USER MOD reduce.3.24.130724 H: found=0, std=0, add=1216, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1214 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 121 ASN : amide:sc= -0.189 X(o=0.86,f=0.83) USER MOD Set 1.2: A 147 THR OG1 : rot -72:sc= 1.05 USER MOD Set 2.1: A 110 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 112 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 80 CYS SG : rot 160:sc= 0 USER MOD Set 3.2: A 103 ASN : amide:sc= -0.525 K(o=-0.53,f=-3.9!) USER MOD Set 4.1: A 38 TYR OH : rot -15:sc= 0.301 USER MOD Set 4.2: A 47 ASN :FLIP amide:sc= 0.32 F(o=-0.5,f=0.62) USER MOD Set 5.1: A 35 THR OG1 : rot 157:sc= 1.6 USER MOD Set 5.2: A 66 TYR OH : rot 70:sc= -0.408 USER MOD Set 6.1: A 32 TYR OH : rot 155:sc= 0.0893 USER MOD Set 6.2: A 84 CYS SG : rot -5:sc= -0.0311 USER MOD Set 6.3: A 96 HIS : no HD1:sc= -6.34! C(o=-6.3!,f=-6.3!) USER MOD Set 7.1: A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 7.2: A 61 ASN :FLIP amide:sc= -0.0111 F(o=-0.74,f=-0.011) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.202 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot -16:sc= 0.684 USER MOD Single : A 8 ASN : amide:sc= -2.6! C(o=-2.6!,f=-3.7!) USER MOD Single : A 9 SER OG : rot 54:sc= 0.236 USER MOD Single : A 17 CYS SG : rot 180:sc= -0.0083 USER MOD Single : A 19 THR OG1 : rot -96:sc= 1.84 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 ASN : amide:sc= -0.248 K(o=-0.25,f=-1.1) USER MOD Single : A 24 ASN : amide:sc= -0.0637 K(o=-0.064,f=-1.7!) USER MOD Single : A 30 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0881) USER MOD Single : A 39 HIS : no HD1:sc= -4.84! C(o=-4.8!,f=-5!) USER MOD Single : A 45 CYS SG : rot 30:sc= 0.434 USER MOD Single : A 49 ASN : amide:sc= -0.0142 X(o=-0.014,f=-0.014) USER MOD Single : A 50 THR OG1 : rot 120:sc= 0.398 USER MOD Single : A 51 GLN : amide:sc=-0.00925 K(o=-0.0092,f=-2!) USER MOD Single : A 55 CYS SG : rot 70:sc= -0.323 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc= -0.0348 K(o=-0.035,f=-1.1) USER MOD Single : A 65 ASN : amide:sc= -0.161 X(o=-0.16,f=-0.13) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 140:sc= -5.15! USER MOD Single : A 85 SER OG : rot 30:sc= 0.36 USER MOD Single : A 87 LYS NZ :NH3+ -162:sc= -0.0226 (180deg=-0.194) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 CYS SG : rot 180:sc= 0 USER MOD Single : A 105 ASN : amide:sc= -0.129 K(o=-0.13,f=-2.1!) USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 47:sc= 1.2 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 MET CE :methyl 165:sc= 0 (180deg=-0.088) USER MOD Single : A 127 HIS : no HD1:sc= -0.461 X(o=-0.46,f=-0.052) USER MOD Single : A 134 ASN : amide:sc= -0.584 K(o=-0.58,f=-1.3) USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 34:sc= 0.0454 USER MOD Single : A 142 ASN : amide:sc= -12.9! C(o=-13!,f=-19!) USER MOD Single : A 144 ASN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 145 LYS NZ :NH3+ -123:sc= -0.143! (180deg=-0.837) USER MOD Single : A 149 CYS SG : rot 44:sc= -0.304 USER MOD Single : A 158 SER OG : rot -40:sc= 1.44 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 0.084 27.868 -12.776 1.00 0.00 N ATOM 2 CA GLY A 1 0.291 27.923 -11.341 1.00 0.00 C ATOM 3 C GLY A 1 0.647 26.572 -10.754 1.00 0.00 C ATOM 4 O GLY A 1 0.060 26.145 -9.760 1.00 0.00 O ATOM 0 H1 GLY A 1 -0.157 28.816 -13.129 1.00 0.00 H new ATOM 0 H2 GLY A 1 0.954 27.537 -13.240 1.00 0.00 H new ATOM 0 H3 GLY A 1 -0.694 27.211 -12.990 1.00 0.00 H new ATOM 0 HA2 GLY A 1 1.087 28.633 -11.119 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -0.613 28.297 -10.861 1.00 0.00 H new ATOM 8 N SER A 2 1.611 25.896 -11.371 1.00 0.00 N ATOM 9 CA SER A 2 2.040 24.582 -10.906 1.00 0.00 C ATOM 10 C SER A 2 3.468 24.286 -11.357 1.00 0.00 C ATOM 11 O SER A 2 3.824 24.510 -12.514 1.00 0.00 O ATOM 12 CB SER A 2 1.094 23.499 -11.428 1.00 0.00 C ATOM 13 OG SER A 2 -0.238 23.740 -11.008 1.00 0.00 O ATOM 0 H SER A 2 2.109 26.236 -12.193 1.00 0.00 H new ATOM 0 HA SER A 2 2.014 24.583 -9.816 1.00 0.00 H new ATOM 0 HB2 SER A 2 1.136 23.469 -12.517 1.00 0.00 H new ATOM 0 HB3 SER A 2 1.421 22.523 -11.070 1.00 0.00 H new ATOM 0 HG SER A 2 -0.823 23.035 -11.356 1.00 0.00 H new ATOM 19 N SER A 3 4.280 23.781 -10.434 1.00 0.00 N ATOM 20 CA SER A 3 5.670 23.458 -10.735 1.00 0.00 C ATOM 21 C SER A 3 5.758 22.422 -11.851 1.00 0.00 C ATOM 22 O SER A 3 4.741 21.943 -12.350 1.00 0.00 O ATOM 23 CB SER A 3 6.376 22.936 -9.482 1.00 0.00 C ATOM 24 OG SER A 3 6.850 24.004 -8.680 1.00 0.00 O ATOM 0 H SER A 3 4.000 23.587 -9.473 1.00 0.00 H new ATOM 0 HA SER A 3 6.165 24.369 -11.070 1.00 0.00 H new ATOM 0 HB2 SER A 3 5.688 22.320 -8.903 1.00 0.00 H new ATOM 0 HB3 SER A 3 7.210 22.296 -9.771 1.00 0.00 H new ATOM 0 HG SER A 3 7.295 23.643 -7.885 1.00 0.00 H new ATOM 30 N GLY A 4 6.984 22.080 -12.238 1.00 0.00 N ATOM 31 CA GLY A 4 7.184 21.103 -13.292 1.00 0.00 C ATOM 32 C GLY A 4 7.887 19.854 -12.800 1.00 0.00 C ATOM 33 O GLY A 4 8.466 19.847 -11.714 1.00 0.00 O ATOM 0 H GLY A 4 7.842 22.462 -11.840 1.00 0.00 H new ATOM 0 HA2 GLY A 4 6.218 20.829 -13.717 1.00 0.00 H new ATOM 0 HA3 GLY A 4 7.769 21.553 -14.094 1.00 0.00 H new ATOM 37 N SER A 5 7.836 18.794 -13.600 1.00 0.00 N ATOM 38 CA SER A 5 8.469 17.531 -13.237 1.00 0.00 C ATOM 39 C SER A 5 7.806 16.926 -12.003 1.00 0.00 C ATOM 40 O SER A 5 8.482 16.467 -11.083 1.00 0.00 O ATOM 41 CB SER A 5 9.962 17.742 -12.975 1.00 0.00 C ATOM 42 OG SER A 5 10.695 16.554 -13.222 1.00 0.00 O ATOM 0 H SER A 5 7.363 18.784 -14.504 1.00 0.00 H new ATOM 0 HA SER A 5 8.347 16.839 -14.070 1.00 0.00 H new ATOM 0 HB2 SER A 5 10.337 18.543 -13.612 1.00 0.00 H new ATOM 0 HB3 SER A 5 10.112 18.058 -11.943 1.00 0.00 H new ATOM 0 HG SER A 5 11.646 16.715 -13.049 1.00 0.00 H new ATOM 48 N SER A 6 6.477 16.929 -11.992 1.00 0.00 N ATOM 49 CA SER A 6 5.720 16.384 -10.871 1.00 0.00 C ATOM 50 C SER A 6 4.289 16.059 -11.288 1.00 0.00 C ATOM 51 O SER A 6 3.721 16.714 -12.161 1.00 0.00 O ATOM 52 CB SER A 6 5.711 17.375 -9.705 1.00 0.00 C ATOM 53 OG SER A 6 7.028 17.661 -9.269 1.00 0.00 O ATOM 0 H SER A 6 5.902 17.303 -12.747 1.00 0.00 H new ATOM 0 HA SER A 6 6.205 15.462 -10.551 1.00 0.00 H new ATOM 0 HB2 SER A 6 5.218 18.297 -10.011 1.00 0.00 H new ATOM 0 HB3 SER A 6 5.132 16.963 -8.878 1.00 0.00 H new ATOM 0 HG SER A 6 7.642 16.981 -9.616 1.00 0.00 H new ATOM 59 N GLY A 7 3.712 15.040 -10.657 1.00 0.00 N ATOM 60 CA GLY A 7 2.353 14.644 -10.975 1.00 0.00 C ATOM 61 C GLY A 7 1.979 13.309 -10.363 1.00 0.00 C ATOM 62 O GLY A 7 1.706 12.346 -11.078 1.00 0.00 O ATOM 0 H GLY A 7 4.162 14.482 -9.931 1.00 0.00 H new ATOM 0 HA2 GLY A 7 1.663 15.409 -10.620 1.00 0.00 H new ATOM 0 HA3 GLY A 7 2.238 14.589 -12.058 1.00 0.00 H new ATOM 66 N ASN A 8 1.970 13.251 -9.035 1.00 0.00 N ATOM 67 CA ASN A 8 1.629 12.022 -8.327 1.00 0.00 C ATOM 68 C ASN A 8 0.264 12.141 -7.657 1.00 0.00 C ATOM 69 O ASN A 8 0.032 13.043 -6.853 1.00 0.00 O ATOM 70 CB ASN A 8 2.697 11.701 -7.279 1.00 0.00 C ATOM 71 CG ASN A 8 3.279 12.949 -6.644 1.00 0.00 C ATOM 72 OD1 ASN A 8 2.606 13.642 -5.882 1.00 0.00 O ATOM 73 ND2 ASN A 8 4.536 13.241 -6.958 1.00 0.00 N ATOM 0 H ASN A 8 2.195 14.039 -8.428 1.00 0.00 H new ATOM 0 HA ASN A 8 1.587 11.212 -9.055 1.00 0.00 H new ATOM 0 HB2 ASN A 8 2.262 11.071 -6.503 1.00 0.00 H new ATOM 0 HB3 ASN A 8 3.498 11.127 -7.745 1.00 0.00 H new ATOM 0 HD21 ASN A 8 4.981 14.069 -6.563 1.00 0.00 H new ATOM 0 HD22 ASN A 8 5.056 12.637 -7.595 1.00 0.00 H new ATOM 80 N SER A 9 -0.637 11.223 -7.996 1.00 0.00 N ATOM 81 CA SER A 9 -1.981 11.227 -7.430 1.00 0.00 C ATOM 82 C SER A 9 -2.383 9.826 -6.977 1.00 0.00 C ATOM 83 O SER A 9 -2.891 9.642 -5.872 1.00 0.00 O ATOM 84 CB SER A 9 -2.987 11.752 -8.455 1.00 0.00 C ATOM 85 OG SER A 9 -4.227 11.074 -8.347 1.00 0.00 O ATOM 0 H SER A 9 -0.460 10.468 -8.659 1.00 0.00 H new ATOM 0 HA SER A 9 -1.981 11.885 -6.561 1.00 0.00 H new ATOM 0 HB2 SER A 9 -3.139 12.821 -8.305 1.00 0.00 H new ATOM 0 HB3 SER A 9 -2.586 11.625 -9.461 1.00 0.00 H new ATOM 0 HG SER A 9 -4.546 11.122 -7.422 1.00 0.00 H new ATOM 91 N ALA A 10 -2.152 8.843 -7.841 1.00 0.00 N ATOM 92 CA ALA A 10 -2.488 7.459 -7.530 1.00 0.00 C ATOM 93 C ALA A 10 -1.230 6.608 -7.385 1.00 0.00 C ATOM 94 O ALA A 10 -0.320 6.680 -8.212 1.00 0.00 O ATOM 95 CB ALA A 10 -3.395 6.882 -8.607 1.00 0.00 C ATOM 0 H ALA A 10 -1.734 8.979 -8.761 1.00 0.00 H new ATOM 0 HA ALA A 10 -3.017 7.445 -6.577 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -3.638 5.848 -8.362 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -4.313 7.467 -8.662 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -2.885 6.917 -9.569 1.00 0.00 H new ATOM 101 N LEU A 11 -1.185 5.804 -6.328 1.00 0.00 N ATOM 102 CA LEU A 11 -0.038 4.939 -6.074 1.00 0.00 C ATOM 103 C LEU A 11 -0.147 3.642 -6.869 1.00 0.00 C ATOM 104 O LEU A 11 -1.157 2.942 -6.798 1.00 0.00 O ATOM 105 CB LEU A 11 0.069 4.628 -4.580 1.00 0.00 C ATOM 106 CG LEU A 11 0.975 3.456 -4.202 1.00 0.00 C ATOM 107 CD1 LEU A 11 2.380 3.672 -4.740 1.00 0.00 C ATOM 108 CD2 LEU A 11 1.003 3.269 -2.692 1.00 0.00 C ATOM 0 H LEU A 11 -1.929 5.733 -5.634 1.00 0.00 H new ATOM 0 HA LEU A 11 0.861 5.465 -6.395 1.00 0.00 H new ATOM 0 HB2 LEU A 11 0.430 5.520 -4.068 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -0.932 4.425 -4.199 1.00 0.00 H new ATOM 0 HG LEU A 11 0.571 2.550 -4.653 1.00 0.00 H new ATOM 0 HD11 LEU A 11 3.010 2.828 -4.461 1.00 0.00 H new ATOM 0 HD12 LEU A 11 2.345 3.755 -5.826 1.00 0.00 H new ATOM 0 HD13 LEU A 11 2.794 4.588 -4.319 1.00 0.00 H new ATOM 0 HD21 LEU A 11 1.653 2.431 -2.441 1.00 0.00 H new ATOM 0 HD22 LEU A 11 1.382 4.176 -2.220 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -0.006 3.067 -2.332 1.00 0.00 H new ATOM 120 N ARG A 12 0.900 3.327 -7.623 1.00 0.00 N ATOM 121 CA ARG A 12 0.923 2.113 -8.431 1.00 0.00 C ATOM 122 C ARG A 12 2.144 1.261 -8.097 1.00 0.00 C ATOM 123 O ARG A 12 3.282 1.708 -8.239 1.00 0.00 O ATOM 124 CB ARG A 12 0.924 2.465 -9.919 1.00 0.00 C ATOM 125 CG ARG A 12 1.406 1.334 -10.813 1.00 0.00 C ATOM 126 CD ARG A 12 0.763 1.399 -12.189 1.00 0.00 C ATOM 127 NE ARG A 12 1.608 0.796 -13.217 1.00 0.00 N ATOM 128 CZ ARG A 12 1.139 0.302 -14.357 1.00 0.00 C ATOM 129 NH1 ARG A 12 -0.161 0.340 -14.615 1.00 0.00 N ATOM 130 NH2 ARG A 12 1.971 -0.230 -15.243 1.00 0.00 N ATOM 0 H ARG A 12 1.744 3.895 -7.692 1.00 0.00 H new ATOM 0 HA ARG A 12 0.026 1.537 -8.202 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -0.086 2.747 -10.217 1.00 0.00 H new ATOM 0 HB3 ARG A 12 1.559 3.337 -10.077 1.00 0.00 H new ATOM 0 HG2 ARG A 12 2.490 1.385 -10.914 1.00 0.00 H new ATOM 0 HG3 ARG A 12 1.174 0.376 -10.347 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -0.199 0.887 -12.164 1.00 0.00 H new ATOM 0 HD3 ARG A 12 0.564 2.439 -12.447 1.00 0.00 H new ATOM 0 HE ARG A 12 2.613 0.752 -13.050 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -0.804 0.749 -13.937 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -0.518 -0.040 -15.491 1.00 0.00 H new ATOM 0 HH21 ARG A 12 2.972 -0.260 -15.049 1.00 0.00 H new ATOM 0 HH22 ARG A 12 1.610 -0.609 -16.118 1.00 0.00 H new ATOM 144 N ILE A 13 1.899 0.033 -7.653 1.00 0.00 N ATOM 145 CA ILE A 13 2.978 -0.881 -7.301 1.00 0.00 C ATOM 146 C ILE A 13 2.774 -2.248 -7.946 1.00 0.00 C ATOM 147 O ILE A 13 1.651 -2.747 -8.027 1.00 0.00 O ATOM 148 CB ILE A 13 3.090 -1.058 -5.775 1.00 0.00 C ATOM 149 CG1 ILE A 13 3.203 0.305 -5.089 1.00 0.00 C ATOM 150 CG2 ILE A 13 4.286 -1.932 -5.429 1.00 0.00 C ATOM 151 CD1 ILE A 13 2.871 0.268 -3.614 1.00 0.00 C ATOM 0 H ILE A 13 0.963 -0.352 -7.529 1.00 0.00 H new ATOM 0 HA ILE A 13 3.901 -0.439 -7.677 1.00 0.00 H new ATOM 0 HB ILE A 13 2.188 -1.552 -5.414 1.00 0.00 H new ATOM 0 HG12 ILE A 13 4.217 0.683 -5.216 1.00 0.00 H new ATOM 0 HG13 ILE A 13 2.536 1.009 -5.586 1.00 0.00 H new ATOM 0 HG21 ILE A 13 4.351 -2.047 -4.347 1.00 0.00 H new ATOM 0 HG22 ILE A 13 4.167 -2.912 -5.892 1.00 0.00 H new ATOM 0 HG23 ILE A 13 5.198 -1.464 -5.800 1.00 0.00 H new ATOM 0 HD11 ILE A 13 2.972 1.268 -3.193 1.00 0.00 H new ATOM 0 HD12 ILE A 13 1.847 -0.080 -3.480 1.00 0.00 H new ATOM 0 HD13 ILE A 13 3.554 -0.411 -3.104 1.00 0.00 H new ATOM 163 N LYS A 14 3.867 -2.849 -8.402 1.00 0.00 N ATOM 164 CA LYS A 14 3.810 -4.160 -9.038 1.00 0.00 C ATOM 165 C LYS A 14 4.700 -5.159 -8.305 1.00 0.00 C ATOM 166 O LYS A 14 5.877 -4.893 -8.059 1.00 0.00 O ATOM 167 CB LYS A 14 4.240 -4.059 -10.503 1.00 0.00 C ATOM 168 CG LYS A 14 4.285 -5.398 -11.218 1.00 0.00 C ATOM 169 CD LYS A 14 5.298 -5.391 -12.351 1.00 0.00 C ATOM 170 CE LYS A 14 5.024 -6.505 -13.350 1.00 0.00 C ATOM 171 NZ LYS A 14 6.125 -6.643 -14.343 1.00 0.00 N ATOM 0 H LYS A 14 4.804 -2.449 -8.343 1.00 0.00 H new ATOM 0 HA LYS A 14 2.780 -4.514 -8.991 1.00 0.00 H new ATOM 0 HB2 LYS A 14 3.552 -3.398 -11.030 1.00 0.00 H new ATOM 0 HB3 LYS A 14 5.226 -3.597 -10.552 1.00 0.00 H new ATOM 0 HG2 LYS A 14 4.539 -6.183 -10.506 1.00 0.00 H new ATOM 0 HG3 LYS A 14 3.297 -5.634 -11.613 1.00 0.00 H new ATOM 0 HD2 LYS A 14 5.269 -4.428 -12.861 1.00 0.00 H new ATOM 0 HD3 LYS A 14 6.302 -5.505 -11.943 1.00 0.00 H new ATOM 0 HE2 LYS A 14 4.895 -7.447 -12.817 1.00 0.00 H new ATOM 0 HE3 LYS A 14 4.088 -6.303 -13.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 5.900 -7.412 -15.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 6.231 -5.752 -14.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 7.013 -6.861 -13.848 1.00 0.00 H new ATOM 185 N ILE A 15 4.130 -6.309 -7.959 1.00 0.00 N ATOM 186 CA ILE A 15 4.873 -7.348 -7.257 1.00 0.00 C ATOM 187 C ILE A 15 5.544 -8.303 -8.238 1.00 0.00 C ATOM 188 O ILE A 15 5.039 -8.538 -9.337 1.00 0.00 O ATOM 189 CB ILE A 15 3.959 -8.155 -6.316 1.00 0.00 C ATOM 190 CG1 ILE A 15 3.188 -7.215 -5.388 1.00 0.00 C ATOM 191 CG2 ILE A 15 4.777 -9.152 -5.509 1.00 0.00 C ATOM 192 CD1 ILE A 15 4.014 -6.695 -4.232 1.00 0.00 C ATOM 0 H ILE A 15 3.157 -6.544 -8.153 1.00 0.00 H new ATOM 0 HA ILE A 15 5.637 -6.844 -6.665 1.00 0.00 H new ATOM 0 HB ILE A 15 3.240 -8.709 -6.919 1.00 0.00 H new ATOM 0 HG12 ILE A 15 2.816 -6.370 -5.967 1.00 0.00 H new ATOM 0 HG13 ILE A 15 2.317 -7.740 -4.995 1.00 0.00 H new ATOM 0 HG21 ILE A 15 4.117 -9.715 -4.849 1.00 0.00 H new ATOM 0 HG22 ILE A 15 5.284 -9.839 -6.186 1.00 0.00 H new ATOM 0 HG23 ILE A 15 5.517 -8.618 -4.913 1.00 0.00 H new ATOM 0 HD11 ILE A 15 3.403 -6.035 -3.616 1.00 0.00 H new ATOM 0 HD12 ILE A 15 4.364 -7.533 -3.629 1.00 0.00 H new ATOM 0 HD13 ILE A 15 4.871 -6.142 -4.617 1.00 0.00 H new ATOM 204 N LEU A 16 6.684 -8.852 -7.834 1.00 0.00 N ATOM 205 CA LEU A 16 7.425 -9.785 -8.677 1.00 0.00 C ATOM 206 C LEU A 16 7.208 -11.223 -8.219 1.00 0.00 C ATOM 207 O LEU A 16 6.539 -12.006 -8.895 1.00 0.00 O ATOM 208 CB LEU A 16 8.917 -9.449 -8.652 1.00 0.00 C ATOM 209 CG LEU A 16 9.400 -8.459 -9.713 1.00 0.00 C ATOM 210 CD1 LEU A 16 9.133 -8.999 -11.109 1.00 0.00 C ATOM 211 CD2 LEU A 16 8.728 -7.107 -9.525 1.00 0.00 C ATOM 0 H LEU A 16 7.116 -8.668 -6.928 1.00 0.00 H new ATOM 0 HA LEU A 16 7.054 -9.689 -9.697 1.00 0.00 H new ATOM 0 HB2 LEU A 16 9.162 -9.046 -7.669 1.00 0.00 H new ATOM 0 HB3 LEU A 16 9.480 -10.376 -8.765 1.00 0.00 H new ATOM 0 HG LEU A 16 10.476 -8.328 -9.597 1.00 0.00 H new ATOM 0 HD11 LEU A 16 9.483 -8.281 -11.850 1.00 0.00 H new ATOM 0 HD12 LEU A 16 9.661 -9.943 -11.241 1.00 0.00 H new ATOM 0 HD13 LEU A 16 8.063 -9.161 -11.238 1.00 0.00 H new ATOM 0 HD21 LEU A 16 9.083 -6.415 -10.288 1.00 0.00 H new ATOM 0 HD22 LEU A 16 7.648 -7.222 -9.614 1.00 0.00 H new ATOM 0 HD23 LEU A 16 8.971 -6.714 -8.538 1.00 0.00 H new ATOM 223 N CYS A 17 7.775 -11.564 -7.067 1.00 0.00 N ATOM 224 CA CYS A 17 7.643 -12.908 -6.517 1.00 0.00 C ATOM 225 C CYS A 17 8.226 -12.981 -5.110 1.00 0.00 C ATOM 226 O CYS A 17 8.671 -11.974 -4.559 1.00 0.00 O ATOM 227 CB CYS A 17 8.340 -13.923 -7.425 1.00 0.00 C ATOM 228 SG CYS A 17 10.131 -14.010 -7.196 1.00 0.00 S ATOM 0 H CYS A 17 8.331 -10.928 -6.496 1.00 0.00 H new ATOM 0 HA CYS A 17 6.581 -13.149 -6.462 1.00 0.00 H new ATOM 0 HB2 CYS A 17 7.913 -14.909 -7.244 1.00 0.00 H new ATOM 0 HB3 CYS A 17 8.129 -13.670 -8.464 1.00 0.00 H new ATOM 0 HG CYS A 17 10.629 -14.897 -8.006 1.00 0.00 H new ATOM 234 N ALA A 18 8.220 -14.178 -4.533 1.00 0.00 N ATOM 235 CA ALA A 18 8.750 -14.382 -3.191 1.00 0.00 C ATOM 236 C ALA A 18 9.786 -15.500 -3.173 1.00 0.00 C ATOM 237 O ALA A 18 9.678 -16.473 -3.920 1.00 0.00 O ATOM 238 CB ALA A 18 7.620 -14.691 -2.220 1.00 0.00 C ATOM 0 H ALA A 18 7.854 -15.021 -4.974 1.00 0.00 H new ATOM 0 HA ALA A 18 9.243 -13.462 -2.878 1.00 0.00 H new ATOM 0 HB1 ALA A 18 8.030 -14.841 -1.221 1.00 0.00 H new ATOM 0 HB2 ALA A 18 6.917 -13.858 -2.203 1.00 0.00 H new ATOM 0 HB3 ALA A 18 7.103 -15.595 -2.540 1.00 0.00 H new ATOM 244 N THR A 19 10.792 -15.355 -2.316 1.00 0.00 N ATOM 245 CA THR A 19 11.849 -16.352 -2.202 1.00 0.00 C ATOM 246 C THR A 19 11.915 -16.926 -0.791 1.00 0.00 C ATOM 247 O THR A 19 11.800 -16.195 0.193 1.00 0.00 O ATOM 248 CB THR A 19 13.223 -15.758 -2.567 1.00 0.00 C ATOM 249 OG1 THR A 19 14.242 -16.751 -2.414 1.00 0.00 O ATOM 250 CG2 THR A 19 13.543 -14.557 -1.690 1.00 0.00 C ATOM 0 H THR A 19 10.897 -14.556 -1.690 1.00 0.00 H new ATOM 0 HA THR A 19 11.607 -17.150 -2.904 1.00 0.00 H new ATOM 0 HB THR A 19 13.188 -15.431 -3.606 1.00 0.00 H new ATOM 0 HG1 THR A 19 14.666 -16.652 -1.536 1.00 0.00 H new ATOM 0 HG21 THR A 19 14.518 -14.154 -1.966 1.00 0.00 H new ATOM 0 HG22 THR A 19 12.781 -13.791 -1.830 1.00 0.00 H new ATOM 0 HG23 THR A 19 13.560 -14.864 -0.644 1.00 0.00 H new ATOM 258 N TYR A 20 12.100 -18.238 -0.700 1.00 0.00 N ATOM 259 CA TYR A 20 12.179 -18.910 0.591 1.00 0.00 C ATOM 260 C TYR A 20 10.836 -18.860 1.315 1.00 0.00 C ATOM 261 O TYR A 20 10.772 -18.568 2.510 1.00 0.00 O ATOM 262 CB TYR A 20 13.263 -18.269 1.459 1.00 0.00 C ATOM 263 CG TYR A 20 14.491 -17.851 0.682 1.00 0.00 C ATOM 264 CD1 TYR A 20 15.126 -18.736 -0.181 1.00 0.00 C ATOM 265 CD2 TYR A 20 15.017 -16.571 0.811 1.00 0.00 C ATOM 266 CE1 TYR A 20 16.249 -18.359 -0.891 1.00 0.00 C ATOM 267 CE2 TYR A 20 16.139 -16.185 0.103 1.00 0.00 C ATOM 268 CZ TYR A 20 16.751 -17.083 -0.746 1.00 0.00 C ATOM 269 OH TYR A 20 17.869 -16.703 -1.453 1.00 0.00 O ATOM 0 H TYR A 20 12.198 -18.857 -1.505 1.00 0.00 H new ATOM 0 HA TYR A 20 12.437 -19.954 0.413 1.00 0.00 H new ATOM 0 HB2 TYR A 20 12.846 -17.396 1.961 1.00 0.00 H new ATOM 0 HB3 TYR A 20 13.558 -18.973 2.237 1.00 0.00 H new ATOM 0 HD1 TYR A 20 14.735 -19.736 -0.298 1.00 0.00 H new ATOM 0 HD2 TYR A 20 14.541 -15.866 1.476 1.00 0.00 H new ATOM 0 HE1 TYR A 20 16.731 -19.060 -1.556 1.00 0.00 H new ATOM 0 HE2 TYR A 20 16.534 -15.186 0.214 1.00 0.00 H new ATOM 0 HH TYR A 20 18.092 -15.773 -1.238 1.00 0.00 H new ATOM 279 N VAL A 21 9.765 -19.146 0.582 1.00 0.00 N ATOM 280 CA VAL A 21 8.423 -19.136 1.152 1.00 0.00 C ATOM 281 C VAL A 21 8.224 -20.306 2.109 1.00 0.00 C ATOM 282 O VAL A 21 8.955 -21.294 2.058 1.00 0.00 O ATOM 283 CB VAL A 21 7.346 -19.195 0.053 1.00 0.00 C ATOM 284 CG1 VAL A 21 5.959 -19.303 0.670 1.00 0.00 C ATOM 285 CG2 VAL A 21 7.442 -17.978 -0.853 1.00 0.00 C ATOM 0 H VAL A 21 9.801 -19.388 -0.408 1.00 0.00 H new ATOM 0 HA VAL A 21 8.319 -18.200 1.701 1.00 0.00 H new ATOM 0 HB VAL A 21 7.518 -20.084 -0.553 1.00 0.00 H new ATOM 0 HG11 VAL A 21 5.211 -19.344 -0.122 1.00 0.00 H new ATOM 0 HG12 VAL A 21 5.899 -20.209 1.273 1.00 0.00 H new ATOM 0 HG13 VAL A 21 5.773 -18.434 1.301 1.00 0.00 H new ATOM 0 HG21 VAL A 21 6.673 -18.037 -1.624 1.00 0.00 H new ATOM 0 HG22 VAL A 21 7.296 -17.073 -0.263 1.00 0.00 H new ATOM 0 HG23 VAL A 21 8.425 -17.951 -1.323 1.00 0.00 H new ATOM 295 N ASN A 22 7.227 -20.187 2.981 1.00 0.00 N ATOM 296 CA ASN A 22 6.931 -21.236 3.950 1.00 0.00 C ATOM 297 C ASN A 22 6.212 -22.405 3.284 1.00 0.00 C ATOM 298 O ASN A 22 5.163 -22.850 3.750 1.00 0.00 O ATOM 299 CB ASN A 22 6.075 -20.679 5.089 1.00 0.00 C ATOM 300 CG ASN A 22 6.914 -20.139 6.232 1.00 0.00 C ATOM 301 OD1 ASN A 22 7.951 -20.705 6.576 1.00 0.00 O ATOM 302 ND2 ASN A 22 6.466 -19.038 6.825 1.00 0.00 N ATOM 0 H ASN A 22 6.611 -19.376 3.036 1.00 0.00 H new ATOM 0 HA ASN A 22 7.875 -21.598 4.357 1.00 0.00 H new ATOM 0 HB2 ASN A 22 5.436 -19.885 4.704 1.00 0.00 H new ATOM 0 HB3 ASN A 22 5.418 -21.464 5.463 1.00 0.00 H new ATOM 0 HD21 ASN A 22 6.988 -18.628 7.600 1.00 0.00 H new ATOM 0 HD22 ASN A 22 5.601 -18.603 6.506 1.00 0.00 H new ATOM 309 N VAL A 23 6.784 -22.898 2.190 1.00 0.00 N ATOM 310 CA VAL A 23 6.199 -24.017 1.460 1.00 0.00 C ATOM 311 C VAL A 23 7.015 -25.290 1.659 1.00 0.00 C ATOM 312 O VAL A 23 8.137 -25.403 1.167 1.00 0.00 O ATOM 313 CB VAL A 23 6.101 -23.714 -0.047 1.00 0.00 C ATOM 314 CG1 VAL A 23 4.877 -22.860 -0.342 1.00 0.00 C ATOM 315 CG2 VAL A 23 7.369 -23.029 -0.536 1.00 0.00 C ATOM 0 H VAL A 23 7.651 -22.540 1.790 1.00 0.00 H new ATOM 0 HA VAL A 23 5.196 -24.166 1.859 1.00 0.00 H new ATOM 0 HB VAL A 23 5.994 -24.657 -0.583 1.00 0.00 H new ATOM 0 HG11 VAL A 23 4.825 -22.656 -1.412 1.00 0.00 H new ATOM 0 HG12 VAL A 23 3.978 -23.392 -0.030 1.00 0.00 H new ATOM 0 HG13 VAL A 23 4.950 -21.919 0.203 1.00 0.00 H new ATOM 0 HG21 VAL A 23 7.283 -22.822 -1.603 1.00 0.00 H new ATOM 0 HG22 VAL A 23 7.509 -22.093 0.005 1.00 0.00 H new ATOM 0 HG23 VAL A 23 8.225 -23.680 -0.361 1.00 0.00 H new ATOM 325 N ASN A 24 6.442 -26.245 2.384 1.00 0.00 N ATOM 326 CA ASN A 24 7.116 -27.511 2.648 1.00 0.00 C ATOM 327 C ASN A 24 6.527 -28.630 1.795 1.00 0.00 C ATOM 328 O ASN A 24 7.220 -29.226 0.970 1.00 0.00 O ATOM 329 CB ASN A 24 7.004 -27.872 4.131 1.00 0.00 C ATOM 330 CG ASN A 24 8.050 -27.172 4.977 1.00 0.00 C ATOM 331 OD1 ASN A 24 8.874 -26.415 4.464 1.00 0.00 O ATOM 332 ND2 ASN A 24 8.021 -27.423 6.281 1.00 0.00 N ATOM 0 H ASN A 24 5.513 -26.167 2.799 1.00 0.00 H new ATOM 0 HA ASN A 24 8.168 -27.395 2.387 1.00 0.00 H new ATOM 0 HB2 ASN A 24 6.011 -27.606 4.493 1.00 0.00 H new ATOM 0 HB3 ASN A 24 7.108 -28.951 4.248 1.00 0.00 H new ATOM 0 HD21 ASN A 24 8.700 -26.981 6.901 1.00 0.00 H new ATOM 0 HD22 ASN A 24 7.320 -28.058 6.663 1.00 0.00 H new ATOM 339 N ILE A 25 5.244 -28.909 1.999 1.00 0.00 N ATOM 340 CA ILE A 25 4.561 -29.955 1.248 1.00 0.00 C ATOM 341 C ILE A 25 4.000 -29.413 -0.063 1.00 0.00 C ATOM 342 O ILE A 25 4.180 -28.240 -0.389 1.00 0.00 O ATOM 343 CB ILE A 25 3.414 -30.579 2.065 1.00 0.00 C ATOM 344 CG1 ILE A 25 2.404 -29.504 2.469 1.00 0.00 C ATOM 345 CG2 ILE A 25 3.964 -31.286 3.295 1.00 0.00 C ATOM 346 CD1 ILE A 25 1.186 -30.055 3.178 1.00 0.00 C ATOM 0 H ILE A 25 4.657 -28.425 2.678 1.00 0.00 H new ATOM 0 HA ILE A 25 5.303 -30.724 1.033 1.00 0.00 H new ATOM 0 HB ILE A 25 2.904 -31.316 1.444 1.00 0.00 H new ATOM 0 HG12 ILE A 25 2.896 -28.780 3.119 1.00 0.00 H new ATOM 0 HG13 ILE A 25 2.083 -28.965 1.578 1.00 0.00 H new ATOM 0 HG21 ILE A 25 3.142 -31.722 3.862 1.00 0.00 H new ATOM 0 HG22 ILE A 25 4.649 -32.075 2.985 1.00 0.00 H new ATOM 0 HG23 ILE A 25 4.496 -30.568 3.920 1.00 0.00 H new ATOM 0 HD11 ILE A 25 0.513 -29.237 3.435 1.00 0.00 H new ATOM 0 HD12 ILE A 25 0.670 -30.757 2.523 1.00 0.00 H new ATOM 0 HD13 ILE A 25 1.496 -30.569 4.088 1.00 0.00 H new ATOM 358 N ARG A 26 3.316 -30.275 -0.809 1.00 0.00 N ATOM 359 CA ARG A 26 2.728 -29.883 -2.084 1.00 0.00 C ATOM 360 C ARG A 26 1.218 -30.104 -2.076 1.00 0.00 C ATOM 361 O ARG A 26 0.664 -30.703 -2.998 1.00 0.00 O ATOM 362 CB ARG A 26 3.364 -30.673 -3.228 1.00 0.00 C ATOM 363 CG ARG A 26 4.883 -30.636 -3.223 1.00 0.00 C ATOM 364 CD ARG A 26 5.465 -31.745 -2.360 1.00 0.00 C ATOM 365 NE ARG A 26 5.444 -33.037 -3.042 1.00 0.00 N ATOM 366 CZ ARG A 26 6.311 -33.383 -3.987 1.00 0.00 C ATOM 367 NH1 ARG A 26 7.262 -32.538 -4.360 1.00 0.00 N ATOM 368 NH2 ARG A 26 6.228 -34.577 -4.560 1.00 0.00 N ATOM 0 H ARG A 26 3.156 -31.249 -0.552 1.00 0.00 H new ATOM 0 HA ARG A 26 2.922 -28.821 -2.234 1.00 0.00 H new ATOM 0 HB2 ARG A 26 3.034 -31.710 -3.169 1.00 0.00 H new ATOM 0 HB3 ARG A 26 3.002 -30.277 -4.177 1.00 0.00 H new ATOM 0 HG2 ARG A 26 5.254 -30.735 -4.243 1.00 0.00 H new ATOM 0 HG3 ARG A 26 5.223 -29.669 -2.853 1.00 0.00 H new ATOM 0 HD2 ARG A 26 6.491 -31.494 -2.090 1.00 0.00 H new ATOM 0 HD3 ARG A 26 4.899 -31.816 -1.431 1.00 0.00 H new ATOM 0 HE ARG A 26 4.724 -33.710 -2.778 1.00 0.00 H new ATOM 0 HH11 ARG A 26 7.329 -31.620 -3.921 1.00 0.00 H new ATOM 0 HH12 ARG A 26 7.927 -32.806 -5.086 1.00 0.00 H new ATOM 0 HH21 ARG A 26 5.498 -35.230 -4.275 1.00 0.00 H new ATOM 0 HH22 ARG A 26 6.894 -34.842 -5.286 1.00 0.00 H new ATOM 382 N ASP A 27 0.559 -29.617 -1.030 1.00 0.00 N ATOM 383 CA ASP A 27 -0.886 -29.760 -0.902 1.00 0.00 C ATOM 384 C ASP A 27 -1.599 -28.478 -1.322 1.00 0.00 C ATOM 385 O ASP A 27 -2.566 -28.514 -2.083 1.00 0.00 O ATOM 386 CB ASP A 27 -1.259 -30.118 0.537 1.00 0.00 C ATOM 387 CG ASP A 27 -1.082 -31.595 0.830 1.00 0.00 C ATOM 388 OD1 ASP A 27 0.041 -32.107 0.642 1.00 0.00 O ATOM 389 OD2 ASP A 27 -2.067 -32.239 1.249 1.00 0.00 O ATOM 0 H ASP A 27 1.003 -29.120 -0.258 1.00 0.00 H new ATOM 0 HA ASP A 27 -1.206 -30.565 -1.563 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -0.643 -29.538 1.224 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -2.295 -29.835 0.722 1.00 0.00 H new ATOM 394 N ILE A 28 -1.116 -27.347 -0.819 1.00 0.00 N ATOM 395 CA ILE A 28 -1.707 -26.054 -1.141 1.00 0.00 C ATOM 396 C ILE A 28 -2.063 -25.966 -2.621 1.00 0.00 C ATOM 397 O ILE A 28 -1.295 -26.396 -3.482 1.00 0.00 O ATOM 398 CB ILE A 28 -0.756 -24.896 -0.784 1.00 0.00 C ATOM 399 CG1 ILE A 28 -0.432 -24.916 0.711 1.00 0.00 C ATOM 400 CG2 ILE A 28 -1.374 -23.563 -1.179 1.00 0.00 C ATOM 401 CD1 ILE A 28 0.936 -24.362 1.040 1.00 0.00 C ATOM 0 H ILE A 28 -0.317 -27.300 -0.187 1.00 0.00 H new ATOM 0 HA ILE A 28 -2.615 -25.965 -0.545 1.00 0.00 H new ATOM 0 HB ILE A 28 0.173 -25.023 -1.340 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -1.187 -24.339 1.246 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -0.497 -25.941 1.075 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -0.690 -22.754 -0.921 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -1.560 -23.552 -2.253 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -2.315 -23.426 -0.647 1.00 0.00 H new ATOM 0 HD11 ILE A 28 1.098 -24.407 2.117 1.00 0.00 H new ATOM 0 HD12 ILE A 28 1.699 -24.953 0.533 1.00 0.00 H new ATOM 0 HD13 ILE A 28 0.999 -23.326 0.707 1.00 0.00 H new ATOM 413 N ASP A 29 -3.232 -25.405 -2.910 1.00 0.00 N ATOM 414 CA ASP A 29 -3.689 -25.258 -4.287 1.00 0.00 C ATOM 415 C ASP A 29 -3.040 -24.046 -4.949 1.00 0.00 C ATOM 416 O ASP A 29 -2.381 -24.168 -5.982 1.00 0.00 O ATOM 417 CB ASP A 29 -5.212 -25.122 -4.329 1.00 0.00 C ATOM 418 CG ASP A 29 -5.911 -26.465 -4.404 1.00 0.00 C ATOM 419 OD1 ASP A 29 -5.799 -27.248 -3.437 1.00 0.00 O ATOM 420 OD2 ASP A 29 -6.572 -26.733 -5.429 1.00 0.00 O ATOM 0 H ASP A 29 -3.880 -25.045 -2.210 1.00 0.00 H new ATOM 0 HA ASP A 29 -3.396 -26.151 -4.838 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -5.551 -24.588 -3.441 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -5.496 -24.519 -5.191 1.00 0.00 H new ATOM 425 N LYS A 30 -3.230 -22.877 -4.347 1.00 0.00 N ATOM 426 CA LYS A 30 -2.663 -21.643 -4.877 1.00 0.00 C ATOM 427 C LYS A 30 -2.308 -20.679 -3.749 1.00 0.00 C ATOM 428 O LYS A 30 -2.487 -20.994 -2.572 1.00 0.00 O ATOM 429 CB LYS A 30 -3.648 -20.977 -5.840 1.00 0.00 C ATOM 430 CG LYS A 30 -4.052 -21.862 -7.006 1.00 0.00 C ATOM 431 CD LYS A 30 -2.997 -21.858 -8.100 1.00 0.00 C ATOM 432 CE LYS A 30 -3.125 -20.635 -8.994 1.00 0.00 C ATOM 433 NZ LYS A 30 -4.294 -20.739 -9.911 1.00 0.00 N ATOM 0 H LYS A 30 -3.773 -22.758 -3.491 1.00 0.00 H new ATOM 0 HA LYS A 30 -1.750 -21.895 -5.417 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -4.542 -20.687 -5.288 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -3.201 -20.061 -6.228 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -4.208 -22.881 -6.653 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -5.002 -21.517 -7.414 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -2.005 -21.878 -7.650 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -3.092 -22.762 -8.702 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -3.226 -19.743 -8.376 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -2.213 -20.516 -9.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -4.234 -19.995 -10.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -4.292 -21.672 -10.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -5.173 -20.623 -9.367 1.00 0.00 H new ATOM 447 N ILE A 31 -1.806 -19.505 -4.116 1.00 0.00 N ATOM 448 CA ILE A 31 -1.429 -18.495 -3.134 1.00 0.00 C ATOM 449 C ILE A 31 -1.824 -17.099 -3.603 1.00 0.00 C ATOM 450 O ILE A 31 -2.353 -16.928 -4.701 1.00 0.00 O ATOM 451 CB ILE A 31 0.085 -18.521 -2.853 1.00 0.00 C ATOM 452 CG1 ILE A 31 0.866 -18.654 -4.161 1.00 0.00 C ATOM 453 CG2 ILE A 31 0.428 -19.661 -1.906 1.00 0.00 C ATOM 454 CD1 ILE A 31 2.331 -18.298 -4.029 1.00 0.00 C ATOM 0 H ILE A 31 -1.651 -19.229 -5.086 1.00 0.00 H new ATOM 0 HA ILE A 31 -1.965 -18.732 -2.215 1.00 0.00 H new ATOM 0 HB ILE A 31 0.368 -17.582 -2.377 1.00 0.00 H new ATOM 0 HG12 ILE A 31 0.781 -19.678 -4.523 1.00 0.00 H new ATOM 0 HG13 ILE A 31 0.410 -18.011 -4.914 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.501 -19.666 -1.717 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -0.106 -19.526 -0.965 1.00 0.00 H new ATOM 0 HG23 ILE A 31 0.134 -20.609 -2.356 1.00 0.00 H new ATOM 0 HD11 ILE A 31 2.822 -18.415 -4.995 1.00 0.00 H new ATOM 0 HD12 ILE A 31 2.426 -17.264 -3.697 1.00 0.00 H new ATOM 0 HD13 ILE A 31 2.802 -18.958 -3.300 1.00 0.00 H new ATOM 466 N TYR A 32 -1.563 -16.103 -2.763 1.00 0.00 N ATOM 467 CA TYR A 32 -1.892 -14.721 -3.090 1.00 0.00 C ATOM 468 C TYR A 32 -1.340 -13.766 -2.036 1.00 0.00 C ATOM 469 O TYR A 32 -1.100 -14.155 -0.893 1.00 0.00 O ATOM 470 CB TYR A 32 -3.407 -14.549 -3.207 1.00 0.00 C ATOM 471 CG TYR A 32 -4.096 -14.332 -1.879 1.00 0.00 C ATOM 472 CD1 TYR A 32 -3.953 -13.136 -1.187 1.00 0.00 C ATOM 473 CD2 TYR A 32 -4.891 -15.323 -1.316 1.00 0.00 C ATOM 474 CE1 TYR A 32 -4.580 -12.933 0.027 1.00 0.00 C ATOM 475 CE2 TYR A 32 -5.523 -15.129 -0.103 1.00 0.00 C ATOM 476 CZ TYR A 32 -5.364 -13.932 0.565 1.00 0.00 C ATOM 477 OH TYR A 32 -5.991 -13.734 1.773 1.00 0.00 O ATOM 0 H TYR A 32 -1.124 -16.227 -1.851 1.00 0.00 H new ATOM 0 HA TYR A 32 -1.431 -14.481 -4.048 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -3.619 -13.702 -3.859 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -3.829 -15.433 -3.685 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -3.341 -12.351 -1.606 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -5.017 -16.261 -1.836 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -4.457 -11.997 0.552 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -6.138 -15.910 0.320 1.00 0.00 H new ATOM 0 HH TYR A 32 -6.782 -14.309 1.829 1.00 0.00 H new ATOM 487 N VAL A 33 -1.141 -12.512 -2.430 1.00 0.00 N ATOM 488 CA VAL A 33 -0.619 -11.498 -1.521 1.00 0.00 C ATOM 489 C VAL A 33 -1.662 -10.422 -1.241 1.00 0.00 C ATOM 490 O VAL A 33 -2.506 -10.126 -2.087 1.00 0.00 O ATOM 491 CB VAL A 33 0.649 -10.834 -2.089 1.00 0.00 C ATOM 492 CG1 VAL A 33 1.161 -9.762 -1.139 1.00 0.00 C ATOM 493 CG2 VAL A 33 1.723 -11.878 -2.356 1.00 0.00 C ATOM 0 H VAL A 33 -1.333 -12.174 -3.373 1.00 0.00 H new ATOM 0 HA VAL A 33 -0.367 -12.007 -0.590 1.00 0.00 H new ATOM 0 HB VAL A 33 0.395 -10.356 -3.035 1.00 0.00 H new ATOM 0 HG11 VAL A 33 2.057 -9.304 -1.557 1.00 0.00 H new ATOM 0 HG12 VAL A 33 0.394 -9.000 -1.003 1.00 0.00 H new ATOM 0 HG13 VAL A 33 1.399 -10.213 -0.176 1.00 0.00 H new ATOM 0 HG21 VAL A 33 2.612 -11.391 -2.757 1.00 0.00 H new ATOM 0 HG22 VAL A 33 1.976 -12.386 -1.425 1.00 0.00 H new ATOM 0 HG23 VAL A 33 1.351 -12.606 -3.077 1.00 0.00 H new ATOM 503 N ARG A 34 -1.597 -9.839 -0.048 1.00 0.00 N ATOM 504 CA ARG A 34 -2.536 -8.795 0.344 1.00 0.00 C ATOM 505 C ARG A 34 -1.799 -7.513 0.719 1.00 0.00 C ATOM 506 O ARG A 34 -0.824 -7.541 1.470 1.00 0.00 O ATOM 507 CB ARG A 34 -3.393 -9.266 1.520 1.00 0.00 C ATOM 508 CG ARG A 34 -4.534 -8.320 1.859 1.00 0.00 C ATOM 509 CD ARG A 34 -5.793 -8.663 1.078 1.00 0.00 C ATOM 510 NE ARG A 34 -7.005 -8.304 1.808 1.00 0.00 N ATOM 511 CZ ARG A 34 -8.231 -8.598 1.388 1.00 0.00 C ATOM 512 NH1 ARG A 34 -8.405 -9.254 0.249 1.00 0.00 N ATOM 513 NH2 ARG A 34 -9.285 -8.237 2.108 1.00 0.00 N ATOM 0 H ARG A 34 -0.904 -10.072 0.663 1.00 0.00 H new ATOM 0 HA ARG A 34 -3.183 -8.585 -0.508 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -3.804 -10.249 1.289 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -2.757 -9.384 2.398 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -4.743 -8.369 2.928 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -4.236 -7.295 1.639 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -5.779 -8.142 0.121 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -5.804 -9.731 0.860 1.00 0.00 H new ATOM 0 HE ARG A 34 -6.905 -7.800 2.689 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -7.597 -9.534 -0.307 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -9.347 -9.479 -0.071 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -9.155 -7.733 2.985 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -10.225 -8.463 1.784 1.00 0.00 H new ATOM 527 N THR A 35 -2.270 -6.388 0.189 1.00 0.00 N ATOM 528 CA THR A 35 -1.655 -5.096 0.466 1.00 0.00 C ATOM 529 C THR A 35 -2.694 -4.081 0.929 1.00 0.00 C ATOM 530 O THR A 35 -3.892 -4.267 0.724 1.00 0.00 O ATOM 531 CB THR A 35 -0.929 -4.542 -0.774 1.00 0.00 C ATOM 532 OG1 THR A 35 -1.884 -4.141 -1.762 1.00 0.00 O ATOM 533 CG2 THR A 35 0.010 -5.585 -1.362 1.00 0.00 C ATOM 0 H THR A 35 -3.076 -6.346 -0.435 1.00 0.00 H new ATOM 0 HA THR A 35 -0.928 -5.256 1.262 1.00 0.00 H new ATOM 0 HB THR A 35 -0.340 -3.678 -0.467 1.00 0.00 H new ATOM 0 HG1 THR A 35 -1.480 -3.475 -2.356 1.00 0.00 H new ATOM 0 HG21 THR A 35 0.512 -5.171 -2.237 1.00 0.00 H new ATOM 0 HG22 THR A 35 0.754 -5.866 -0.617 1.00 0.00 H new ATOM 0 HG23 THR A 35 -0.562 -6.466 -1.655 1.00 0.00 H new ATOM 541 N GLY A 36 -2.225 -3.005 1.555 1.00 0.00 N ATOM 542 CA GLY A 36 -3.128 -1.976 2.036 1.00 0.00 C ATOM 543 C GLY A 36 -2.452 -1.014 2.993 1.00 0.00 C ATOM 544 O GLY A 36 -1.605 -1.415 3.792 1.00 0.00 O ATOM 0 H GLY A 36 -1.237 -2.828 1.737 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -3.526 -1.420 1.187 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -3.976 -2.445 2.535 1.00 0.00 H new ATOM 548 N ILE A 37 -2.825 0.259 2.912 1.00 0.00 N ATOM 549 CA ILE A 37 -2.248 1.280 3.778 1.00 0.00 C ATOM 550 C ILE A 37 -3.003 1.371 5.099 1.00 0.00 C ATOM 551 O ILE A 37 -4.230 1.270 5.134 1.00 0.00 O ATOM 552 CB ILE A 37 -2.255 2.663 3.099 1.00 0.00 C ATOM 553 CG1 ILE A 37 -1.261 2.689 1.936 1.00 0.00 C ATOM 554 CG2 ILE A 37 -1.925 3.751 4.110 1.00 0.00 C ATOM 555 CD1 ILE A 37 -1.787 2.039 0.676 1.00 0.00 C ATOM 0 H ILE A 37 -3.524 0.608 2.256 1.00 0.00 H new ATOM 0 HA ILE A 37 -1.217 0.984 3.971 1.00 0.00 H new ATOM 0 HB ILE A 37 -3.253 2.853 2.704 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -0.997 3.724 1.718 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -0.345 2.183 2.241 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.934 4.722 3.615 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -2.668 3.744 4.908 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -0.937 3.568 4.532 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -1.029 2.094 -0.106 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -2.025 0.995 0.877 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -2.687 2.559 0.347 1.00 0.00 H new ATOM 567 N TYR A 38 -2.263 1.564 6.185 1.00 0.00 N ATOM 568 CA TYR A 38 -2.862 1.669 7.510 1.00 0.00 C ATOM 569 C TYR A 38 -2.234 2.811 8.304 1.00 0.00 C ATOM 570 O TYR A 38 -1.040 3.087 8.178 1.00 0.00 O ATOM 571 CB TYR A 38 -2.698 0.353 8.272 1.00 0.00 C ATOM 572 CG TYR A 38 -3.622 -0.744 7.793 1.00 0.00 C ATOM 573 CD1 TYR A 38 -3.335 -1.468 6.642 1.00 0.00 C ATOM 574 CD2 TYR A 38 -4.783 -1.055 8.490 1.00 0.00 C ATOM 575 CE1 TYR A 38 -4.176 -2.470 6.200 1.00 0.00 C ATOM 576 CE2 TYR A 38 -5.630 -2.057 8.056 1.00 0.00 C ATOM 577 CZ TYR A 38 -5.322 -2.761 6.910 1.00 0.00 C ATOM 578 OH TYR A 38 -6.164 -3.758 6.474 1.00 0.00 O ATOM 0 H TYR A 38 -1.247 1.651 6.174 1.00 0.00 H new ATOM 0 HA TYR A 38 -3.924 1.879 7.385 1.00 0.00 H new ATOM 0 HB2 TYR A 38 -1.666 0.014 8.177 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -2.879 0.532 9.332 1.00 0.00 H new ATOM 0 HD1 TYR A 38 -2.438 -1.243 6.083 1.00 0.00 H new ATOM 0 HD2 TYR A 38 -5.028 -0.504 9.386 1.00 0.00 H new ATOM 0 HE1 TYR A 38 -3.938 -3.023 5.303 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -6.528 -2.288 8.611 1.00 0.00 H new ATOM 0 HH TYR A 38 -5.945 -3.989 5.547 1.00 0.00 H new ATOM 588 N HIS A 39 -3.047 3.471 9.122 1.00 0.00 N ATOM 589 CA HIS A 39 -2.572 4.583 9.938 1.00 0.00 C ATOM 590 C HIS A 39 -2.717 4.267 11.424 1.00 0.00 C ATOM 591 O HIS A 39 -3.776 4.477 12.013 1.00 0.00 O ATOM 592 CB HIS A 39 -3.344 5.858 9.599 1.00 0.00 C ATOM 593 CG HIS A 39 -2.891 7.057 10.374 1.00 0.00 C ATOM 594 ND1 HIS A 39 -3.136 8.352 9.969 1.00 0.00 N ATOM 595 CD2 HIS A 39 -2.205 7.151 11.537 1.00 0.00 C ATOM 596 CE1 HIS A 39 -2.619 9.191 10.849 1.00 0.00 C ATOM 597 NE2 HIS A 39 -2.049 8.488 11.811 1.00 0.00 N ATOM 0 H HIS A 39 -4.037 3.256 9.238 1.00 0.00 H new ATOM 0 HA HIS A 39 -1.516 4.737 9.718 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -3.240 6.064 8.534 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -4.404 5.692 9.789 1.00 0.00 H new ATOM 0 HD2 HIS A 39 -1.847 6.328 12.138 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -2.656 10.269 10.791 1.00 0.00 H new ATOM 0 HE2 HIS A 39 -1.571 8.875 12.625 1.00 0.00 H new ATOM 606 N GLY A 40 -1.644 3.759 12.023 1.00 0.00 N ATOM 607 CA GLY A 40 -1.673 3.422 13.434 1.00 0.00 C ATOM 608 C GLY A 40 -2.430 2.137 13.708 1.00 0.00 C ATOM 609 O GLY A 40 -2.882 1.901 14.827 1.00 0.00 O ATOM 0 H GLY A 40 -0.756 3.575 11.556 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -0.652 3.324 13.802 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -2.135 4.238 13.990 1.00 0.00 H new ATOM 613 N GLY A 41 -2.570 1.304 12.681 1.00 0.00 N ATOM 614 CA GLY A 41 -3.280 0.048 12.836 1.00 0.00 C ATOM 615 C GLY A 41 -4.649 0.072 12.186 1.00 0.00 C ATOM 616 O GLY A 41 -5.172 -0.968 11.788 1.00 0.00 O ATOM 0 H GLY A 41 -2.204 1.477 11.745 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -2.688 -0.757 12.400 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -3.389 -0.176 13.897 1.00 0.00 H new ATOM 620 N GLU A 42 -5.232 1.263 12.081 1.00 0.00 N ATOM 621 CA GLU A 42 -6.551 1.416 11.478 1.00 0.00 C ATOM 622 C GLU A 42 -6.444 1.534 9.960 1.00 0.00 C ATOM 623 O GLU A 42 -5.528 2.158 9.424 1.00 0.00 O ATOM 624 CB GLU A 42 -7.257 2.648 12.048 1.00 0.00 C ATOM 625 CG GLU A 42 -7.419 2.612 13.558 1.00 0.00 C ATOM 626 CD GLU A 42 -6.168 3.057 14.291 1.00 0.00 C ATOM 627 OE1 GLU A 42 -5.792 4.240 14.156 1.00 0.00 O ATOM 628 OE2 GLU A 42 -5.566 2.223 14.998 1.00 0.00 O ATOM 0 H GLU A 42 -4.812 2.134 12.405 1.00 0.00 H new ATOM 0 HA GLU A 42 -7.137 0.528 11.716 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -6.693 3.539 11.773 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -8.241 2.738 11.587 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -8.252 3.254 13.846 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -7.676 1.599 13.868 1.00 0.00 H new ATOM 635 N PRO A 43 -7.402 0.920 9.250 1.00 0.00 N ATOM 636 CA PRO A 43 -7.439 0.942 7.785 1.00 0.00 C ATOM 637 C PRO A 43 -7.778 2.322 7.234 1.00 0.00 C ATOM 638 O PRO A 43 -8.338 3.163 7.939 1.00 0.00 O ATOM 639 CB PRO A 43 -8.546 -0.058 7.443 1.00 0.00 C ATOM 640 CG PRO A 43 -9.428 -0.072 8.644 1.00 0.00 C ATOM 641 CD PRO A 43 -8.524 0.158 9.824 1.00 0.00 C ATOM 0 HA PRO A 43 -6.471 0.693 7.349 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -9.095 0.248 6.552 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -8.137 -1.048 7.241 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -10.189 0.705 8.578 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -9.951 -1.024 8.733 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -9.027 0.717 10.613 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -8.189 -0.782 10.263 1.00 0.00 H new ATOM 649 N LEU A 44 -7.438 2.550 5.970 1.00 0.00 N ATOM 650 CA LEU A 44 -7.707 3.829 5.323 1.00 0.00 C ATOM 651 C LEU A 44 -8.599 3.644 4.099 1.00 0.00 C ATOM 652 O LEU A 44 -9.420 4.505 3.781 1.00 0.00 O ATOM 653 CB LEU A 44 -6.396 4.503 4.916 1.00 0.00 C ATOM 654 CG LEU A 44 -5.677 5.291 6.012 1.00 0.00 C ATOM 655 CD1 LEU A 44 -5.045 4.345 7.021 1.00 0.00 C ATOM 656 CD2 LEU A 44 -4.625 6.209 5.407 1.00 0.00 C ATOM 0 H LEU A 44 -6.975 1.865 5.373 1.00 0.00 H new ATOM 0 HA LEU A 44 -8.229 4.466 6.037 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -5.717 3.736 4.543 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -6.601 5.179 4.086 1.00 0.00 H new ATOM 0 HG LEU A 44 -6.411 5.907 6.532 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -4.538 4.923 7.794 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -5.820 3.730 7.478 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -4.323 3.703 6.516 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -4.124 6.762 6.202 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -3.893 5.614 4.862 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -5.104 6.910 4.724 1.00 0.00 H new ATOM 668 N CYS A 45 -8.433 2.515 3.419 1.00 0.00 N ATOM 669 CA CYS A 45 -9.223 2.215 2.231 1.00 0.00 C ATOM 670 C CYS A 45 -9.333 0.709 2.015 1.00 0.00 C ATOM 671 O CYS A 45 -8.597 -0.069 2.622 1.00 0.00 O ATOM 672 CB CYS A 45 -8.601 2.875 0.999 1.00 0.00 C ATOM 673 SG CYS A 45 -9.145 4.576 0.719 1.00 0.00 S ATOM 0 H CYS A 45 -7.758 1.792 3.670 1.00 0.00 H new ATOM 0 HA CYS A 45 -10.225 2.615 2.382 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -7.516 2.864 1.103 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -8.843 2.278 0.119 1.00 0.00 H new ATOM 0 HG CYS A 45 -9.424 5.136 1.859 1.00 0.00 H new ATOM 679 N ASP A 46 -10.256 0.306 1.150 1.00 0.00 N ATOM 680 CA ASP A 46 -10.463 -1.107 0.855 1.00 0.00 C ATOM 681 C ASP A 46 -9.146 -1.782 0.484 1.00 0.00 C ATOM 682 O ASP A 46 -8.392 -1.278 -0.347 1.00 0.00 O ATOM 683 CB ASP A 46 -11.473 -1.270 -0.282 1.00 0.00 C ATOM 684 CG ASP A 46 -11.268 -0.254 -1.388 1.00 0.00 C ATOM 685 OD1 ASP A 46 -11.511 0.946 -1.143 1.00 0.00 O ATOM 686 OD2 ASP A 46 -10.867 -0.659 -2.499 1.00 0.00 O ATOM 0 H ASP A 46 -10.873 0.938 0.640 1.00 0.00 H new ATOM 0 HA ASP A 46 -10.857 -1.587 1.751 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -11.391 -2.275 -0.696 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -12.483 -1.171 0.116 1.00 0.00 H new ATOM 691 N ASN A 47 -8.877 -2.926 1.106 1.00 0.00 N ATOM 692 CA ASN A 47 -7.651 -3.670 0.842 1.00 0.00 C ATOM 693 C ASN A 47 -7.631 -4.194 -0.591 1.00 0.00 C ATOM 694 O ASN A 47 -8.679 -4.423 -1.194 1.00 0.00 O ATOM 695 CB ASN A 47 -7.515 -4.834 1.825 1.00 0.00 C ATOM 696 CG ASN A 47 -7.223 -4.367 3.238 1.00 0.00 C ATOM 697 OD1 ASN A 47 -6.087 -3.704 3.419 1.00 0.00 O flip ATOM 698 ND2 ASN A 47 -8.011 -4.599 4.155 1.00 0.00 N flip ATOM 0 H ASN A 47 -9.492 -3.357 1.796 1.00 0.00 H new ATOM 0 HA ASN A 47 -6.808 -2.992 0.974 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -8.435 -5.418 1.821 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -6.716 -5.496 1.492 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -8.873 -5.112 3.969 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -7.802 -4.278 5.100 1.00 0.00 H new ATOM 705 N VAL A 48 -6.430 -4.382 -1.129 1.00 0.00 N ATOM 706 CA VAL A 48 -6.272 -4.881 -2.490 1.00 0.00 C ATOM 707 C VAL A 48 -5.624 -6.261 -2.498 1.00 0.00 C ATOM 708 O VAL A 48 -4.708 -6.532 -1.723 1.00 0.00 O ATOM 709 CB VAL A 48 -5.422 -3.922 -3.344 1.00 0.00 C ATOM 710 CG1 VAL A 48 -5.370 -4.396 -4.788 1.00 0.00 C ATOM 711 CG2 VAL A 48 -5.969 -2.505 -3.259 1.00 0.00 C ATOM 0 H VAL A 48 -5.553 -4.196 -0.643 1.00 0.00 H new ATOM 0 HA VAL A 48 -7.271 -4.950 -2.920 1.00 0.00 H new ATOM 0 HB VAL A 48 -4.405 -3.919 -2.951 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -4.765 -3.706 -5.376 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -4.928 -5.391 -4.829 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -6.380 -4.431 -5.196 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -5.356 -1.841 -3.869 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -6.996 -2.489 -3.625 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -5.948 -2.168 -2.222 1.00 0.00 H new ATOM 721 N ASN A 49 -6.107 -7.130 -3.379 1.00 0.00 N ATOM 722 CA ASN A 49 -5.575 -8.484 -3.489 1.00 0.00 C ATOM 723 C ASN A 49 -5.059 -8.754 -4.899 1.00 0.00 C ATOM 724 O ASN A 49 -5.692 -8.378 -5.886 1.00 0.00 O ATOM 725 CB ASN A 49 -6.650 -9.508 -3.122 1.00 0.00 C ATOM 726 CG ASN A 49 -7.959 -9.256 -3.845 1.00 0.00 C ATOM 727 OD1 ASN A 49 -8.825 -8.533 -3.350 1.00 0.00 O ATOM 728 ND2 ASN A 49 -8.110 -9.852 -5.022 1.00 0.00 N ATOM 0 H ASN A 49 -6.866 -6.921 -4.028 1.00 0.00 H new ATOM 0 HA ASN A 49 -4.741 -8.577 -2.793 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -6.292 -10.509 -3.363 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -6.821 -9.481 -2.046 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -8.970 -9.719 -5.554 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -7.366 -10.443 -5.394 1.00 0.00 H new ATOM 735 N THR A 50 -3.905 -9.408 -4.986 1.00 0.00 N ATOM 736 CA THR A 50 -3.304 -9.728 -6.275 1.00 0.00 C ATOM 737 C THR A 50 -3.892 -11.011 -6.852 1.00 0.00 C ATOM 738 O THR A 50 -4.710 -11.671 -6.213 1.00 0.00 O ATOM 739 CB THR A 50 -1.776 -9.885 -6.158 1.00 0.00 C ATOM 740 OG1 THR A 50 -1.460 -10.984 -5.296 1.00 0.00 O ATOM 741 CG2 THR A 50 -1.141 -8.612 -5.618 1.00 0.00 C ATOM 0 H THR A 50 -3.368 -9.726 -4.179 1.00 0.00 H new ATOM 0 HA THR A 50 -3.527 -8.896 -6.943 1.00 0.00 H new ATOM 0 HB THR A 50 -1.376 -10.078 -7.153 1.00 0.00 H new ATOM 0 HG1 THR A 50 -0.936 -11.648 -5.791 1.00 0.00 H new ATOM 0 HG21 THR A 50 -0.062 -8.747 -5.544 1.00 0.00 H new ATOM 0 HG22 THR A 50 -1.358 -7.783 -6.292 1.00 0.00 H new ATOM 0 HG23 THR A 50 -1.548 -8.393 -4.631 1.00 0.00 H new ATOM 749 N GLN A 51 -3.468 -11.357 -8.064 1.00 0.00 N ATOM 750 CA GLN A 51 -3.954 -12.561 -8.727 1.00 0.00 C ATOM 751 C GLN A 51 -3.544 -13.811 -7.955 1.00 0.00 C ATOM 752 O GLN A 51 -2.808 -13.731 -6.972 1.00 0.00 O ATOM 753 CB GLN A 51 -3.418 -12.632 -10.158 1.00 0.00 C ATOM 754 CG GLN A 51 -1.912 -12.826 -10.235 1.00 0.00 C ATOM 755 CD GLN A 51 -1.430 -13.097 -11.646 1.00 0.00 C ATOM 756 OE1 GLN A 51 -0.844 -14.144 -11.924 1.00 0.00 O ATOM 757 NE2 GLN A 51 -1.674 -12.153 -12.547 1.00 0.00 N ATOM 0 H GLN A 51 -2.790 -10.821 -8.606 1.00 0.00 H new ATOM 0 HA GLN A 51 -5.043 -12.515 -8.756 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -3.909 -13.453 -10.681 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -3.685 -11.715 -10.683 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -1.415 -11.936 -9.850 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -1.623 -13.656 -9.591 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -2.163 -11.301 -12.273 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -1.373 -12.280 -13.513 1.00 0.00 H new ATOM 766 N ARG A 52 -4.025 -14.964 -8.407 1.00 0.00 N ATOM 767 CA ARG A 52 -3.710 -16.231 -7.757 1.00 0.00 C ATOM 768 C ARG A 52 -2.648 -16.995 -8.543 1.00 0.00 C ATOM 769 O ARG A 52 -2.801 -17.237 -9.740 1.00 0.00 O ATOM 770 CB ARG A 52 -4.971 -17.086 -7.619 1.00 0.00 C ATOM 771 CG ARG A 52 -5.744 -16.828 -6.336 1.00 0.00 C ATOM 772 CD ARG A 52 -7.151 -17.400 -6.409 1.00 0.00 C ATOM 773 NE ARG A 52 -8.069 -16.507 -7.112 1.00 0.00 N ATOM 774 CZ ARG A 52 -9.391 -16.611 -7.044 1.00 0.00 C ATOM 775 NH1 ARG A 52 -9.948 -17.563 -6.308 1.00 0.00 N ATOM 776 NH2 ARG A 52 -10.160 -15.761 -7.712 1.00 0.00 N ATOM 0 H ARG A 52 -4.634 -15.047 -9.221 1.00 0.00 H new ATOM 0 HA ARG A 52 -3.317 -16.013 -6.764 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -5.624 -16.896 -8.471 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -4.692 -18.139 -7.660 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -5.213 -17.272 -5.494 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -5.795 -15.755 -6.150 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -7.124 -18.365 -6.916 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -7.522 -17.580 -5.400 1.00 0.00 H new ATOM 0 HE ARG A 52 -7.673 -15.763 -7.686 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -9.361 -18.218 -5.792 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -10.964 -17.640 -6.258 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -9.736 -15.027 -8.279 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -11.175 -15.842 -7.659 1.00 0.00 H new ATOM 790 N VAL A 53 -1.571 -17.371 -7.860 1.00 0.00 N ATOM 791 CA VAL A 53 -0.484 -18.108 -8.494 1.00 0.00 C ATOM 792 C VAL A 53 -0.109 -19.341 -7.680 1.00 0.00 C ATOM 793 O VAL A 53 -0.276 -19.385 -6.461 1.00 0.00 O ATOM 794 CB VAL A 53 0.765 -17.224 -8.670 1.00 0.00 C ATOM 795 CG1 VAL A 53 0.366 -15.800 -9.029 1.00 0.00 C ATOM 796 CG2 VAL A 53 1.616 -17.246 -7.409 1.00 0.00 C ATOM 0 H VAL A 53 -1.428 -17.178 -6.869 1.00 0.00 H new ATOM 0 HA VAL A 53 -0.842 -18.419 -9.476 1.00 0.00 H new ATOM 0 HB VAL A 53 1.360 -17.627 -9.490 1.00 0.00 H new ATOM 0 HG11 VAL A 53 1.262 -15.191 -9.149 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -0.198 -15.804 -9.962 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -0.252 -15.384 -8.233 1.00 0.00 H new ATOM 0 HG21 VAL A 53 2.494 -16.616 -7.552 1.00 0.00 H new ATOM 0 HG22 VAL A 53 1.032 -16.870 -6.569 1.00 0.00 H new ATOM 0 HG23 VAL A 53 1.933 -18.268 -7.202 1.00 0.00 H new ATOM 806 N PRO A 54 0.411 -20.368 -8.368 1.00 0.00 N ATOM 807 CA PRO A 54 0.822 -21.622 -7.729 1.00 0.00 C ATOM 808 C PRO A 54 2.062 -21.450 -6.859 1.00 0.00 C ATOM 809 O PRO A 54 2.977 -20.703 -7.207 1.00 0.00 O ATOM 810 CB PRO A 54 1.124 -22.542 -8.915 1.00 0.00 C ATOM 811 CG PRO A 54 1.471 -21.619 -10.031 1.00 0.00 C ATOM 812 CD PRO A 54 0.638 -20.385 -9.823 1.00 0.00 C ATOM 0 HA PRO A 54 0.055 -22.008 -7.057 1.00 0.00 H new ATOM 0 HB2 PRO A 54 1.948 -23.219 -8.691 1.00 0.00 H new ATOM 0 HB3 PRO A 54 0.262 -23.160 -9.166 1.00 0.00 H new ATOM 0 HG2 PRO A 54 2.534 -21.378 -10.022 1.00 0.00 H new ATOM 0 HG3 PRO A 54 1.256 -22.076 -10.997 1.00 0.00 H new ATOM 0 HD2 PRO A 54 1.158 -19.488 -10.159 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -0.300 -20.436 -10.376 1.00 0.00 H new ATOM 820 N CYS A 55 2.086 -22.146 -5.728 1.00 0.00 N ATOM 821 CA CYS A 55 3.215 -22.070 -4.807 1.00 0.00 C ATOM 822 C CYS A 55 4.533 -22.293 -5.543 1.00 0.00 C ATOM 823 O CYS A 55 5.486 -21.533 -5.373 1.00 0.00 O ATOM 824 CB CYS A 55 3.060 -23.102 -3.690 1.00 0.00 C ATOM 825 SG CYS A 55 2.872 -24.802 -4.277 1.00 0.00 S ATOM 0 H CYS A 55 1.337 -22.769 -5.426 1.00 0.00 H new ATOM 0 HA CYS A 55 3.228 -21.072 -4.369 1.00 0.00 H new ATOM 0 HB2 CYS A 55 3.931 -23.049 -3.037 1.00 0.00 H new ATOM 0 HB3 CYS A 55 2.192 -22.840 -3.085 1.00 0.00 H new ATOM 0 HG CYS A 55 3.996 -25.213 -4.784 1.00 0.00 H new ATOM 831 N SER A 56 4.578 -23.341 -6.359 1.00 0.00 N ATOM 832 CA SER A 56 5.781 -23.668 -7.117 1.00 0.00 C ATOM 833 C SER A 56 6.345 -22.427 -7.802 1.00 0.00 C ATOM 834 O SER A 56 7.559 -22.242 -7.873 1.00 0.00 O ATOM 835 CB SER A 56 5.475 -24.745 -8.159 1.00 0.00 C ATOM 836 OG SER A 56 6.657 -25.167 -8.818 1.00 0.00 O ATOM 0 H SER A 56 3.796 -23.978 -6.512 1.00 0.00 H new ATOM 0 HA SER A 56 6.528 -24.048 -6.420 1.00 0.00 H new ATOM 0 HB2 SER A 56 5.000 -25.599 -7.676 1.00 0.00 H new ATOM 0 HB3 SER A 56 4.766 -24.357 -8.890 1.00 0.00 H new ATOM 0 HG SER A 56 6.435 -25.857 -9.478 1.00 0.00 H new ATOM 842 N ASN A 57 5.454 -21.579 -8.305 1.00 0.00 N ATOM 843 CA ASN A 57 5.862 -20.355 -8.985 1.00 0.00 C ATOM 844 C ASN A 57 5.073 -19.156 -8.467 1.00 0.00 C ATOM 845 O ASN A 57 4.035 -18.782 -9.012 1.00 0.00 O ATOM 846 CB ASN A 57 5.664 -20.496 -10.495 1.00 0.00 C ATOM 847 CG ASN A 57 6.721 -21.374 -11.138 1.00 0.00 C ATOM 848 OD1 ASN A 57 7.871 -21.403 -10.698 1.00 0.00 O ATOM 849 ND2 ASN A 57 6.335 -22.095 -12.183 1.00 0.00 N ATOM 0 H ASN A 57 4.445 -21.717 -8.255 1.00 0.00 H new ATOM 0 HA ASN A 57 6.919 -20.189 -8.778 1.00 0.00 H new ATOM 0 HB2 ASN A 57 4.678 -20.916 -10.692 1.00 0.00 H new ATOM 0 HB3 ASN A 57 5.687 -19.508 -10.955 1.00 0.00 H new ATOM 0 HD21 ASN A 57 7.002 -22.705 -12.656 1.00 0.00 H new ATOM 0 HD22 ASN A 57 5.371 -22.039 -12.513 1.00 0.00 H new ATOM 856 N PRO A 58 5.577 -18.537 -7.389 1.00 0.00 N ATOM 857 CA PRO A 58 4.937 -17.371 -6.774 1.00 0.00 C ATOM 858 C PRO A 58 5.031 -16.128 -7.653 1.00 0.00 C ATOM 859 O PRO A 58 4.603 -15.043 -7.258 1.00 0.00 O ATOM 860 CB PRO A 58 5.730 -17.172 -5.480 1.00 0.00 C ATOM 861 CG PRO A 58 7.063 -17.775 -5.756 1.00 0.00 C ATOM 862 CD PRO A 58 6.811 -18.929 -6.687 1.00 0.00 C ATOM 0 HA PRO A 58 3.870 -17.528 -6.616 1.00 0.00 H new ATOM 0 HB2 PRO A 58 5.818 -16.115 -5.228 1.00 0.00 H new ATOM 0 HB3 PRO A 58 5.241 -17.661 -4.637 1.00 0.00 H new ATOM 0 HG2 PRO A 58 7.734 -17.046 -6.211 1.00 0.00 H new ATOM 0 HG3 PRO A 58 7.537 -18.113 -4.834 1.00 0.00 H new ATOM 0 HD2 PRO A 58 7.639 -19.074 -7.381 1.00 0.00 H new ATOM 0 HD3 PRO A 58 6.684 -19.865 -6.142 1.00 0.00 H new ATOM 870 N ARG A 59 5.593 -16.293 -8.846 1.00 0.00 N ATOM 871 CA ARG A 59 5.743 -15.184 -9.780 1.00 0.00 C ATOM 872 C ARG A 59 4.397 -14.523 -10.060 1.00 0.00 C ATOM 873 O ARG A 59 3.543 -15.093 -10.739 1.00 0.00 O ATOM 874 CB ARG A 59 6.365 -15.672 -11.089 1.00 0.00 C ATOM 875 CG ARG A 59 7.002 -14.564 -11.912 1.00 0.00 C ATOM 876 CD ARG A 59 7.982 -15.121 -12.932 1.00 0.00 C ATOM 877 NE ARG A 59 9.336 -15.220 -12.393 1.00 0.00 N ATOM 878 CZ ARG A 59 10.414 -15.415 -13.145 1.00 0.00 C ATOM 879 NH1 ARG A 59 10.297 -15.530 -14.460 1.00 0.00 N ATOM 880 NH2 ARG A 59 11.612 -15.494 -12.580 1.00 0.00 N ATOM 0 H ARG A 59 5.952 -17.184 -9.188 1.00 0.00 H new ATOM 0 HA ARG A 59 6.403 -14.446 -9.325 1.00 0.00 H new ATOM 0 HB2 ARG A 59 7.120 -16.425 -10.864 1.00 0.00 H new ATOM 0 HB3 ARG A 59 5.596 -16.160 -11.687 1.00 0.00 H new ATOM 0 HG2 ARG A 59 6.225 -13.997 -12.424 1.00 0.00 H new ATOM 0 HG3 ARG A 59 7.519 -13.869 -11.250 1.00 0.00 H new ATOM 0 HD2 ARG A 59 7.648 -16.107 -13.255 1.00 0.00 H new ATOM 0 HD3 ARG A 59 7.989 -14.482 -13.815 1.00 0.00 H new ATOM 0 HE ARG A 59 9.461 -15.135 -11.384 1.00 0.00 H new ATOM 0 HH11 ARG A 59 9.378 -15.469 -14.897 1.00 0.00 H new ATOM 0 HH12 ARG A 59 11.126 -15.680 -15.035 1.00 0.00 H new ATOM 0 HH21 ARG A 59 11.706 -15.405 -11.568 1.00 0.00 H new ATOM 0 HH22 ARG A 59 12.439 -15.644 -13.157 1.00 0.00 H new ATOM 894 N TRP A 60 4.214 -13.318 -9.532 1.00 0.00 N ATOM 895 CA TRP A 60 2.971 -12.580 -9.724 1.00 0.00 C ATOM 896 C TRP A 60 3.075 -11.642 -10.922 1.00 0.00 C ATOM 897 O TRP A 60 2.235 -11.671 -11.820 1.00 0.00 O ATOM 898 CB TRP A 60 2.627 -11.783 -8.465 1.00 0.00 C ATOM 899 CG TRP A 60 1.837 -12.569 -7.462 1.00 0.00 C ATOM 900 CD1 TRP A 60 0.501 -12.845 -7.506 1.00 0.00 C ATOM 901 CD2 TRP A 60 2.336 -13.177 -6.266 1.00 0.00 C ATOM 902 NE1 TRP A 60 0.138 -13.589 -6.409 1.00 0.00 N ATOM 903 CE2 TRP A 60 1.246 -13.807 -5.633 1.00 0.00 C ATOM 904 CE3 TRP A 60 3.597 -13.253 -5.669 1.00 0.00 C ATOM 905 CZ2 TRP A 60 1.382 -14.501 -4.434 1.00 0.00 C ATOM 906 CZ3 TRP A 60 3.730 -13.942 -4.478 1.00 0.00 C ATOM 907 CH2 TRP A 60 2.628 -14.559 -3.871 1.00 0.00 C ATOM 0 H TRP A 60 4.911 -12.831 -8.968 1.00 0.00 H new ATOM 0 HA TRP A 60 2.176 -13.300 -9.918 1.00 0.00 H new ATOM 0 HB2 TRP A 60 3.550 -11.437 -7.999 1.00 0.00 H new ATOM 0 HB3 TRP A 60 2.061 -10.896 -8.749 1.00 0.00 H new ATOM 0 HD1 TRP A 60 -0.172 -12.526 -8.288 1.00 0.00 H new ATOM 0 HE1 TRP A 60 -0.804 -13.924 -6.206 1.00 0.00 H new ATOM 0 HE3 TRP A 60 4.453 -12.782 -6.130 1.00 0.00 H new ATOM 0 HZ2 TRP A 60 0.534 -14.977 -3.964 1.00 0.00 H new ATOM 0 HZ3 TRP A 60 4.700 -14.006 -4.007 1.00 0.00 H new ATOM 0 HH2 TRP A 60 2.765 -15.091 -2.941 1.00 0.00 H new ATOM 918 N ASN A 61 4.112 -10.810 -10.928 1.00 0.00 N ATOM 919 CA ASN A 61 4.325 -9.862 -12.016 1.00 0.00 C ATOM 920 C ASN A 61 3.016 -9.189 -12.415 1.00 0.00 C ATOM 921 O ASN A 61 2.669 -9.135 -13.594 1.00 0.00 O ATOM 922 CB ASN A 61 4.935 -10.573 -13.226 1.00 0.00 C ATOM 923 CG ASN A 61 6.448 -10.645 -13.152 1.00 0.00 C ATOM 924 OD1 ASN A 61 6.957 -11.517 -12.289 1.00 0.00 O flip ATOM 925 ND2 ASN A 61 7.151 -9.925 -13.862 1.00 0.00 N flip ATOM 0 H ASN A 61 4.817 -10.773 -10.192 1.00 0.00 H new ATOM 0 HA ASN A 61 5.016 -9.094 -11.667 1.00 0.00 H new ATOM 0 HB2 ASN A 61 4.529 -11.582 -13.294 1.00 0.00 H new ATOM 0 HB3 ASN A 61 4.643 -10.050 -14.137 1.00 0.00 H new ATOM 0 HD21 ASN A 61 6.717 -9.269 -14.511 1.00 0.00 H new ATOM 0 HD22 ASN A 61 8.167 -9.985 -13.801 1.00 0.00 H new ATOM 932 N GLU A 62 2.294 -8.675 -11.423 1.00 0.00 N ATOM 933 CA GLU A 62 1.023 -8.005 -11.671 1.00 0.00 C ATOM 934 C GLU A 62 1.059 -6.566 -11.165 1.00 0.00 C ATOM 935 O GLU A 62 1.580 -6.290 -10.084 1.00 0.00 O ATOM 936 CB GLU A 62 -0.120 -8.766 -10.997 1.00 0.00 C ATOM 937 CG GLU A 62 -1.454 -8.042 -11.061 1.00 0.00 C ATOM 938 CD GLU A 62 -2.636 -8.991 -11.026 1.00 0.00 C ATOM 939 OE1 GLU A 62 -2.924 -9.539 -9.941 1.00 0.00 O ATOM 940 OE2 GLU A 62 -3.272 -9.187 -12.082 1.00 0.00 O ATOM 0 H GLU A 62 2.568 -8.710 -10.441 1.00 0.00 H new ATOM 0 HA GLU A 62 0.854 -7.989 -12.748 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -0.223 -9.743 -11.469 1.00 0.00 H new ATOM 0 HB3 GLU A 62 0.138 -8.943 -9.953 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -1.526 -7.347 -10.224 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -1.497 -7.448 -11.974 1.00 0.00 H new ATOM 947 N TRP A 63 0.504 -5.654 -11.954 1.00 0.00 N ATOM 948 CA TRP A 63 0.473 -4.243 -11.587 1.00 0.00 C ATOM 949 C TRP A 63 -0.713 -3.943 -10.676 1.00 0.00 C ATOM 950 O TRP A 63 -1.863 -3.943 -11.118 1.00 0.00 O ATOM 951 CB TRP A 63 0.402 -3.370 -12.841 1.00 0.00 C ATOM 952 CG TRP A 63 1.726 -3.199 -13.522 1.00 0.00 C ATOM 953 CD1 TRP A 63 2.181 -3.883 -14.613 1.00 0.00 C ATOM 954 CD2 TRP A 63 2.766 -2.286 -13.155 1.00 0.00 C ATOM 955 NE1 TRP A 63 3.442 -3.450 -14.946 1.00 0.00 N ATOM 956 CE2 TRP A 63 3.823 -2.471 -14.068 1.00 0.00 C ATOM 957 CE3 TRP A 63 2.907 -1.330 -12.146 1.00 0.00 C ATOM 958 CZ2 TRP A 63 5.003 -1.735 -13.999 1.00 0.00 C ATOM 959 CZ3 TRP A 63 4.079 -0.600 -12.079 1.00 0.00 C ATOM 960 CH2 TRP A 63 5.114 -0.805 -13.001 1.00 0.00 C ATOM 0 H TRP A 63 0.069 -5.866 -12.852 1.00 0.00 H new ATOM 0 HA TRP A 63 1.391 -4.014 -11.045 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -0.305 -3.812 -13.543 1.00 0.00 H new ATOM 0 HB3 TRP A 63 0.011 -2.389 -12.570 1.00 0.00 H new ATOM 0 HD1 TRP A 63 1.631 -4.651 -15.137 1.00 0.00 H new ATOM 0 HE1 TRP A 63 4.003 -3.801 -15.722 1.00 0.00 H new ATOM 0 HE3 TRP A 63 2.115 -1.164 -11.431 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 5.802 -1.892 -14.708 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 4.199 0.141 -11.303 1.00 0.00 H new ATOM 0 HH2 TRP A 63 6.017 -0.218 -12.923 1.00 0.00 H new ATOM 971 N LEU A 64 -0.427 -3.688 -9.405 1.00 0.00 N ATOM 972 CA LEU A 64 -1.471 -3.386 -8.431 1.00 0.00 C ATOM 973 C LEU A 64 -1.604 -1.881 -8.224 1.00 0.00 C ATOM 974 O LEU A 64 -0.641 -1.207 -7.860 1.00 0.00 O ATOM 975 CB LEU A 64 -1.165 -4.071 -7.098 1.00 0.00 C ATOM 976 CG LEU A 64 -2.377 -4.475 -6.257 1.00 0.00 C ATOM 977 CD1 LEU A 64 -3.242 -5.471 -7.014 1.00 0.00 C ATOM 978 CD2 LEU A 64 -1.931 -5.059 -4.925 1.00 0.00 C ATOM 0 H LEU A 64 0.519 -3.684 -9.024 1.00 0.00 H new ATOM 0 HA LEU A 64 -2.416 -3.765 -8.819 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -0.573 -4.964 -7.299 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -0.542 -3.403 -6.504 1.00 0.00 H new ATOM 0 HG LEU A 64 -2.972 -3.583 -6.059 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -4.100 -5.748 -6.401 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -3.590 -5.018 -7.942 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -2.657 -6.362 -7.242 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -2.806 -5.341 -4.340 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -1.314 -5.940 -5.102 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -1.352 -4.315 -4.377 1.00 0.00 H new ATOM 990 N ASN A 65 -2.804 -1.361 -8.457 1.00 0.00 N ATOM 991 CA ASN A 65 -3.064 0.065 -8.295 1.00 0.00 C ATOM 992 C ASN A 65 -3.770 0.342 -6.971 1.00 0.00 C ATOM 993 O ASN A 65 -4.585 -0.458 -6.511 1.00 0.00 O ATOM 994 CB ASN A 65 -3.912 0.585 -9.457 1.00 0.00 C ATOM 995 CG ASN A 65 -5.216 -0.175 -9.608 1.00 0.00 C ATOM 996 OD1 ASN A 65 -6.213 0.147 -8.963 1.00 0.00 O ATOM 997 ND2 ASN A 65 -5.212 -1.191 -10.463 1.00 0.00 N ATOM 0 H ASN A 65 -3.612 -1.905 -8.759 1.00 0.00 H new ATOM 0 HA ASN A 65 -2.106 0.586 -8.292 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -4.127 1.642 -9.301 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -3.341 0.509 -10.382 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -6.059 -1.740 -10.606 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -4.362 -1.422 -10.977 1.00 0.00 H new ATOM 1004 N TYR A 66 -3.453 1.480 -6.365 1.00 0.00 N ATOM 1005 CA TYR A 66 -4.055 1.862 -5.093 1.00 0.00 C ATOM 1006 C TYR A 66 -4.940 3.094 -5.258 1.00 0.00 C ATOM 1007 O TYR A 66 -4.528 4.094 -5.846 1.00 0.00 O ATOM 1008 CB TYR A 66 -2.968 2.137 -4.052 1.00 0.00 C ATOM 1009 CG TYR A 66 -2.209 0.899 -3.629 1.00 0.00 C ATOM 1010 CD1 TYR A 66 -1.268 0.317 -4.469 1.00 0.00 C ATOM 1011 CD2 TYR A 66 -2.432 0.314 -2.389 1.00 0.00 C ATOM 1012 CE1 TYR A 66 -0.572 -0.814 -4.087 1.00 0.00 C ATOM 1013 CE2 TYR A 66 -1.739 -0.816 -1.998 1.00 0.00 C ATOM 1014 CZ TYR A 66 -0.811 -1.377 -2.851 1.00 0.00 C ATOM 1015 OH TYR A 66 -0.119 -2.502 -2.466 1.00 0.00 O ATOM 0 H TYR A 66 -2.783 2.154 -6.734 1.00 0.00 H new ATOM 0 HA TYR A 66 -4.675 1.034 -4.750 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -2.264 2.864 -4.457 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -3.425 2.591 -3.173 1.00 0.00 H new ATOM 0 HD1 TYR A 66 -1.077 0.756 -5.437 1.00 0.00 H new ATOM 0 HD2 TYR A 66 -3.159 0.749 -1.719 1.00 0.00 H new ATOM 0 HE1 TYR A 66 0.155 -1.255 -4.753 1.00 0.00 H new ATOM 0 HE2 TYR A 66 -1.923 -1.258 -1.030 1.00 0.00 H new ATOM 0 HH TYR A 66 0.819 -2.269 -2.304 1.00 0.00 H new ATOM 1025 N ASP A 67 -6.157 3.014 -4.733 1.00 0.00 N ATOM 1026 CA ASP A 67 -7.102 4.123 -4.819 1.00 0.00 C ATOM 1027 C ASP A 67 -6.838 5.148 -3.720 1.00 0.00 C ATOM 1028 O ASP A 67 -7.761 5.587 -3.034 1.00 0.00 O ATOM 1029 CB ASP A 67 -8.538 3.606 -4.718 1.00 0.00 C ATOM 1030 CG ASP A 67 -9.529 4.510 -5.425 1.00 0.00 C ATOM 1031 OD1 ASP A 67 -9.240 4.932 -6.564 1.00 0.00 O ATOM 1032 OD2 ASP A 67 -10.594 4.794 -4.839 1.00 0.00 O ATOM 0 H ASP A 67 -6.513 2.193 -4.243 1.00 0.00 H new ATOM 0 HA ASP A 67 -6.967 4.610 -5.785 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -8.592 2.606 -5.148 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -8.816 3.517 -3.668 1.00 0.00 H new ATOM 1037 N ILE A 68 -5.574 5.524 -3.560 1.00 0.00 N ATOM 1038 CA ILE A 68 -5.190 6.497 -2.545 1.00 0.00 C ATOM 1039 C ILE A 68 -4.665 7.778 -3.183 1.00 0.00 C ATOM 1040 O ILE A 68 -4.399 7.823 -4.384 1.00 0.00 O ATOM 1041 CB ILE A 68 -4.114 5.929 -1.600 1.00 0.00 C ATOM 1042 CG1 ILE A 68 -2.788 5.761 -2.344 1.00 0.00 C ATOM 1043 CG2 ILE A 68 -4.571 4.602 -1.013 1.00 0.00 C ATOM 1044 CD1 ILE A 68 -1.907 6.990 -2.295 1.00 0.00 C ATOM 0 H ILE A 68 -4.799 5.170 -4.120 1.00 0.00 H new ATOM 0 HA ILE A 68 -6.087 6.722 -1.968 1.00 0.00 H new ATOM 0 HB ILE A 68 -3.963 6.632 -0.781 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -2.245 4.918 -1.917 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -2.994 5.513 -3.385 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -3.800 4.214 -0.348 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -5.493 4.751 -0.452 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -4.748 3.889 -1.819 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -0.984 6.798 -2.843 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -2.431 7.831 -2.749 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -1.670 7.227 -1.258 1.00 0.00 H new ATOM 1056 N TYR A 69 -4.516 8.819 -2.371 1.00 0.00 N ATOM 1057 CA TYR A 69 -4.024 10.103 -2.855 1.00 0.00 C ATOM 1058 C TYR A 69 -2.675 10.441 -2.227 1.00 0.00 C ATOM 1059 O TYR A 69 -2.512 10.376 -1.008 1.00 0.00 O ATOM 1060 CB TYR A 69 -5.034 11.209 -2.549 1.00 0.00 C ATOM 1061 CG TYR A 69 -5.276 12.147 -3.709 1.00 0.00 C ATOM 1062 CD1 TYR A 69 -5.409 11.661 -5.005 1.00 0.00 C ATOM 1063 CD2 TYR A 69 -5.371 13.519 -3.512 1.00 0.00 C ATOM 1064 CE1 TYR A 69 -5.629 12.515 -6.069 1.00 0.00 C ATOM 1065 CE2 TYR A 69 -5.592 14.380 -4.570 1.00 0.00 C ATOM 1066 CZ TYR A 69 -5.720 13.873 -5.846 1.00 0.00 C ATOM 1067 OH TYR A 69 -5.940 14.727 -6.902 1.00 0.00 O ATOM 0 H TYR A 69 -4.729 8.798 -1.374 1.00 0.00 H new ATOM 0 HA TYR A 69 -3.893 10.030 -3.935 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -5.981 10.754 -2.257 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -4.681 11.786 -1.694 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -5.339 10.598 -5.183 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -5.270 13.920 -2.514 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -5.729 12.121 -7.070 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -5.664 15.444 -4.399 1.00 0.00 H new ATOM 0 HH TYR A 69 -5.979 15.650 -6.574 1.00 0.00 H new ATOM 1077 N ILE A 70 -1.712 10.803 -3.068 1.00 0.00 N ATOM 1078 CA ILE A 70 -0.379 11.154 -2.596 1.00 0.00 C ATOM 1079 C ILE A 70 -0.420 12.384 -1.695 1.00 0.00 C ATOM 1080 O ILE A 70 0.070 12.373 -0.566 1.00 0.00 O ATOM 1081 CB ILE A 70 0.581 11.423 -3.770 1.00 0.00 C ATOM 1082 CG1 ILE A 70 1.170 10.109 -4.288 1.00 0.00 C ATOM 1083 CG2 ILE A 70 1.689 12.374 -3.341 1.00 0.00 C ATOM 1084 CD1 ILE A 70 0.354 9.475 -5.392 1.00 0.00 C ATOM 0 H ILE A 70 -1.830 10.861 -4.079 1.00 0.00 H new ATOM 0 HA ILE A 70 -0.012 10.301 -2.025 1.00 0.00 H new ATOM 0 HB ILE A 70 0.020 11.891 -4.579 1.00 0.00 H new ATOM 0 HG12 ILE A 70 2.180 10.292 -4.653 1.00 0.00 H new ATOM 0 HG13 ILE A 70 1.253 9.406 -3.459 1.00 0.00 H new ATOM 0 HG21 ILE A 70 2.359 12.554 -4.181 1.00 0.00 H new ATOM 0 HG22 ILE A 70 1.252 13.318 -3.016 1.00 0.00 H new ATOM 0 HG23 ILE A 70 2.250 11.931 -2.518 1.00 0.00 H new ATOM 0 HD11 ILE A 70 0.831 8.548 -5.710 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -0.650 9.260 -5.025 1.00 0.00 H new ATOM 0 HD13 ILE A 70 0.292 10.160 -6.238 1.00 0.00 H new ATOM 1096 N PRO A 71 -1.020 13.470 -2.204 1.00 0.00 N ATOM 1097 CA PRO A 71 -1.143 14.728 -1.461 1.00 0.00 C ATOM 1098 C PRO A 71 -2.114 14.618 -0.291 1.00 0.00 C ATOM 1099 O PRO A 71 -2.322 15.580 0.448 1.00 0.00 O ATOM 1100 CB PRO A 71 -1.676 15.708 -2.509 1.00 0.00 C ATOM 1101 CG PRO A 71 -2.383 14.852 -3.503 1.00 0.00 C ATOM 1102 CD PRO A 71 -1.627 13.553 -3.543 1.00 0.00 C ATOM 0 HA PRO A 71 -0.196 15.033 -1.016 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -2.352 16.437 -2.062 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -0.866 16.269 -2.975 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -3.421 14.691 -3.211 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -2.398 15.325 -4.485 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -2.289 12.709 -3.737 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -0.871 13.552 -4.328 1.00 0.00 H new ATOM 1110 N ASP A 72 -2.707 13.440 -0.129 1.00 0.00 N ATOM 1111 CA ASP A 72 -3.656 13.204 0.953 1.00 0.00 C ATOM 1112 C ASP A 72 -3.145 12.120 1.897 1.00 0.00 C ATOM 1113 O ASP A 72 -3.670 11.943 2.997 1.00 0.00 O ATOM 1114 CB ASP A 72 -5.019 12.804 0.386 1.00 0.00 C ATOM 1115 CG ASP A 72 -6.161 13.164 1.315 1.00 0.00 C ATOM 1116 OD1 ASP A 72 -6.395 14.373 1.527 1.00 0.00 O ATOM 1117 OD2 ASP A 72 -6.822 12.238 1.830 1.00 0.00 O ATOM 0 H ASP A 72 -2.547 12.634 -0.733 1.00 0.00 H new ATOM 0 HA ASP A 72 -3.764 14.130 1.517 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -5.168 13.296 -0.575 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -5.031 11.730 0.200 1.00 0.00 H new ATOM 1122 N LEU A 73 -2.121 11.397 1.460 1.00 0.00 N ATOM 1123 CA LEU A 73 -1.539 10.329 2.265 1.00 0.00 C ATOM 1124 C LEU A 73 -0.758 10.900 3.445 1.00 0.00 C ATOM 1125 O LEU A 73 0.257 11.576 3.279 1.00 0.00 O ATOM 1126 CB LEU A 73 -0.622 9.456 1.406 1.00 0.00 C ATOM 1127 CG LEU A 73 -0.511 7.989 1.820 1.00 0.00 C ATOM 1128 CD1 LEU A 73 0.211 7.863 3.153 1.00 0.00 C ATOM 1129 CD2 LEU A 73 -1.890 7.350 1.896 1.00 0.00 C ATOM 0 H LEU A 73 -1.676 11.531 0.552 1.00 0.00 H new ATOM 0 HA LEU A 73 -2.353 9.717 2.654 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -0.976 9.496 0.376 1.00 0.00 H new ATOM 0 HB3 LEU A 73 0.377 9.892 1.417 1.00 0.00 H new ATOM 0 HG LEU A 73 0.071 7.462 1.064 1.00 0.00 H new ATOM 0 HD11 LEU A 73 0.280 6.811 3.431 1.00 0.00 H new ATOM 0 HD12 LEU A 73 1.213 8.282 3.065 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -0.343 8.405 3.919 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -1.791 6.306 2.192 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -2.496 7.880 2.631 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -2.371 7.406 0.920 1.00 0.00 H new ATOM 1141 N PRO A 74 -1.240 10.620 4.665 1.00 0.00 N ATOM 1142 CA PRO A 74 -0.600 11.094 5.896 1.00 0.00 C ATOM 1143 C PRO A 74 0.735 10.405 6.158 1.00 0.00 C ATOM 1144 O PRO A 74 0.913 9.231 5.833 1.00 0.00 O ATOM 1145 CB PRO A 74 -1.613 10.729 6.984 1.00 0.00 C ATOM 1146 CG PRO A 74 -2.379 9.583 6.420 1.00 0.00 C ATOM 1147 CD PRO A 74 -2.445 9.819 4.937 1.00 0.00 C ATOM 0 HA PRO A 74 -0.366 12.158 5.851 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -1.114 10.453 7.913 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -2.269 11.569 7.212 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -1.886 8.637 6.643 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -3.378 9.531 6.852 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -2.439 8.882 4.380 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -3.353 10.351 4.655 1.00 0.00 H new ATOM 1155 N ARG A 75 1.670 11.143 6.747 1.00 0.00 N ATOM 1156 CA ARG A 75 2.990 10.603 7.052 1.00 0.00 C ATOM 1157 C ARG A 75 2.882 9.395 7.977 1.00 0.00 C ATOM 1158 O ARG A 75 3.578 8.397 7.795 1.00 0.00 O ATOM 1159 CB ARG A 75 3.867 11.677 7.697 1.00 0.00 C ATOM 1160 CG ARG A 75 3.957 12.959 6.885 1.00 0.00 C ATOM 1161 CD ARG A 75 4.811 12.772 5.641 1.00 0.00 C ATOM 1162 NE ARG A 75 4.603 13.841 4.669 1.00 0.00 N ATOM 1163 CZ ARG A 75 5.036 15.085 4.841 1.00 0.00 C ATOM 1164 NH1 ARG A 75 5.697 15.414 5.942 1.00 0.00 N ATOM 1165 NH2 ARG A 75 4.808 16.003 3.910 1.00 0.00 N ATOM 0 H ARG A 75 1.538 12.116 7.023 1.00 0.00 H new ATOM 0 HA ARG A 75 3.449 10.283 6.117 1.00 0.00 H new ATOM 0 HB2 ARG A 75 3.473 11.910 8.686 1.00 0.00 H new ATOM 0 HB3 ARG A 75 4.871 11.277 7.840 1.00 0.00 H new ATOM 0 HG2 ARG A 75 2.956 13.279 6.596 1.00 0.00 H new ATOM 0 HG3 ARG A 75 4.379 13.753 7.502 1.00 0.00 H new ATOM 0 HD2 ARG A 75 5.863 12.740 5.925 1.00 0.00 H new ATOM 0 HD3 ARG A 75 4.576 11.812 5.181 1.00 0.00 H new ATOM 0 HE ARG A 75 4.098 13.621 3.811 1.00 0.00 H new ATOM 0 HH11 ARG A 75 5.874 14.711 6.660 1.00 0.00 H new ATOM 0 HH12 ARG A 75 6.028 16.370 6.071 1.00 0.00 H new ATOM 0 HH21 ARG A 75 4.300 15.754 3.061 1.00 0.00 H new ATOM 0 HH22 ARG A 75 5.141 16.958 4.043 1.00 0.00 H new ATOM 1179 N ALA A 76 2.006 9.494 8.972 1.00 0.00 N ATOM 1180 CA ALA A 76 1.806 8.409 9.925 1.00 0.00 C ATOM 1181 C ALA A 76 1.449 7.110 9.211 1.00 0.00 C ATOM 1182 O ALA A 76 1.784 6.022 9.678 1.00 0.00 O ATOM 1183 CB ALA A 76 0.722 8.779 10.926 1.00 0.00 C ATOM 0 H ALA A 76 1.424 10.315 9.139 1.00 0.00 H new ATOM 0 HA ALA A 76 2.742 8.252 10.461 1.00 0.00 H new ATOM 0 HB1 ALA A 76 0.583 7.960 11.631 1.00 0.00 H new ATOM 0 HB2 ALA A 76 1.018 9.678 11.467 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -0.213 8.965 10.398 1.00 0.00 H new ATOM 1189 N ALA A 77 0.766 7.232 8.077 1.00 0.00 N ATOM 1190 CA ALA A 77 0.364 6.067 7.299 1.00 0.00 C ATOM 1191 C ALA A 77 1.574 5.380 6.674 1.00 0.00 C ATOM 1192 O ALA A 77 2.673 5.934 6.656 1.00 0.00 O ATOM 1193 CB ALA A 77 -0.631 6.470 6.221 1.00 0.00 C ATOM 0 H ALA A 77 0.480 8.126 7.677 1.00 0.00 H new ATOM 0 HA ALA A 77 -0.115 5.358 7.974 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -0.923 5.590 5.648 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -1.514 6.909 6.686 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -0.171 7.200 5.556 1.00 0.00 H new ATOM 1199 N ARG A 78 1.364 4.171 6.164 1.00 0.00 N ATOM 1200 CA ARG A 78 2.438 3.408 5.540 1.00 0.00 C ATOM 1201 C ARG A 78 1.876 2.274 4.688 1.00 0.00 C ATOM 1202 O ARG A 78 0.670 2.026 4.683 1.00 0.00 O ATOM 1203 CB ARG A 78 3.376 2.842 6.607 1.00 0.00 C ATOM 1204 CG ARG A 78 2.722 1.802 7.503 1.00 0.00 C ATOM 1205 CD ARG A 78 3.437 1.691 8.841 1.00 0.00 C ATOM 1206 NE ARG A 78 3.166 2.837 9.704 1.00 0.00 N ATOM 1207 CZ ARG A 78 3.620 2.945 10.948 1.00 0.00 C ATOM 1208 NH1 ARG A 78 4.363 1.980 11.471 1.00 0.00 N ATOM 1209 NH2 ARG A 78 3.330 4.019 11.670 1.00 0.00 N ATOM 0 H ARG A 78 0.460 3.699 6.171 1.00 0.00 H new ATOM 0 HA ARG A 78 2.999 4.081 4.892 1.00 0.00 H new ATOM 0 HB2 ARG A 78 4.242 2.395 6.118 1.00 0.00 H new ATOM 0 HB3 ARG A 78 3.746 3.660 7.225 1.00 0.00 H new ATOM 0 HG2 ARG A 78 1.678 2.067 7.668 1.00 0.00 H new ATOM 0 HG3 ARG A 78 2.730 0.833 7.004 1.00 0.00 H new ATOM 0 HD2 ARG A 78 3.124 0.776 9.344 1.00 0.00 H new ATOM 0 HD3 ARG A 78 4.511 1.610 8.672 1.00 0.00 H new ATOM 0 HE ARG A 78 2.597 3.597 9.331 1.00 0.00 H new ATOM 0 HH11 ARG A 78 4.587 1.153 10.918 1.00 0.00 H new ATOM 0 HH12 ARG A 78 4.711 2.065 12.426 1.00 0.00 H new ATOM 0 HH21 ARG A 78 2.758 4.763 11.270 1.00 0.00 H new ATOM 0 HH22 ARG A 78 3.679 4.101 12.625 1.00 0.00 H new ATOM 1223 N LEU A 79 2.758 1.590 3.967 1.00 0.00 N ATOM 1224 CA LEU A 79 2.350 0.482 3.110 1.00 0.00 C ATOM 1225 C LEU A 79 2.507 -0.852 3.832 1.00 0.00 C ATOM 1226 O LEU A 79 3.457 -1.050 4.591 1.00 0.00 O ATOM 1227 CB LEU A 79 3.175 0.478 1.822 1.00 0.00 C ATOM 1228 CG LEU A 79 2.928 -0.694 0.871 1.00 0.00 C ATOM 1229 CD1 LEU A 79 1.505 -0.658 0.336 1.00 0.00 C ATOM 1230 CD2 LEU A 79 3.931 -0.672 -0.274 1.00 0.00 C ATOM 0 H LEU A 79 3.760 1.783 3.959 1.00 0.00 H new ATOM 0 HA LEU A 79 1.298 0.617 2.860 1.00 0.00 H new ATOM 0 HB2 LEU A 79 2.976 1.405 1.284 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.231 0.486 2.091 1.00 0.00 H new ATOM 0 HG LEU A 79 3.061 -1.622 1.427 1.00 0.00 H new ATOM 0 HD11 LEU A 79 1.349 -1.500 -0.339 1.00 0.00 H new ATOM 0 HD12 LEU A 79 0.802 -0.723 1.167 1.00 0.00 H new ATOM 0 HD13 LEU A 79 1.343 0.275 -0.204 1.00 0.00 H new ATOM 0 HD21 LEU A 79 3.740 -1.513 -0.941 1.00 0.00 H new ATOM 0 HD22 LEU A 79 3.830 0.261 -0.828 1.00 0.00 H new ATOM 0 HD23 LEU A 79 4.942 -0.748 0.126 1.00 0.00 H new ATOM 1242 N CYS A 80 1.572 -1.764 3.590 1.00 0.00 N ATOM 1243 CA CYS A 80 1.608 -3.080 4.217 1.00 0.00 C ATOM 1244 C CYS A 80 1.444 -4.183 3.176 1.00 0.00 C ATOM 1245 O CYS A 80 0.769 -3.999 2.162 1.00 0.00 O ATOM 1246 CB CYS A 80 0.509 -3.194 5.275 1.00 0.00 C ATOM 1247 SG CYS A 80 0.640 -1.981 6.609 1.00 0.00 S ATOM 0 H CYS A 80 0.780 -1.616 2.964 1.00 0.00 H new ATOM 0 HA CYS A 80 2.579 -3.200 4.697 1.00 0.00 H new ATOM 0 HB2 CYS A 80 -0.461 -3.081 4.790 1.00 0.00 H new ATOM 0 HB3 CYS A 80 0.536 -4.195 5.705 1.00 0.00 H new ATOM 0 HG CYS A 80 -0.511 -1.862 7.202 1.00 0.00 H new ATOM 1253 N LEU A 81 2.067 -5.328 3.432 1.00 0.00 N ATOM 1254 CA LEU A 81 1.992 -6.461 2.515 1.00 0.00 C ATOM 1255 C LEU A 81 2.235 -7.774 3.252 1.00 0.00 C ATOM 1256 O LEU A 81 3.131 -7.871 4.090 1.00 0.00 O ATOM 1257 CB LEU A 81 3.014 -6.299 1.389 1.00 0.00 C ATOM 1258 CG LEU A 81 4.254 -5.469 1.721 1.00 0.00 C ATOM 1259 CD1 LEU A 81 5.462 -5.985 0.955 1.00 0.00 C ATOM 1260 CD2 LEU A 81 4.011 -3.999 1.412 1.00 0.00 C ATOM 0 H LEU A 81 2.629 -5.497 4.266 1.00 0.00 H new ATOM 0 HA LEU A 81 0.990 -6.485 2.087 1.00 0.00 H new ATOM 0 HB2 LEU A 81 3.339 -7.291 1.075 1.00 0.00 H new ATOM 0 HB3 LEU A 81 2.514 -5.842 0.535 1.00 0.00 H new ATOM 0 HG LEU A 81 4.458 -5.566 2.787 1.00 0.00 H new ATOM 0 HD11 LEU A 81 6.335 -5.382 1.204 1.00 0.00 H new ATOM 0 HD12 LEU A 81 5.649 -7.024 1.227 1.00 0.00 H new ATOM 0 HD13 LEU A 81 5.269 -5.919 -0.116 1.00 0.00 H new ATOM 0 HD21 LEU A 81 4.904 -3.424 1.655 1.00 0.00 H new ATOM 0 HD22 LEU A 81 3.781 -3.883 0.353 1.00 0.00 H new ATOM 0 HD23 LEU A 81 3.173 -3.636 2.007 1.00 0.00 H new ATOM 1272 N SER A 82 1.431 -8.783 2.933 1.00 0.00 N ATOM 1273 CA SER A 82 1.557 -10.091 3.565 1.00 0.00 C ATOM 1274 C SER A 82 1.142 -11.202 2.605 1.00 0.00 C ATOM 1275 O SER A 82 0.244 -11.021 1.782 1.00 0.00 O ATOM 1276 CB SER A 82 0.704 -10.152 4.834 1.00 0.00 C ATOM 1277 OG SER A 82 -0.674 -10.014 4.529 1.00 0.00 O ATOM 0 H SER A 82 0.685 -8.720 2.240 1.00 0.00 H new ATOM 0 HA SER A 82 2.604 -10.238 3.832 1.00 0.00 H new ATOM 0 HB2 SER A 82 0.874 -11.100 5.345 1.00 0.00 H new ATOM 0 HB3 SER A 82 1.009 -9.361 5.520 1.00 0.00 H new ATOM 0 HG SER A 82 -1.195 -10.629 5.086 1.00 0.00 H new ATOM 1283 N ILE A 83 1.802 -12.349 2.717 1.00 0.00 N ATOM 1284 CA ILE A 83 1.501 -13.490 1.861 1.00 0.00 C ATOM 1285 C ILE A 83 0.488 -14.420 2.519 1.00 0.00 C ATOM 1286 O ILE A 83 0.510 -14.618 3.734 1.00 0.00 O ATOM 1287 CB ILE A 83 2.772 -14.291 1.523 1.00 0.00 C ATOM 1288 CG1 ILE A 83 3.909 -13.344 1.131 1.00 0.00 C ATOM 1289 CG2 ILE A 83 2.492 -15.282 0.403 1.00 0.00 C ATOM 1290 CD1 ILE A 83 5.280 -13.975 1.225 1.00 0.00 C ATOM 0 H ILE A 83 2.549 -12.513 3.392 1.00 0.00 H new ATOM 0 HA ILE A 83 1.078 -13.090 0.940 1.00 0.00 H new ATOM 0 HB ILE A 83 3.077 -14.849 2.408 1.00 0.00 H new ATOM 0 HG12 ILE A 83 3.747 -12.997 0.110 1.00 0.00 H new ATOM 0 HG13 ILE A 83 3.877 -12.465 1.775 1.00 0.00 H new ATOM 0 HG21 ILE A 83 3.400 -15.840 0.176 1.00 0.00 H new ATOM 0 HG22 ILE A 83 1.710 -15.973 0.716 1.00 0.00 H new ATOM 0 HG23 ILE A 83 2.165 -14.743 -0.486 1.00 0.00 H new ATOM 0 HD11 ILE A 83 6.037 -13.247 0.933 1.00 0.00 H new ATOM 0 HD12 ILE A 83 5.463 -14.297 2.250 1.00 0.00 H new ATOM 0 HD13 ILE A 83 5.330 -14.837 0.560 1.00 0.00 H new ATOM 1302 N CYS A 84 -0.398 -14.989 1.709 1.00 0.00 N ATOM 1303 CA CYS A 84 -1.420 -15.900 2.213 1.00 0.00 C ATOM 1304 C CYS A 84 -1.579 -17.103 1.289 1.00 0.00 C ATOM 1305 O CYS A 84 -1.435 -16.987 0.072 1.00 0.00 O ATOM 1306 CB CYS A 84 -2.757 -15.171 2.355 1.00 0.00 C ATOM 1307 SG CYS A 84 -2.724 -13.788 3.519 1.00 0.00 S ATOM 0 H CYS A 84 -0.429 -14.836 0.701 1.00 0.00 H new ATOM 0 HA CYS A 84 -1.103 -16.257 3.193 1.00 0.00 H new ATOM 0 HB2 CYS A 84 -3.062 -14.801 1.376 1.00 0.00 H new ATOM 0 HB3 CYS A 84 -3.515 -15.885 2.677 1.00 0.00 H new ATOM 0 HG CYS A 84 -1.567 -13.745 4.110 1.00 0.00 H new ATOM 1313 N SER A 85 -1.873 -18.258 1.876 1.00 0.00 N ATOM 1314 CA SER A 85 -2.046 -19.485 1.106 1.00 0.00 C ATOM 1315 C SER A 85 -3.509 -19.918 1.095 1.00 0.00 C ATOM 1316 O SER A 85 -4.114 -20.129 2.146 1.00 0.00 O ATOM 1317 CB SER A 85 -1.176 -20.602 1.685 1.00 0.00 C ATOM 1318 OG SER A 85 -1.667 -21.031 2.943 1.00 0.00 O ATOM 0 H SER A 85 -1.997 -18.371 2.882 1.00 0.00 H new ATOM 0 HA SER A 85 -1.736 -19.288 0.080 1.00 0.00 H new ATOM 0 HB2 SER A 85 -1.153 -21.444 0.994 1.00 0.00 H new ATOM 0 HB3 SER A 85 -0.150 -20.250 1.793 1.00 0.00 H new ATOM 0 HG SER A 85 -2.639 -20.910 2.973 1.00 0.00 H new ATOM 1324 N VAL A 86 -4.072 -20.049 -0.102 1.00 0.00 N ATOM 1325 CA VAL A 86 -5.463 -20.458 -0.252 1.00 0.00 C ATOM 1326 C VAL A 86 -5.563 -21.901 -0.733 1.00 0.00 C ATOM 1327 O VAL A 86 -5.043 -22.252 -1.792 1.00 0.00 O ATOM 1328 CB VAL A 86 -6.213 -19.545 -1.241 1.00 0.00 C ATOM 1329 CG1 VAL A 86 -5.654 -19.709 -2.647 1.00 0.00 C ATOM 1330 CG2 VAL A 86 -7.704 -19.843 -1.214 1.00 0.00 C ATOM 0 H VAL A 86 -3.586 -19.878 -0.982 1.00 0.00 H new ATOM 0 HA VAL A 86 -5.926 -20.373 0.731 1.00 0.00 H new ATOM 0 HB VAL A 86 -6.067 -18.509 -0.936 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -6.196 -19.057 -3.332 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -4.597 -19.443 -2.652 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -5.769 -20.745 -2.966 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -8.219 -19.189 -1.918 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -7.872 -20.883 -1.494 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -8.091 -19.671 -0.210 1.00 0.00 H new ATOM 1340 N LYS A 87 -6.235 -22.735 0.053 1.00 0.00 N ATOM 1341 CA LYS A 87 -6.406 -24.142 -0.292 1.00 0.00 C ATOM 1342 C LYS A 87 -7.849 -24.584 -0.072 1.00 0.00 C ATOM 1343 O LYS A 87 -8.515 -24.126 0.855 1.00 0.00 O ATOM 1344 CB LYS A 87 -5.462 -25.011 0.543 1.00 0.00 C ATOM 1345 CG LYS A 87 -5.814 -26.488 0.517 1.00 0.00 C ATOM 1346 CD LYS A 87 -4.600 -27.356 0.804 1.00 0.00 C ATOM 1347 CE LYS A 87 -5.005 -28.724 1.332 1.00 0.00 C ATOM 1348 NZ LYS A 87 -5.532 -28.648 2.722 1.00 0.00 N ATOM 0 H LYS A 87 -6.670 -22.461 0.934 1.00 0.00 H new ATOM 0 HA LYS A 87 -6.164 -24.264 -1.348 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -4.443 -24.882 0.177 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -5.476 -24.661 1.575 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -6.590 -26.691 1.255 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -6.226 -26.748 -0.458 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -4.013 -27.475 -0.107 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -3.960 -26.859 1.533 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -5.764 -29.155 0.679 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -4.145 -29.393 1.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -5.510 -29.594 3.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -4.943 -27.998 3.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -6.511 -28.299 2.703 1.00 0.00 H new ATOM 1362 N GLY A 88 -8.326 -25.480 -0.931 1.00 0.00 N ATOM 1363 CA GLY A 88 -9.686 -25.971 -0.813 1.00 0.00 C ATOM 1364 C GLY A 88 -10.091 -26.845 -1.983 1.00 0.00 C ATOM 1365 O GLY A 88 -9.341 -26.989 -2.948 1.00 0.00 O ATOM 0 H GLY A 88 -7.794 -25.875 -1.707 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -9.785 -26.539 0.112 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -10.369 -25.125 -0.742 1.00 0.00 H new ATOM 1369 N ARG A 89 -11.280 -27.433 -1.896 1.00 0.00 N ATOM 1370 CA ARG A 89 -11.782 -28.301 -2.955 1.00 0.00 C ATOM 1371 C ARG A 89 -12.825 -27.577 -3.803 1.00 0.00 C ATOM 1372 O ARG A 89 -13.270 -26.482 -3.458 1.00 0.00 O ATOM 1373 CB ARG A 89 -12.388 -29.572 -2.357 1.00 0.00 C ATOM 1374 CG ARG A 89 -11.633 -30.096 -1.147 1.00 0.00 C ATOM 1375 CD ARG A 89 -10.487 -31.008 -1.557 1.00 0.00 C ATOM 1376 NE ARG A 89 -10.965 -32.272 -2.110 1.00 0.00 N ATOM 1377 CZ ARG A 89 -10.204 -33.099 -2.817 1.00 0.00 C ATOM 1378 NH1 ARG A 89 -8.935 -32.797 -3.057 1.00 0.00 N ATOM 1379 NH2 ARG A 89 -10.711 -34.232 -3.287 1.00 0.00 N ATOM 0 H ARG A 89 -11.913 -27.324 -1.104 1.00 0.00 H new ATOM 0 HA ARG A 89 -10.943 -28.573 -3.596 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -13.421 -29.372 -2.072 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -12.413 -30.347 -3.123 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -11.244 -29.258 -0.569 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -12.318 -30.640 -0.497 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -9.866 -30.501 -2.296 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -9.855 -31.207 -0.692 1.00 0.00 H new ATOM 0 HE ARG A 89 -11.937 -32.534 -1.944 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -8.541 -31.927 -2.698 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -8.353 -33.434 -3.600 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -11.686 -34.468 -3.105 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -10.125 -34.866 -3.830 1.00 0.00 H new ATOM 1393 N LYS A 90 -13.211 -28.197 -4.913 1.00 0.00 N ATOM 1394 CA LYS A 90 -14.201 -27.614 -5.810 1.00 0.00 C ATOM 1395 C LYS A 90 -15.563 -27.522 -5.131 1.00 0.00 C ATOM 1396 O LYS A 90 -16.179 -26.457 -5.095 1.00 0.00 O ATOM 1397 CB LYS A 90 -14.313 -28.446 -7.090 1.00 0.00 C ATOM 1398 CG LYS A 90 -13.377 -27.989 -8.196 1.00 0.00 C ATOM 1399 CD LYS A 90 -14.003 -26.888 -9.036 1.00 0.00 C ATOM 1400 CE LYS A 90 -14.817 -27.459 -10.187 1.00 0.00 C ATOM 1401 NZ LYS A 90 -15.896 -26.528 -10.619 1.00 0.00 N ATOM 0 H LYS A 90 -12.853 -29.104 -5.213 1.00 0.00 H new ATOM 0 HA LYS A 90 -13.873 -26.606 -6.066 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -14.102 -29.489 -6.855 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -15.340 -28.402 -7.453 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -12.445 -27.630 -7.760 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -13.125 -28.836 -8.834 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -14.644 -26.269 -8.408 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -13.220 -26.239 -9.429 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -14.158 -27.667 -11.030 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -15.257 -28.409 -9.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -16.428 -26.954 -11.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -16.540 -26.349 -9.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -15.475 -25.630 -10.932 1.00 0.00 H new ATOM 1415 N GLY A 91 -16.028 -28.645 -4.591 1.00 0.00 N ATOM 1416 CA GLY A 91 -17.314 -28.668 -3.919 1.00 0.00 C ATOM 1417 C GLY A 91 -17.243 -28.105 -2.513 1.00 0.00 C ATOM 1418 O GLY A 91 -18.257 -28.016 -1.822 1.00 0.00 O ATOM 0 H GLY A 91 -15.537 -29.539 -4.607 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -18.035 -28.094 -4.501 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -17.681 -29.694 -3.878 1.00 0.00 H new ATOM 1422 N ALA A 92 -16.043 -27.726 -2.089 1.00 0.00 N ATOM 1423 CA ALA A 92 -15.844 -27.168 -0.757 1.00 0.00 C ATOM 1424 C ALA A 92 -15.316 -25.740 -0.833 1.00 0.00 C ATOM 1425 O ALA A 92 -15.076 -25.212 -1.919 1.00 0.00 O ATOM 1426 CB ALA A 92 -14.892 -28.043 0.045 1.00 0.00 C ATOM 0 H ALA A 92 -15.193 -27.795 -2.649 1.00 0.00 H new ATOM 0 HA ALA A 92 -16.810 -27.144 -0.252 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -14.753 -27.614 1.037 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -15.310 -29.045 0.138 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -13.930 -28.097 -0.465 1.00 0.00 H new ATOM 1432 N LYS A 93 -15.136 -25.118 0.328 1.00 0.00 N ATOM 1433 CA LYS A 93 -14.636 -23.750 0.394 1.00 0.00 C ATOM 1434 C LYS A 93 -13.116 -23.732 0.517 1.00 0.00 C ATOM 1435 O LYS A 93 -12.489 -24.770 0.727 1.00 0.00 O ATOM 1436 CB LYS A 93 -15.263 -23.012 1.579 1.00 0.00 C ATOM 1437 CG LYS A 93 -16.605 -22.377 1.260 1.00 0.00 C ATOM 1438 CD LYS A 93 -16.435 -21.040 0.557 1.00 0.00 C ATOM 1439 CE LYS A 93 -17.776 -20.361 0.320 1.00 0.00 C ATOM 1440 NZ LYS A 93 -17.614 -19.012 -0.289 1.00 0.00 N ATOM 0 H LYS A 93 -15.329 -25.540 1.236 1.00 0.00 H new ATOM 0 HA LYS A 93 -14.914 -23.243 -0.530 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -15.389 -23.711 2.406 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -14.576 -22.237 1.918 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -17.186 -23.050 0.629 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -17.170 -22.236 2.181 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -15.798 -20.390 1.157 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -15.929 -21.191 -0.396 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -18.388 -20.983 -0.333 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -18.310 -20.271 1.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -18.550 -18.582 -0.435 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -17.052 -18.410 0.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -17.127 -19.100 -1.204 1.00 0.00 H new ATOM 1454 N GLU A 94 -12.530 -22.546 0.385 1.00 0.00 N ATOM 1455 CA GLU A 94 -11.083 -22.395 0.483 1.00 0.00 C ATOM 1456 C GLU A 94 -10.685 -21.823 1.841 1.00 0.00 C ATOM 1457 O GLU A 94 -11.510 -21.242 2.546 1.00 0.00 O ATOM 1458 CB GLU A 94 -10.566 -21.488 -0.636 1.00 0.00 C ATOM 1459 CG GLU A 94 -10.837 -22.027 -2.031 1.00 0.00 C ATOM 1460 CD GLU A 94 -11.009 -20.926 -3.058 1.00 0.00 C ATOM 1461 OE1 GLU A 94 -11.794 -19.990 -2.798 1.00 0.00 O ATOM 1462 OE2 GLU A 94 -10.360 -21.000 -4.122 1.00 0.00 O ATOM 0 H GLU A 94 -13.034 -21.677 0.210 1.00 0.00 H new ATOM 0 HA GLU A 94 -10.633 -23.382 0.379 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -11.029 -20.506 -0.539 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -9.492 -21.348 -0.512 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -10.014 -22.675 -2.333 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -11.736 -22.643 -2.010 1.00 0.00 H new ATOM 1469 N GLU A 95 -9.417 -21.992 2.199 1.00 0.00 N ATOM 1470 CA GLU A 95 -8.911 -21.494 3.473 1.00 0.00 C ATOM 1471 C GLU A 95 -7.678 -20.619 3.264 1.00 0.00 C ATOM 1472 O GLU A 95 -6.659 -21.075 2.744 1.00 0.00 O ATOM 1473 CB GLU A 95 -8.569 -22.660 4.403 1.00 0.00 C ATOM 1474 CG GLU A 95 -8.434 -22.256 5.862 1.00 0.00 C ATOM 1475 CD GLU A 95 -7.755 -23.320 6.701 1.00 0.00 C ATOM 1476 OE1 GLU A 95 -6.507 -23.330 6.749 1.00 0.00 O ATOM 1477 OE2 GLU A 95 -8.470 -24.143 7.310 1.00 0.00 O ATOM 0 H GLU A 95 -8.721 -22.469 1.626 1.00 0.00 H new ATOM 0 HA GLU A 95 -9.692 -20.889 3.933 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -9.343 -23.422 4.316 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -7.635 -23.115 4.073 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.865 -21.329 5.927 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -9.423 -22.052 6.272 1.00 0.00 H new ATOM 1484 N HIS A 96 -7.779 -19.358 3.672 1.00 0.00 N ATOM 1485 CA HIS A 96 -6.673 -18.417 3.530 1.00 0.00 C ATOM 1486 C HIS A 96 -5.902 -18.284 4.840 1.00 0.00 C ATOM 1487 O HIS A 96 -6.477 -17.963 5.880 1.00 0.00 O ATOM 1488 CB HIS A 96 -7.193 -17.049 3.089 1.00 0.00 C ATOM 1489 CG HIS A 96 -8.040 -17.100 1.855 1.00 0.00 C ATOM 1490 ND1 HIS A 96 -8.317 -15.989 1.086 1.00 0.00 N ATOM 1491 CD2 HIS A 96 -8.671 -18.137 1.256 1.00 0.00 C ATOM 1492 CE1 HIS A 96 -9.083 -16.340 0.069 1.00 0.00 C ATOM 1493 NE2 HIS A 96 -9.312 -17.639 0.149 1.00 0.00 N ATOM 0 H HIS A 96 -8.615 -18.964 4.104 1.00 0.00 H new ATOM 0 HA HIS A 96 -5.996 -18.802 2.768 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -7.774 -16.611 3.901 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -6.345 -16.387 2.911 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -8.670 -19.165 1.587 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -9.458 -15.678 -0.697 1.00 0.00 H new ATOM 0 HE2 HIS A 96 -9.874 -18.183 -0.506 1.00 0.00 H new ATOM 1502 N CYS A 97 -4.598 -18.532 4.781 1.00 0.00 N ATOM 1503 CA CYS A 97 -3.749 -18.441 5.963 1.00 0.00 C ATOM 1504 C CYS A 97 -2.459 -17.689 5.649 1.00 0.00 C ATOM 1505 O CYS A 97 -1.700 -18.057 4.752 1.00 0.00 O ATOM 1506 CB CYS A 97 -3.423 -19.839 6.491 1.00 0.00 C ATOM 1507 SG CYS A 97 -3.146 -19.907 8.277 1.00 0.00 S ATOM 0 H CYS A 97 -4.106 -18.797 3.928 1.00 0.00 H new ATOM 0 HA CYS A 97 -4.293 -17.889 6.729 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -4.241 -20.512 6.235 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -2.534 -20.210 5.982 1.00 0.00 H new ATOM 0 HG CYS A 97 -2.880 -21.130 8.629 1.00 0.00 H new ATOM 1513 N PRO A 98 -2.205 -16.610 6.403 1.00 0.00 N ATOM 1514 CA PRO A 98 -1.008 -15.783 6.223 1.00 0.00 C ATOM 1515 C PRO A 98 0.265 -16.504 6.653 1.00 0.00 C ATOM 1516 O PRO A 98 0.267 -17.254 7.630 1.00 0.00 O ATOM 1517 CB PRO A 98 -1.271 -14.577 7.129 1.00 0.00 C ATOM 1518 CG PRO A 98 -2.208 -15.082 8.170 1.00 0.00 C ATOM 1519 CD PRO A 98 -3.065 -16.114 7.490 1.00 0.00 C ATOM 0 HA PRO A 98 -0.847 -15.521 5.177 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -0.347 -14.207 7.574 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -1.709 -13.750 6.570 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -1.663 -15.518 9.007 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -2.817 -14.273 8.573 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -3.350 -16.914 8.174 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -3.988 -15.680 7.106 1.00 0.00 H new ATOM 1527 N LEU A 99 1.347 -16.273 5.917 1.00 0.00 N ATOM 1528 CA LEU A 99 2.628 -16.901 6.223 1.00 0.00 C ATOM 1529 C LEU A 99 3.607 -15.885 6.803 1.00 0.00 C ATOM 1530 O LEU A 99 4.276 -16.154 7.801 1.00 0.00 O ATOM 1531 CB LEU A 99 3.221 -17.535 4.963 1.00 0.00 C ATOM 1532 CG LEU A 99 2.272 -18.408 4.142 1.00 0.00 C ATOM 1533 CD1 LEU A 99 2.901 -18.769 2.805 1.00 0.00 C ATOM 1534 CD2 LEU A 99 1.901 -19.666 4.915 1.00 0.00 C ATOM 0 H LEU A 99 1.363 -15.656 5.105 1.00 0.00 H new ATOM 0 HA LEU A 99 2.455 -17.678 6.967 1.00 0.00 H new ATOM 0 HB2 LEU A 99 3.596 -16.738 4.321 1.00 0.00 H new ATOM 0 HB3 LEU A 99 4.079 -18.140 5.254 1.00 0.00 H new ATOM 0 HG LEU A 99 1.361 -17.841 3.951 1.00 0.00 H new ATOM 0 HD11 LEU A 99 2.211 -19.391 2.234 1.00 0.00 H new ATOM 0 HD12 LEU A 99 3.116 -17.858 2.246 1.00 0.00 H new ATOM 0 HD13 LEU A 99 3.828 -19.317 2.975 1.00 0.00 H new ATOM 0 HD21 LEU A 99 1.225 -20.275 4.315 1.00 0.00 H new ATOM 0 HD22 LEU A 99 2.803 -20.236 5.137 1.00 0.00 H new ATOM 0 HD23 LEU A 99 1.409 -19.388 5.847 1.00 0.00 H new ATOM 1546 N ALA A 100 3.684 -14.718 6.173 1.00 0.00 N ATOM 1547 CA ALA A 100 4.578 -13.661 6.630 1.00 0.00 C ATOM 1548 C ALA A 100 3.899 -12.297 6.556 1.00 0.00 C ATOM 1549 O ALA A 100 2.754 -12.187 6.118 1.00 0.00 O ATOM 1550 CB ALA A 100 5.859 -13.661 5.808 1.00 0.00 C ATOM 0 H ALA A 100 3.138 -14.480 5.345 1.00 0.00 H new ATOM 0 HA ALA A 100 4.828 -13.856 7.673 1.00 0.00 H new ATOM 0 HB1 ALA A 100 6.517 -12.867 6.160 1.00 0.00 H new ATOM 0 HB2 ALA A 100 6.361 -14.623 5.916 1.00 0.00 H new ATOM 0 HB3 ALA A 100 5.618 -13.494 4.758 1.00 0.00 H new ATOM 1556 N TRP A 101 4.612 -11.263 6.985 1.00 0.00 N ATOM 1557 CA TRP A 101 4.077 -9.906 6.968 1.00 0.00 C ATOM 1558 C TRP A 101 5.201 -8.879 6.889 1.00 0.00 C ATOM 1559 O TRP A 101 6.224 -9.012 7.558 1.00 0.00 O ATOM 1560 CB TRP A 101 3.226 -9.655 8.214 1.00 0.00 C ATOM 1561 CG TRP A 101 3.972 -9.873 9.496 1.00 0.00 C ATOM 1562 CD1 TRP A 101 4.049 -11.033 10.212 1.00 0.00 C ATOM 1563 CD2 TRP A 101 4.744 -8.904 10.213 1.00 0.00 C ATOM 1564 NE1 TRP A 101 4.822 -10.844 11.332 1.00 0.00 N ATOM 1565 CE2 TRP A 101 5.261 -9.547 11.355 1.00 0.00 C ATOM 1566 CE3 TRP A 101 5.051 -7.557 10.002 1.00 0.00 C ATOM 1567 CZ2 TRP A 101 6.065 -8.886 12.280 1.00 0.00 C ATOM 1568 CZ3 TRP A 101 5.849 -6.903 10.921 1.00 0.00 C ATOM 1569 CH2 TRP A 101 6.350 -7.568 12.048 1.00 0.00 C ATOM 0 H TRP A 101 5.562 -11.337 7.349 1.00 0.00 H new ATOM 0 HA TRP A 101 3.451 -9.800 6.082 1.00 0.00 H new ATOM 0 HB2 TRP A 101 2.851 -8.632 8.189 1.00 0.00 H new ATOM 0 HB3 TRP A 101 2.357 -10.313 8.191 1.00 0.00 H new ATOM 0 HD1 TRP A 101 3.572 -11.963 9.938 1.00 0.00 H new ATOM 0 HE1 TRP A 101 5.034 -11.554 12.033 1.00 0.00 H new ATOM 0 HE3 TRP A 101 4.671 -7.036 9.136 1.00 0.00 H new ATOM 0 HZ2 TRP A 101 6.450 -9.396 13.151 1.00 0.00 H new ATOM 0 HZ3 TRP A 101 6.091 -5.862 10.768 1.00 0.00 H new ATOM 0 HH2 TRP A 101 6.973 -7.030 12.747 1.00 0.00 H new ATOM 1580 N GLY A 102 5.003 -7.853 6.066 1.00 0.00 N ATOM 1581 CA GLY A 102 6.009 -6.818 5.915 1.00 0.00 C ATOM 1582 C GLY A 102 5.401 -5.446 5.698 1.00 0.00 C ATOM 1583 O GLY A 102 4.429 -5.301 4.958 1.00 0.00 O ATOM 0 H GLY A 102 4.164 -7.721 5.501 1.00 0.00 H new ATOM 0 HA2 GLY A 102 6.640 -6.796 6.804 1.00 0.00 H new ATOM 0 HA3 GLY A 102 6.655 -7.063 5.072 1.00 0.00 H new ATOM 1587 N ASN A 103 5.975 -4.437 6.346 1.00 0.00 N ATOM 1588 CA ASN A 103 5.482 -3.070 6.222 1.00 0.00 C ATOM 1589 C ASN A 103 6.580 -2.140 5.715 1.00 0.00 C ATOM 1590 O ASN A 103 7.740 -2.260 6.110 1.00 0.00 O ATOM 1591 CB ASN A 103 4.957 -2.571 7.569 1.00 0.00 C ATOM 1592 CG ASN A 103 3.722 -3.324 8.024 1.00 0.00 C ATOM 1593 OD1 ASN A 103 3.304 -4.294 7.390 1.00 0.00 O ATOM 1594 ND2 ASN A 103 3.130 -2.880 9.127 1.00 0.00 N ATOM 0 H ASN A 103 6.781 -4.540 6.962 1.00 0.00 H new ATOM 0 HA ASN A 103 4.666 -3.068 5.499 1.00 0.00 H new ATOM 0 HB2 ASN A 103 5.739 -2.674 8.321 1.00 0.00 H new ATOM 0 HB3 ASN A 103 4.724 -1.509 7.494 1.00 0.00 H new ATOM 0 HD21 ASN A 103 2.295 -3.346 9.480 1.00 0.00 H new ATOM 0 HD22 ASN A 103 3.511 -2.073 9.621 1.00 0.00 H new ATOM 1601 N ILE A 104 6.205 -1.214 4.839 1.00 0.00 N ATOM 1602 CA ILE A 104 7.158 -0.263 4.280 1.00 0.00 C ATOM 1603 C ILE A 104 6.748 1.173 4.591 1.00 0.00 C ATOM 1604 O ILE A 104 5.569 1.519 4.534 1.00 0.00 O ATOM 1605 CB ILE A 104 7.288 -0.428 2.754 1.00 0.00 C ATOM 1606 CG1 ILE A 104 8.090 -1.688 2.422 1.00 0.00 C ATOM 1607 CG2 ILE A 104 7.945 0.801 2.143 1.00 0.00 C ATOM 1608 CD1 ILE A 104 7.988 -2.104 0.971 1.00 0.00 C ATOM 0 H ILE A 104 5.249 -1.102 4.501 1.00 0.00 H new ATOM 0 HA ILE A 104 8.122 -0.472 4.744 1.00 0.00 H new ATOM 0 HB ILE A 104 6.290 -0.533 2.328 1.00 0.00 H new ATOM 0 HG12 ILE A 104 9.138 -1.518 2.670 1.00 0.00 H new ATOM 0 HG13 ILE A 104 7.742 -2.507 3.052 1.00 0.00 H new ATOM 0 HG21 ILE A 104 8.030 0.670 1.064 1.00 0.00 H new ATOM 0 HG22 ILE A 104 7.338 1.681 2.355 1.00 0.00 H new ATOM 0 HG23 ILE A 104 8.938 0.934 2.572 1.00 0.00 H new ATOM 0 HD11 ILE A 104 8.581 -3.004 0.808 1.00 0.00 H new ATOM 0 HD12 ILE A 104 6.946 -2.306 0.723 1.00 0.00 H new ATOM 0 HD13 ILE A 104 8.363 -1.302 0.335 1.00 0.00 H new ATOM 1620 N ASN A 105 7.731 2.005 4.919 1.00 0.00 N ATOM 1621 CA ASN A 105 7.473 3.404 5.239 1.00 0.00 C ATOM 1622 C ASN A 105 7.218 4.214 3.971 1.00 0.00 C ATOM 1623 O ASN A 105 8.141 4.788 3.392 1.00 0.00 O ATOM 1624 CB ASN A 105 8.654 3.999 6.008 1.00 0.00 C ATOM 1625 CG ASN A 105 8.633 3.626 7.478 1.00 0.00 C ATOM 1626 OD1 ASN A 105 7.579 3.329 8.040 1.00 0.00 O ATOM 1627 ND2 ASN A 105 9.802 3.642 8.109 1.00 0.00 N ATOM 0 H ASN A 105 8.713 1.735 4.970 1.00 0.00 H new ATOM 0 HA ASN A 105 6.581 3.449 5.864 1.00 0.00 H new ATOM 0 HB2 ASN A 105 9.586 3.653 5.561 1.00 0.00 H new ATOM 0 HB3 ASN A 105 8.637 5.085 5.911 1.00 0.00 H new ATOM 0 HD21 ASN A 105 9.850 3.402 9.099 1.00 0.00 H new ATOM 0 HD22 ASN A 105 10.651 3.894 7.603 1.00 0.00 H new ATOM 1634 N LEU A 106 5.961 4.255 3.545 1.00 0.00 N ATOM 1635 CA LEU A 106 5.583 4.995 2.346 1.00 0.00 C ATOM 1636 C LEU A 106 6.430 6.254 2.194 1.00 0.00 C ATOM 1637 O LEU A 106 6.781 6.649 1.081 1.00 0.00 O ATOM 1638 CB LEU A 106 4.100 5.367 2.398 1.00 0.00 C ATOM 1639 CG LEU A 106 3.119 4.277 1.965 1.00 0.00 C ATOM 1640 CD1 LEU A 106 1.699 4.650 2.360 1.00 0.00 C ATOM 1641 CD2 LEU A 106 3.212 4.042 0.464 1.00 0.00 C ATOM 0 H LEU A 106 5.186 3.785 4.012 1.00 0.00 H new ATOM 0 HA LEU A 106 5.760 4.354 1.482 1.00 0.00 H new ATOM 0 HB2 LEU A 106 3.856 5.663 3.418 1.00 0.00 H new ATOM 0 HB3 LEU A 106 3.943 6.241 1.766 1.00 0.00 H new ATOM 0 HG LEU A 106 3.385 3.351 2.475 1.00 0.00 H new ATOM 0 HD11 LEU A 106 1.015 3.863 2.044 1.00 0.00 H new ATOM 0 HD12 LEU A 106 1.641 4.768 3.442 1.00 0.00 H new ATOM 0 HD13 LEU A 106 1.421 5.587 1.878 1.00 0.00 H new ATOM 0 HD21 LEU A 106 2.507 3.263 0.173 1.00 0.00 H new ATOM 0 HD22 LEU A 106 2.972 4.965 -0.064 1.00 0.00 H new ATOM 0 HD23 LEU A 106 4.224 3.730 0.207 1.00 0.00 H new ATOM 1653 N PHE A 107 6.757 6.881 3.319 1.00 0.00 N ATOM 1654 CA PHE A 107 7.565 8.095 3.311 1.00 0.00 C ATOM 1655 C PHE A 107 8.957 7.827 3.876 1.00 0.00 C ATOM 1656 O PHE A 107 9.103 7.426 5.031 1.00 0.00 O ATOM 1657 CB PHE A 107 6.877 9.196 4.121 1.00 0.00 C ATOM 1658 CG PHE A 107 5.661 9.765 3.448 1.00 0.00 C ATOM 1659 CD1 PHE A 107 5.781 10.510 2.286 1.00 0.00 C ATOM 1660 CD2 PHE A 107 4.397 9.554 3.977 1.00 0.00 C ATOM 1661 CE1 PHE A 107 4.664 11.035 1.664 1.00 0.00 C ATOM 1662 CE2 PHE A 107 3.277 10.076 3.358 1.00 0.00 C ATOM 1663 CZ PHE A 107 3.410 10.818 2.201 1.00 0.00 C ATOM 0 H PHE A 107 6.475 6.568 4.248 1.00 0.00 H new ATOM 0 HA PHE A 107 7.669 8.425 2.277 1.00 0.00 H new ATOM 0 HB2 PHE A 107 6.590 8.795 5.093 1.00 0.00 H new ATOM 0 HB3 PHE A 107 7.590 10.000 4.305 1.00 0.00 H new ATOM 0 HD1 PHE A 107 6.759 10.683 1.861 1.00 0.00 H new ATOM 0 HD2 PHE A 107 4.286 8.976 4.882 1.00 0.00 H new ATOM 0 HE1 PHE A 107 4.772 11.614 0.759 1.00 0.00 H new ATOM 0 HE2 PHE A 107 2.298 9.904 3.779 1.00 0.00 H new ATOM 0 HZ PHE A 107 2.536 11.228 1.717 1.00 0.00 H new ATOM 1673 N ASP A 108 9.975 8.050 3.054 1.00 0.00 N ATOM 1674 CA ASP A 108 11.356 7.833 3.470 1.00 0.00 C ATOM 1675 C ASP A 108 11.658 8.583 4.764 1.00 0.00 C ATOM 1676 O ASP A 108 10.771 9.197 5.358 1.00 0.00 O ATOM 1677 CB ASP A 108 12.320 8.280 2.370 1.00 0.00 C ATOM 1678 CG ASP A 108 13.627 7.513 2.399 1.00 0.00 C ATOM 1679 OD1 ASP A 108 13.624 6.351 2.856 1.00 0.00 O ATOM 1680 OD2 ASP A 108 14.654 8.075 1.963 1.00 0.00 O ATOM 0 H ASP A 108 9.871 8.381 2.095 1.00 0.00 H new ATOM 0 HA ASP A 108 11.492 6.766 3.649 1.00 0.00 H new ATOM 0 HB2 ASP A 108 11.845 8.146 1.398 1.00 0.00 H new ATOM 0 HB3 ASP A 108 12.524 9.345 2.481 1.00 0.00 H new ATOM 1685 N TYR A 109 12.913 8.529 5.194 1.00 0.00 N ATOM 1686 CA TYR A 109 13.331 9.201 6.418 1.00 0.00 C ATOM 1687 C TYR A 109 13.460 10.705 6.198 1.00 0.00 C ATOM 1688 O TYR A 109 13.917 11.437 7.077 1.00 0.00 O ATOM 1689 CB TYR A 109 14.663 8.630 6.909 1.00 0.00 C ATOM 1690 CG TYR A 109 15.573 8.171 5.793 1.00 0.00 C ATOM 1691 CD1 TYR A 109 16.102 9.079 4.883 1.00 0.00 C ATOM 1692 CD2 TYR A 109 15.905 6.829 5.647 1.00 0.00 C ATOM 1693 CE1 TYR A 109 16.934 8.663 3.861 1.00 0.00 C ATOM 1694 CE2 TYR A 109 16.737 6.405 4.629 1.00 0.00 C ATOM 1695 CZ TYR A 109 17.248 7.326 3.738 1.00 0.00 C ATOM 1696 OH TYR A 109 18.077 6.909 2.723 1.00 0.00 O ATOM 0 H TYR A 109 13.659 8.027 4.713 1.00 0.00 H new ATOM 0 HA TYR A 109 12.567 9.028 7.176 1.00 0.00 H new ATOM 0 HB2 TYR A 109 15.179 9.388 7.498 1.00 0.00 H new ATOM 0 HB3 TYR A 109 14.465 7.789 7.574 1.00 0.00 H new ATOM 0 HD1 TYR A 109 15.859 10.127 4.976 1.00 0.00 H new ATOM 0 HD2 TYR A 109 15.505 6.105 6.342 1.00 0.00 H new ATOM 0 HE1 TYR A 109 17.336 9.381 3.162 1.00 0.00 H new ATOM 0 HE2 TYR A 109 16.986 5.359 4.531 1.00 0.00 H new ATOM 0 HH TYR A 109 18.199 5.938 2.778 1.00 0.00 H new ATOM 1706 N THR A 110 13.055 11.160 5.017 1.00 0.00 N ATOM 1707 CA THR A 110 13.124 12.576 4.678 1.00 0.00 C ATOM 1708 C THR A 110 11.785 13.083 4.155 1.00 0.00 C ATOM 1709 O THR A 110 11.716 14.132 3.514 1.00 0.00 O ATOM 1710 CB THR A 110 14.212 12.848 3.622 1.00 0.00 C ATOM 1711 OG1 THR A 110 14.258 11.773 2.678 1.00 0.00 O ATOM 1712 CG2 THR A 110 15.575 13.012 4.278 1.00 0.00 C ATOM 0 H THR A 110 12.675 10.568 4.278 1.00 0.00 H new ATOM 0 HA THR A 110 13.377 13.108 5.595 1.00 0.00 H new ATOM 0 HB THR A 110 13.962 13.774 3.105 1.00 0.00 H new ATOM 0 HG1 THR A 110 14.951 11.954 2.009 1.00 0.00 H new ATOM 0 HG21 THR A 110 16.327 13.203 3.512 1.00 0.00 H new ATOM 0 HG22 THR A 110 15.545 13.850 4.974 1.00 0.00 H new ATOM 0 HG23 THR A 110 15.831 12.100 4.818 1.00 0.00 H new ATOM 1720 N ASP A 111 10.725 12.333 4.432 1.00 0.00 N ATOM 1721 CA ASP A 111 9.387 12.708 3.990 1.00 0.00 C ATOM 1722 C ASP A 111 9.290 12.684 2.468 1.00 0.00 C ATOM 1723 O ASP A 111 8.521 13.438 1.872 1.00 0.00 O ATOM 1724 CB ASP A 111 9.023 14.097 4.516 1.00 0.00 C ATOM 1725 CG ASP A 111 9.196 14.212 6.017 1.00 0.00 C ATOM 1726 OD1 ASP A 111 10.353 14.326 6.475 1.00 0.00 O ATOM 1727 OD2 ASP A 111 8.175 14.189 6.735 1.00 0.00 O ATOM 0 H ASP A 111 10.766 11.462 4.961 1.00 0.00 H new ATOM 0 HA ASP A 111 8.682 11.980 4.392 1.00 0.00 H new ATOM 0 HB2 ASP A 111 9.646 14.843 4.023 1.00 0.00 H new ATOM 0 HB3 ASP A 111 7.989 14.322 4.254 1.00 0.00 H new ATOM 1732 N THR A 112 10.078 11.814 1.844 1.00 0.00 N ATOM 1733 CA THR A 112 10.084 11.694 0.391 1.00 0.00 C ATOM 1734 C THR A 112 9.661 10.297 -0.046 1.00 0.00 C ATOM 1735 O THR A 112 10.426 9.339 0.075 1.00 0.00 O ATOM 1736 CB THR A 112 11.475 12.003 -0.193 1.00 0.00 C ATOM 1737 OG1 THR A 112 11.884 13.323 0.186 1.00 0.00 O ATOM 1738 CG2 THR A 112 11.464 11.887 -1.709 1.00 0.00 C ATOM 0 H THR A 112 10.720 11.182 2.322 1.00 0.00 H new ATOM 0 HA THR A 112 9.369 12.423 0.011 1.00 0.00 H new ATOM 0 HB THR A 112 12.181 11.275 0.206 1.00 0.00 H new ATOM 0 HG1 THR A 112 12.770 13.511 -0.188 1.00 0.00 H new ATOM 0 HG21 THR A 112 12.457 12.110 -2.098 1.00 0.00 H new ATOM 0 HG22 THR A 112 11.181 10.874 -1.994 1.00 0.00 H new ATOM 0 HG23 THR A 112 10.745 12.594 -2.123 1.00 0.00 H new ATOM 1746 N LEU A 113 8.440 10.186 -0.557 1.00 0.00 N ATOM 1747 CA LEU A 113 7.915 8.904 -1.014 1.00 0.00 C ATOM 1748 C LEU A 113 9.015 8.062 -1.653 1.00 0.00 C ATOM 1749 O LEU A 113 9.881 8.583 -2.355 1.00 0.00 O ATOM 1750 CB LEU A 113 6.779 9.123 -2.015 1.00 0.00 C ATOM 1751 CG LEU A 113 5.457 9.623 -1.431 1.00 0.00 C ATOM 1752 CD1 LEU A 113 4.607 10.273 -2.512 1.00 0.00 C ATOM 1753 CD2 LEU A 113 4.700 8.481 -0.770 1.00 0.00 C ATOM 0 H LEU A 113 7.795 10.968 -0.665 1.00 0.00 H new ATOM 0 HA LEU A 113 7.529 8.368 -0.147 1.00 0.00 H new ATOM 0 HB2 LEU A 113 7.116 9.839 -2.765 1.00 0.00 H new ATOM 0 HB3 LEU A 113 6.592 8.182 -2.533 1.00 0.00 H new ATOM 0 HG LEU A 113 5.678 10.373 -0.672 1.00 0.00 H new ATOM 0 HD11 LEU A 113 3.670 10.622 -2.077 1.00 0.00 H new ATOM 0 HD12 LEU A 113 5.146 11.118 -2.940 1.00 0.00 H new ATOM 0 HD13 LEU A 113 4.394 9.545 -3.295 1.00 0.00 H new ATOM 0 HD21 LEU A 113 3.762 8.855 -0.360 1.00 0.00 H new ATOM 0 HD22 LEU A 113 4.490 7.708 -1.509 1.00 0.00 H new ATOM 0 HD23 LEU A 113 5.305 8.060 0.033 1.00 0.00 H new ATOM 1765 N VAL A 114 8.972 6.756 -1.406 1.00 0.00 N ATOM 1766 CA VAL A 114 9.962 5.841 -1.959 1.00 0.00 C ATOM 1767 C VAL A 114 9.783 5.681 -3.465 1.00 0.00 C ATOM 1768 O VAL A 114 8.792 6.139 -4.034 1.00 0.00 O ATOM 1769 CB VAL A 114 9.879 4.454 -1.294 1.00 0.00 C ATOM 1770 CG1 VAL A 114 10.284 4.539 0.170 1.00 0.00 C ATOM 1771 CG2 VAL A 114 8.478 3.879 -1.435 1.00 0.00 C ATOM 0 H VAL A 114 8.262 6.309 -0.826 1.00 0.00 H new ATOM 0 HA VAL A 114 10.941 6.275 -1.756 1.00 0.00 H new ATOM 0 HB VAL A 114 10.574 3.785 -1.801 1.00 0.00 H new ATOM 0 HG11 VAL A 114 10.219 3.550 0.623 1.00 0.00 H new ATOM 0 HG12 VAL A 114 11.308 4.906 0.244 1.00 0.00 H new ATOM 0 HG13 VAL A 114 9.615 5.223 0.693 1.00 0.00 H new ATOM 0 HG21 VAL A 114 8.437 2.899 -0.960 1.00 0.00 H new ATOM 0 HG22 VAL A 114 7.761 4.545 -0.955 1.00 0.00 H new ATOM 0 HG23 VAL A 114 8.230 3.780 -2.492 1.00 0.00 H new ATOM 1781 N SER A 115 10.748 5.029 -4.105 1.00 0.00 N ATOM 1782 CA SER A 115 10.698 4.811 -5.546 1.00 0.00 C ATOM 1783 C SER A 115 11.769 3.816 -5.982 1.00 0.00 C ATOM 1784 O SER A 115 12.706 3.528 -5.238 1.00 0.00 O ATOM 1785 CB SER A 115 10.884 6.135 -6.289 1.00 0.00 C ATOM 1786 OG SER A 115 9.647 6.810 -6.445 1.00 0.00 O ATOM 0 H SER A 115 11.574 4.642 -3.648 1.00 0.00 H new ATOM 0 HA SER A 115 9.720 4.397 -5.793 1.00 0.00 H new ATOM 0 HB2 SER A 115 11.581 6.769 -5.741 1.00 0.00 H new ATOM 0 HB3 SER A 115 11.326 5.948 -7.268 1.00 0.00 H new ATOM 0 HG SER A 115 9.166 6.812 -5.591 1.00 0.00 H new ATOM 1792 N GLY A 116 11.623 3.292 -7.195 1.00 0.00 N ATOM 1793 CA GLY A 116 12.583 2.334 -7.711 1.00 0.00 C ATOM 1794 C GLY A 116 12.410 0.955 -7.105 1.00 0.00 C ATOM 1795 O GLY A 116 12.137 0.823 -5.912 1.00 0.00 O ATOM 0 H GLY A 116 10.856 3.514 -7.830 1.00 0.00 H new ATOM 0 HA2 GLY A 116 12.479 2.267 -8.794 1.00 0.00 H new ATOM 0 HA3 GLY A 116 13.593 2.692 -7.510 1.00 0.00 H new ATOM 1799 N LYS A 117 12.567 -0.075 -7.929 1.00 0.00 N ATOM 1800 CA LYS A 117 12.426 -1.451 -7.469 1.00 0.00 C ATOM 1801 C LYS A 117 13.148 -1.658 -6.141 1.00 0.00 C ATOM 1802 O LYS A 117 14.156 -1.010 -5.865 1.00 0.00 O ATOM 1803 CB LYS A 117 12.977 -2.420 -8.517 1.00 0.00 C ATOM 1804 CG LYS A 117 12.456 -3.839 -8.368 1.00 0.00 C ATOM 1805 CD LYS A 117 13.025 -4.758 -9.436 1.00 0.00 C ATOM 1806 CE LYS A 117 12.048 -5.868 -9.795 1.00 0.00 C ATOM 1807 NZ LYS A 117 12.582 -6.751 -10.868 1.00 0.00 N ATOM 0 H LYS A 117 12.792 0.017 -8.920 1.00 0.00 H new ATOM 0 HA LYS A 117 11.365 -1.651 -7.321 1.00 0.00 H new ATOM 0 HB2 LYS A 117 12.722 -2.051 -9.510 1.00 0.00 H new ATOM 0 HB3 LYS A 117 14.065 -2.433 -8.451 1.00 0.00 H new ATOM 0 HG2 LYS A 117 12.717 -4.221 -7.381 1.00 0.00 H new ATOM 0 HG3 LYS A 117 11.368 -3.836 -8.431 1.00 0.00 H new ATOM 0 HD2 LYS A 117 13.262 -4.178 -10.328 1.00 0.00 H new ATOM 0 HD3 LYS A 117 13.959 -5.194 -9.082 1.00 0.00 H new ATOM 0 HE2 LYS A 117 11.833 -6.464 -8.908 1.00 0.00 H new ATOM 0 HE3 LYS A 117 11.105 -5.430 -10.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 11.887 -7.494 -11.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 12.763 -6.188 -11.723 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 13.469 -7.189 -10.548 1.00 0.00 H new ATOM 1821 N MET A 118 12.625 -2.566 -5.324 1.00 0.00 N ATOM 1822 CA MET A 118 13.222 -2.860 -4.026 1.00 0.00 C ATOM 1823 C MET A 118 12.768 -4.223 -3.515 1.00 0.00 C ATOM 1824 O MET A 118 11.696 -4.707 -3.876 1.00 0.00 O ATOM 1825 CB MET A 118 12.853 -1.774 -3.014 1.00 0.00 C ATOM 1826 CG MET A 118 13.249 -2.114 -1.586 1.00 0.00 C ATOM 1827 SD MET A 118 13.493 -0.648 -0.565 1.00 0.00 S ATOM 1828 CE MET A 118 11.797 -0.153 -0.273 1.00 0.00 C ATOM 0 H MET A 118 11.789 -3.111 -5.537 1.00 0.00 H new ATOM 0 HA MET A 118 14.305 -2.880 -4.148 1.00 0.00 H new ATOM 0 HB2 MET A 118 13.335 -0.840 -3.303 1.00 0.00 H new ATOM 0 HB3 MET A 118 11.777 -1.603 -3.053 1.00 0.00 H new ATOM 0 HG2 MET A 118 12.477 -2.739 -1.138 1.00 0.00 H new ATOM 0 HG3 MET A 118 14.167 -2.701 -1.598 1.00 0.00 H new ATOM 0 HE1 MET A 118 11.764 0.565 0.546 1.00 0.00 H new ATOM 0 HE2 MET A 118 11.391 0.306 -1.175 1.00 0.00 H new ATOM 0 HE3 MET A 118 11.202 -1.028 -0.012 1.00 0.00 H new ATOM 1838 N ALA A 119 13.592 -4.838 -2.672 1.00 0.00 N ATOM 1839 CA ALA A 119 13.274 -6.145 -2.110 1.00 0.00 C ATOM 1840 C ALA A 119 13.673 -6.223 -0.641 1.00 0.00 C ATOM 1841 O ALA A 119 14.818 -5.943 -0.282 1.00 0.00 O ATOM 1842 CB ALA A 119 13.964 -7.244 -2.906 1.00 0.00 C ATOM 0 H ALA A 119 14.484 -4.452 -2.364 1.00 0.00 H new ATOM 0 HA ALA A 119 12.195 -6.288 -2.174 1.00 0.00 H new ATOM 0 HB1 ALA A 119 13.718 -8.215 -2.475 1.00 0.00 H new ATOM 0 HB2 ALA A 119 13.626 -7.210 -3.942 1.00 0.00 H new ATOM 0 HB3 ALA A 119 15.043 -7.095 -2.872 1.00 0.00 H new ATOM 1848 N LEU A 120 12.724 -6.604 0.206 1.00 0.00 N ATOM 1849 CA LEU A 120 12.976 -6.718 1.638 1.00 0.00 C ATOM 1850 C LEU A 120 12.367 -7.999 2.199 1.00 0.00 C ATOM 1851 O LEU A 120 11.397 -8.525 1.656 1.00 0.00 O ATOM 1852 CB LEU A 120 12.407 -5.504 2.375 1.00 0.00 C ATOM 1853 CG LEU A 120 10.930 -5.197 2.121 1.00 0.00 C ATOM 1854 CD1 LEU A 120 10.047 -6.035 3.033 1.00 0.00 C ATOM 1855 CD2 LEU A 120 10.652 -3.715 2.322 1.00 0.00 C ATOM 0 H LEU A 120 11.772 -6.839 -0.074 1.00 0.00 H new ATOM 0 HA LEU A 120 14.055 -6.754 1.789 1.00 0.00 H new ATOM 0 HB2 LEU A 120 12.547 -5.655 3.445 1.00 0.00 H new ATOM 0 HB3 LEU A 120 12.993 -4.628 2.097 1.00 0.00 H new ATOM 0 HG LEU A 120 10.697 -5.453 1.087 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.000 -5.804 2.839 1.00 0.00 H new ATOM 0 HD12 LEU A 120 10.226 -7.093 2.841 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.281 -5.810 4.073 1.00 0.00 H new ATOM 0 HD21 LEU A 120 9.597 -3.514 2.137 1.00 0.00 H new ATOM 0 HD22 LEU A 120 10.901 -3.434 3.345 1.00 0.00 H new ATOM 0 HD23 LEU A 120 11.259 -3.134 1.628 1.00 0.00 H new ATOM 1867 N ASN A 121 12.943 -8.494 3.289 1.00 0.00 N ATOM 1868 CA ASN A 121 12.456 -9.713 3.925 1.00 0.00 C ATOM 1869 C ASN A 121 11.224 -9.427 4.778 1.00 0.00 C ATOM 1870 O ASN A 121 10.989 -8.289 5.187 1.00 0.00 O ATOM 1871 CB ASN A 121 13.554 -10.337 4.788 1.00 0.00 C ATOM 1872 CG ASN A 121 14.652 -10.972 3.957 1.00 0.00 C ATOM 1873 OD1 ASN A 121 15.640 -10.322 3.613 1.00 0.00 O ATOM 1874 ND2 ASN A 121 14.484 -12.248 3.630 1.00 0.00 N ATOM 0 H ASN A 121 13.748 -8.070 3.751 1.00 0.00 H new ATOM 0 HA ASN A 121 12.177 -10.416 3.140 1.00 0.00 H new ATOM 0 HB2 ASN A 121 13.986 -9.571 5.431 1.00 0.00 H new ATOM 0 HB3 ASN A 121 13.114 -11.091 5.441 1.00 0.00 H new ATOM 0 HD21 ASN A 121 15.190 -12.729 3.072 1.00 0.00 H new ATOM 0 HD22 ASN A 121 13.649 -12.748 3.937 1.00 0.00 H new ATOM 1881 N LEU A 122 10.440 -10.466 5.042 1.00 0.00 N ATOM 1882 CA LEU A 122 9.231 -10.327 5.848 1.00 0.00 C ATOM 1883 C LEU A 122 9.340 -11.136 7.136 1.00 0.00 C ATOM 1884 O LEU A 122 9.980 -12.187 7.169 1.00 0.00 O ATOM 1885 CB LEU A 122 8.008 -10.780 5.049 1.00 0.00 C ATOM 1886 CG LEU A 122 7.983 -10.379 3.574 1.00 0.00 C ATOM 1887 CD1 LEU A 122 7.183 -11.385 2.761 1.00 0.00 C ATOM 1888 CD2 LEU A 122 7.407 -8.980 3.411 1.00 0.00 C ATOM 0 H LEU A 122 10.619 -11.414 4.710 1.00 0.00 H new ATOM 0 HA LEU A 122 9.117 -9.275 6.110 1.00 0.00 H new ATOM 0 HB2 LEU A 122 7.941 -11.866 5.111 1.00 0.00 H new ATOM 0 HB3 LEU A 122 7.116 -10.378 5.529 1.00 0.00 H new ATOM 0 HG LEU A 122 9.007 -10.374 3.201 1.00 0.00 H new ATOM 0 HD11 LEU A 122 7.176 -11.083 1.714 1.00 0.00 H new ATOM 0 HD12 LEU A 122 7.639 -12.371 2.852 1.00 0.00 H new ATOM 0 HD13 LEU A 122 6.160 -11.423 3.134 1.00 0.00 H new ATOM 0 HD21 LEU A 122 7.397 -8.711 2.355 1.00 0.00 H new ATOM 0 HD22 LEU A 122 6.389 -8.958 3.801 1.00 0.00 H new ATOM 0 HD23 LEU A 122 8.022 -8.267 3.961 1.00 0.00 H new ATOM 1900 N TRP A 123 8.709 -10.640 8.194 1.00 0.00 N ATOM 1901 CA TRP A 123 8.733 -11.318 9.485 1.00 0.00 C ATOM 1902 C TRP A 123 7.637 -12.375 9.566 1.00 0.00 C ATOM 1903 O TRP A 123 6.581 -12.258 8.943 1.00 0.00 O ATOM 1904 CB TRP A 123 8.566 -10.306 10.620 1.00 0.00 C ATOM 1905 CG TRP A 123 9.403 -9.075 10.445 1.00 0.00 C ATOM 1906 CD1 TRP A 123 9.197 -8.064 9.551 1.00 0.00 C ATOM 1907 CD2 TRP A 123 10.580 -8.727 11.183 1.00 0.00 C ATOM 1908 NE1 TRP A 123 10.175 -7.108 9.688 1.00 0.00 N ATOM 1909 CE2 TRP A 123 11.035 -7.491 10.683 1.00 0.00 C ATOM 1910 CE3 TRP A 123 11.292 -9.339 12.218 1.00 0.00 C ATOM 1911 CZ2 TRP A 123 12.169 -6.859 11.183 1.00 0.00 C ATOM 1912 CZ3 TRP A 123 12.419 -8.710 12.713 1.00 0.00 C ATOM 1913 CH2 TRP A 123 12.848 -7.480 12.197 1.00 0.00 C ATOM 0 H TRP A 123 8.175 -9.771 8.184 1.00 0.00 H new ATOM 0 HA TRP A 123 9.698 -11.813 9.588 1.00 0.00 H new ATOM 0 HB2 TRP A 123 7.517 -10.017 10.688 1.00 0.00 H new ATOM 0 HB3 TRP A 123 8.827 -10.783 11.564 1.00 0.00 H new ATOM 0 HD1 TRP A 123 8.385 -8.022 8.840 1.00 0.00 H new ATOM 0 HE1 TRP A 123 10.248 -6.252 9.138 1.00 0.00 H new ATOM 0 HE3 TRP A 123 10.968 -10.286 12.624 1.00 0.00 H new ATOM 0 HZ2 TRP A 123 12.502 -5.912 10.785 1.00 0.00 H new ATOM 0 HZ3 TRP A 123 12.979 -9.175 13.511 1.00 0.00 H new ATOM 0 HH2 TRP A 123 13.731 -7.013 12.607 1.00 0.00 H new ATOM 1924 N PRO A 124 7.890 -13.434 10.350 1.00 0.00 N ATOM 1925 CA PRO A 124 6.935 -14.531 10.530 1.00 0.00 C ATOM 1926 C PRO A 124 5.709 -14.108 11.331 1.00 0.00 C ATOM 1927 O PRO A 124 5.820 -13.380 12.318 1.00 0.00 O ATOM 1928 CB PRO A 124 7.741 -15.579 11.302 1.00 0.00 C ATOM 1929 CG PRO A 124 8.789 -14.799 12.017 1.00 0.00 C ATOM 1930 CD PRO A 124 9.127 -13.640 11.122 1.00 0.00 C ATOM 0 HA PRO A 124 6.543 -14.889 9.578 1.00 0.00 H new ATOM 0 HB2 PRO A 124 7.110 -16.128 12.001 1.00 0.00 H new ATOM 0 HB3 PRO A 124 8.184 -16.313 10.629 1.00 0.00 H new ATOM 0 HG2 PRO A 124 8.425 -14.452 12.984 1.00 0.00 H new ATOM 0 HG3 PRO A 124 9.669 -15.413 12.209 1.00 0.00 H new ATOM 0 HD2 PRO A 124 9.395 -12.753 11.697 1.00 0.00 H new ATOM 0 HD3 PRO A 124 9.973 -13.867 10.473 1.00 0.00 H new ATOM 1938 N VAL A 125 4.538 -14.568 10.899 1.00 0.00 N ATOM 1939 CA VAL A 125 3.290 -14.237 11.577 1.00 0.00 C ATOM 1940 C VAL A 125 3.260 -14.817 12.987 1.00 0.00 C ATOM 1941 O VAL A 125 3.731 -15.927 13.239 1.00 0.00 O ATOM 1942 CB VAL A 125 2.071 -14.758 10.794 1.00 0.00 C ATOM 1943 CG1 VAL A 125 1.912 -13.999 9.486 1.00 0.00 C ATOM 1944 CG2 VAL A 125 2.200 -16.253 10.540 1.00 0.00 C ATOM 0 H VAL A 125 4.428 -15.170 10.083 1.00 0.00 H new ATOM 0 HA VAL A 125 3.239 -13.150 11.633 1.00 0.00 H new ATOM 0 HB VAL A 125 1.177 -14.590 11.395 1.00 0.00 H new ATOM 0 HG11 VAL A 125 1.045 -14.381 8.947 1.00 0.00 H new ATOM 0 HG12 VAL A 125 1.770 -12.939 9.695 1.00 0.00 H new ATOM 0 HG13 VAL A 125 2.806 -14.132 8.877 1.00 0.00 H new ATOM 0 HG21 VAL A 125 1.330 -16.604 9.986 1.00 0.00 H new ATOM 0 HG22 VAL A 125 3.102 -16.447 9.960 1.00 0.00 H new ATOM 0 HG23 VAL A 125 2.260 -16.780 11.492 1.00 0.00 H new ATOM 1954 N PRO A 126 2.694 -14.050 13.930 1.00 0.00 N ATOM 1955 CA PRO A 126 2.588 -14.467 15.332 1.00 0.00 C ATOM 1956 C PRO A 126 1.594 -15.608 15.523 1.00 0.00 C ATOM 1957 O PRO A 126 0.650 -15.759 14.747 1.00 0.00 O ATOM 1958 CB PRO A 126 2.096 -13.204 16.042 1.00 0.00 C ATOM 1959 CG PRO A 126 1.387 -12.428 14.986 1.00 0.00 C ATOM 1960 CD PRO A 126 2.113 -12.716 13.702 1.00 0.00 C ATOM 0 HA PRO A 126 3.534 -14.847 15.717 1.00 0.00 H new ATOM 0 HB2 PRO A 126 1.429 -13.449 16.869 1.00 0.00 H new ATOM 0 HB3 PRO A 126 2.927 -12.636 16.460 1.00 0.00 H new ATOM 0 HG2 PRO A 126 0.341 -12.727 14.918 1.00 0.00 H new ATOM 0 HG3 PRO A 126 1.400 -11.361 15.211 1.00 0.00 H new ATOM 0 HD2 PRO A 126 1.436 -12.713 12.848 1.00 0.00 H new ATOM 0 HD3 PRO A 126 2.883 -11.971 13.500 1.00 0.00 H new ATOM 1968 N HIS A 127 1.811 -16.408 16.562 1.00 0.00 N ATOM 1969 CA HIS A 127 0.933 -17.535 16.856 1.00 0.00 C ATOM 1970 C HIS A 127 -0.522 -17.083 16.934 1.00 0.00 C ATOM 1971 O HIS A 127 -0.809 -15.935 17.269 1.00 0.00 O ATOM 1972 CB HIS A 127 1.344 -18.200 18.169 1.00 0.00 C ATOM 1973 CG HIS A 127 0.731 -17.566 19.380 1.00 0.00 C ATOM 1974 ND1 HIS A 127 1.367 -16.597 20.126 1.00 0.00 N ATOM 1975 CD2 HIS A 127 -0.470 -17.767 19.972 1.00 0.00 C ATOM 1976 CE1 HIS A 127 0.585 -16.230 21.126 1.00 0.00 C ATOM 1977 NE2 HIS A 127 -0.536 -16.925 21.055 1.00 0.00 N ATOM 0 H HIS A 127 2.587 -16.297 17.214 1.00 0.00 H new ATOM 0 HA HIS A 127 1.028 -18.259 16.047 1.00 0.00 H new ATOM 0 HB2 HIS A 127 1.061 -19.252 18.138 1.00 0.00 H new ATOM 0 HB3 HIS A 127 2.430 -18.164 18.261 1.00 0.00 H new ATOM 0 HD2 HIS A 127 -1.234 -18.460 19.652 1.00 0.00 H new ATOM 0 HE1 HIS A 127 0.822 -15.488 21.874 1.00 0.00 H new ATOM 0 HE2 HIS A 127 -1.323 -16.849 21.700 1.00 0.00 H new ATOM 1986 N GLY A 128 -1.438 -17.996 16.622 1.00 0.00 N ATOM 1987 CA GLY A 128 -2.852 -17.671 16.663 1.00 0.00 C ATOM 1988 C GLY A 128 -3.160 -16.339 16.010 1.00 0.00 C ATOM 1989 O GLY A 128 -3.307 -15.324 16.692 1.00 0.00 O ATOM 0 H GLY A 128 -1.226 -18.954 16.342 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -3.417 -18.457 16.162 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -3.187 -17.650 17.700 1.00 0.00 H new ATOM 1993 N LEU A 129 -3.257 -16.339 14.685 1.00 0.00 N ATOM 1994 CA LEU A 129 -3.548 -15.120 13.939 1.00 0.00 C ATOM 1995 C LEU A 129 -4.797 -15.292 13.080 1.00 0.00 C ATOM 1996 O LEU A 129 -4.792 -16.045 12.106 1.00 0.00 O ATOM 1997 CB LEU A 129 -2.357 -14.741 13.057 1.00 0.00 C ATOM 1998 CG LEU A 129 -2.483 -13.426 12.287 1.00 0.00 C ATOM 1999 CD1 LEU A 129 -2.713 -12.267 13.245 1.00 0.00 C ATOM 2000 CD2 LEU A 129 -1.241 -13.182 11.442 1.00 0.00 C ATOM 0 H LEU A 129 -3.138 -17.170 14.105 1.00 0.00 H new ATOM 0 HA LEU A 129 -3.730 -14.320 14.656 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -1.468 -14.687 13.685 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -2.192 -15.545 12.339 1.00 0.00 H new ATOM 0 HG LEU A 129 -3.343 -13.498 11.621 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -2.800 -11.339 12.679 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -3.631 -12.437 13.808 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -1.873 -12.193 13.935 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -1.348 -12.242 10.901 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -0.365 -13.131 12.089 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -1.119 -13.998 10.730 1.00 0.00 H new ATOM 2012 N GLU A 130 -5.863 -14.588 13.447 1.00 0.00 N ATOM 2013 CA GLU A 130 -7.118 -14.663 12.708 1.00 0.00 C ATOM 2014 C GLU A 130 -7.058 -13.809 11.445 1.00 0.00 C ATOM 2015 O GLU A 130 -7.327 -14.290 10.344 1.00 0.00 O ATOM 2016 CB GLU A 130 -8.282 -14.207 13.590 1.00 0.00 C ATOM 2017 CG GLU A 130 -8.445 -15.030 14.857 1.00 0.00 C ATOM 2018 CD GLU A 130 -9.806 -14.848 15.500 1.00 0.00 C ATOM 2019 OE1 GLU A 130 -10.822 -15.118 14.827 1.00 0.00 O ATOM 2020 OE2 GLU A 130 -9.854 -14.435 16.678 1.00 0.00 O ATOM 0 H GLU A 130 -5.883 -13.960 14.251 1.00 0.00 H new ATOM 0 HA GLU A 130 -7.277 -15.701 12.416 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -8.133 -13.162 13.862 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -9.205 -14.257 13.013 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -8.296 -16.084 14.623 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -7.670 -14.749 15.570 1.00 0.00 H new ATOM 2027 N ASP A 131 -6.703 -12.540 11.612 1.00 0.00 N ATOM 2028 CA ASP A 131 -6.607 -11.618 10.487 1.00 0.00 C ATOM 2029 C ASP A 131 -5.593 -12.117 9.461 1.00 0.00 C ATOM 2030 O ASP A 131 -4.716 -12.920 9.780 1.00 0.00 O ATOM 2031 CB ASP A 131 -6.213 -10.223 10.975 1.00 0.00 C ATOM 2032 CG ASP A 131 -7.216 -9.648 11.955 1.00 0.00 C ATOM 2033 OD1 ASP A 131 -8.271 -9.155 11.503 1.00 0.00 O ATOM 2034 OD2 ASP A 131 -6.946 -9.689 13.174 1.00 0.00 O ATOM 0 H ASP A 131 -6.477 -12.126 12.516 1.00 0.00 H new ATOM 0 HA ASP A 131 -7.585 -11.564 10.009 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -5.233 -10.271 11.449 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -6.121 -9.554 10.119 1.00 0.00 H new ATOM 2039 N LEU A 132 -5.721 -11.636 8.229 1.00 0.00 N ATOM 2040 CA LEU A 132 -4.817 -12.034 7.156 1.00 0.00 C ATOM 2041 C LEU A 132 -3.635 -11.075 7.056 1.00 0.00 C ATOM 2042 O LEU A 132 -2.483 -11.500 6.955 1.00 0.00 O ATOM 2043 CB LEU A 132 -5.565 -12.079 5.822 1.00 0.00 C ATOM 2044 CG LEU A 132 -6.815 -12.960 5.784 1.00 0.00 C ATOM 2045 CD1 LEU A 132 -7.751 -12.510 4.673 1.00 0.00 C ATOM 2046 CD2 LEU A 132 -6.431 -14.421 5.601 1.00 0.00 C ATOM 0 H LEU A 132 -6.441 -10.970 7.949 1.00 0.00 H new ATOM 0 HA LEU A 132 -4.436 -13.029 7.386 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -5.853 -11.062 5.555 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -4.876 -12.427 5.053 1.00 0.00 H new ATOM 0 HG LEU A 132 -7.338 -12.858 6.735 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -8.635 -13.148 4.661 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -8.052 -11.477 4.847 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -7.238 -12.582 3.714 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -7.332 -15.034 5.576 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -5.886 -14.539 4.665 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -5.800 -14.738 6.431 1.00 0.00 H new ATOM 2058 N LEU A 133 -3.927 -9.779 7.086 1.00 0.00 N ATOM 2059 CA LEU A 133 -2.888 -8.758 7.002 1.00 0.00 C ATOM 2060 C LEU A 133 -2.606 -8.154 8.374 1.00 0.00 C ATOM 2061 O LEU A 133 -3.524 -7.900 9.152 1.00 0.00 O ATOM 2062 CB LEU A 133 -3.304 -7.659 6.023 1.00 0.00 C ATOM 2063 CG LEU A 133 -2.179 -6.767 5.498 1.00 0.00 C ATOM 2064 CD1 LEU A 133 -1.559 -7.371 4.247 1.00 0.00 C ATOM 2065 CD2 LEU A 133 -2.698 -5.365 5.214 1.00 0.00 C ATOM 0 H LEU A 133 -4.875 -9.410 7.168 1.00 0.00 H new ATOM 0 HA LEU A 133 -1.975 -9.232 6.640 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -3.797 -8.127 5.171 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -4.044 -7.026 6.512 1.00 0.00 H new ATOM 0 HG LEU A 133 -1.408 -6.699 6.265 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -0.760 -6.722 3.887 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -1.151 -8.354 4.482 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -2.322 -7.470 3.474 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -1.883 -4.744 4.841 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -3.489 -5.414 4.465 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -3.094 -4.931 6.132 1.00 0.00 H new ATOM 2077 N ASN A 134 -1.329 -7.923 8.661 1.00 0.00 N ATOM 2078 CA ASN A 134 -0.926 -7.346 9.939 1.00 0.00 C ATOM 2079 C ASN A 134 -0.521 -5.885 9.772 1.00 0.00 C ATOM 2080 O ASN A 134 0.634 -5.562 9.495 1.00 0.00 O ATOM 2081 CB ASN A 134 0.235 -8.143 10.538 1.00 0.00 C ATOM 2082 CG ASN A 134 0.651 -7.622 11.900 1.00 0.00 C ATOM 2083 OD1 ASN A 134 -0.138 -6.992 12.604 1.00 0.00 O ATOM 2084 ND2 ASN A 134 1.897 -7.884 12.278 1.00 0.00 N ATOM 0 H ASN A 134 -0.556 -8.126 8.027 1.00 0.00 H new ATOM 0 HA ASN A 134 -1.779 -7.393 10.616 1.00 0.00 H new ATOM 0 HB2 ASN A 134 -0.054 -9.190 10.625 1.00 0.00 H new ATOM 0 HB3 ASN A 134 1.088 -8.103 9.860 1.00 0.00 H new ATOM 0 HD21 ASN A 134 2.234 -7.559 13.184 1.00 0.00 H new ATOM 0 HD22 ASN A 134 2.517 -8.410 11.662 1.00 0.00 H new ATOM 2091 N PRO A 135 -1.494 -4.978 9.944 1.00 0.00 N ATOM 2092 CA PRO A 135 -1.264 -3.536 9.819 1.00 0.00 C ATOM 2093 C PRO A 135 -0.413 -2.983 10.958 1.00 0.00 C ATOM 2094 O PRO A 135 0.219 -1.936 10.821 1.00 0.00 O ATOM 2095 CB PRO A 135 -2.675 -2.945 9.871 1.00 0.00 C ATOM 2096 CG PRO A 135 -3.479 -3.949 10.623 1.00 0.00 C ATOM 2097 CD PRO A 135 -2.895 -5.291 10.275 1.00 0.00 C ATOM 0 HA PRO A 135 -0.717 -3.289 8.909 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -2.681 -1.977 10.373 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -3.075 -2.787 8.870 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -3.426 -3.767 11.696 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -4.531 -3.896 10.342 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -2.965 -5.988 11.110 1.00 0.00 H new ATOM 0 HD3 PRO A 135 -3.414 -5.749 9.433 1.00 0.00 H new ATOM 2105 N ILE A 136 -0.402 -3.694 12.080 1.00 0.00 N ATOM 2106 CA ILE A 136 0.373 -3.275 13.242 1.00 0.00 C ATOM 2107 C ILE A 136 1.831 -3.704 13.114 1.00 0.00 C ATOM 2108 O ILE A 136 2.715 -3.128 13.745 1.00 0.00 O ATOM 2109 CB ILE A 136 -0.208 -3.855 14.545 1.00 0.00 C ATOM 2110 CG1 ILE A 136 -1.735 -3.749 14.540 1.00 0.00 C ATOM 2111 CG2 ILE A 136 0.374 -3.134 15.751 1.00 0.00 C ATOM 2112 CD1 ILE A 136 -2.241 -2.327 14.448 1.00 0.00 C ATOM 0 H ILE A 136 -0.921 -4.563 12.210 1.00 0.00 H new ATOM 0 HA ILE A 136 0.319 -2.187 13.282 1.00 0.00 H new ATOM 0 HB ILE A 136 0.064 -4.908 14.610 1.00 0.00 H new ATOM 0 HG12 ILE A 136 -2.128 -4.321 13.700 1.00 0.00 H new ATOM 0 HG13 ILE A 136 -2.126 -4.207 15.448 1.00 0.00 H new ATOM 0 HG21 ILE A 136 -0.046 -3.555 16.664 1.00 0.00 H new ATOM 0 HG22 ILE A 136 1.457 -3.256 15.760 1.00 0.00 H new ATOM 0 HG23 ILE A 136 0.129 -2.073 15.694 1.00 0.00 H new ATOM 0 HD11 ILE A 136 -3.331 -2.328 14.449 1.00 0.00 H new ATOM 0 HD12 ILE A 136 -1.877 -1.755 15.302 1.00 0.00 H new ATOM 0 HD13 ILE A 136 -1.880 -1.871 13.526 1.00 0.00 H new ATOM 2124 N GLY A 137 2.074 -4.718 12.289 1.00 0.00 N ATOM 2125 CA GLY A 137 3.426 -5.206 12.092 1.00 0.00 C ATOM 2126 C GLY A 137 4.451 -4.089 12.092 1.00 0.00 C ATOM 2127 O GLY A 137 4.134 -2.946 11.762 1.00 0.00 O ATOM 0 H GLY A 137 1.359 -5.210 11.754 1.00 0.00 H new ATOM 0 HA2 GLY A 137 3.670 -5.919 12.880 1.00 0.00 H new ATOM 0 HA3 GLY A 137 3.480 -5.745 11.146 1.00 0.00 H new ATOM 2131 N VAL A 138 5.683 -4.418 12.465 1.00 0.00 N ATOM 2132 CA VAL A 138 6.758 -3.434 12.508 1.00 0.00 C ATOM 2133 C VAL A 138 7.155 -2.992 11.103 1.00 0.00 C ATOM 2134 O VAL A 138 6.679 -3.541 10.109 1.00 0.00 O ATOM 2135 CB VAL A 138 8.000 -3.990 13.229 1.00 0.00 C ATOM 2136 CG1 VAL A 138 7.612 -4.603 14.566 1.00 0.00 C ATOM 2137 CG2 VAL A 138 8.713 -5.010 12.353 1.00 0.00 C ATOM 0 H VAL A 138 5.962 -5.359 12.742 1.00 0.00 H new ATOM 0 HA VAL A 138 6.379 -2.576 13.063 1.00 0.00 H new ATOM 0 HB VAL A 138 8.687 -3.165 13.420 1.00 0.00 H new ATOM 0 HG11 VAL A 138 8.503 -4.991 15.061 1.00 0.00 H new ATOM 0 HG12 VAL A 138 7.150 -3.842 15.195 1.00 0.00 H new ATOM 0 HG13 VAL A 138 6.905 -5.416 14.402 1.00 0.00 H new ATOM 0 HG21 VAL A 138 9.588 -5.392 12.878 1.00 0.00 H new ATOM 0 HG22 VAL A 138 8.036 -5.834 12.129 1.00 0.00 H new ATOM 0 HG23 VAL A 138 9.027 -4.535 11.423 1.00 0.00 H new ATOM 2147 N THR A 139 8.031 -1.996 11.028 1.00 0.00 N ATOM 2148 CA THR A 139 8.492 -1.479 9.746 1.00 0.00 C ATOM 2149 C THR A 139 9.983 -1.732 9.555 1.00 0.00 C ATOM 2150 O THR A 139 10.695 -2.055 10.505 1.00 0.00 O ATOM 2151 CB THR A 139 8.220 0.032 9.618 1.00 0.00 C ATOM 2152 OG1 THR A 139 8.664 0.711 10.798 1.00 0.00 O ATOM 2153 CG2 THR A 139 6.738 0.298 9.402 1.00 0.00 C ATOM 0 H THR A 139 8.436 -1.531 11.840 1.00 0.00 H new ATOM 0 HA THR A 139 7.934 -2.008 8.974 1.00 0.00 H new ATOM 0 HB THR A 139 8.770 0.406 8.755 1.00 0.00 H new ATOM 0 HG1 THR A 139 8.489 1.671 10.708 1.00 0.00 H new ATOM 0 HG21 THR A 139 6.570 1.371 9.314 1.00 0.00 H new ATOM 0 HG22 THR A 139 6.409 -0.196 8.488 1.00 0.00 H new ATOM 0 HG23 THR A 139 6.172 -0.090 10.249 1.00 0.00 H new ATOM 2161 N GLY A 140 10.451 -1.584 8.319 1.00 0.00 N ATOM 2162 CA GLY A 140 11.856 -1.801 8.026 1.00 0.00 C ATOM 2163 C GLY A 140 12.119 -3.170 7.432 1.00 0.00 C ATOM 2164 O GLY A 140 11.308 -4.085 7.578 1.00 0.00 O ATOM 0 H GLY A 140 9.882 -1.318 7.515 1.00 0.00 H new ATOM 0 HA2 GLY A 140 12.202 -1.035 7.332 1.00 0.00 H new ATOM 0 HA3 GLY A 140 12.437 -1.688 8.941 1.00 0.00 H new ATOM 2168 N SER A 141 13.256 -3.312 6.758 1.00 0.00 N ATOM 2169 CA SER A 141 13.622 -4.579 6.134 1.00 0.00 C ATOM 2170 C SER A 141 14.094 -5.583 7.181 1.00 0.00 C ATOM 2171 O SER A 141 14.939 -5.273 8.019 1.00 0.00 O ATOM 2172 CB SER A 141 14.720 -4.359 5.091 1.00 0.00 C ATOM 2173 OG SER A 141 15.843 -3.710 5.662 1.00 0.00 O ATOM 0 H SER A 141 13.940 -2.566 6.630 1.00 0.00 H new ATOM 0 HA SER A 141 12.738 -4.982 5.641 1.00 0.00 H new ATOM 0 HB2 SER A 141 15.025 -5.318 4.671 1.00 0.00 H new ATOM 0 HB3 SER A 141 14.330 -3.760 4.268 1.00 0.00 H new ATOM 0 HG SER A 141 15.956 -4.006 6.589 1.00 0.00 H new ATOM 2179 N ASN A 142 13.539 -6.790 7.126 1.00 0.00 N ATOM 2180 CA ASN A 142 13.902 -7.842 8.069 1.00 0.00 C ATOM 2181 C ASN A 142 15.313 -8.354 7.797 1.00 0.00 C ATOM 2182 O ASN A 142 15.613 -8.883 6.727 1.00 0.00 O ATOM 2183 CB ASN A 142 12.903 -8.998 7.984 1.00 0.00 C ATOM 2184 CG ASN A 142 12.726 -9.708 9.313 1.00 0.00 C ATOM 2185 OD1 ASN A 142 13.257 -9.275 10.336 1.00 0.00 O ATOM 2186 ND2 ASN A 142 11.977 -10.804 9.302 1.00 0.00 N ATOM 0 H ASN A 142 12.837 -7.064 6.439 1.00 0.00 H new ATOM 0 HA ASN A 142 13.875 -7.420 9.074 1.00 0.00 H new ATOM 0 HB2 ASN A 142 11.939 -8.617 7.647 1.00 0.00 H new ATOM 0 HB3 ASN A 142 13.242 -9.714 7.235 1.00 0.00 H new ATOM 0 HD21 ASN A 142 11.822 -11.324 10.165 1.00 0.00 H new ATOM 0 HD22 ASN A 142 11.557 -11.126 8.430 1.00 0.00 H new ATOM 2193 N PRO A 143 16.201 -8.194 8.789 1.00 0.00 N ATOM 2194 CA PRO A 143 17.595 -8.635 8.682 1.00 0.00 C ATOM 2195 C PRO A 143 17.725 -10.154 8.679 1.00 0.00 C ATOM 2196 O PRO A 143 18.830 -10.692 8.631 1.00 0.00 O ATOM 2197 CB PRO A 143 18.251 -8.045 9.933 1.00 0.00 C ATOM 2198 CG PRO A 143 17.136 -7.890 10.908 1.00 0.00 C ATOM 2199 CD PRO A 143 15.913 -7.572 10.092 1.00 0.00 C ATOM 0 HA PRO A 143 18.054 -8.309 7.749 1.00 0.00 H new ATOM 0 HB2 PRO A 143 19.027 -8.704 10.321 1.00 0.00 H new ATOM 0 HB3 PRO A 143 18.724 -7.087 9.717 1.00 0.00 H new ATOM 0 HG2 PRO A 143 16.993 -8.803 11.486 1.00 0.00 H new ATOM 0 HG3 PRO A 143 17.348 -7.092 11.620 1.00 0.00 H new ATOM 0 HD2 PRO A 143 15.011 -7.984 10.543 1.00 0.00 H new ATOM 0 HD3 PRO A 143 15.760 -6.497 9.999 1.00 0.00 H new ATOM 2207 N ASN A 144 16.587 -10.840 8.730 1.00 0.00 N ATOM 2208 CA ASN A 144 16.574 -12.299 8.733 1.00 0.00 C ATOM 2209 C ASN A 144 16.492 -12.845 7.311 1.00 0.00 C ATOM 2210 O ASN A 144 15.508 -12.624 6.605 1.00 0.00 O ATOM 2211 CB ASN A 144 15.396 -12.817 9.559 1.00 0.00 C ATOM 2212 CG ASN A 144 15.395 -12.268 10.973 1.00 0.00 C ATOM 2213 OD1 ASN A 144 16.441 -11.903 11.509 1.00 0.00 O ATOM 2214 ND2 ASN A 144 14.218 -12.208 11.584 1.00 0.00 N ATOM 0 H ASN A 144 15.663 -10.410 8.770 1.00 0.00 H new ATOM 0 HA ASN A 144 17.505 -12.645 9.183 1.00 0.00 H new ATOM 0 HB2 ASN A 144 14.463 -12.545 9.066 1.00 0.00 H new ATOM 0 HB3 ASN A 144 15.432 -13.906 9.595 1.00 0.00 H new ATOM 0 HD21 ASN A 144 14.156 -11.848 12.536 1.00 0.00 H new ATOM 0 HD22 ASN A 144 13.376 -12.522 11.101 1.00 0.00 H new ATOM 2221 N LYS A 145 17.532 -13.560 6.896 1.00 0.00 N ATOM 2222 CA LYS A 145 17.579 -14.140 5.560 1.00 0.00 C ATOM 2223 C LYS A 145 16.702 -15.386 5.477 1.00 0.00 C ATOM 2224 O LYS A 145 15.959 -15.569 4.513 1.00 0.00 O ATOM 2225 CB LYS A 145 19.020 -14.492 5.184 1.00 0.00 C ATOM 2226 CG LYS A 145 20.013 -13.381 5.477 1.00 0.00 C ATOM 2227 CD LYS A 145 19.807 -12.191 4.555 1.00 0.00 C ATOM 2228 CE LYS A 145 20.157 -10.883 5.247 1.00 0.00 C ATOM 2229 NZ LYS A 145 18.974 -10.277 5.919 1.00 0.00 N ATOM 0 H LYS A 145 18.355 -13.752 7.467 1.00 0.00 H new ATOM 0 HA LYS A 145 17.197 -13.400 4.856 1.00 0.00 H new ATOM 0 HB2 LYS A 145 19.320 -15.388 5.727 1.00 0.00 H new ATOM 0 HB3 LYS A 145 19.061 -14.734 4.122 1.00 0.00 H new ATOM 0 HG2 LYS A 145 19.907 -13.062 6.514 1.00 0.00 H new ATOM 0 HG3 LYS A 145 21.029 -13.760 5.362 1.00 0.00 H new ATOM 0 HD2 LYS A 145 20.424 -12.309 3.664 1.00 0.00 H new ATOM 0 HD3 LYS A 145 18.769 -12.162 4.223 1.00 0.00 H new ATOM 0 HE2 LYS A 145 20.941 -11.060 5.983 1.00 0.00 H new ATOM 0 HE3 LYS A 145 20.558 -10.181 4.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 18.821 -9.316 5.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 18.132 -10.858 5.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 19.142 -10.234 6.944 1.00 0.00 H new ATOM 2243 N GLU A 146 16.794 -16.238 6.493 1.00 0.00 N ATOM 2244 CA GLU A 146 16.008 -17.465 6.534 1.00 0.00 C ATOM 2245 C GLU A 146 14.538 -17.180 6.237 1.00 0.00 C ATOM 2246 O GLU A 146 13.812 -18.046 5.746 1.00 0.00 O ATOM 2247 CB GLU A 146 16.142 -18.138 7.902 1.00 0.00 C ATOM 2248 CG GLU A 146 15.657 -17.276 9.055 1.00 0.00 C ATOM 2249 CD GLU A 146 15.357 -18.085 10.302 1.00 0.00 C ATOM 2250 OE1 GLU A 146 14.524 -19.011 10.223 1.00 0.00 O ATOM 2251 OE2 GLU A 146 15.958 -17.791 11.357 1.00 0.00 O ATOM 0 H GLU A 146 17.405 -16.101 7.298 1.00 0.00 H new ATOM 0 HA GLU A 146 16.392 -18.138 5.767 1.00 0.00 H new ATOM 0 HB2 GLU A 146 15.579 -19.071 7.895 1.00 0.00 H new ATOM 0 HB3 GLU A 146 17.187 -18.398 8.069 1.00 0.00 H new ATOM 0 HG2 GLU A 146 16.413 -16.526 9.286 1.00 0.00 H new ATOM 0 HG3 GLU A 146 14.759 -16.739 8.750 1.00 0.00 H new ATOM 2258 N THR A 147 14.105 -15.960 6.540 1.00 0.00 N ATOM 2259 CA THR A 147 12.723 -15.561 6.308 1.00 0.00 C ATOM 2260 C THR A 147 12.487 -15.222 4.841 1.00 0.00 C ATOM 2261 O THR A 147 13.395 -14.805 4.122 1.00 0.00 O ATOM 2262 CB THR A 147 12.337 -14.345 7.173 1.00 0.00 C ATOM 2263 OG1 THR A 147 13.112 -13.204 6.787 1.00 0.00 O ATOM 2264 CG2 THR A 147 12.557 -14.639 8.649 1.00 0.00 C ATOM 0 H THR A 147 14.692 -15.232 6.947 1.00 0.00 H new ATOM 0 HA THR A 147 12.098 -16.409 6.587 1.00 0.00 H new ATOM 0 HB THR A 147 11.279 -14.135 7.015 1.00 0.00 H new ATOM 0 HG1 THR A 147 14.038 -13.320 7.087 1.00 0.00 H new ATOM 0 HG21 THR A 147 12.278 -13.766 9.239 1.00 0.00 H new ATOM 0 HG22 THR A 147 11.943 -15.490 8.946 1.00 0.00 H new ATOM 0 HG23 THR A 147 13.608 -14.872 8.821 1.00 0.00 H new ATOM 2272 N PRO A 148 11.239 -15.403 4.384 1.00 0.00 N ATOM 2273 CA PRO A 148 10.855 -15.121 2.998 1.00 0.00 C ATOM 2274 C PRO A 148 10.856 -13.628 2.688 1.00 0.00 C ATOM 2275 O PRO A 148 10.542 -12.806 3.550 1.00 0.00 O ATOM 2276 CB PRO A 148 9.436 -15.687 2.901 1.00 0.00 C ATOM 2277 CG PRO A 148 8.919 -15.653 4.298 1.00 0.00 C ATOM 2278 CD PRO A 148 10.107 -15.898 5.185 1.00 0.00 C ATOM 0 HA PRO A 148 11.553 -15.559 2.285 1.00 0.00 H new ATOM 0 HB2 PRO A 148 8.815 -15.088 2.234 1.00 0.00 H new ATOM 0 HB3 PRO A 148 9.441 -16.703 2.505 1.00 0.00 H new ATOM 0 HG2 PRO A 148 8.458 -14.691 4.520 1.00 0.00 H new ATOM 0 HG3 PRO A 148 8.155 -16.415 4.450 1.00 0.00 H new ATOM 0 HD2 PRO A 148 10.020 -15.363 6.131 1.00 0.00 H new ATOM 0 HD3 PRO A 148 10.217 -16.955 5.426 1.00 0.00 H new ATOM 2286 N CYS A 149 11.210 -13.285 1.455 1.00 0.00 N ATOM 2287 CA CYS A 149 11.252 -11.889 1.032 1.00 0.00 C ATOM 2288 C CYS A 149 10.370 -11.666 -0.193 1.00 0.00 C ATOM 2289 O CYS A 149 10.201 -12.561 -1.021 1.00 0.00 O ATOM 2290 CB CYS A 149 12.690 -11.471 0.723 1.00 0.00 C ATOM 2291 SG CYS A 149 12.823 -9.999 -0.318 1.00 0.00 S ATOM 0 H CYS A 149 11.472 -13.953 0.730 1.00 0.00 H new ATOM 0 HA CYS A 149 10.871 -11.276 1.849 1.00 0.00 H new ATOM 0 HB2 CYS A 149 13.213 -11.288 1.661 1.00 0.00 H new ATOM 0 HB3 CYS A 149 13.200 -12.299 0.230 1.00 0.00 H new ATOM 0 HG CYS A 149 11.988 -9.095 0.100 1.00 0.00 H new ATOM 2297 N LEU A 150 9.810 -10.466 -0.300 1.00 0.00 N ATOM 2298 CA LEU A 150 8.943 -10.124 -1.423 1.00 0.00 C ATOM 2299 C LEU A 150 9.520 -8.960 -2.221 1.00 0.00 C ATOM 2300 O LEU A 150 10.218 -8.106 -1.675 1.00 0.00 O ATOM 2301 CB LEU A 150 7.542 -9.770 -0.922 1.00 0.00 C ATOM 2302 CG LEU A 150 6.546 -10.927 -0.840 1.00 0.00 C ATOM 2303 CD1 LEU A 150 5.442 -10.611 0.158 1.00 0.00 C ATOM 2304 CD2 LEU A 150 5.958 -11.223 -2.212 1.00 0.00 C ATOM 0 H LEU A 150 9.940 -9.714 0.377 1.00 0.00 H new ATOM 0 HA LEU A 150 8.878 -10.993 -2.078 1.00 0.00 H new ATOM 0 HB2 LEU A 150 7.634 -9.325 0.069 1.00 0.00 H new ATOM 0 HB3 LEU A 150 7.126 -9.005 -1.577 1.00 0.00 H new ATOM 0 HG LEU A 150 7.077 -11.814 -0.495 1.00 0.00 H new ATOM 0 HD11 LEU A 150 4.742 -11.446 0.203 1.00 0.00 H new ATOM 0 HD12 LEU A 150 5.878 -10.449 1.144 1.00 0.00 H new ATOM 0 HD13 LEU A 150 4.913 -9.711 -0.157 1.00 0.00 H new ATOM 0 HD21 LEU A 150 5.251 -12.049 -2.134 1.00 0.00 H new ATOM 0 HD22 LEU A 150 5.442 -10.338 -2.585 1.00 0.00 H new ATOM 0 HD23 LEU A 150 6.759 -11.494 -2.900 1.00 0.00 H new ATOM 2316 N GLU A 151 9.222 -8.931 -3.516 1.00 0.00 N ATOM 2317 CA GLU A 151 9.711 -7.870 -4.389 1.00 0.00 C ATOM 2318 C GLU A 151 8.561 -6.994 -4.877 1.00 0.00 C ATOM 2319 O GLU A 151 7.480 -7.490 -5.199 1.00 0.00 O ATOM 2320 CB GLU A 151 10.456 -8.466 -5.585 1.00 0.00 C ATOM 2321 CG GLU A 151 11.954 -8.597 -5.366 1.00 0.00 C ATOM 2322 CD GLU A 151 12.341 -9.939 -4.775 1.00 0.00 C ATOM 2323 OE1 GLU A 151 11.545 -10.893 -4.899 1.00 0.00 O ATOM 2324 OE2 GLU A 151 13.440 -10.035 -4.190 1.00 0.00 O ATOM 0 H GLU A 151 8.645 -9.630 -3.984 1.00 0.00 H new ATOM 0 HA GLU A 151 10.399 -7.250 -3.814 1.00 0.00 H new ATOM 0 HB2 GLU A 151 10.042 -9.450 -5.806 1.00 0.00 H new ATOM 0 HB3 GLU A 151 10.279 -7.841 -6.461 1.00 0.00 H new ATOM 0 HG2 GLU A 151 12.470 -8.460 -6.316 1.00 0.00 H new ATOM 0 HG3 GLU A 151 12.292 -7.801 -4.703 1.00 0.00 H new ATOM 2331 N LEU A 152 8.800 -5.688 -4.929 1.00 0.00 N ATOM 2332 CA LEU A 152 7.785 -4.741 -5.377 1.00 0.00 C ATOM 2333 C LEU A 152 8.426 -3.542 -6.068 1.00 0.00 C ATOM 2334 O LEU A 152 9.560 -3.174 -5.766 1.00 0.00 O ATOM 2335 CB LEU A 152 6.940 -4.270 -4.191 1.00 0.00 C ATOM 2336 CG LEU A 152 7.672 -3.447 -3.131 1.00 0.00 C ATOM 2337 CD1 LEU A 152 9.046 -4.037 -2.851 1.00 0.00 C ATOM 2338 CD2 LEU A 152 7.793 -1.995 -3.573 1.00 0.00 C ATOM 0 H LEU A 152 9.688 -5.261 -4.666 1.00 0.00 H new ATOM 0 HA LEU A 152 7.141 -5.249 -6.095 1.00 0.00 H new ATOM 0 HB2 LEU A 152 6.110 -3.676 -4.575 1.00 0.00 H new ATOM 0 HB3 LEU A 152 6.508 -5.146 -3.708 1.00 0.00 H new ATOM 0 HG LEU A 152 7.091 -3.479 -2.209 1.00 0.00 H new ATOM 0 HD11 LEU A 152 9.552 -3.438 -2.094 1.00 0.00 H new ATOM 0 HD12 LEU A 152 8.936 -5.060 -2.490 1.00 0.00 H new ATOM 0 HD13 LEU A 152 9.636 -4.037 -3.768 1.00 0.00 H new ATOM 0 HD21 LEU A 152 8.317 -1.424 -2.806 1.00 0.00 H new ATOM 0 HD22 LEU A 152 8.351 -1.945 -4.508 1.00 0.00 H new ATOM 0 HD23 LEU A 152 6.798 -1.576 -3.722 1.00 0.00 H new ATOM 2350 N GLU A 153 7.690 -2.937 -6.995 1.00 0.00 N ATOM 2351 CA GLU A 153 8.187 -1.778 -7.727 1.00 0.00 C ATOM 2352 C GLU A 153 7.295 -0.562 -7.492 1.00 0.00 C ATOM 2353 O GLU A 153 6.092 -0.602 -7.747 1.00 0.00 O ATOM 2354 CB GLU A 153 8.263 -2.087 -9.224 1.00 0.00 C ATOM 2355 CG GLU A 153 9.451 -2.953 -9.607 1.00 0.00 C ATOM 2356 CD GLU A 153 9.411 -3.389 -11.059 1.00 0.00 C ATOM 2357 OE1 GLU A 153 8.776 -4.425 -11.350 1.00 0.00 O ATOM 2358 OE2 GLU A 153 10.013 -2.694 -11.903 1.00 0.00 O ATOM 0 H GLU A 153 6.749 -3.230 -7.257 1.00 0.00 H new ATOM 0 HA GLU A 153 9.187 -1.549 -7.359 1.00 0.00 H new ATOM 0 HB2 GLU A 153 7.345 -2.589 -9.530 1.00 0.00 H new ATOM 0 HB3 GLU A 153 8.314 -1.150 -9.778 1.00 0.00 H new ATOM 0 HG2 GLU A 153 10.373 -2.401 -9.423 1.00 0.00 H new ATOM 0 HG3 GLU A 153 9.474 -3.835 -8.967 1.00 0.00 H new ATOM 2365 N PHE A 154 7.895 0.518 -7.003 1.00 0.00 N ATOM 2366 CA PHE A 154 7.156 1.746 -6.732 1.00 0.00 C ATOM 2367 C PHE A 154 7.061 2.612 -7.985 1.00 0.00 C ATOM 2368 O PHE A 154 8.070 3.101 -8.492 1.00 0.00 O ATOM 2369 CB PHE A 154 7.829 2.532 -5.605 1.00 0.00 C ATOM 2370 CG PHE A 154 7.646 1.912 -4.249 1.00 0.00 C ATOM 2371 CD1 PHE A 154 6.422 1.974 -3.603 1.00 0.00 C ATOM 2372 CD2 PHE A 154 8.699 1.267 -3.620 1.00 0.00 C ATOM 2373 CE1 PHE A 154 6.250 1.404 -2.356 1.00 0.00 C ATOM 2374 CE2 PHE A 154 8.534 0.695 -2.373 1.00 0.00 C ATOM 2375 CZ PHE A 154 7.308 0.764 -1.740 1.00 0.00 C ATOM 0 H PHE A 154 8.890 0.568 -6.786 1.00 0.00 H new ATOM 0 HA PHE A 154 6.147 1.473 -6.424 1.00 0.00 H new ATOM 0 HB2 PHE A 154 8.895 2.615 -5.817 1.00 0.00 H new ATOM 0 HB3 PHE A 154 7.428 3.545 -5.590 1.00 0.00 H new ATOM 0 HD1 PHE A 154 5.592 2.474 -4.080 1.00 0.00 H new ATOM 0 HD2 PHE A 154 9.660 1.211 -4.110 1.00 0.00 H new ATOM 0 HE1 PHE A 154 5.290 1.459 -1.864 1.00 0.00 H new ATOM 0 HE2 PHE A 154 9.362 0.195 -1.894 1.00 0.00 H new ATOM 0 HZ PHE A 154 7.177 0.318 -0.765 1.00 0.00 H new ATOM 2385 N ASP A 155 5.841 2.795 -8.478 1.00 0.00 N ATOM 2386 CA ASP A 155 5.612 3.602 -9.671 1.00 0.00 C ATOM 2387 C ASP A 155 4.596 4.705 -9.395 1.00 0.00 C ATOM 2388 O ASP A 155 3.512 4.447 -8.872 1.00 0.00 O ATOM 2389 CB ASP A 155 5.126 2.721 -10.823 1.00 0.00 C ATOM 2390 CG ASP A 155 6.270 2.149 -11.638 1.00 0.00 C ATOM 2391 OD1 ASP A 155 7.181 1.541 -11.037 1.00 0.00 O ATOM 2392 OD2 ASP A 155 6.255 2.310 -12.876 1.00 0.00 O ATOM 0 H ASP A 155 4.996 2.396 -8.070 1.00 0.00 H new ATOM 0 HA ASP A 155 6.557 4.066 -9.952 1.00 0.00 H new ATOM 0 HB2 ASP A 155 4.525 1.904 -10.423 1.00 0.00 H new ATOM 0 HB3 ASP A 155 4.477 3.306 -11.475 1.00 0.00 H new ATOM 2397 N TRP A 156 4.954 5.934 -9.747 1.00 0.00 N ATOM 2398 CA TRP A 156 4.074 7.077 -9.536 1.00 0.00 C ATOM 2399 C TRP A 156 3.824 7.822 -10.843 1.00 0.00 C ATOM 2400 O TRP A 156 4.463 8.837 -11.122 1.00 0.00 O ATOM 2401 CB TRP A 156 4.677 8.028 -8.501 1.00 0.00 C ATOM 2402 CG TRP A 156 5.206 7.326 -7.287 1.00 0.00 C ATOM 2403 CD1 TRP A 156 6.460 6.811 -7.119 1.00 0.00 C ATOM 2404 CD2 TRP A 156 4.495 7.060 -6.073 1.00 0.00 C ATOM 2405 NE1 TRP A 156 6.571 6.241 -5.873 1.00 0.00 N ATOM 2406 CE2 TRP A 156 5.380 6.381 -5.212 1.00 0.00 C ATOM 2407 CE3 TRP A 156 3.198 7.331 -5.628 1.00 0.00 C ATOM 2408 CZ2 TRP A 156 5.007 5.970 -3.935 1.00 0.00 C ATOM 2409 CZ3 TRP A 156 2.829 6.922 -4.361 1.00 0.00 C ATOM 2410 CH2 TRP A 156 3.731 6.248 -3.526 1.00 0.00 C ATOM 0 H TRP A 156 5.848 6.165 -10.180 1.00 0.00 H new ATOM 0 HA TRP A 156 3.120 6.704 -9.164 1.00 0.00 H new ATOM 0 HB2 TRP A 156 5.484 8.594 -8.965 1.00 0.00 H new ATOM 0 HB3 TRP A 156 3.918 8.748 -8.194 1.00 0.00 H new ATOM 0 HD1 TRP A 156 7.248 6.846 -7.856 1.00 0.00 H new ATOM 0 HE1 TRP A 156 7.405 5.787 -5.501 1.00 0.00 H new ATOM 0 HE3 TRP A 156 2.497 7.851 -6.264 1.00 0.00 H new ATOM 0 HZ2 TRP A 156 5.700 5.450 -3.290 1.00 0.00 H new ATOM 0 HZ3 TRP A 156 1.829 7.125 -4.008 1.00 0.00 H new ATOM 0 HH2 TRP A 156 3.413 5.942 -2.540 1.00 0.00 H new ATOM 2421 N PHE A 157 2.892 7.311 -11.641 1.00 0.00 N ATOM 2422 CA PHE A 157 2.559 7.928 -12.920 1.00 0.00 C ATOM 2423 C PHE A 157 1.640 9.130 -12.721 1.00 0.00 C ATOM 2424 O PHE A 157 1.937 10.234 -13.177 1.00 0.00 O ATOM 2425 CB PHE A 157 1.891 6.908 -13.844 1.00 0.00 C ATOM 2426 CG PHE A 157 0.543 6.454 -13.360 1.00 0.00 C ATOM 2427 CD1 PHE A 157 0.434 5.448 -12.414 1.00 0.00 C ATOM 2428 CD2 PHE A 157 -0.615 7.034 -13.853 1.00 0.00 C ATOM 2429 CE1 PHE A 157 -0.805 5.028 -11.967 1.00 0.00 C ATOM 2430 CE2 PHE A 157 -1.857 6.619 -13.409 1.00 0.00 C ATOM 2431 CZ PHE A 157 -1.951 5.614 -12.466 1.00 0.00 C ATOM 0 H PHE A 157 2.354 6.472 -11.425 1.00 0.00 H new ATOM 0 HA PHE A 157 3.485 8.273 -13.381 1.00 0.00 H new ATOM 0 HB2 PHE A 157 1.784 7.345 -14.837 1.00 0.00 H new ATOM 0 HB3 PHE A 157 2.543 6.040 -13.946 1.00 0.00 H new ATOM 0 HD1 PHE A 157 1.328 4.986 -12.021 1.00 0.00 H new ATOM 0 HD2 PHE A 157 -0.547 7.819 -14.592 1.00 0.00 H new ATOM 0 HE1 PHE A 157 -0.876 4.243 -11.229 1.00 0.00 H new ATOM 0 HE2 PHE A 157 -2.752 7.080 -13.799 1.00 0.00 H new ATOM 0 HZ PHE A 157 -2.920 5.287 -12.119 1.00 0.00 H new ATOM 2441 N SER A 158 0.522 8.906 -12.037 1.00 0.00 N ATOM 2442 CA SER A 158 -0.443 9.968 -11.781 1.00 0.00 C ATOM 2443 C SER A 158 -1.583 9.465 -10.900 1.00 0.00 C ATOM 2444 O SER A 158 -2.306 8.542 -11.271 1.00 0.00 O ATOM 2445 CB SER A 158 -1.002 10.507 -13.100 1.00 0.00 C ATOM 2446 OG SER A 158 -2.170 9.803 -13.484 1.00 0.00 O ATOM 0 H SER A 158 0.263 7.998 -11.650 1.00 0.00 H new ATOM 0 HA SER A 158 0.071 10.773 -11.256 1.00 0.00 H new ATOM 0 HB2 SER A 158 -1.231 11.568 -12.995 1.00 0.00 H new ATOM 0 HB3 SER A 158 -0.247 10.419 -13.881 1.00 0.00 H new ATOM 0 HG SER A 158 -2.057 8.850 -13.288 1.00 0.00 H new TER 2452 SER A 158