 22.775 -5.046 -7.127 1.00 0.00 H new ATOM 0 HB1 ALA B 103 21.205 -3.565 -8.320 1.00 0.00 H new ATOM 0 HB2 ALA B 103 20.372 -4.946 -7.567 1.00 0.00 H new ATOM 0 HB3 ALA B 103 20.286 -3.336 -6.813 1.00 0.00 H new ATOM 1404 N GLU B 104 22.498 -2.194 -5.489 1.00 0.00 N ATOM 1405 CA GLU B 104 23.190 -0.955 -5.184 1.00 0.00 C ATOM 1406 C GLU B 104 24.434 -1.236 -4.355 1.00 0.00 C ATOM 1407 O GLU B 104 25.494 -0.668 -4.607 1.00 0.00 O ATOM 1408 CB GLU B 104 22.276 0.024 -4.439 1.00 0.00 C ATOM 1409 CG GLU B 104 21.059 0.487 -5.229 1.00 0.00 C ATOM 1410 CD GLU B 104 19.948 -0.542 -5.243 1.00 0.00 C ATOM 1411 OE1 GLU B 104 19.759 -1.227 -4.215 1.00 0.00 O ATOM 1412 OE2 GLU B 104 19.274 -0.685 -6.283 1.00 0.00 O ATOM 0 H GLU B 104 21.615 -2.317 -4.993 1.00 0.00 H new ATOM 0 HA GLU B 104 23.483 -0.496 -6.128 1.00 0.00 H new ATOM 0 HB2 GLU B 104 21.936 -0.448 -3.517 1.00 0.00 H new ATOM 0 HB3 GLU B 104 22.860 0.899 -4.152 1.00 0.00 H new ATOM 0 HG2 GLU B 104 20.684 1.416 -4.800 1.00 0.00 H new ATOM 0 HG3 GLU B 104 21.358 0.708 -6.254 1.00 0.00 H new ATOM 1414 N LEU B 105 24.298 -2.133 -3.381 1.00 0.00 N ATOM 1415 CA LEU B 105 25.400 -2.502 -2.497 1.00 0.00 C ATOM 1416 C LEU B 105 26.634 -2.956 -3.277 1.00 0.00 C ATOM 1417 O LEU B 105 27.738 -2.454 -3.053 1.00 0.00 O ATOM 1418 CB LEU B 105 24.956 -3.609 -1.536 1.00 0.00 C ATOM 1419 CG LEU B 105 25.990 -4.077 -0.510 1.00 0.00 C ATOM 1420 CD1 LEU B 105 26.197 -3.024 0.569 1.00 0.00 C ATOM 1421 CD2 LEU B 105 25.567 -5.403 0.103 1.00 0.00 C ATOM 0 H LEU B 105 23.425 -2.622 -3.183 1.00 0.00 H new ATOM 0 HA LEU B 105 25.675 -1.612 -1.931 1.00 0.00 H new ATOM 0 HB2 LEU B 105 24.075 -3.260 -0.998 1.00 0.00 H new ATOM 0 HB3 LEU B 105 24.648 -4.471 -2.128 1.00 0.00 H new ATOM 0 HG LEU B 105 26.941 -4.223 -1.023 1.00 0.00 H new ATOM 0 HD11 LEU B 105 26.936 -3.379 1.287 1.00 0.00 H new ATOM 0 HD12 LEU B 105 26.550 -2.099 0.112 1.00 0.00 H new ATOM 0 HD13 LEU B 105 25.253 -2.838 1.082 1.00 0.00 H new ATOM 0 HD21 LEU B 105 26.313 -5.722 0.831 1.00 0.00 H new ATOM 0 HD22 LEU B 105 24.604 -5.284 0.599 1.00 0.00 H new ATOM 0 HD23 LEU B 105 25.480 -6.155 -0.681 1.00 0.00 H new ATOM 1423 N ARG B 106 26.434 -3.891 -4.200 1.00 0.00 N ATOM 1424 CA ARG B 106 27.526 -4.421 -5.011 1.00 0.00 C ATOM 1425 C ARG B 106 28.152 -3.325 -5.873 1.00 0.00 C ATOM 1426 O ARG B 106 29.340 -3.375 -6.200 1.00 0.00 O ATOM 1427 CB ARG B 106 27.019 -5.569 -5.894 1.00 0.00 C ATOM 1428 CG ARG B 106 28.074 -6.601 -6.270 1.00 0.00 C ATOM 1429 CD ARG B 106 27.424 -7.850 -6.854 1.00 0.00 C ATOM 1430 NE ARG B 106 28.390 -8.921 -7.115 1.00 0.00 N ATOM 1431 CZ ARG B 106 28.245 -10.180 -6.696 1.00 0.00 C ATOM 1432 NH1 ARG B 106 27.182 -10.538 -5.985 1.00 0.00 N ATOM 1433 NH2 ARG B 106 29.162 -11.084 -7.002 1.00 0.00 N ATOM 0 H ARG B 106 25.522 -4.299 -4.406 1.00 0.00 H new ATOM 0 HA ARG B 106 28.295 -4.803 -4.340 1.00 0.00 H new ATOM 0 HB2 ARG B 106 26.205 -6.075 -5.375 1.00 0.00 H new ATOM 0 HB3 ARG B 106 26.601 -5.148 -6.808 1.00 0.00 H new ATOM 0 HG2 ARG B 106 28.766 -6.173 -6.995 1.00 0.00 H new ATOM 0 HG3 ARG B 106 28.659 -6.867 -5.390 1.00 0.00 H new ATOM 0 HD2 ARG B 106 26.662 -8.214 -6.165 1.00 0.00 H new ATOM 0 HD3 ARG B 106 26.916 -7.590 -7.783 1.00 0.00 H new ATOM 0 HE ARG B 106 29.226 -8.689 -7.651 1.00 0.00 H new ATOM 0 HH11 ARG B 106 26.467 -9.848 -5.754 1.00 0.00 H new ATOM 0 HH12 ARG B 106 27.081 -11.503 -5.670 1.00 0.00 H new ATOM 0 HH21 ARG B 106 29.976 -10.818 -7.556 1.00 0.00 H new ATOM 0 HH22 ARG B 106 29.055 -12.047 -6.684 1.00 0.00 H new ATOM 1440 N HIS B 107 27.350 -2.321 -6.220 1.00 0.00 N ATOM 1441 CA HIS B 107 27.819 -1.215 -7.045 1.00 0.00 C ATOM 1442 C HIS B 107 28.592 -0.186 -6.219 1.00 0.00 C ATOM 1443 O HIS B 107 29.572 0.389 -6.694 1.00 0.00 O ATOM 1444 CB HIS B 107 26.648 -0.551 -7.780 1.00 0.00 C ATOM 1445 CG HIS B 107 27.054 0.205 -9.006 1.00 0.00 C ATOM 1446 ND1 HIS B 107 27.038 -0.344 -10.267 1.00 0.00 N ATOM 1447 CD2 HIS B 107 27.489 1.479 -9.161 1.00 0.00 C ATOM 1448 CE1 HIS B 107 27.444 0.554 -11.142 1.00 0.00 C ATOM 1449 NE2 HIS B 107 27.725 1.671 -10.497 1.00 0.00 N ATOM 0 H HIS B 107 26.371 -2.252 -5.941 1.00 0.00 H new ATOM 0 HA HIS B 107 28.505 -1.625 -7.786 1.00 0.00 H new ATOM 0 HB2 HIS B 107 25.926 -1.318 -8.060 1.00 0.00 H new ATOM 0 HB3 HIS B 107 26.141 0.130 -7.096 1.00 0.00 H new ATOM 0 HD2 HIS B 107 27.625 2.208 -8.376 1.00 0.00 H new ATOM 0 HE1 HIS B 107 27.532 0.402 -12.208 1.00 0.00 H new ATOM 0 HE2 HIS B 107 28.062 2.534 -10.923 1.00 0.00 H new ATOM 1453 N VAL B 108 28.146 0.056 -4.991 1.00 0.00 N ATOM 1454 CA VAL B 108 28.814 1.012 -4.115 1.00 0.00 C ATOM 1455 C VAL B 108 30.221 0.531 -3.785 1.00 0.00 C ATOM 1456 O VAL B 108 31.179 1.301 -3.830 1.00 0.00 O ATOM 1457 CB VAL B 108 28.035 1.252 -2.802 1.00 0.00 C ATOM 1458 CG1 VAL B 108 28.769 2.251 -1.916 1.00 0.00 C ATOM 1459 CG2 VAL B 108 26.632 1.747 -3.098 1.00 0.00 C ATOM 0 H VAL B 108 27.328 -0.395 -4.581 1.00 0.00 H new ATOM 0 HA VAL B 108 28.858 1.958 -4.655 1.00 0.00 H new ATOM 0 HB VAL B 108 27.965 0.303 -2.270 1.00 0.00 H new ATOM 0 HG11 VAL B 108 28.204 2.406 -0.997 1.00 0.00 H new ATOM 0 HG12 VAL B 108 29.758 1.863 -1.673 1.00 0.00 H new ATOM 0 HG13 VAL B 108 28.871 3.199 -2.444 1.00 0.00 H new ATOM 0 HG21 VAL B 108 26.099 1.910 -2.162 1.00 0.00 H new ATOM 0 HG22 VAL B 108 26.686 2.684 -3.653 1.00 0.00 H new ATOM 0 HG23 VAL B 108 26.102 1.003 -3.693 1.00 0.00 H new ATOM 1461 N MET B 109 30.337 -0.756 -3.481 1.00 0.00 N ATOM 1462 CA MET B 109 31.623 -1.357 -3.146 1.00 0.00 C ATOM 1463 C MET B 109 32.641 -1.154 -4.266 1.00 0.00 C ATOM 1464 O MET B 109 33.808 -0.847 -4.015 1.00 0.00 O ATOM 1465 CB MET B 109 31.453 -2.851 -2.866 1.00 0.00 C ATOM 1466 CG MET B 109 30.833 -3.168 -1.515 1.00 0.00 C ATOM 1467 SD MET B 109 30.429 -4.916 -1.337 1.00 0.00 S ATOM 1468 CE MET B 109 29.949 -4.987 0.390 1.00 0.00 C ATOM 0 H MET B 109 29.552 -1.407 -3.460 1.00 0.00 H new ATOM 0 HA MET B 109 31.998 -0.861 -2.250 1.00 0.00 H new ATOM 0 HB2 MET B 109 30.832 -3.287 -3.649 1.00 0.00 H new ATOM 0 HB3 MET B 109 32.429 -3.333 -2.927 1.00 0.00 H new ATOM 0 HG2 MET B 109 31.523 -2.875 -0.724 1.00 0.00 H new ATOM 0 HG3 MET B 109 29.928 -2.574 -1.385 1.00 0.00 H new ATOM 0 HE1 MET B 109 29.671 -6.009 0.649 1.00 0.00 H new ATOM 0 HE2 MET B 109 30.785 -4.669 1.013 1.00 0.00 H new ATOM 0 HE3 MET B 109 29.099 -4.326 0.559 1.00 0.00 H new ATOM 1470 N THR B 110 32.195 -1.310 -5.502 1.00 0.00 N ATOM 1471 CA THR B 110 33.073 -1.148 -6.649 1.00 0.00 C ATOM 1472 C THR B 110 33.342 0.328 -6.942 1.00 0.00 C ATOM 1473 O THR B 110 34.445 0.696 -7.348 1.00 0.00 O ATOM 1474 CB THR B 110 32.495 -1.834 -7.894 1.00 0.00 C ATOM 1475 OG1 THR B 110 31.064 -1.865 -7.794 1.00 0.00 O ATOM 1476 CG2 THR B 110 33.024 -3.255 -8.014 1.00 0.00 C ATOM 0 H THR B 110 31.231 -1.548 -5.736 1.00 0.00 H new ATOM 0 HA THR B 110 34.019 -1.627 -6.397 1.00 0.00 H new ATOM 0 HB THR B 110 32.796 -1.273 -8.779 1.00 0.00 H new ATOM 0 HG1 THR B 110 30.735 -0.978 -7.538 1.00 0.00 H new ATOM 0 HG21 THR B 110 32.603 -3.726 -8.902 1.00 0.00 H new ATOM 0 HG22 THR B 110 34.111 -3.233 -8.095 1.00 0.00 H new ATOM 0 HG23 THR B 110 32.737 -3.826 -7.131 1.00 0.00 H new ATOM 1479 N ASN B 111 32.339 1.175 -6.707 1.00 0.00 N ATOM 1480 CA ASN B 111 32.475 2.611 -6.943 1.00 0.00 C ATOM 1481 C ASN B 111 33.470 3.239 -5.972 1.00 0.00 C ATOM 1482 O ASN B 111 34.057 4.281 -6.257 1.00 0.00 O ATOM 1483 CB ASN B 111 31.120 3.326 -6.870 1.00 0.00 C ATOM 1484 CG ASN B 111 30.485 3.521 -8.238 1.00 0.00 C ATOM 1485 OD1 ASN B 111 30.629 2.680 -9.125 1.00 0.00 O ATOM 1486 ND2 ASN B 111 29.784 4.631 -8.424 1.00 0.00 N ATOM 0 H ASN B 111 31.425 0.891 -6.354 1.00 0.00 H new ATOM 0 HA ASN B 111 32.863 2.736 -7.954 1.00 0.00 H new ATOM 0 HB2 ASN B 111 30.443 2.750 -6.239 1.00 0.00 H new ATOM 0 HB3 ASN B 111 31.252 4.297 -6.393 1.00 0.00 H new ATOM 0 HD21 ASN B 111 29.342 4.810 -9.326 1.00 0.00 H new ATOM 0 HD22 ASN B 111 29.686 5.306 -7.665 1.00 0.00 H new ATOM 1490 N LEU B 112 33.661 2.593 -4.828 1.00 0.00 N ATOM 1491 CA LEU B 112 34.603 3.074 -3.826 1.00 0.00 C ATOM 1492 C LEU B 112 36.033 2.736 -4.236 1.00 0.00 C ATOM 1493 O LEU B 112 36.997 3.193 -3.620 1.00 0.00 O ATOM 1494 CB LEU B 112 34.290 2.464 -2.457 1.00 0.00 C ATOM 1495 CG LEU B 112 33.011 2.954 -1.775 1.00 0.00 C ATOM 1496 CD1 LEU B 112 32.764 2.183 -0.487 1.00 0.00 C ATOM 1497 CD2 LEU B 112 33.083 4.449 -1.501 1.00 0.00 C ATOM 0 H LEU B 112 33.175 1.734 -4.571 1.00 0.00 H new ATOM 0 HA LEU B 112 34.505 4.157 -3.755 1.00 0.00 H new ATOM 0 HB2 LEU B 112 34.224 1.382 -2.571 1.00 0.00 H new ATOM 0 HB3 LEU B 112 35.131 2.664 -1.793 1.00 0.00 H new ATOM 0 HG LEU B 112 32.174 2.773 -2.450 1.00 0.00 H new ATOM 0 HD11 LEU B 112 31.850 2.545 -0.016 1.00 0.00 H new ATOM 0 HD12 LEU B 112 32.660 1.122 -0.713 1.00 0.00 H new ATOM 0 HD13 LEU B 112 33.605 2.329 0.191 1.00 0.00 H new ATOM 0 HD21 LEU B 112 32.163 4.775 -1.016 1.00 0.00 H new ATOM 0 HD22 LEU B 112 33.931 4.659 -0.849 1.00 0.00 H new ATOM 0 HD23 LEU B 112 33.207 4.986 -2.442 1.00 0.00 H new ATOM 1499 N GLY B 113 36.158 1.931 -5.286 1.00 0.00 N ATOM 1500 CA GLY B 113 37.462 1.542 -5.777 1.00 0.00 C ATOM 1501 C GLY B 113 38.078 0.429 -4.961 1.00 0.00 C ATOM 1502 O GLY B 113 39.298 0.253 -4.961 1.00 0.00 O ATOM 0 H GLY B 113 35.373 1.540 -5.807 1.00 0.00 H new ATOM 0 HA2 GLY B 113 37.375 1.222 -6.815 1.00 0.00 H new ATOM 0 HA3 GLY B 113 38.125 2.407 -5.764 1.00 0.00 H new ATOM 1504 N GLU B 114 37.237 -0.321 -4.259 1.00 0.00 N ATOM 1505 CA GLU B 114 37.705 -1.423 -3.434 1.00 0.00 C ATOM 1506 C GLU B 114 38.049 -2.630 -4.297 1.00 0.00 C ATOM 1507 O GLU B 114 37.283 -3.010 -5.185 1.00 0.00 O ATOM 1508 CB GLU B 114 36.655 -1.804 -2.386 1.00 0.00 C ATOM 1509 CG GLU B 114 36.471 -0.775 -1.279 1.00 0.00 C ATOM 1510 CD GLU B 114 37.730 -0.567 -0.459 1.00 0.00 C ATOM 1511 OE1 GLU B 114 38.508 -1.532 -0.293 1.00 0.00 O ATOM 1512 OE2 GLU B 114 37.949 0.564 0.024 1.00 0.00 O ATOM 0 H GLU B 114 36.226 -0.184 -4.246 1.00 0.00 H new ATOM 0 HA GLU B 114 38.606 -1.096 -2.915 1.00 0.00 H new ATOM 0 HB2 GLU B 114 35.699 -1.957 -2.886 1.00 0.00 H new ATOM 0 HB3 GLU B 114 36.936 -2.757 -1.937 1.00 0.00 H new ATOM 0 HG2 GLU B 114 36.167 0.175 -1.718 1.00 0.00 H new ATOM 0 HG3 GLU B 114 35.663 -1.095 -0.622 1.00 0.00 H new ATOM 1514 N LYS B 115 39.203 -3.224 -4.039 1.00 0.00 N ATOM 1515 CA LYS B 115 39.652 -4.390 -4.788 1.00 0.00 C ATOM 1516 C LYS B 115 39.148 -5.673 -4.141 1.00 0.00 C ATOM 1517 O LYS B 115 39.932 -6.537 -3.749 1.00 0.00 O ATOM 1518 CB LYS B 115 41.176 -4.412 -4.887 1.00 0.00 C ATOM 1519 CG LYS B 115 41.757 -3.316 -5.764 1.00 0.00 C ATOM 1520 CD LYS B 115 43.276 -3.362 -5.761 1.00 0.00 C ATOM 1521 CE LYS B 115 43.844 -2.933 -4.418 1.00 0.00 C ATOM 1522 NZ LYS B 115 45.307 -3.179 -4.330 1.00 0.00 N ATOM 0 H LYS B 115 39.850 -2.917 -3.313 1.00 0.00 H new ATOM 0 HA LYS B 115 39.239 -4.325 -5.795 1.00 0.00 H new ATOM 0 HB2 LYS B 115 41.596 -4.321 -3.885 1.00 0.00 H new ATOM 0 HB3 LYS B 115 41.490 -5.380 -5.278 1.00 0.00 H new ATOM 0 HG2 LYS B 115 41.389 -3.428 -6.784 1.00 0.00 H new ATOM 0 HG3 LYS B 115 41.419 -2.343 -5.408 1.00 0.00 H new ATOM 0 HD2 LYS B 115 43.611 -4.373 -5.992 1.00 0.00 H new ATOM 0 HD3 LYS B 115 43.662 -2.711 -6.545 1.00 0.00 H new ATOM 0 HE2 LYS B 115 43.644 -1.873 -4.261 1.00 0.00 H new ATOM 0 HE3 LYS B 115 43.336 -3.474 -3.620 1.00 0.00 H new ATOM 0 HZ1 LYS B 115 45.655 -2.873 -3.399 1.00 0.00 H new ATOM 0 HZ2 LYS B 115 45.496 -4.194 -4.454 1.00 0.00 H new ATOM 0 HZ3 LYS B 115 45.795 -2.642 -5.076 1.00 0.00 H new ATOM 1527 N LEU B 116 37.837 -5.781 -4.016 1.00 0.00 N ATOM 1528 CA LEU B 116 37.225 -6.952 -3.420 1.00 0.00 C ATOM 1529 C LEU B 116 36.679 -7.856 -4.513 1.00 0.00 C ATOM 1530 O LEU B 116 35.859 -7.427 -5.329 1.00 0.00 O ATOM 1531 CB LEU B 116 36.101 -6.534 -2.466 1.00 0.00 C ATOM 1532 CG LEU B 116 35.774 -7.513 -1.337 1.00 0.00 C ATOM 1533 CD1 LEU B 116 36.977 -7.709 -0.428 1.00 0.00 C ATOM 1534 CD2 LEU B 116 34.570 -7.026 -0.544 1.00 0.00 C ATOM 0 H LEU B 116 37.175 -5.068 -4.321 1.00 0.00 H new ATOM 0 HA LEU B 116 37.977 -7.497 -2.850 1.00 0.00 H new ATOM 0 HB2 LEU B 116 36.368 -5.575 -2.021 1.00 0.00 H new ATOM 0 HB3 LEU B 116 35.196 -6.373 -3.052 1.00 0.00 H new ATOM 0 HG LEU B 116 35.526 -8.478 -1.779 1.00 0.00 H new ATOM 0 HD11 LEU B 116 36.722 -8.409 0.368 1.00 0.00 H new ATOM 0 HD12 LEU B 116 37.810 -8.107 -1.008 1.00 0.00 H new ATOM 0 HD13 LEU B 116 37.263 -6.752 0.009 1.00 0.00 H new ATOM 0 HD21 LEU B 116 34.350 -7.734 0.255 1.00 0.00 H new ATOM 0 HD22 LEU B 116 34.789 -6.049 -0.114 1.00 0.00 H new ATOM 0 HD23 LEU B 116 33.707 -6.946 -1.205 1.00 0.00 H new ATOM 1536 N THR B 117 37.153 -9.094 -4.544 1.00 0.00 N ATOM 1537 CA THR B 117 36.718 -10.062 -5.539 1.00 0.00 C ATOM 1538 C THR B 117 35.223 -10.341 -5.419 1.00 0.00 C ATOM 1539 O THR B 117 34.656 -10.251 -4.329 1.00 0.00 O ATOM 1540 CB THR B 117 37.486 -11.381 -5.376 1.00 0.00 C ATOM 1541 OG1 THR B 117 38.457 -11.234 -4.330 1.00 0.00 O ATOM 1542 CG2 THR B 117 38.192 -11.745 -6.671 1.00 0.00 C ATOM 0 H THR B 117 37.844 -9.453 -3.885 1.00 0.00 H new ATOM 0 HA THR B 117 36.922 -9.636 -6.521 1.00 0.00 H new ATOM 0 HB THR B 117 36.782 -12.174 -5.124 1.00 0.00 H new ATOM 0 HG1 THR B 117 38.949 -12.074 -4.220 1.00 0.00 H new ATOM 0 HG21 THR B 117 38.732 -12.683 -6.540 1.00 0.00 H new ATOM 0 HG22 THR B 117 37.456 -11.859 -7.467 1.00 0.00 H new ATOM 0 HG23 THR B 117 38.895 -10.955 -6.937 1.00 0.00 H new ATOM 1545 N ASP B 118 34.595 -10.697 -6.538 1.00 0.00 N ATOM 1546 CA ASP B 118 33.164 -10.986 -6.566 1.00 0.00 C ATOM 1547 C ASP B 118 32.779 -12.055 -5.548 1.00 0.00 C ATOM 1548 O ASP B 118 31.707 -11.988 -4.947 1.00 0.00 O ATOM 1549 CB ASP B 118 32.717 -11.399 -7.968 1.00 0.00 C ATOM 1550 CG ASP B 118 32.147 -10.244 -8.763 1.00 0.00 C ATOM 1551 OD1 ASP B 118 30.937 -9.972 -8.629 1.00 0.00 O ATOM 1552 OD2 ASP B 118 32.905 -9.605 -9.524 1.00 0.00 O ATOM 0 H ASP B 118 35.059 -10.792 -7.442 1.00 0.00 H new ATOM 0 HA ASP B 118 32.647 -10.067 -6.292 1.00 0.00 H new ATOM 0 HB2 ASP B 118 33.566 -11.821 -8.506 1.00 0.00 H new ATOM 0 HB3 ASP B 118 31.967 -12.186 -7.889 1.00 0.00 H new ATOM 1554 N GLU B 119 33.661 -13.030 -5.350 1.00 0.00 N ATOM 1555 CA GLU B 119 33.417 -14.102 -4.389 1.00 0.00 C ATOM 1556 C GLU B 119 33.268 -13.549 -2.976 1.00 0.00 C ATOM 1557 O GLU B 119 32.357 -13.933 -2.249 1.00 0.00 O ATOM 1558 CB GLU B 119 34.537 -15.147 -4.434 1.00 0.00 C ATOM 1559 CG GLU B 119 34.433 -16.121 -5.597 1.00 0.00 C ATOM 1560 CD GLU B 119 33.109 -16.857 -5.634 1.00 0.00 C ATOM 1561 OE1 GLU B 119 32.939 -17.830 -4.872 1.00 0.00 O ATOM 1562 OE2 GLU B 119 32.224 -16.460 -6.422 1.00 0.00 O ATOM 0 H GLU B 119 34.552 -13.100 -5.842 1.00 0.00 H new ATOM 0 HA GLU B 119 32.482 -14.587 -4.669 1.00 0.00 H new ATOM 0 HB2 GLU B 119 35.497 -14.633 -4.490 1.00 0.00 H new ATOM 0 HB3 GLU B 119 34.531 -15.710 -3.501 1.00 0.00 H new ATOM 0 HG2 GLU B 119 34.567 -15.578 -6.532 1.00 0.00 H new ATOM 0 HG3 GLU B 119 35.244 -16.846 -5.531 1.00 0.00 H new ATOM 1564 N GLU B 120 34.156 -12.626 -2.607 1.00 0.00 N ATOM 1565 CA GLU B 120 34.124 -12.012 -1.282 1.00 0.00 C ATOM 1566 C GLU B 120 32.808 -11.270 -1.073 1.00 0.00 C ATOM 1567 O GLU B 120 32.176 -11.376 -0.021 1.00 0.00 O ATOM 1568 CB GLU B 120 35.301 -11.046 -1.115 1.00 0.00 C ATOM 1569 CG GLU B 120 36.653 -11.724 -0.956 1.00 0.00 C ATOM 1570 CD GLU B 120 37.003 -12.022 0.490 1.00 0.00 C ATOM 1571 OE1 GLU B 120 36.116 -11.923 1.360 1.00 0.00 O ATOM 1572 OE2 GLU B 120 38.177 -12.354 0.760 1.00 0.00 O ATOM 0 H GLU B 120 34.907 -12.287 -3.209 1.00 0.00 H new ATOM 0 HA GLU B 120 34.206 -12.801 -0.534 1.00 0.00 H new ATOM 0 HB2 GLU B 120 35.339 -10.386 -1.981 1.00 0.00 H new ATOM 0 HB3 GLU B 120 35.119 -10.418 -0.243 1.00 0.00 H new ATOM 0 HG2 GLU B 120 36.655 -12.655 -1.523 1.00 0.00 H new ATOM 0 HG3 GLU B 120 37.425 -11.087 -1.387 1.00 0.00 H new ATOM 1574 N VAL B 121 32.390 -10.538 -2.100 1.00 0.00 N ATOM 1575 CA VAL B 121 31.146 -9.783 -2.050 1.00 0.00 C ATOM 1576 C VAL B 121 29.962 -10.735 -1.905 1.00 0.00 C ATOM 1577 O VAL B 121 29.068 -10.513 -1.086 1.00 0.00 O ATOM 1578 CB VAL B 121 30.954 -8.923 -3.316 1.00 0.00 C ATOM 1579 CG1 VAL B 121 29.687 -8.085 -3.211 1.00 0.00 C ATOM 1580 CG2 VAL B 121 32.165 -8.033 -3.551 1.00 0.00 C ATOM 0 H VAL B 121 32.898 -10.452 -2.980 1.00 0.00 H new ATOM 0 HA VAL B 121 31.198 -9.119 -1.187 1.00 0.00 H new ATOM 0 HB VAL B 121 30.851 -9.594 -4.169 1.00 0.00 H new ATOM 0 HG11 VAL B 121 29.571 -7.486 -4.114 1.00 0.00 H new ATOM 0 HG12 VAL B 121 28.825 -8.742 -3.098 1.00 0.00 H new ATOM 0 HG13 VAL B 121 29.757 -7.426 -2.346 1.00 0.00 H new ATOM 0 HG21 VAL B 121 32.008 -7.435 -4.449 1.00 0.00 H new ATOM 0 HG22 VAL B 121 32.303 -7.373 -2.695 1.00 0.00 H new ATOM 0 HG23 VAL B 121 33.053 -8.653 -3.678 1.00 0.00 H new ATOM 1582 N ASP B 122 29.976 -11.810 -2.689 1.00 0.00 N ATOM 1583 CA ASP B 122 28.910 -12.801 -2.649 1.00 0.00 C ATOM 1584 C ASP B 122 28.865 -13.501 -1.296 1.00 0.00 C ATOM 1585 O ASP B 122 27.788 -13.815 -0.787 1.00 0.00 O ATOM 1586 CB ASP B 122 29.043 -13.814 -3.788 1.00 0.00 C ATOM 1587 CG ASP B 122 28.210 -13.440 -5.003 1.00 0.00 C ATOM 1588 OD1 ASP B 122 27.073 -12.952 -4.828 1.00 0.00 O ATOM 1589 OD2 ASP B 122 28.683 -13.631 -6.145 1.00 0.00 O ATOM 0 H ASP B 122 30.716 -12.015 -3.360 1.00 0.00 H new ATOM 0 HA ASP B 122 27.966 -12.274 -2.788 1.00 0.00 H new ATOM 0 HB2 ASP B 122 30.090 -13.891 -4.080 1.00 0.00 H new ATOM 0 HB3 ASP B 122 28.738 -14.798 -3.432 1.00 0.00 H new ATOM 1591 N GLU B 123 30.036 -13.739 -0.713 1.00 0.00 N ATOM 1592 CA GLU B 123 30.113 -14.374 0.594 1.00 0.00 C ATOM 1593 C GLU B 123 29.478 -13.477 1.647 1.00 0.00 C ATOM 1594 O GLU B 123 28.771 -13.952 2.533 1.00 0.00 O ATOM 1595 CB GLU B 123 31.556 -14.719 0.967 1.00 0.00 C ATOM 1596 CG GLU B 123 32.129 -15.884 0.176 1.00 0.00 C ATOM 1597 CD GLU B 123 33.482 -16.341 0.680 1.00 0.00 C ATOM 1598 OE1 GLU B 123 34.328 -15.485 1.003 1.00 0.00 O ATOM 1599 OE2 GLU B 123 33.711 -17.567 0.755 1.00 0.00 O ATOM 0 H GLU B 123 30.939 -13.502 -1.124 1.00 0.00 H new ATOM 0 HA GLU B 123 29.559 -15.312 0.550 1.00 0.00 H new ATOM 0 HB2 GLU B 123 32.183 -13.841 0.810 1.00 0.00 H new ATOM 0 HB3 GLU B 123 31.601 -14.956 2.030 1.00 0.00 H new ATOM 0 HG2 GLU B 123 31.432 -16.721 0.218 1.00 0.00 H new ATOM 0 HG3 GLU B 123 32.218 -15.595 -0.871 1.00 0.00 H new ATOM 1601 N MET B 124 29.707 -12.173 1.526 1.00 0.00 N ATOM 1602 CA MET B 124 29.134 -11.213 2.457 1.00 0.00 C ATOM 1603 C MET B 124 27.614 -11.211 2.336 1.00 0.00 C ATOM 1604 O MET B 124 26.901 -11.046 3.325 1.00 0.00 O ATOM 1605 CB MET B 124 29.692 -9.810 2.213 1.00 0.00 C ATOM 1606 CG MET B 124 31.142 -9.637 2.638 1.00 0.00 C ATOM 1607 SD MET B 124 31.697 -7.925 2.540 1.00 0.00 S ATOM 1608 CE MET B 124 33.422 -8.105 2.988 1.00 0.00 C ATOM 0 H MET B 124 30.284 -11.760 0.794 1.00 0.00 H new ATOM 0 HA MET B 124 29.408 -11.511 3.469 1.00 0.00 H new ATOM 0 HB2 MET B 124 29.605 -9.575 1.152 1.00 0.00 H new ATOM 0 HB3 MET B 124 29.078 -9.088 2.751 1.00 0.00 H new ATOM 0 HG2 MET B 124 31.262 -9.995 3.660 1.00 0.00 H new ATOM 0 HG3 MET B 124 31.778 -10.257 2.006 1.00 0.00 H new ATOM 0 HE1 MET B 124 33.914 -7.134 2.939 1.00 0.00 H new ATOM 0 HE2 MET B 124 33.495 -8.498 4.002 1.00 0.00 H new ATOM 0 HE3 MET B 124 33.908 -8.793 2.296 1.00 0.00 H new ATOM 1610 N ILE B 125 27.125 -11.420 1.114 1.00 0.00 N ATOM 1611 CA ILE B 125 25.689 -11.468 0.855 1.00 0.00 C ATOM 1612 C ILE B 125 25.074 -12.685 1.547 1.00 0.00 C ATOM 1613 O ILE B 125 23.905 -12.678 1.932 1.00 0.00 O ATOM 1614 CB ILE B 125 25.398 -11.517 -0.664 1.00 0.00 C ATOM 1615 CG1 ILE B 125 25.879 -10.226 -1.329 1.00 0.00 C ATOM 1616 CG2 ILE B 125 23.914 -11.741 -0.937 1.00 0.00 C ATOM 1617 CD1 ILE B 125 25.760 -10.226 -2.838 1.00 0.00 C ATOM 0 H ILE B 125 27.705 -11.559 0.287 1.00 0.00 H new ATOM 0 HA ILE B 125 25.240 -10.560 1.257 1.00 0.00 H new ATOM 0 HB ILE B 125 25.942 -12.360 -1.090 1.00 0.00 H new ATOM 0 HG12 ILE B 125 25.306 -9.389 -0.930 1.00 0.00 H new ATOM 0 HG13 ILE B 125 26.921 -10.057 -1.058 1.00 0.00 H new ATOM 0 HG21 ILE B 125 23.742 -11.770 -2.013 1.00 0.00 H new ATOM 0 HG22 ILE B 125 23.601 -12.686 -0.494 1.00 0.00 H new ATOM 0 HG23 ILE B 125 23.337 -10.926 -0.500 1.00 0.00 H new ATOM 0 HD11 ILE B 125 26.122 -9.276 -3.231 1.00 0.00 H new ATOM 0 HD12 ILE B 125 26.357 -11.040 -3.250 1.00 0.00 H new ATOM 0 HD13 ILE B 125 24.716 -10.362 -3.121 1.00 0.00 H new ATOM 1619 N ARG B 126 25.888 -13.723 1.710 1.00 0.00 N ATOM 1620 CA ARG B 126 25.451 -14.952 2.364 1.00 0.00 C ATOM 1621 C ARG B 126 25.482 -14.794 3.883 1.00 0.00 C ATOM 1622 O ARG B 126 24.665 -15.382 4.596 1.00 0.00 O ATOM 1623 CB ARG B 126 26.335 -16.128 1.937 1.00 0.00 C ATOM 1624 CG ARG B 126 26.079 -16.622 0.521 1.00 0.00 C ATOM 1625 CD ARG B 126 24.799 -17.439 0.439 1.00 0.00 C ATOM 1626 NE ARG B 126 24.892 -18.674 1.215 1.00 0.00 N ATOM 1627 CZ ARG B 126 23.882 -19.202 1.909 1.00 0.00 C ATOM 1628 NH1 ARG B 126 22.697 -18.606 1.928 1.00 0.00 N ATOM 1629 NH2 ARG B 126 24.059 -20.321 2.595 1.00 0.00 N ATOM 0 H ARG B 126 26.859 -13.737 1.397 1.00 0.00 H new ATOM 0 HA ARG B 126 24.425 -15.156 2.058 1.00 0.00 H new ATOM 0 HB2 ARG B 126 27.380 -15.831 2.022 1.00 0.00 H new ATOM 0 HB3 ARG B 126 26.181 -16.954 2.631 1.00 0.00 H new ATOM 0 HG2 ARG B 126 26.012 -15.770 -0.156 1.00 0.00 H new ATOM 0 HG3 ARG B 126 26.921 -17.229 0.188 1.00 0.00 H new ATOM 0 HD2 ARG B 126 23.963 -16.842 0.804 1.00 0.00 H new ATOM 0 HD3 ARG B 126 24.588 -17.680 -0.603 1.00 0.00 H new ATOM 0 HE ARG B 126 25.787 -19.164 1.227 1.00 0.00 H new ATOM 0 HH11 ARG B 126 22.554 -17.739 1.410 1.00 0.00 H new ATOM 0 HH12 ARG B 126 21.929 -19.015 2.460 1.00 0.00 H new ATOM 0 HH21 ARG B 126 24.969 -20.781 2.594 1.00 0.00 H new ATOM 0 HH22 ARG B 126 23.285 -20.722 3.125 1.00 0.00 H new ATOM 1636 N GLU B 127 26.434 -13.999 4.365 1.00 0.00 N ATOM 1637 CA GLU B 127 26.585 -13.744 5.793 1.00 0.00 C ATOM 1638 C GLU B 127 25.407 -12.936 6.320 1.00 0.00 C ATOM 1639 O GLU B 127 24.958 -13.131 7.448 1.00 0.00 O ATOM 1640 CB GLU B 127 27.885 -12.978 6.057 1.00 0.00 C ATOM 1641 CG GLU B 127 29.148 -13.729 5.666 1.00 0.00 C ATOM 1642 CD GLU B 127 29.709 -14.572 6.793 1.00 0.00 C ATOM 1643 OE1 GLU B 127 30.299 -13.996 7.733 1.00 0.00 O ATOM 1644 OE2 GLU B 127 29.578 -15.813 6.736 1.00 0.00 O ATOM 0 H GLU B 127 27.117 -13.517 3.781 1.00 0.00 H new ATOM 0 HA GLU B 127 26.617 -14.703 6.309 1.00 0.00 H new ATOM 0 HB2 GLU B 127 27.854 -12.035 5.511 1.00 0.00 H new ATOM 0 HB3 GLU B 127 27.938 -12.731 7.117 1.00 0.00 H new ATOM 0 HG2 GLU B 127 28.932 -14.371 4.812 1.00 0.00 H new ATOM 0 HG3 GLU B 127 29.904 -13.013 5.344 1.00 0.00 H new ATOM 1646 N ALA B 128 24.914 -12.023 5.495 1.00 0.00 N ATOM 1647 CA ALA B 128 23.788 -11.181 5.869 1.00 0.00 C ATOM 1648 C ALA B 128 22.493 -11.724 5.275 1.00 0.00 C ATOM 1649 O ALA B 128 22.507 -12.675 4.493 1.00 0.00 O ATOM 1650 CB ALA B 128 24.030 -9.747 5.419 1.00 0.00 C ATOM 0 H ALA B 128 25.278 -11.847 4.559 1.00 0.00 H new ATOM 0 HA ALA B 128 23.692 -11.189 6.955 1.00 0.00 H new ATOM 0 HB1 ALA B 128 23.180 -9.128 5.705 1.00 0.00 H new ATOM 0 HB2 ALA B 128 24.934 -9.364 5.893 1.00 0.00 H new ATOM 0 HB3 ALA B 128 24.150 -9.721 4.336 1.00 0.00 H new ATOM 1652 N ASP B 129 21.376 -11.123 5.653 1.00 0.00 N ATOM 1653 CA ASP B 129 20.071 -11.539 5.163 1.00 0.00 C ATOM 1654 C ASP B 129 19.606 -10.620 4.036 1.00 0.00 C ATOM 1655 O ASP B 129 18.838 -9.682 4.249 1.00 0.00 O ATOM 1656 CB ASP B 129 19.044 -11.597 6.304 1.00 0.00 C ATOM 1657 CG ASP B 129 18.904 -10.299 7.088 1.00 0.00 C ATOM 1658 OD1 ASP B 129 19.925 -9.615 7.329 1.00 0.00 O ATOM 1659 OD2 ASP B 129 17.771 -9.965 7.492 1.00 0.00 O ATOM 0 H ASP B 129 21.348 -10.338 6.304 1.00 0.00 H new ATOM 0 HA ASP B 129 20.161 -12.547 4.758 1.00 0.00 H new ATOM 0 HB2 ASP B 129 18.072 -11.864 5.889 1.00 0.00 H new ATOM 0 HB3 ASP B 129 19.327 -12.394 6.991 1.00 0.00 H new ATOM 1661 N ILE B 130 20.099 -10.889 2.832 1.00 0.00 N ATOM 1662 CA ILE B 130 19.752 -10.084 1.670 1.00 0.00 C ATOM 1663 C ILE B 130 18.781 -10.808 0.740 1.00 0.00 C ATOM 1664 O ILE B 130 17.574 -10.556 0.770 1.00 0.00 O ATOM 1665 CB ILE B 130 21.008 -9.655 0.882 1.00 0.00 C ATOM 1666 CG1 ILE B 130 22.000 -8.955 1.819 1.00 0.00 C ATOM 1667 CG2 ILE B 130 20.628 -8.742 -0.281 1.00 0.00 C ATOM 1668 CD1 ILE B 130 23.313 -8.581 1.168 1.00 0.00 C ATOM 0 H ILE B 130 20.740 -11.658 2.637 1.00 0.00 H new ATOM 0 HA ILE B 130 19.256 -9.192 2.053 1.00 0.00 H new ATOM 0 HB ILE B 130 21.484 -10.545 0.470 1.00 0.00 H new ATOM 0 HG12 ILE B 130 21.534 -8.052 2.214 1.00 0.00 H new ATOM 0 HG13 ILE B 130 22.202 -9.608 2.668 1.00 0.00 H new ATOM 0 HG21 ILE B 130 21.527 -8.451 -0.824 1.00 0.00 H new ATOM 0 HG22 ILE B 130 19.953 -9.271 -0.954 1.00 0.00 H new ATOM 0 HG23 ILE B 130 20.132 -7.851 0.103 1.00 0.00 H new ATOM 0 HD11 ILE B 130 23.955 -8.091 1.900 1.00 0.00 H new ATOM 0 HD12 ILE B 130 23.805 -9.481 0.798 1.00 0.00 H new ATOM 0 HD13 ILE B 130 23.126 -7.901 0.337 1.00 0.00 H new ATOM 1670 N ASP B 131 19.308 -11.716 -0.078 1.00 0.00 N ATOM 1671 CA ASP B 131 18.482 -12.453 -1.030 1.00 0.00 C ATOM 1672 C ASP B 131 17.521 -13.388 -0.312 1.00 0.00 C ATOM 1673 O ASP B 131 17.920 -14.154 0.569 1.00 0.00 O ATOM 1674 CB ASP B 131 19.343 -13.229 -2.029 1.00 0.00 C ATOM 1675 CG ASP B 131 18.734 -13.251 -3.419 1.00 0.00 C ATOM 1676 OD1 ASP B 131 17.721 -13.946 -3.620 1.00 0.00 O ATOM 1677 OD2 ASP B 131 19.269 -12.562 -4.317 1.00 0.00 O ATOM 0 H ASP B 131 20.299 -11.958 -0.101 1.00 0.00 H new ATOM 0 HA ASP B 131 17.895 -11.723 -1.587 1.00 0.00 H new ATOM 0 HB2 ASP B 131 20.335 -12.780 -2.076 1.00 0.00 H new ATOM 0 HB3 ASP B 131 19.473 -14.252 -1.676 1.00 0.00 H new ATOM 1679 N GLY B 132 16.252 -13.304 -0.678 1.00 0.00 N ATOM 1680 CA GLY B 132 15.245 -14.133 -0.054 1.00 0.00 C ATOM 1681 C GLY B 132 14.606 -13.437 1.130 1.00 0.00 C ATOM 1682 O GLY B 132 13.651 -13.946 1.722 1.00 0.00 O ATOM 0 H GLY B 132 15.901 -12.674 -1.399 1.00 0.00 H new ATOM 0 HA2 GLY B 132 14.478 -14.387 -0.785 1.00 0.00 H new ATOM 0 HA3 GLY B 132 15.696 -15.070 0.274 1.00 0.00 H new ATOM 1684 N ASP B 133 15.129 -12.267 1.475 1.00 0.00 N ATOM 1685 CA ASP B 133 14.601 -11.505 2.596 1.00 0.00 C ATOM 1686 C ASP B 133 13.960 -10.202 2.125 1.00 0.00 C ATOM 1687 O ASP B 133 12.770 -10.170 1.817 1.00 0.00 O ATOM 1688 CB ASP B 133 15.677 -11.245 3.652 1.00 0.00 C ATOM 1689 CG ASP B 133 15.157 -11.453 5.060 1.00 0.00 C ATOM 1690 OD1 ASP B 133 14.634 -10.489 5.659 1.00 0.00 O ATOM 1691 OD2 ASP B 133 15.258 -12.589 5.575 1.00 0.00 O ATOM 0 H ASP B 133 15.915 -11.828 0.996 1.00 0.00 H new ATOM 0 HA ASP B 133 13.822 -12.107 3.064 1.00 0.00 H new ATOM 0 HB2 ASP B 133 16.524 -11.909 3.477 1.00 0.00 H new ATOM 0 HB3 ASP B 133 16.046 -10.224 3.549 1.00 0.00 H new ATOM 1693 N GLY B 134 14.743 -9.131 2.049 1.00 0.00 N ATOM 1694 CA GLY B 134 14.198 -7.861 1.609 1.00 0.00 C ATOM 1695 C GLY B 134 15.225 -6.749 1.518 1.00 0.00 C ATOM 1696 O GLY B 134 16.150 -6.815 0.712 1.00 0.00 O ATOM 0 H GLY B 134 15.736 -9.119 2.282 1.00 0.00 H new ATOM 0 HA2 GLY B 134 13.735 -7.995 0.632 1.00 0.00 H new ATOM 0 HA3 GLY B 134 13.409 -7.558 2.297 1.00 0.00 H new ATOM 1698 N GLN B 135 15.058 -5.734 2.360 1.00 0.00 N ATOM 1699 CA GLN B 135 15.945 -4.576 2.365 1.00 0.00 C ATOM 1700 C GLN B 135 17.245 -4.856 3.110 1.00 0.00 C ATOM 1701 O GLN B 135 17.311 -5.747 3.955 1.00 0.00 O ATOM 1702 CB GLN B 135 15.244 -3.370 3.000 1.00 0.00 C ATOM 1703 CG GLN B 135 13.877 -3.045 2.416 1.00 0.00 C ATOM 1704 CD GLN B 135 13.913 -2.769 0.923 1.00 0.00 C ATOM 1705 OE1 GLN B 135 14.934 -2.364 0.374 1.00 0.00 O ATOM 1706 NE2 GLN B 135 12.785 -2.967 0.260 1.00 0.00 N ATOM 0 H GLN B 135 14.310 -5.691 3.053 1.00 0.00 H new ATOM 0 HA GLN B 135 16.191 -4.356 1.326 1.00 0.00 H new ATOM 0 HB2 GLN B 135 15.132 -3.554 4.069 1.00 0.00 H new ATOM 0 HB3 GLN B 135 15.886 -2.496 2.892 1.00 0.00 H new ATOM 0 HG2 GLN B 135 13.200 -3.877 2.609 1.00 0.00 H new ATOM 0 HG3 GLN B 135 13.467 -2.175 2.930 1.00 0.00 H new ATOM 0 HE21 GLN B 135 11.957 -3.304 0.751 1.00 0.00 H new ATOM 0 HE22 GLN B 135 12.743 -2.782 -0.742 1.00 0.00 H new ATOM 1710 N VAL B 136 18.276 -4.084 2.788 1.00 0.00 N ATOM 1711 CA VAL B 136 19.580 -4.230 3.422 1.00 0.00 C ATOM 1712 C VAL B 136 20.039 -2.900 4.016 1.00 0.00 C ATOM 1713 O VAL B 136 20.021 -1.868 3.342 1.00 0.00 O ATOM 1714 CB VAL B 136 20.649 -4.705 2.411 1.00 0.00 C ATOM 1715 CG1 VAL B 136 21.902 -5.172 3.134 1.00 0.00 C ATOM 1716 CG2 VAL B 136 20.099 -5.801 1.513 1.00 0.00 C ATOM 0 H VAL B 136 18.233 -3.345 2.086 1.00 0.00 H new ATOM 0 HA VAL B 136 19.471 -4.976 4.209 1.00 0.00 H new ATOM 0 HB VAL B 136 20.918 -3.859 1.779 1.00 0.00 H new ATOM 0 HG11 VAL B 136 22.641 -5.502 2.404 1.00 0.00 H new ATOM 0 HG12 VAL B 136 22.312 -4.349 3.720 1.00 0.00 H new ATOM 0 HG13 VAL B 136 21.652 -6.000 3.797 1.00 0.00 H new ATOM 0 HG21 VAL B 136 20.870 -6.118 0.811 1.00 0.00 H new ATOM 0 HG22 VAL B 136 19.792 -6.651 2.123 1.00 0.00 H new ATOM 0 HG23 VAL B 136 19.239 -5.422 0.960 1.00 0.00 H new ATOM 1718 N ASN B 137 20.443 -2.928 5.277 1.00 0.00 N ATOM 1719 CA ASN B 137 20.920 -1.730 5.951 1.00 0.00 C ATOM 1720 C ASN B 137 22.440 -1.628 5.841 1.00 0.00 C ATOM 1721 O ASN B 137 23.171 -2.505 6.301 1.00 0.00 O ATOM 1722 CB ASN B 137 20.442 -1.670 7.411 1.00 0.00 C ATOM 1723 CG ASN B 137 20.846 -2.872 8.250 1.00 0.00 C ATOM 1724 OD1 ASN B 137 21.049 -3.974 7.740 1.00 0.00 O ATOM 1725 ND2 ASN B 137 20.947 -2.673 9.552 1.00 0.00 N ATOM 0 H ASN B 137 20.450 -3.768 5.855 1.00 0.00 H new ATOM 0 HA ASN B 137 20.489 -0.863 5.450 1.00 0.00 H new ATOM 0 HB2 ASN B 137 20.840 -0.767 7.875 1.00 0.00 H new ATOM 0 HB3 ASN B 137 19.356 -1.582 7.422 1.00 0.00 H new ATOM 0 HD21 ASN B 137 21.200 -3.446 10.168 1.00 0.00 H new ATOM 0 HD22 ASN B 137 20.772 -1.747 9.941 1.00 0.00 H new ATOM 1729 N TYR B 138 22.907 -0.550 5.222 1.00 0.00 N ATOM 1730 CA TYR B 138 24.338 -0.334 5.004 1.00 0.00 C ATOM 1731 C TYR B 138 25.150 -0.264 6.296 1.00 0.00 C ATOM 1732 O TYR B 138 26.349 -0.546 6.291 1.00 0.00 O ATOM 1733 CB TYR B 138 24.585 0.910 4.138 1.00 0.00 C ATOM 1734 CG TYR B 138 24.504 2.236 4.876 1.00 0.00 C ATOM 1735 CD1 TYR B 138 23.280 2.832 5.149 1.00 0.00 C ATOM 1736 CD2 TYR B 138 25.655 2.894 5.290 1.00 0.00 C ATOM 1737 CE1 TYR B 138 23.205 4.043 5.813 1.00 0.00 C ATOM 1738 CE2 TYR B 138 25.593 4.103 5.954 1.00 0.00 C ATOM 1739 CZ TYR B 138 24.366 4.673 6.214 1.00 0.00 C ATOM 1740 OH TYR B 138 24.298 5.878 6.875 1.00 0.00 O ATOM 0 H TYR B 138 22.313 0.195 4.859 1.00 0.00 H new ATOM 0 HA TYR B 138 24.693 -1.215 4.468 1.00 0.00 H new ATOM 0 HB2 TYR B 138 25.571 0.826 3.681 1.00 0.00 H new ATOM 0 HB3 TYR B 138 23.858 0.919 3.326 1.00 0.00 H new ATOM 0 HD1 TYR B 138 22.370 2.341 4.837 1.00 0.00 H new ATOM 0 HD2 TYR B 138 26.619 2.451 5.088 1.00 0.00 H new ATOM 0 HE1 TYR B 138 22.244 4.493 6.016 1.00 0.00 H new ATOM 0 HE2 TYR B 138 26.500 4.598 6.267 1.00 0.00 H new ATOM 0 HH TYR B 138 25.204 6.186 7.088 1.00 0.00 H new ATOM 1743 N GLU B 139 24.500 0.093 7.397 1.00 0.00 N ATOM 1744 CA GLU B 139 25.177 0.221 8.683 1.00 0.00 C ATOM 1745 C GLU B 139 25.874 -1.066 9.115 1.00 0.00 C ATOM 1746 O GLU B 139 26.979 -1.021 9.662 1.00 0.00 O ATOM 1747 CB GLU B 139 24.214 0.708 9.762 1.00 0.00 C ATOM 1748 CG GLU B 139 23.684 2.108 9.514 1.00 0.00 C ATOM 1749 CD GLU B 139 23.091 2.726 10.757 1.00 0.00 C ATOM 1750 OE1 GLU B 139 21.972 2.340 11.139 1.00 0.00 O ATOM 1751 OE2 GLU B 139 23.743 3.607 11.357 1.00 0.00 O ATOM 0 H GLU B 139 23.502 0.300 7.426 1.00 0.00 H new ATOM 0 HA GLU B 139 25.958 0.970 8.550 1.00 0.00 H new ATOM 0 HB2 GLU B 139 23.374 0.016 9.827 1.00 0.00 H new ATOM 0 HB3 GLU B 139 24.721 0.686 10.727 1.00 0.00 H new ATOM 0 HG2 GLU B 139 24.493 2.740 9.147 1.00 0.00 H new ATOM 0 HG3 GLU B 139 22.926 2.074 8.731 1.00 0.00 H new ATOM 1753 N GLU B 140 25.244 -2.208 8.854 1.00 0.00 N ATOM 1754 CA GLU B 140 25.819 -3.495 9.228 1.00 0.00 C ATOM 1755 C GLU B 140 27.133 -3.740 8.498 1.00 0.00 C ATOM 1756 O GLU B 140 28.084 -4.269 9.069 1.00 0.00 O ATOM 1757 CB GLU B 140 24.840 -4.639 8.956 1.00 0.00 C ATOM 1758 CG GLU B 140 23.738 -4.768 9.992 1.00 0.00 C ATOM 1759 CD GLU B 140 24.265 -4.742 11.415 1.00 0.00 C ATOM 1760 OE1 GLU B 140 25.311 -5.370 11.684 1.00 0.00 O ATOM 1761 OE2 GLU B 140 23.632 -4.095 12.276 1.00 0.00 O ATOM 0 H GLU B 140 24.339 -2.268 8.387 1.00 0.00 H new ATOM 0 HA GLU B 140 26.020 -3.464 10.299 1.00 0.00 H new ATOM 0 HB2 GLU B 140 24.387 -4.491 7.976 1.00 0.00 H new ATOM 0 HB3 GLU B 140 25.395 -5.576 8.912 1.00 0.00 H new ATOM 0 HG2 GLU B 140 23.023 -3.956 9.859 1.00 0.00 H new ATOM 0 HG3 GLU B 140 23.197 -5.700 9.826 1.00 0.00 H new ATOM 1763 N PHE B 141 27.187 -3.339 7.238 1.00 0.00 N ATOM 1764 CA PHE B 141 28.391 -3.517 6.443 1.00 0.00 C ATOM 1765 C PHE B 141 29.459 -2.504 6.837 1.00 0.00 C ATOM 1766 O PHE B 141 30.646 -2.821 6.867 1.00 0.00 O ATOM 1767 CB PHE B 141 28.076 -3.434 4.949 1.00 0.00 C ATOM 1768 CG PHE B 141 27.419 -4.674 4.412 1.00 0.00 C ATOM 1769 CD1 PHE B 141 28.185 -5.734 3.956 1.00 0.00 C ATOM 1770 CD2 PHE B 141 26.039 -4.783 4.367 1.00 0.00 C ATOM 1771 CE1 PHE B 141 27.588 -6.878 3.465 1.00 0.00 C ATOM 1772 CE2 PHE B 141 25.436 -5.925 3.876 1.00 0.00 C ATOM 1773 CZ PHE B 141 26.212 -6.975 3.425 1.00 0.00 C ATOM 0 H PHE B 141 26.415 -2.890 6.746 1.00 0.00 H new ATOM 0 HA PHE B 141 28.785 -4.513 6.646 1.00 0.00 H new ATOM 0 HB2 PHE B 141 27.425 -2.579 4.769 1.00 0.00 H new ATOM 0 HB3 PHE B 141 29.000 -3.253 4.399 1.00 0.00 H new ATOM 0 HD1 PHE B 141 29.262 -5.665 3.985 1.00 0.00 H new ATOM 0 HD2 PHE B 141 25.427 -3.966 4.720 1.00 0.00 H new ATOM 0 HE1 PHE B 141 28.198 -7.697 3.112 1.00 0.00 H new ATOM 0 HE2 PHE B 141 24.359 -5.997 3.845 1.00 0.00 H new ATOM 0 HZ PHE B 141 25.743 -7.869 3.042 1.00 0.00 H new ATOM 1775 N VAL B 142 29.029 -1.288 7.153 1.00 0.00 N ATOM 1776 CA VAL B 142 29.954 -0.231 7.551 1.00 0.00 C ATOM 1777 C VAL B 142 30.714 -0.618 8.818 1.00 0.00 C ATOM 1778 O VAL B 142 31.941 -0.517 8.873 1.00 0.00 O ATOM 1779 CB VAL B 142 29.228 1.114 7.759 1.00 0.00 C ATOM 1780 CG1 VAL B 142 30.150 2.132 8.416 1.00 0.00 C ATOM 1781 CG2 VAL B 142 28.725 1.646 6.427 1.00 0.00 C ATOM 0 H VAL B 142 28.048 -1.009 7.142 1.00 0.00 H new ATOM 0 HA VAL B 142 30.668 -0.107 6.737 1.00 0.00 H new ATOM 0 HB VAL B 142 28.378 0.947 8.420 1.00 0.00 H new ATOM 0 HG11 VAL B 142 29.616 3.072 8.552 1.00 0.00 H new ATOM 0 HG12 VAL B 142 30.475 1.756 9.386 1.00 0.00 H new ATOM 0 HG13 VAL B 142 31.020 2.298 7.781 1.00 0.00 H new ATOM 0 HG21 VAL B 142 28.214 2.596 6.584 1.00 0.00 H new ATOM 0 HG22 VAL B 142 29.568 1.795 5.753 1.00 0.00 H new ATOM 0 HG23 VAL B 142 28.031 0.929 5.987 1.00 0.00 H new ATOM 1783 N GLN B 143 29.980 -1.082 9.822 1.00 0.00 N ATOM 1784 CA GLN B 143 30.580 -1.490 11.084 1.00 0.00 C ATOM 1785 C GLN B 143 31.498 -2.691 10.893 1.00 0.00 C ATOM 1786 O GLN B 143 32.575 -2.756 11.476 1.00 0.00 O ATOM 1787 CB GLN B 143 29.504 -1.795 12.127 1.00 0.00 C ATOM 1788 CG GLN B 143 28.932 -0.552 12.787 1.00 0.00 C ATOM 1789 CD GLN B 143 27.872 -0.869 13.822 1.00 0.00 C ATOM 1790 OE1 GLN B 143 27.107 -1.825 13.675 1.00 0.00 O ATOM 1791 NE2 GLN B 143 27.826 -0.072 14.881 1.00 0.00 N ATOM 0 H GLN B 143 28.966 -1.185 9.785 1.00 0.00 H new ATOM 0 HA GLN B 143 31.183 -0.659 11.449 1.00 0.00 H new ATOM 0 HB2 GLN B 143 28.695 -2.350 11.652 1.00 0.00 H new ATOM 0 HB3 GLN B 143 29.927 -2.443 12.895 1.00 0.00 H new ATOM 0 HG2 GLN B 143 29.740 0.006 13.261 1.00 0.00 H new ATOM 0 HG3 GLN B 143 28.503 0.095 12.022 1.00 0.00 H new ATOM 0 HE21 GLN B 143 28.479 0.708 14.961 1.00 0.00 H new ATOM 0 HE22 GLN B 143 27.138 -0.239 15.615 1.00 0.00 H new ATOM 1795 N MET B 144 31.073 -3.628 10.057 1.00 0.00 N ATOM 1796 CA MET B 144 31.868 -4.823 9.785 1.00 0.00 C ATOM 1797 C MET B 144 33.161 -4.460 9.061 1.00 0.00 C ATOM 1798 O MET B 144 34.232 -4.977 9.377 1.00 0.00 O ATOM 1799 CB MET B 144 31.068 -5.829 8.955 1.00 0.00 C ATOM 1800 CG MET B 144 31.780 -7.157 8.743 1.00 0.00 C ATOM 1801 SD MET B 144 31.012 -8.170 7.464 1.00 0.00 S ATOM 1802 CE MET B 144 29.406 -8.489 8.194 1.00 0.00 C ATOM 0 H MET B 144 30.186 -3.587 9.556 1.00 0.00 H new ATOM 0 HA MET B 144 32.121 -5.281 10.741 1.00 0.00 H new ATOM 0 HB2 MET B 144 30.113 -6.014 9.448 1.00 0.00 H new ATOM 0 HB3 MET B 144 30.845 -5.388 7.983 1.00 0.00 H new ATOM 0 HG2 MET B 144 32.819 -6.967 8.474 1.00 0.00 H new ATOM 0 HG3 MET B 144 31.790 -7.712 9.681 1.00 0.00 H new ATOM 0 HE1 MET B 144 28.869 -9.219 7.588 1.00 0.00 H new ATOM 0 HE2 MET B 144 29.536 -8.881 9.203 1.00 0.00 H new ATOM 0 HE3 MET B 144 28.835 -7.562 8.236 1.00 0.00 H new ATOM 1804 N MET B 145 33.058 -3.548 8.100 1.00 0.00 N ATOM 1805 CA MET B 145 34.215 -3.112 7.323 1.00 0.00 C ATOM 1806 C MET B 145 35.230 -2.368 8.183 1.00 0.00 C ATOM 1807 O MET B 145 36.426 -2.402 7.906 1.00 0.00 O ATOM 1808 CB MET B 145 33.793 -2.244 6.133 1.00 0.00 C ATOM 1809 CG MET B 145 33.206 -3.024 4.966 1.00 0.00 C ATOM 1810 SD MET B 145 32.879 -1.989 3.527 1.00 0.00 S ATOM 1811 CE MET B 145 31.716 -0.808 4.205 1.00 0.00 C ATOM 0 H MET B 145 32.182 -3.095 7.839 1.00 0.00 H new ATOM 0 HA MET B 145 34.694 -4.014 6.942 1.00 0.00 H new ATOM 0 HB2 MET B 145 33.058 -1.514 6.473 1.00 0.00 H new ATOM 0 HB3 MET B 145 34.660 -1.684 5.781 1.00 0.00 H new ATOM 0 HG2 MET B 145 33.894 -3.821 4.685 1.00 0.00 H new ATOM 0 HG3 MET B 145 32.278 -3.500 5.283 1.00 0.00 H new ATOM 0 HE1 MET B 145 31.248 -0.251 3.393 1.00 0.00 H new ATOM 0 HE2 MET B 145 30.949 -1.337 4.772 1.00 0.00 H new ATOM 0 HE3 MET B 145 32.242 -0.116 4.863 1.00 0.00 H new ATOM 1813 N THR B 146 34.753 -1.705 9.229 1.00 0.00 N ATOM 1814 CA THR B 146 35.635 -0.958 10.116 1.00 0.00 C ATOM 1815 C THR B 146 36.148 -1.836 11.258 1.00 0.00 C ATOM 1816 O THR B 146 36.967 -1.408 12.072 1.00 0.00 O ATOM 1817 CB THR B 146 34.944 0.301 10.680 1.00 0.00 C ATOM 1818 OG1 THR B 146 33.577 0.005 10.997 1.00 0.00 O ATOM 1819 CG2 THR B 146 34.984 1.432 9.662 1.00 0.00 C ATOM 0 H THR B 146 33.766 -1.669 9.483 1.00 0.00 H new ATOM 0 HA THR B 146 36.488 -0.636 9.518 1.00 0.00 H new ATOM 0 HB THR B 146 35.474 0.610 11.581 1.00 0.00 H new ATOM 0 HG1 THR B 146 33.049 -0.023 10.172 1.00 0.00 H new ATOM 0 HG21 THR B 146 34.492 2.312 10.076 1.00 0.00 H new ATOM 0 HG22 THR B 146 36.021 1.673 9.426 1.00 0.00 H new ATOM 0 HG23 THR B 146 34.468 1.122 8.753 1.00 0.00 H new ATOM 1822 N ALA B 147 35.671 -3.072 11.303 1.00 0.00 N ATOM 1823 CA ALA B 147 36.081 -4.011 12.339 1.00 0.00 C ATOM 1824 C ALA B 147 36.970 -5.098 11.749 1.00 0.00 C ATOM 1825 O ALA B 147 37.261 -6.107 12.396 1.00 0.00 O ATOM 1826 CB ALA B 147 34.864 -4.622 13.017 1.00 0.00 C ATOM 0 H ALA B 147 34.999 -3.449 10.634 1.00 0.00 H new ATOM 0 HA ALA B 147 36.654 -3.469 13.091 1.00 0.00 H new ATOM 0 HB1 ALA B 147 35.189 -5.321 13.788 1.00 0.00 H new ATOM 0 HB2 ALA B 147 34.266 -3.832 13.472 1.00 0.00 H new ATOM 0 HB3 ALA B 147 34.263 -5.152 12.278 1.00 0.00 H new ATOM 1828 N LYS B 148 37.389 -4.889 10.513 1.00 0.00 N ATOM 1829 CA LYS B 148 38.248 -5.838 9.827 1.00 0.00 C ATOM 1830 C LYS B 148 39.490 -5.135 9.299 1.00 0.00 C ATOM 1831 O LYS B 148 39.343 -4.086 8.640 1.00 0.00 O ATOM 1832 CB LYS B 148 37.500 -6.534 8.686 1.00 0.00 C ATOM 1833 CG LYS B 148 36.392 -7.470 9.146 1.00 0.00 C ATOM 1834 CD LYS B 148 35.815 -8.273 7.988 1.00 0.00 C ATOM 1835 CE LYS B 148 36.834 -9.258 7.433 1.00 0.00 C ATOM 1836 NZ LYS B 148 36.223 -10.222 6.479 1.00 0.00 N ATOM 1837 OXT LYS B 148 40.608 -5.625 9.562 1.00 0.00 O ATOM 0 H LYS B 148 37.147 -4.066 9.962 1.00 0.00 H new ATOM 0 HA LYS B 148 38.553 -6.602 10.543 1.00 0.00 H new ATOM 0 HB2 LYS B 148 37.071 -5.775 8.032 1.00 0.00 H new ATOM 0 HB3 LYS B 148 38.215 -7.101 8.090 1.00 0.00 H new ATOM 0 HG2 LYS B 148 36.782 -8.151 9.902 1.00 0.00 H new ATOM 0 HG3 LYS B 148 35.599 -6.890 9.618 1.00 0.00 H new ATOM 0 HD2 LYS B 148 34.930 -8.813 8.323 1.00 0.00 H new ATOM 0 HD3 LYS B 148 35.494 -7.595 7.197 1.00 0.00 H new ATOM 0 HE2 LYS B 148 37.631 -8.709 6.932 1.00 0.00 H new ATOM 0 HE3 LYS B 148 37.293 -9.806 8.256 1.00 0.00 H new ATOM 0 HZ1 LYS B 148 36.954 -10.873 6.127 1.00 0.00 H new ATOM 0 HZ2 LYS B 148 35.480 -10.765 6.963 1.00 0.00 H new ATOM 0 HZ3 LYS B 148 35.808 -9.703 5.679 1.00 0.00 H new