USER MOD reduce.3.24.130724 H: found=0, std=0, add=820, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 821 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 120 SER OG : rot 124:sc= -0.606 USER MOD Set 1.2: A 124 MET CE :methyl 141:sc= -0.158 (180deg=-0.952) USER MOD Set 2.1: A 110 GLN : amide:sc= -1.13 K(o=-1.1,f=-0.0093) USER MOD Set 2.2: A 113 SER OG : rot -150:sc= 0.00425 USER MOD Set 3.1: A 108 TYR OH : rot -46:sc= 0.181 USER MOD Set 3.2: A 122 ASN : amide:sc= 0.34 K(o=0.52,f=-4.1!) USER MOD Set 4.1: A 58 MET CE :methyl 174:sc= -1.1 (180deg=-1.3) USER MOD Set 4.2: A 104 SER OG : rot 180:sc= -0.109 USER MOD Set 5.1: A 62 GLN : amide:sc= -4.75! C(o=-3.9!,f=-9.1!) USER MOD Set 5.2: A 63 SER OG : rot -11:sc= 0.02 USER MOD Set 5.3: A 67 SER OG : rot 94:sc= 0.821 USER MOD Set 6.1: A 47 GLN : amide:sc= 0.503 K(o=1.6,f=0.1) USER MOD Set 6.2: A 61 SER OG : rot 136:sc= 1.13 USER MOD Set 7.1: A 43 LYS NZ :NH3+ -139:sc= 0.986 (180deg=0) USER MOD Set 7.2: A 85 ASN : amide:sc= 0.195 K(o=1.2,f=-7.2!) USER MOD Single : A 27 SER OG : rot 157:sc= 1.41 USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 GLN : amide:sc= -1.42! C(o=-1.4!,f=-5.8!) USER MOD Single : A 38 THR OG1 : rot 178:sc= -0.0454 USER MOD Single : A 40 SER OG : rot -2:sc= 0.16! USER MOD Single : A 41 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0866) USER MOD Single : A 57 HIS : no HD1:sc= -2.79! C(o=-2.8!,f=-4.3!) USER MOD Single : A 68 SER OG : rot 132:sc= 1.28 USER MOD Single : A 69 LYS NZ :NH3+ 169:sc=-0.00633 (180deg=-0.118) USER MOD Single : A 70 GLN : amide:sc= -1.09 K(o=-1.1,f=-0.011) USER MOD Single : A 75 SER OG : rot -57:sc= 1.25 USER MOD Single : A 76 GLN : amide:sc= -1.12 K(o=-1.1,f=-0.11) USER MOD Single : A 78 SER OG : rot 180:sc= 0.0176 USER MOD Single : A 79 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0331) USER MOD Single : A 82 GLN : amide:sc= -0.614 K(o=-0.61,f=0) USER MOD Single : A 91 SER OG : rot 117:sc= 0.787 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0.045 USER MOD Single : A 99 TYR OH : rot -110:sc= -1.05 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= -5.3! K(o=-5.3!,f=-1.1) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 130:sc= -0.343 USER MOD Single : A 116 ASN : amide:sc= -0.386 K(o=-0.39,f=-3.8!) USER MOD Single : A 118 SER OG : rot 180:sc=-0.00476 USER MOD Single : A 119 HIS : no HE2:sc= 0.775 K(o=0.78,f=-2.4!) USER MOD Single : A 126 HIS : no HD1:sc= -0.0204 X(o=-0.02,f=-0.02) USER MOD Single : A 127 SER OG : rot 121:sc= 0.233 USER MOD Single : A 131 THR OG1 : rot 180:sc= -0.604 USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 25 -103.381 -12.634 -26.299 1.00 0.00 N ATOM 2 CA ARG A 25 -103.100 -11.450 -25.452 1.00 0.00 C ATOM 3 C ARG A 25 -101.648 -11.036 -25.611 1.00 0.00 C ATOM 4 O ARG A 25 -100.793 -11.881 -25.890 1.00 0.00 O ATOM 5 CB ARG A 25 -103.409 -11.723 -23.968 1.00 0.00 C ATOM 6 CG ARG A 25 -102.449 -12.678 -23.262 1.00 0.00 C ATOM 7 CD ARG A 25 -102.670 -14.124 -23.673 1.00 0.00 C ATOM 8 NE ARG A 25 -101.841 -15.048 -22.901 1.00 0.00 N ATOM 9 CZ ARG A 25 -101.828 -16.366 -23.087 1.00 0.00 C ATOM 10 NH1 ARG A 25 -102.549 -16.906 -24.059 1.00 0.00 N ATOM 11 NH2 ARG A 25 -101.084 -17.135 -22.304 1.00 0.00 N ATOM 0 HA ARG A 25 -103.751 -10.641 -25.783 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -103.407 -10.773 -23.434 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -104.418 -12.129 -23.894 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -101.422 -12.391 -23.488 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -102.575 -12.586 -22.183 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -103.721 -14.382 -23.539 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -102.447 -14.237 -24.734 1.00 0.00 H new ATOM 0 HE ARG A 25 -101.237 -14.660 -22.177 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -103.114 -16.312 -24.665 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -102.539 -17.916 -24.201 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -100.524 -16.716 -21.562 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -101.072 -18.145 -22.444 1.00 0.00 H new ATOM 25 N LEU A 26 -101.381 -9.740 -25.437 1.00 0.00 N ATOM 26 CA LEU A 26 -100.039 -9.186 -25.598 1.00 0.00 C ATOM 27 C LEU A 26 -99.554 -9.424 -27.019 1.00 0.00 C ATOM 28 O LEU A 26 -98.890 -10.417 -27.299 1.00 0.00 O ATOM 29 CB LEU A 26 -99.054 -9.812 -24.599 1.00 0.00 C ATOM 30 CG LEU A 26 -99.392 -9.611 -23.123 1.00 0.00 C ATOM 31 CD1 LEU A 26 -98.416 -10.376 -22.243 1.00 0.00 C ATOM 32 CD2 LEU A 26 -99.368 -8.135 -22.771 1.00 0.00 C ATOM 0 H LEU A 26 -102.087 -9.049 -25.182 1.00 0.00 H new ATOM 0 HA LEU A 26 -100.086 -8.115 -25.400 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -98.995 -10.882 -24.797 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -98.063 -9.398 -24.786 1.00 0.00 H new ATOM 0 HG LEU A 26 -100.396 -9.997 -22.945 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -98.672 -10.221 -21.195 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -98.472 -11.439 -22.477 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -97.403 -10.017 -22.426 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -99.611 -8.009 -21.716 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -98.375 -7.731 -22.966 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -100.101 -7.604 -23.378 1.00 0.00 H new ATOM 44 N SER A 27 -99.914 -8.545 -27.931 1.00 0.00 N ATOM 45 CA SER A 27 -99.587 -8.772 -29.319 1.00 0.00 C ATOM 46 C SER A 27 -99.259 -7.475 -30.043 1.00 0.00 C ATOM 47 O SER A 27 -99.716 -6.399 -29.657 1.00 0.00 O ATOM 48 CB SER A 27 -100.744 -9.498 -29.990 1.00 0.00 C ATOM 49 OG SER A 27 -101.941 -8.742 -29.909 1.00 0.00 O ATOM 0 H SER A 27 -100.424 -7.682 -27.740 1.00 0.00 H new ATOM 0 HA SER A 27 -98.691 -9.391 -29.371 1.00 0.00 H new ATOM 0 HB2 SER A 27 -100.501 -9.687 -31.035 1.00 0.00 H new ATOM 0 HB3 SER A 27 -100.891 -10.469 -29.516 1.00 0.00 H new ATOM 0 HG SER A 27 -102.550 -9.016 -30.626 1.00 0.00 H new ATOM 55 N TRP A 28 -98.480 -7.588 -31.108 1.00 0.00 N ATOM 56 CA TRP A 28 -98.030 -6.424 -31.859 1.00 0.00 C ATOM 57 C TRP A 28 -99.069 -5.965 -32.884 1.00 0.00 C ATOM 58 O TRP A 28 -98.729 -5.394 -33.916 1.00 0.00 O ATOM 59 CB TRP A 28 -96.676 -6.709 -32.527 1.00 0.00 C ATOM 60 CG TRP A 28 -96.657 -7.861 -33.498 1.00 0.00 C ATOM 61 CD1 TRP A 28 -97.604 -8.838 -33.670 1.00 0.00 C ATOM 62 CD2 TRP A 28 -95.609 -8.156 -34.429 1.00 0.00 C ATOM 63 NE1 TRP A 28 -97.208 -9.711 -34.655 1.00 0.00 N ATOM 64 CE2 TRP A 28 -95.986 -9.312 -35.137 1.00 0.00 C ATOM 65 CE3 TRP A 28 -94.387 -7.547 -34.733 1.00 0.00 C ATOM 66 CZ2 TRP A 28 -95.183 -9.871 -36.131 1.00 0.00 C ATOM 67 CZ3 TRP A 28 -93.593 -8.101 -35.718 1.00 0.00 C ATOM 68 CH2 TRP A 28 -93.992 -9.251 -36.408 1.00 0.00 C ATOM 0 H TRP A 28 -98.144 -8.479 -31.474 1.00 0.00 H new ATOM 0 HA TRP A 28 -97.902 -5.603 -31.153 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -96.354 -5.810 -33.052 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -95.940 -6.903 -31.747 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -98.526 -8.911 -33.113 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -97.736 -10.523 -34.976 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -94.070 -6.659 -34.207 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -95.488 -10.760 -36.663 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -92.648 -7.638 -35.960 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -93.349 -9.658 -37.174 1.00 0.00 H new ATOM 79 N TYR A 29 -100.338 -6.206 -32.587 1.00 0.00 N ATOM 80 CA TYR A 29 -101.418 -5.657 -33.391 1.00 0.00 C ATOM 81 C TYR A 29 -102.429 -4.943 -32.500 1.00 0.00 C ATOM 82 O TYR A 29 -103.493 -4.524 -32.954 1.00 0.00 O ATOM 83 CB TYR A 29 -102.095 -6.737 -34.255 1.00 0.00 C ATOM 84 CG TYR A 29 -102.555 -7.976 -33.511 1.00 0.00 C ATOM 85 CD1 TYR A 29 -103.741 -7.986 -32.785 1.00 0.00 C ATOM 86 CD2 TYR A 29 -101.807 -9.146 -33.556 1.00 0.00 C ATOM 87 CE1 TYR A 29 -104.164 -9.124 -32.124 1.00 0.00 C ATOM 88 CE2 TYR A 29 -102.222 -10.288 -32.896 1.00 0.00 C ATOM 89 CZ TYR A 29 -103.400 -10.272 -32.180 1.00 0.00 C ATOM 90 OH TYR A 29 -103.815 -11.407 -31.517 1.00 0.00 O ATOM 0 H TYR A 29 -100.643 -6.776 -31.798 1.00 0.00 H new ATOM 0 HA TYR A 29 -100.989 -4.928 -34.078 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -102.957 -6.292 -34.752 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -101.399 -7.041 -35.036 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -104.342 -7.090 -32.737 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -100.884 -9.164 -34.117 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -105.089 -9.115 -31.566 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -101.626 -11.188 -32.941 1.00 0.00 H new ATOM 0 HH TYR A 29 -103.164 -12.126 -31.659 1.00 0.00 H new ATOM 100 N ASP A 30 -102.076 -4.794 -31.224 1.00 0.00 N ATOM 101 CA ASP A 30 -102.895 -4.053 -30.279 1.00 0.00 C ATOM 102 C ASP A 30 -102.611 -2.560 -30.411 1.00 0.00 C ATOM 103 O ASP A 30 -101.457 -2.140 -30.348 1.00 0.00 O ATOM 104 CB ASP A 30 -102.602 -4.498 -28.843 1.00 0.00 C ATOM 105 CG ASP A 30 -103.174 -5.855 -28.494 1.00 0.00 C ATOM 106 OD1 ASP A 30 -104.413 -5.984 -28.421 1.00 0.00 O ATOM 107 OD2 ASP A 30 -102.384 -6.794 -28.251 1.00 0.00 O ATOM 0 H ASP A 30 -101.222 -5.181 -30.824 1.00 0.00 H new ATOM 0 HA ASP A 30 -103.943 -4.252 -30.503 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -101.523 -4.520 -28.693 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -103.005 -3.756 -28.154 1.00 0.00 H new ATOM 112 N PRO A 31 -103.659 -1.739 -30.589 1.00 0.00 N ATOM 113 CA PRO A 31 -103.513 -0.289 -30.778 1.00 0.00 C ATOM 114 C PRO A 31 -102.853 0.409 -29.587 1.00 0.00 C ATOM 115 O PRO A 31 -102.203 1.439 -29.746 1.00 0.00 O ATOM 116 CB PRO A 31 -104.956 0.205 -30.940 1.00 0.00 C ATOM 117 CG PRO A 31 -105.738 -1.004 -31.322 1.00 0.00 C ATOM 118 CD PRO A 31 -105.068 -2.158 -30.636 1.00 0.00 C ATOM 0 HA PRO A 31 -102.867 -0.068 -31.628 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -105.330 0.640 -30.013 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -105.025 0.978 -31.706 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -106.778 -0.913 -31.008 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -105.743 -1.141 -32.403 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -105.473 -2.325 -29.638 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -105.195 -3.087 -31.191 1.00 0.00 H new ATOM 126 N ASP A 32 -103.029 -0.152 -28.397 1.00 0.00 N ATOM 127 CA ASP A 32 -102.483 0.451 -27.182 1.00 0.00 C ATOM 128 C ASP A 32 -101.123 -0.147 -26.826 1.00 0.00 C ATOM 129 O ASP A 32 -100.351 0.441 -26.066 1.00 0.00 O ATOM 130 CB ASP A 32 -103.463 0.270 -26.019 1.00 0.00 C ATOM 131 CG ASP A 32 -102.924 0.800 -24.703 1.00 0.00 C ATOM 132 OD1 ASP A 32 -102.637 2.015 -24.617 1.00 0.00 O ATOM 133 OD2 ASP A 32 -102.799 0.004 -23.747 1.00 0.00 O ATOM 0 H ASP A 32 -103.543 -1.020 -28.245 1.00 0.00 H new ATOM 0 HA ASP A 32 -102.341 1.516 -27.368 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -104.397 0.780 -26.255 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -103.697 -0.789 -25.910 1.00 0.00 H new ATOM 138 N PHE A 33 -100.820 -1.296 -27.408 1.00 0.00 N ATOM 139 CA PHE A 33 -99.583 -1.999 -27.098 1.00 0.00 C ATOM 140 C PHE A 33 -98.407 -1.252 -27.708 1.00 0.00 C ATOM 141 O PHE A 33 -98.450 -0.847 -28.872 1.00 0.00 O ATOM 142 CB PHE A 33 -99.657 -3.431 -27.630 1.00 0.00 C ATOM 143 CG PHE A 33 -98.634 -4.372 -27.055 1.00 0.00 C ATOM 144 CD1 PHE A 33 -98.788 -4.874 -25.773 1.00 0.00 C ATOM 145 CD2 PHE A 33 -97.538 -4.774 -27.798 1.00 0.00 C ATOM 146 CE1 PHE A 33 -97.868 -5.757 -25.244 1.00 0.00 C ATOM 147 CE2 PHE A 33 -96.617 -5.653 -27.274 1.00 0.00 C ATOM 148 CZ PHE A 33 -96.779 -6.147 -25.996 1.00 0.00 C ATOM 0 H PHE A 33 -101.411 -1.762 -28.096 1.00 0.00 H new ATOM 0 HA PHE A 33 -99.443 -2.041 -26.018 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -100.651 -3.829 -27.425 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -99.540 -3.407 -28.713 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -99.638 -4.571 -25.180 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -97.404 -4.394 -28.800 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -98.000 -6.142 -24.244 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -95.765 -5.957 -27.865 1.00 0.00 H new ATOM 0 HZ PHE A 33 -96.056 -6.836 -25.586 1.00 0.00 H new ATOM 158 N GLN A 34 -97.370 -1.044 -26.915 1.00 0.00 N ATOM 159 CA GLN A 34 -96.230 -0.269 -27.360 1.00 0.00 C ATOM 160 C GLN A 34 -95.181 -1.143 -28.019 1.00 0.00 C ATOM 161 O GLN A 34 -94.765 -2.165 -27.475 1.00 0.00 O ATOM 162 CB GLN A 34 -95.614 0.513 -26.206 1.00 0.00 C ATOM 163 CG GLN A 34 -96.386 1.771 -25.857 1.00 0.00 C ATOM 164 CD GLN A 34 -96.305 2.842 -26.935 1.00 0.00 C ATOM 165 OE1 GLN A 34 -96.165 2.551 -28.123 1.00 0.00 O ATOM 166 NE2 GLN A 34 -96.397 4.097 -26.521 1.00 0.00 N ATOM 0 H GLN A 34 -97.296 -1.401 -25.962 1.00 0.00 H new ATOM 0 HA GLN A 34 -96.595 0.438 -28.104 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -95.562 -0.129 -25.327 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -94.590 0.783 -26.464 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -97.431 1.513 -25.688 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -96.003 2.177 -24.921 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -96.513 4.299 -25.528 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -96.352 4.861 -27.195 1.00 0.00 H new ATOM 175 N ALA A 35 -94.754 -0.705 -29.184 1.00 0.00 N ATOM 176 CA ALA A 35 -93.761 -1.406 -29.976 1.00 0.00 C ATOM 177 C ALA A 35 -93.115 -0.420 -30.929 1.00 0.00 C ATOM 178 O ALA A 35 -93.750 0.560 -31.318 1.00 0.00 O ATOM 179 CB ALA A 35 -94.393 -2.560 -30.741 1.00 0.00 C ATOM 0 H ALA A 35 -95.089 0.157 -29.614 1.00 0.00 H new ATOM 0 HA ALA A 35 -93.003 -1.829 -29.317 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -93.629 -3.070 -31.327 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -94.839 -3.262 -30.037 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -95.165 -2.175 -31.408 1.00 0.00 H new ATOM 185 N ARG A 36 -91.861 -0.653 -31.289 1.00 0.00 N ATOM 186 CA ARG A 36 -91.126 0.309 -32.095 1.00 0.00 C ATOM 187 C ARG A 36 -89.748 -0.218 -32.455 1.00 0.00 C ATOM 188 O ARG A 36 -89.387 -1.341 -32.110 1.00 0.00 O ATOM 189 CB ARG A 36 -90.952 1.610 -31.307 1.00 0.00 C ATOM 190 CG ARG A 36 -90.132 1.401 -30.043 1.00 0.00 C ATOM 191 CD ARG A 36 -89.983 2.664 -29.223 1.00 0.00 C ATOM 192 NE ARG A 36 -89.127 2.434 -28.061 1.00 0.00 N ATOM 193 CZ ARG A 36 -88.950 3.302 -27.073 1.00 0.00 C ATOM 194 NH1 ARG A 36 -89.619 4.448 -27.053 1.00 0.00 N ATOM 195 NH2 ARG A 36 -88.118 3.004 -26.084 1.00 0.00 N ATOM 0 H ARG A 36 -91.336 -1.491 -31.039 1.00 0.00 H new ATOM 0 HA ARG A 36 -91.693 0.483 -33.009 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -90.465 2.354 -31.937 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -91.932 2.008 -31.043 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -90.604 0.631 -29.433 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -89.143 1.031 -30.314 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -89.559 3.456 -29.841 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -90.964 3.007 -28.895 1.00 0.00 H new ATOM 0 HE ARG A 36 -88.631 1.544 -28.006 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -90.276 4.668 -27.801 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -89.476 5.109 -26.289 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -87.620 2.114 -26.087 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -87.976 3.665 -25.320 1.00 0.00 H new ATOM 209 N LEU A 37 -88.989 0.612 -33.148 1.00 0.00 N ATOM 210 CA LEU A 37 -87.619 0.300 -33.501 1.00 0.00 C ATOM 211 C LEU A 37 -86.661 1.192 -32.719 1.00 0.00 C ATOM 212 O LEU A 37 -86.909 2.391 -32.560 1.00 0.00 O ATOM 213 CB LEU A 37 -87.430 0.502 -34.999 1.00 0.00 C ATOM 214 CG LEU A 37 -88.435 -0.258 -35.858 1.00 0.00 C ATOM 215 CD1 LEU A 37 -88.347 0.191 -37.301 1.00 0.00 C ATOM 216 CD2 LEU A 37 -88.192 -1.752 -35.744 1.00 0.00 C ATOM 0 H LEU A 37 -89.307 1.522 -33.481 1.00 0.00 H new ATOM 0 HA LEU A 37 -87.404 -0.738 -33.249 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -87.506 1.566 -35.224 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -86.423 0.189 -35.273 1.00 0.00 H new ATOM 0 HG LEU A 37 -89.440 -0.041 -35.497 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -89.071 -0.362 -37.899 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -88.563 1.257 -37.364 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -87.343 0.001 -37.680 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -88.915 -2.286 -36.361 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -87.183 -1.983 -36.084 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -88.304 -2.061 -34.705 1.00 0.00 H new ATOM 228 N THR A 38 -85.586 0.608 -32.219 1.00 0.00 N ATOM 229 CA THR A 38 -84.596 1.361 -31.465 1.00 0.00 C ATOM 230 C THR A 38 -83.189 1.050 -31.953 1.00 0.00 C ATOM 231 O THR A 38 -83.010 0.308 -32.926 1.00 0.00 O ATOM 232 CB THR A 38 -84.690 1.084 -29.951 1.00 0.00 C ATOM 233 OG1 THR A 38 -84.699 -0.328 -29.700 1.00 0.00 O ATOM 234 CG2 THR A 38 -85.933 1.728 -29.360 1.00 0.00 C ATOM 0 H THR A 38 -85.375 -0.385 -32.321 1.00 0.00 H new ATOM 0 HA THR A 38 -84.810 2.417 -31.632 1.00 0.00 H new ATOM 0 HB THR A 38 -83.814 1.521 -29.472 1.00 0.00 H new ATOM 0 HG1 THR A 38 -84.722 -0.488 -28.733 1.00 0.00 H new ATOM 0 HG21 THR A 38 -85.978 1.519 -28.291 1.00 0.00 H new ATOM 0 HG22 THR A 38 -85.894 2.806 -29.518 1.00 0.00 H new ATOM 0 HG23 THR A 38 -86.820 1.322 -29.847 1.00 0.00 H new ATOM 242 N ARG A 39 -82.196 1.632 -31.272 1.00 0.00 N ATOM 243 CA ARG A 39 -80.786 1.478 -31.636 1.00 0.00 C ATOM 244 C ARG A 39 -80.538 2.089 -33.009 1.00 0.00 C ATOM 245 O ARG A 39 -79.558 1.769 -33.686 1.00 0.00 O ATOM 246 CB ARG A 39 -80.366 0.000 -31.622 1.00 0.00 C ATOM 247 CG ARG A 39 -80.790 -0.751 -30.368 1.00 0.00 C ATOM 248 CD ARG A 39 -80.308 -0.063 -29.103 1.00 0.00 C ATOM 249 NE ARG A 39 -80.831 -0.713 -27.902 1.00 0.00 N ATOM 250 CZ ARG A 39 -80.590 -0.296 -26.662 1.00 0.00 C ATOM 251 NH1 ARG A 39 -79.819 0.765 -26.450 1.00 0.00 N ATOM 252 NH2 ARG A 39 -81.114 -0.950 -25.632 1.00 0.00 N ATOM 0 H ARG A 39 -82.348 2.222 -30.454 1.00 0.00 H new ATOM 0 HA ARG A 39 -80.181 2.002 -30.896 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -80.793 -0.497 -32.493 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -79.282 -0.060 -31.720 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -81.877 -0.833 -30.345 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -80.394 -1.766 -30.402 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -79.218 -0.072 -29.076 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -80.618 0.982 -29.116 1.00 0.00 H new ATOM 0 HE ARG A 39 -81.418 -1.539 -28.023 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -79.409 1.264 -27.240 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -79.637 1.081 -25.497 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -81.699 -1.770 -25.793 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -80.931 -0.633 -24.680 1.00 0.00 H new ATOM 266 N SER A 40 -81.443 2.971 -33.404 1.00 0.00 N ATOM 267 CA SER A 40 -81.384 3.658 -34.682 1.00 0.00 C ATOM 268 C SER A 40 -82.215 4.935 -34.592 1.00 0.00 C ATOM 269 O SER A 40 -83.116 5.031 -33.756 1.00 0.00 O ATOM 270 CB SER A 40 -81.918 2.751 -35.801 1.00 0.00 C ATOM 271 OG SER A 40 -81.169 1.550 -35.890 1.00 0.00 O ATOM 0 H SER A 40 -82.250 3.232 -32.837 1.00 0.00 H new ATOM 0 HA SER A 40 -80.349 3.910 -34.916 1.00 0.00 H new ATOM 0 HB2 SER A 40 -82.966 2.516 -35.613 1.00 0.00 H new ATOM 0 HB3 SER A 40 -81.876 3.280 -36.753 1.00 0.00 H new ATOM 0 HG SER A 40 -80.443 1.568 -35.232 1.00 0.00 H new ATOM 277 N ASN A 41 -81.919 5.914 -35.437 1.00 0.00 N ATOM 278 CA ASN A 41 -82.649 7.183 -35.412 1.00 0.00 C ATOM 279 C ASN A 41 -83.853 7.131 -36.339 1.00 0.00 C ATOM 280 O ASN A 41 -84.459 8.157 -36.648 1.00 0.00 O ATOM 281 CB ASN A 41 -81.743 8.352 -35.813 1.00 0.00 C ATOM 282 CG ASN A 41 -80.758 8.745 -34.727 1.00 0.00 C ATOM 283 OD1 ASN A 41 -80.318 7.912 -33.935 1.00 0.00 O ATOM 284 ND2 ASN A 41 -80.409 10.023 -34.683 1.00 0.00 N ATOM 0 H ASN A 41 -81.186 5.859 -36.144 1.00 0.00 H new ATOM 0 HA ASN A 41 -82.992 7.342 -34.390 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -81.192 8.084 -36.714 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -82.362 9.214 -36.062 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -79.752 10.348 -33.974 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -80.797 10.681 -35.359 1.00 0.00 H new ATOM 291 N SER A 42 -84.201 5.933 -36.772 1.00 0.00 N ATOM 292 CA SER A 42 -85.311 5.742 -37.682 1.00 0.00 C ATOM 293 C SER A 42 -86.471 5.055 -36.979 1.00 0.00 C ATOM 294 O SER A 42 -86.340 3.938 -36.483 1.00 0.00 O ATOM 295 CB SER A 42 -84.854 4.928 -38.891 1.00 0.00 C ATOM 296 OG SER A 42 -83.689 5.492 -39.471 1.00 0.00 O ATOM 0 H SER A 42 -83.725 5.072 -36.504 1.00 0.00 H new ATOM 0 HA SER A 42 -85.657 6.717 -38.024 1.00 0.00 H new ATOM 0 HB2 SER A 42 -84.653 3.901 -38.587 1.00 0.00 H new ATOM 0 HB3 SER A 42 -85.652 4.891 -39.632 1.00 0.00 H new ATOM 0 HG SER A 42 -83.414 4.953 -40.242 1.00 0.00 H new ATOM 302 N LYS A 43 -87.607 5.734 -36.935 1.00 0.00 N ATOM 303 CA LYS A 43 -88.814 5.164 -36.352 1.00 0.00 C ATOM 304 C LYS A 43 -89.311 4.043 -37.246 1.00 0.00 C ATOM 305 O LYS A 43 -89.992 3.123 -36.803 1.00 0.00 O ATOM 306 CB LYS A 43 -89.906 6.228 -36.230 1.00 0.00 C ATOM 307 CG LYS A 43 -89.441 7.526 -35.596 1.00 0.00 C ATOM 308 CD LYS A 43 -90.534 8.583 -35.640 1.00 0.00 C ATOM 309 CE LYS A 43 -91.070 8.766 -37.051 1.00 0.00 C ATOM 310 NZ LYS A 43 -92.039 9.887 -37.135 1.00 0.00 N ATOM 0 H LYS A 43 -87.719 6.681 -37.296 1.00 0.00 H new ATOM 0 HA LYS A 43 -88.581 4.783 -35.358 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -90.301 6.443 -37.223 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -90.728 5.823 -35.640 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -89.149 7.344 -34.562 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -88.557 7.892 -36.117 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -91.348 8.295 -34.974 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -90.141 9.531 -35.272 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -90.240 8.952 -37.733 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -91.552 7.845 -37.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -92.834 9.614 -37.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -92.396 10.109 -36.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -91.567 10.724 -37.532 1.00 0.00 H new ATOM 324 N CYS A 44 -88.951 4.143 -38.518 1.00 0.00 N ATOM 325 CA CYS A 44 -89.401 3.199 -39.517 1.00 0.00 C ATOM 326 C CYS A 44 -88.255 2.290 -39.965 1.00 0.00 C ATOM 327 O CYS A 44 -88.376 1.594 -40.964 1.00 0.00 O ATOM 328 CB CYS A 44 -89.989 3.959 -40.713 1.00 0.00 C ATOM 329 SG CYS A 44 -90.603 5.619 -40.286 1.00 0.00 S ATOM 0 H CYS A 44 -88.343 4.878 -38.879 1.00 0.00 H new ATOM 0 HA CYS A 44 -90.174 2.566 -39.081 1.00 0.00 H new ATOM 0 HB2 CYS A 44 -89.226 4.050 -41.486 1.00 0.00 H new ATOM 0 HB3 CYS A 44 -90.806 3.376 -41.138 1.00 0.00 H new ATOM 334 N GLN A 45 -87.148 2.283 -39.213 1.00 0.00 N ATOM 335 CA GLN A 45 -86.029 1.375 -39.500 1.00 0.00 C ATOM 336 C GLN A 45 -85.165 1.167 -38.251 1.00 0.00 C ATOM 337 O GLN A 45 -84.672 2.130 -37.667 1.00 0.00 O ATOM 338 CB GLN A 45 -85.173 1.929 -40.644 1.00 0.00 C ATOM 339 CG GLN A 45 -83.997 1.042 -41.015 1.00 0.00 C ATOM 340 CD GLN A 45 -83.191 1.595 -42.174 1.00 0.00 C ATOM 341 OE1 GLN A 45 -83.466 1.296 -43.334 1.00 0.00 O ATOM 342 NE2 GLN A 45 -82.186 2.403 -41.870 1.00 0.00 N ATOM 0 H GLN A 45 -87.002 2.891 -38.407 1.00 0.00 H new ATOM 0 HA GLN A 45 -86.441 0.412 -39.801 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -85.803 2.067 -41.523 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -84.799 2.913 -40.362 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -83.347 0.926 -40.148 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -84.364 0.049 -41.274 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -81.989 2.628 -40.895 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -81.609 2.801 -42.611 1.00 0.00 H new ATOM 351 N GLY A 46 -84.963 -0.088 -37.856 1.00 0.00 N ATOM 352 CA GLY A 46 -84.218 -0.372 -36.638 1.00 0.00 C ATOM 353 C GLY A 46 -84.525 -1.754 -36.096 1.00 0.00 C ATOM 354 O GLY A 46 -85.271 -2.509 -36.717 1.00 0.00 O ATOM 0 H GLY A 46 -85.300 -0.911 -38.355 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -83.150 -0.290 -36.839 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -84.459 0.376 -35.883 1.00 0.00 H new ATOM 358 N GLN A 47 -83.909 -2.113 -34.971 1.00 0.00 N ATOM 359 CA GLN A 47 -84.229 -3.375 -34.302 1.00 0.00 C ATOM 360 C GLN A 47 -85.530 -3.244 -33.516 1.00 0.00 C ATOM 361 O GLN A 47 -85.881 -2.151 -33.071 1.00 0.00 O ATOM 362 CB GLN A 47 -83.097 -3.812 -33.370 1.00 0.00 C ATOM 363 CG GLN A 47 -82.053 -4.687 -34.045 1.00 0.00 C ATOM 364 CD GLN A 47 -82.657 -5.939 -34.652 1.00 0.00 C ATOM 365 OE1 GLN A 47 -83.673 -6.447 -34.178 1.00 0.00 O ATOM 366 NE2 GLN A 47 -82.026 -6.457 -35.692 1.00 0.00 N ATOM 0 H GLN A 47 -83.192 -1.555 -34.507 1.00 0.00 H new ATOM 0 HA GLN A 47 -84.351 -4.138 -35.071 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -82.609 -2.925 -32.966 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -83.522 -4.355 -32.526 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -81.551 -4.114 -34.824 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -81.293 -4.969 -33.317 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -81.187 -6.006 -36.056 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -82.379 -7.308 -36.131 1.00 0.00 H new ATOM 375 N LEU A 48 -86.235 -4.356 -33.332 1.00 0.00 N ATOM 376 CA LEU A 48 -87.564 -4.316 -32.733 1.00 0.00 C ATOM 377 C LEU A 48 -87.504 -4.318 -31.208 1.00 0.00 C ATOM 378 O LEU A 48 -87.021 -5.265 -30.584 1.00 0.00 O ATOM 379 CB LEU A 48 -88.422 -5.483 -33.231 1.00 0.00 C ATOM 380 CG LEU A 48 -89.887 -5.446 -32.775 1.00 0.00 C ATOM 381 CD1 LEU A 48 -90.568 -4.172 -33.256 1.00 0.00 C ATOM 382 CD2 LEU A 48 -90.639 -6.673 -33.272 1.00 0.00 C ATOM 0 H LEU A 48 -85.911 -5.289 -33.587 1.00 0.00 H new ATOM 0 HA LEU A 48 -88.026 -3.380 -33.045 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -88.396 -5.496 -34.321 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -87.974 -6.416 -32.890 1.00 0.00 H new ATOM 0 HG LEU A 48 -89.902 -5.454 -31.685 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -91.606 -4.166 -32.922 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -90.050 -3.305 -32.846 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -90.537 -4.132 -34.345 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -91.675 -6.625 -32.937 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -90.611 -6.700 -34.361 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -90.170 -7.573 -32.874 1.00 0.00 H new ATOM 394 N GLU A 49 -88.003 -3.241 -30.626 1.00 0.00 N ATOM 395 CA GLU A 49 -88.118 -3.114 -29.184 1.00 0.00 C ATOM 396 C GLU A 49 -89.591 -2.984 -28.817 1.00 0.00 C ATOM 397 O GLU A 49 -90.250 -2.015 -29.199 1.00 0.00 O ATOM 398 CB GLU A 49 -87.335 -1.891 -28.703 1.00 0.00 C ATOM 399 CG GLU A 49 -87.331 -1.711 -27.196 1.00 0.00 C ATOM 400 CD GLU A 49 -86.477 -0.538 -26.753 1.00 0.00 C ATOM 401 OE1 GLU A 49 -85.238 -0.693 -26.690 1.00 0.00 O ATOM 402 OE2 GLU A 49 -87.038 0.544 -26.467 1.00 0.00 O ATOM 0 H GLU A 49 -88.341 -2.428 -31.142 1.00 0.00 H new ATOM 0 HA GLU A 49 -87.702 -3.997 -28.699 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -86.305 -1.972 -29.051 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -87.758 -0.998 -29.164 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -88.353 -1.564 -26.848 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -86.963 -2.623 -26.725 1.00 0.00 H new ATOM 409 N VAL A 50 -90.113 -3.972 -28.105 1.00 0.00 N ATOM 410 CA VAL A 50 -91.536 -4.006 -27.793 1.00 0.00 C ATOM 411 C VAL A 50 -91.756 -3.972 -26.286 1.00 0.00 C ATOM 412 O VAL A 50 -91.042 -4.629 -25.533 1.00 0.00 O ATOM 413 CB VAL A 50 -92.217 -5.265 -28.371 1.00 0.00 C ATOM 414 CG1 VAL A 50 -93.705 -5.041 -28.497 1.00 0.00 C ATOM 415 CG2 VAL A 50 -91.618 -5.652 -29.713 1.00 0.00 C ATOM 0 H VAL A 50 -89.577 -4.757 -27.734 1.00 0.00 H new ATOM 0 HA VAL A 50 -91.984 -3.124 -28.252 1.00 0.00 H new ATOM 0 HB VAL A 50 -92.042 -6.091 -27.682 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -94.174 -5.936 -28.906 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -94.125 -4.827 -27.514 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -93.891 -4.198 -29.162 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -92.120 -6.542 -30.092 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -91.749 -4.833 -30.420 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -90.555 -5.859 -29.591 1.00 0.00 H new ATOM 425 N TYR A 51 -92.747 -3.213 -25.846 1.00 0.00 N ATOM 426 CA TYR A 51 -93.008 -3.059 -24.425 1.00 0.00 C ATOM 427 C TYR A 51 -94.106 -4.008 -23.968 1.00 0.00 C ATOM 428 O TYR A 51 -95.293 -3.740 -24.155 1.00 0.00 O ATOM 429 CB TYR A 51 -93.397 -1.615 -24.102 1.00 0.00 C ATOM 430 CG TYR A 51 -93.634 -1.354 -22.631 1.00 0.00 C ATOM 431 CD1 TYR A 51 -92.571 -1.279 -21.740 1.00 0.00 C ATOM 432 CD2 TYR A 51 -94.919 -1.178 -22.136 1.00 0.00 C ATOM 433 CE1 TYR A 51 -92.783 -1.036 -20.398 1.00 0.00 C ATOM 434 CE2 TYR A 51 -95.138 -0.936 -20.796 1.00 0.00 C ATOM 435 CZ TYR A 51 -94.067 -0.866 -19.931 1.00 0.00 C ATOM 436 OH TYR A 51 -94.283 -0.621 -18.595 1.00 0.00 O ATOM 0 H TYR A 51 -93.383 -2.695 -26.452 1.00 0.00 H new ATOM 0 HA TYR A 51 -92.092 -3.305 -23.888 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -92.609 -0.950 -24.456 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -94.301 -1.361 -24.655 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -91.563 -1.413 -22.103 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -95.760 -1.231 -22.811 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -91.946 -0.979 -19.718 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -96.144 -0.802 -20.426 1.00 0.00 H new ATOM 0 HH TYR A 51 -95.244 -0.525 -18.431 1.00 0.00 H new ATOM 446 N LEU A 52 -93.703 -5.123 -23.382 1.00 0.00 N ATOM 447 CA LEU A 52 -94.652 -6.074 -22.831 1.00 0.00 C ATOM 448 C LEU A 52 -94.613 -6.069 -21.328 1.00 0.00 C ATOM 449 O LEU A 52 -93.776 -6.748 -20.739 1.00 0.00 O ATOM 450 CB LEU A 52 -94.409 -7.500 -23.324 1.00 0.00 C ATOM 451 CG LEU A 52 -92.954 -7.970 -23.394 1.00 0.00 C ATOM 452 CD1 LEU A 52 -92.880 -9.476 -23.202 1.00 0.00 C ATOM 453 CD2 LEU A 52 -92.332 -7.590 -24.729 1.00 0.00 C ATOM 0 H LEU A 52 -92.725 -5.391 -23.276 1.00 0.00 H new ATOM 0 HA LEU A 52 -95.633 -5.752 -23.179 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -94.955 -8.182 -22.672 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -94.844 -7.594 -24.319 1.00 0.00 H new ATOM 0 HG LEU A 52 -92.397 -7.479 -22.596 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -91.840 -9.799 -23.254 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -93.294 -9.739 -22.229 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -93.453 -9.971 -23.986 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -91.298 -7.933 -24.759 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -92.893 -8.058 -25.538 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -92.359 -6.507 -24.848 1.00 0.00 H new ATOM 465 N LYS A 53 -95.499 -5.268 -20.735 1.00 0.00 N ATOM 466 CA LYS A 53 -95.757 -5.265 -19.290 1.00 0.00 C ATOM 467 C LYS A 53 -94.534 -4.884 -18.458 1.00 0.00 C ATOM 468 O LYS A 53 -94.543 -3.875 -17.754 1.00 0.00 O ATOM 469 CB LYS A 53 -96.287 -6.631 -18.837 1.00 0.00 C ATOM 470 CG LYS A 53 -97.597 -7.034 -19.502 1.00 0.00 C ATOM 471 CD LYS A 53 -98.050 -8.416 -19.053 1.00 0.00 C ATOM 472 CE LYS A 53 -98.436 -8.436 -17.583 1.00 0.00 C ATOM 473 NZ LYS A 53 -99.681 -7.665 -17.319 1.00 0.00 N ATOM 0 H LYS A 53 -96.066 -4.594 -21.249 1.00 0.00 H new ATOM 0 HA LYS A 53 -96.511 -4.497 -19.118 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -95.534 -7.391 -19.049 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -96.429 -6.615 -17.756 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -98.368 -6.302 -19.262 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -97.474 -7.025 -20.585 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -98.901 -8.733 -19.656 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -97.250 -9.135 -19.228 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -98.574 -9.468 -17.259 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -97.621 -8.022 -16.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -99.990 -7.830 -16.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -99.497 -6.651 -17.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -100.427 -7.975 -17.974 1.00 0.00 H new ATOM 487 N ASP A 54 -93.485 -5.680 -18.551 1.00 0.00 N ATOM 488 CA ASP A 54 -92.352 -5.556 -17.643 1.00 0.00 C ATOM 489 C ASP A 54 -91.132 -4.988 -18.348 1.00 0.00 C ATOM 490 O ASP A 54 -90.271 -4.375 -17.712 1.00 0.00 O ATOM 491 CB ASP A 54 -91.995 -6.919 -17.030 1.00 0.00 C ATOM 492 CG ASP A 54 -91.117 -7.766 -17.937 1.00 0.00 C ATOM 493 OD1 ASP A 54 -91.597 -8.213 -18.996 1.00 0.00 O ATOM 494 OD2 ASP A 54 -89.935 -7.981 -17.602 1.00 0.00 O ATOM 0 H ASP A 54 -93.391 -6.421 -19.246 1.00 0.00 H new ATOM 0 HA ASP A 54 -92.649 -4.868 -16.851 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -91.482 -6.761 -16.081 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -92.913 -7.464 -16.810 1.00 0.00 H new ATOM 499 N GLY A 55 -91.053 -5.173 -19.656 1.00 0.00 N ATOM 500 CA GLY A 55 -89.834 -4.821 -20.355 1.00 0.00 C ATOM 501 C GLY A 55 -90.049 -4.250 -21.726 1.00 0.00 C ATOM 502 O GLY A 55 -90.920 -4.707 -22.468 1.00 0.00 O ATOM 0 H GLY A 55 -91.798 -5.554 -20.239 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -89.282 -4.097 -19.756 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -89.208 -5.709 -20.439 1.00 0.00 H new ATOM 506 N TRP A 56 -89.252 -3.239 -22.054 1.00 0.00 N ATOM 507 CA TRP A 56 -89.036 -2.867 -23.437 1.00 0.00 C ATOM 508 C TRP A 56 -88.133 -3.925 -24.043 1.00 0.00 C ATOM 509 O TRP A 56 -86.957 -3.683 -24.321 1.00 0.00 O ATOM 510 CB TRP A 56 -88.386 -1.483 -23.566 1.00 0.00 C ATOM 511 CG TRP A 56 -89.364 -0.347 -23.622 1.00 0.00 C ATOM 512 CD1 TRP A 56 -89.603 0.587 -22.654 1.00 0.00 C ATOM 513 CD2 TRP A 56 -90.224 -0.017 -24.717 1.00 0.00 C ATOM 514 NE1 TRP A 56 -90.563 1.473 -23.080 1.00 0.00 N ATOM 515 CE2 TRP A 56 -90.961 1.123 -24.343 1.00 0.00 C ATOM 516 CE3 TRP A 56 -90.443 -0.576 -25.979 1.00 0.00 C ATOM 517 CZ2 TRP A 56 -91.899 1.711 -25.187 1.00 0.00 C ATOM 518 CZ3 TRP A 56 -91.376 0.007 -26.813 1.00 0.00 C ATOM 519 CH2 TRP A 56 -92.094 1.141 -26.415 1.00 0.00 C ATOM 0 H TRP A 56 -88.748 -2.666 -21.378 1.00 0.00 H new ATOM 0 HA TRP A 56 -89.993 -2.810 -23.956 1.00 0.00 H new ATOM 0 HB2 TRP A 56 -87.715 -1.329 -22.721 1.00 0.00 H new ATOM 0 HB3 TRP A 56 -87.773 -1.465 -24.467 1.00 0.00 H new ATOM 0 HD1 TRP A 56 -89.109 0.624 -21.694 1.00 0.00 H new ATOM 0 HE1 TRP A 56 -90.921 2.263 -22.543 1.00 0.00 H new ATOM 0 HE3 TRP A 56 -89.892 -1.449 -26.296 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -92.453 2.587 -24.883 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -91.555 -0.419 -27.789 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -92.816 1.574 -27.091 1.00 0.00 H new ATOM 530 N HIS A 57 -88.686 -5.116 -24.182 1.00 0.00 N ATOM 531 CA HIS A 57 -87.912 -6.279 -24.543 1.00 0.00 C ATOM 532 C HIS A 57 -87.485 -6.202 -26.001 1.00 0.00 C ATOM 533 O HIS A 57 -88.318 -6.305 -26.903 1.00 0.00 O ATOM 534 CB HIS A 57 -88.708 -7.569 -24.293 1.00 0.00 C ATOM 535 CG HIS A 57 -88.841 -7.929 -22.840 1.00 0.00 C ATOM 536 ND1 HIS A 57 -87.772 -8.284 -22.046 1.00 0.00 N ATOM 537 CD2 HIS A 57 -89.929 -7.976 -22.036 1.00 0.00 C ATOM 538 CE1 HIS A 57 -88.198 -8.538 -20.821 1.00 0.00 C ATOM 539 NE2 HIS A 57 -89.503 -8.356 -20.790 1.00 0.00 N ATOM 0 H HIS A 57 -89.680 -5.299 -24.047 1.00 0.00 H new ATOM 0 HA HIS A 57 -87.021 -6.299 -23.915 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -89.704 -7.459 -24.723 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -88.223 -8.392 -24.818 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -90.946 -7.755 -22.324 1.00 0.00 H new ATOM 0 HE1 HIS A 57 -87.582 -8.843 -19.988 1.00 0.00 H new ATOM 0 HE2 HIS A 57 -90.099 -8.478 -19.971 1.00 0.00 H new ATOM 548 N MET A 58 -86.200 -5.978 -26.223 1.00 0.00 N ATOM 549 CA MET A 58 -85.654 -5.994 -27.569 1.00 0.00 C ATOM 550 C MET A 58 -85.677 -7.410 -28.102 1.00 0.00 C ATOM 551 O MET A 58 -85.003 -8.285 -27.566 1.00 0.00 O ATOM 552 CB MET A 58 -84.217 -5.475 -27.585 1.00 0.00 C ATOM 553 CG MET A 58 -84.087 -3.999 -27.271 1.00 0.00 C ATOM 554 SD MET A 58 -82.378 -3.425 -27.362 1.00 0.00 S ATOM 555 CE MET A 58 -81.944 -3.933 -29.026 1.00 0.00 C ATOM 0 H MET A 58 -85.518 -5.783 -25.490 1.00 0.00 H new ATOM 0 HA MET A 58 -86.265 -5.344 -28.196 1.00 0.00 H new ATOM 0 HB2 MET A 58 -83.630 -6.042 -26.863 1.00 0.00 H new ATOM 0 HB3 MET A 58 -83.785 -5.666 -28.567 1.00 0.00 H new ATOM 0 HG2 MET A 58 -84.698 -3.426 -27.969 1.00 0.00 H new ATOM 0 HG3 MET A 58 -84.480 -3.807 -26.272 1.00 0.00 H new ATOM 0 HE1 MET A 58 -80.952 -3.556 -29.274 1.00 0.00 H new ATOM 0 HE2 MET A 58 -81.944 -5.021 -29.086 1.00 0.00 H new ATOM 0 HE3 MET A 58 -82.672 -3.531 -29.731 1.00 0.00 H new ATOM 565 N VAL A 59 -86.455 -7.641 -29.137 1.00 0.00 N ATOM 566 CA VAL A 59 -86.572 -8.977 -29.692 1.00 0.00 C ATOM 567 C VAL A 59 -85.742 -9.078 -30.960 1.00 0.00 C ATOM 568 O VAL A 59 -85.508 -8.074 -31.628 1.00 0.00 O ATOM 569 CB VAL A 59 -88.040 -9.347 -29.996 1.00 0.00 C ATOM 570 CG1 VAL A 59 -88.915 -9.116 -28.775 1.00 0.00 C ATOM 571 CG2 VAL A 59 -88.566 -8.563 -31.186 1.00 0.00 C ATOM 0 H VAL A 59 -87.013 -6.930 -29.610 1.00 0.00 H new ATOM 0 HA VAL A 59 -86.201 -9.681 -28.948 1.00 0.00 H new ATOM 0 HB VAL A 59 -88.073 -10.407 -30.249 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -89.945 -9.383 -29.010 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -88.559 -9.734 -27.950 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -88.869 -8.066 -28.488 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -89.602 -8.844 -31.377 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -88.513 -7.496 -30.971 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -87.961 -8.786 -32.065 1.00 0.00 H new ATOM 581 N CYS A 60 -85.294 -10.273 -31.299 1.00 0.00 N ATOM 582 CA CYS A 60 -84.471 -10.437 -32.484 1.00 0.00 C ATOM 583 C CYS A 60 -85.305 -10.732 -33.732 1.00 0.00 C ATOM 584 O CYS A 60 -84.850 -11.435 -34.638 1.00 0.00 O ATOM 585 CB CYS A 60 -83.394 -11.502 -32.272 1.00 0.00 C ATOM 586 SG CYS A 60 -83.782 -12.857 -31.151 1.00 0.00 S ATOM 0 H CYS A 60 -85.482 -11.131 -30.781 1.00 0.00 H new ATOM 0 HA CYS A 60 -83.970 -9.484 -32.655 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -83.146 -11.929 -33.244 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -82.497 -11.005 -31.903 1.00 0.00 H new ATOM 591 N SER A 61 -86.517 -10.162 -33.771 1.00 0.00 N ATOM 592 CA SER A 61 -87.412 -10.222 -34.939 1.00 0.00 C ATOM 593 C SER A 61 -87.971 -11.631 -35.193 1.00 0.00 C ATOM 594 O SER A 61 -89.181 -11.805 -35.315 1.00 0.00 O ATOM 595 CB SER A 61 -86.694 -9.698 -36.185 1.00 0.00 C ATOM 596 OG SER A 61 -86.251 -8.364 -35.988 1.00 0.00 O ATOM 0 H SER A 61 -86.909 -9.641 -32.987 1.00 0.00 H new ATOM 0 HA SER A 61 -88.266 -9.583 -34.716 1.00 0.00 H new ATOM 0 HB2 SER A 61 -85.843 -10.338 -36.416 1.00 0.00 H new ATOM 0 HB3 SER A 61 -87.366 -9.740 -37.042 1.00 0.00 H new ATOM 0 HG SER A 61 -85.337 -8.269 -36.329 1.00 0.00 H new ATOM 602 N GLN A 62 -87.093 -12.631 -35.257 1.00 0.00 N ATOM 603 CA GLN A 62 -87.500 -14.005 -35.555 1.00 0.00 C ATOM 604 C GLN A 62 -88.117 -14.686 -34.341 1.00 0.00 C ATOM 605 O GLN A 62 -88.488 -15.858 -34.394 1.00 0.00 O ATOM 606 CB GLN A 62 -86.306 -14.820 -36.076 1.00 0.00 C ATOM 607 CG GLN A 62 -85.057 -14.780 -35.193 1.00 0.00 C ATOM 608 CD GLN A 62 -85.215 -15.513 -33.872 1.00 0.00 C ATOM 609 OE1 GLN A 62 -85.584 -14.922 -32.858 1.00 0.00 O ATOM 610 NE2 GLN A 62 -84.928 -16.804 -33.874 1.00 0.00 N ATOM 0 H GLN A 62 -86.091 -12.515 -35.106 1.00 0.00 H new ATOM 0 HA GLN A 62 -88.263 -13.959 -36.332 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -86.617 -15.858 -36.191 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -86.042 -14.455 -37.068 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -84.222 -15.215 -35.742 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -84.799 -13.740 -34.992 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -84.625 -17.258 -34.736 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -85.010 -17.346 -33.014 1.00 0.00 H new ATOM 619 N SER A 63 -88.201 -13.948 -33.246 1.00 0.00 N ATOM 620 CA SER A 63 -88.745 -14.470 -32.009 1.00 0.00 C ATOM 621 C SER A 63 -90.209 -14.873 -32.199 1.00 0.00 C ATOM 622 O SER A 63 -90.881 -14.350 -33.094 1.00 0.00 O ATOM 623 CB SER A 63 -88.611 -13.412 -30.921 1.00 0.00 C ATOM 624 OG SER A 63 -87.256 -13.012 -30.777 1.00 0.00 O ATOM 0 H SER A 63 -87.895 -12.976 -33.192 1.00 0.00 H new ATOM 0 HA SER A 63 -88.190 -15.360 -31.712 1.00 0.00 H new ATOM 0 HB2 SER A 63 -89.227 -12.547 -31.169 1.00 0.00 H new ATOM 0 HB3 SER A 63 -88.982 -13.806 -29.975 1.00 0.00 H new ATOM 0 HG SER A 63 -86.678 -13.628 -31.275 1.00 0.00 H new ATOM 630 N TRP A 64 -90.689 -15.799 -31.362 1.00 0.00 N ATOM 631 CA TRP A 64 -92.040 -16.360 -31.476 1.00 0.00 C ATOM 632 C TRP A 64 -92.113 -17.336 -32.649 1.00 0.00 C ATOM 633 O TRP A 64 -92.418 -18.513 -32.465 1.00 0.00 O ATOM 634 CB TRP A 64 -93.112 -15.265 -31.608 1.00 0.00 C ATOM 635 CG TRP A 64 -93.289 -14.457 -30.360 1.00 0.00 C ATOM 636 CD1 TRP A 64 -94.051 -14.789 -29.282 1.00 0.00 C ATOM 637 CD2 TRP A 64 -92.694 -13.187 -30.057 1.00 0.00 C ATOM 638 NE1 TRP A 64 -93.963 -13.813 -28.323 1.00 0.00 N ATOM 639 CE2 TRP A 64 -93.136 -12.818 -28.774 1.00 0.00 C ATOM 640 CE3 TRP A 64 -91.826 -12.330 -30.740 1.00 0.00 C ATOM 641 CZ2 TRP A 64 -92.738 -11.632 -28.163 1.00 0.00 C ATOM 642 CZ3 TRP A 64 -91.432 -11.154 -30.133 1.00 0.00 C ATOM 643 CH2 TRP A 64 -91.886 -10.813 -28.855 1.00 0.00 C ATOM 0 H TRP A 64 -90.151 -16.182 -30.585 1.00 0.00 H new ATOM 0 HA TRP A 64 -92.249 -16.901 -30.553 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -92.843 -14.600 -32.428 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -94.063 -15.727 -31.871 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -94.639 -15.690 -29.195 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -94.437 -13.826 -27.420 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -91.469 -12.584 -31.727 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -93.089 -11.367 -27.177 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -90.762 -10.486 -30.654 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -91.559 -9.887 -28.406 1.00 0.00 H new ATOM 654 N GLY A 65 -91.814 -16.848 -33.844 1.00 0.00 N ATOM 655 CA GLY A 65 -91.773 -17.703 -35.011 1.00 0.00 C ATOM 656 C GLY A 65 -90.459 -18.456 -35.114 1.00 0.00 C ATOM 657 O GLY A 65 -90.019 -19.091 -34.150 1.00 0.00 O ATOM 0 H GLY A 65 -91.598 -15.868 -34.026 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -92.597 -18.415 -34.969 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -91.918 -17.101 -35.908 1.00 0.00 H new ATOM 661 N ARG A 66 -89.832 -18.390 -36.281 1.00 0.00 N ATOM 662 CA ARG A 66 -88.554 -19.050 -36.511 1.00 0.00 C ATOM 663 C ARG A 66 -87.656 -18.179 -37.378 1.00 0.00 C ATOM 664 O ARG A 66 -88.126 -17.246 -38.033 1.00 0.00 O ATOM 665 CB ARG A 66 -88.765 -20.418 -37.170 1.00 0.00 C ATOM 666 CG ARG A 66 -89.460 -21.422 -36.264 1.00 0.00 C ATOM 667 CD ARG A 66 -89.718 -22.740 -36.967 1.00 0.00 C ATOM 668 NE ARG A 66 -90.342 -23.713 -36.071 1.00 0.00 N ATOM 669 CZ ARG A 66 -91.009 -24.789 -36.485 1.00 0.00 C ATOM 670 NH1 ARG A 66 -91.136 -25.040 -37.781 1.00 0.00 N ATOM 671 NH2 ARG A 66 -91.551 -25.616 -35.601 1.00 0.00 N ATOM 0 H ARG A 66 -90.191 -17.882 -37.089 1.00 0.00 H new ATOM 0 HA ARG A 66 -88.067 -19.202 -35.548 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -89.355 -20.289 -38.078 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -87.798 -20.821 -37.473 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -88.847 -21.597 -35.380 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -90.406 -21.004 -35.919 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -90.363 -22.573 -37.830 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -88.778 -23.142 -37.344 1.00 0.00 H new ATOM 0 HE ARG A 66 -90.261 -23.558 -35.066 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -90.722 -24.408 -38.466 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -91.648 -25.865 -38.093 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -91.457 -25.428 -34.603 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -92.062 -26.440 -35.919 1.00 0.00 H new ATOM 685 N SER A 67 -86.364 -18.483 -37.377 1.00 0.00 N ATOM 686 CA SER A 67 -85.394 -17.714 -38.137 1.00 0.00 C ATOM 687 C SER A 67 -85.530 -17.991 -39.635 1.00 0.00 C ATOM 688 O SER A 67 -85.161 -19.063 -40.117 1.00 0.00 O ATOM 689 CB SER A 67 -83.980 -18.047 -37.654 1.00 0.00 C ATOM 690 OG SER A 67 -83.865 -17.842 -36.253 1.00 0.00 O ATOM 0 H SER A 67 -85.965 -19.262 -36.854 1.00 0.00 H new ATOM 0 HA SER A 67 -85.585 -16.653 -37.976 1.00 0.00 H new ATOM 0 HB2 SER A 67 -83.743 -19.083 -37.895 1.00 0.00 H new ATOM 0 HB3 SER A 67 -83.255 -17.424 -38.178 1.00 0.00 H new ATOM 0 HG SER A 67 -84.034 -18.686 -35.784 1.00 0.00 H new ATOM 696 N SER A 68 -86.083 -17.029 -40.356 1.00 0.00 N ATOM 697 CA SER A 68 -86.235 -17.141 -41.797 1.00 0.00 C ATOM 698 C SER A 68 -85.366 -16.088 -42.483 1.00 0.00 C ATOM 699 O SER A 68 -84.883 -15.155 -41.835 1.00 0.00 O ATOM 700 CB SER A 68 -87.711 -16.966 -42.182 1.00 0.00 C ATOM 701 OG SER A 68 -87.948 -17.329 -43.534 1.00 0.00 O ATOM 0 H SER A 68 -86.436 -16.156 -39.963 1.00 0.00 H new ATOM 0 HA SER A 68 -85.912 -18.129 -42.125 1.00 0.00 H new ATOM 0 HB2 SER A 68 -88.333 -17.576 -41.527 1.00 0.00 H new ATOM 0 HB3 SER A 68 -88.007 -15.929 -42.027 1.00 0.00 H new ATOM 0 HG SER A 68 -88.724 -17.926 -43.581 1.00 0.00 H new ATOM 707 N LYS A 69 -85.150 -16.242 -43.781 1.00 0.00 N ATOM 708 CA LYS A 69 -84.343 -15.294 -44.528 1.00 0.00 C ATOM 709 C LYS A 69 -85.218 -14.216 -45.157 1.00 0.00 C ATOM 710 O LYS A 69 -86.015 -14.491 -46.055 1.00 0.00 O ATOM 711 CB LYS A 69 -83.527 -16.001 -45.614 1.00 0.00 C ATOM 712 CG LYS A 69 -82.566 -15.073 -46.345 1.00 0.00 C ATOM 713 CD LYS A 69 -81.855 -15.788 -47.481 1.00 0.00 C ATOM 714 CE LYS A 69 -80.861 -14.879 -48.188 1.00 0.00 C ATOM 715 NZ LYS A 69 -79.729 -14.490 -47.305 1.00 0.00 N ATOM 0 H LYS A 69 -85.522 -17.013 -44.336 1.00 0.00 H new ATOM 0 HA LYS A 69 -83.654 -14.824 -43.827 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -82.961 -16.815 -45.161 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -84.209 -16.450 -46.337 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -83.114 -14.217 -46.739 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -81.830 -14.683 -45.642 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -81.334 -16.662 -47.090 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -82.591 -16.150 -48.199 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -80.473 -15.386 -49.072 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -81.374 -13.982 -48.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -78.988 -14.031 -47.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -80.068 -13.829 -46.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -79.338 -15.338 -46.847 1.00 0.00 H new ATOM 729 N GLN A 70 -85.065 -12.993 -44.661 1.00 0.00 N ATOM 730 CA GLN A 70 -85.741 -11.824 -45.215 1.00 0.00 C ATOM 731 C GLN A 70 -87.261 -11.906 -45.041 1.00 0.00 C ATOM 732 O GLN A 70 -87.759 -12.001 -43.915 1.00 0.00 O ATOM 733 CB GLN A 70 -85.371 -11.637 -46.693 1.00 0.00 C ATOM 734 CG GLN A 70 -83.895 -11.350 -46.917 1.00 0.00 C ATOM 735 CD GLN A 70 -83.537 -11.209 -48.384 1.00 0.00 C ATOM 736 OE1 GLN A 70 -82.621 -10.468 -48.741 1.00 0.00 O ATOM 737 NE2 GLN A 70 -84.242 -11.927 -49.242 1.00 0.00 N ATOM 0 H GLN A 70 -84.467 -12.783 -43.861 1.00 0.00 H new ATOM 0 HA GLN A 70 -85.399 -10.953 -44.656 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -85.646 -12.536 -47.245 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -85.959 -10.817 -47.106 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -83.625 -10.434 -46.393 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -83.303 -12.154 -46.479 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -84.994 -12.529 -48.906 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -84.034 -11.878 -50.239 1.00 0.00 H new ATOM 746 N TRP A 71 -87.989 -11.890 -46.149 1.00 0.00 N ATOM 747 CA TRP A 71 -89.434 -11.746 -46.106 1.00 0.00 C ATOM 748 C TRP A 71 -90.139 -13.091 -45.998 1.00 0.00 C ATOM 749 O TRP A 71 -90.351 -13.775 -47.000 1.00 0.00 O ATOM 750 CB TRP A 71 -89.940 -11.006 -47.347 1.00 0.00 C ATOM 751 CG TRP A 71 -89.479 -9.581 -47.442 1.00 0.00 C ATOM 752 CD1 TRP A 71 -90.078 -8.493 -46.878 1.00 0.00 C ATOM 753 CD2 TRP A 71 -88.336 -9.087 -48.152 1.00 0.00 C ATOM 754 NE1 TRP A 71 -89.381 -7.355 -47.195 1.00 0.00 N ATOM 755 CE2 TRP A 71 -88.306 -7.691 -47.971 1.00 0.00 C ATOM 756 CE3 TRP A 71 -87.333 -9.686 -48.918 1.00 0.00 C ATOM 757 CZ2 TRP A 71 -87.317 -6.889 -48.531 1.00 0.00 C ATOM 758 CZ3 TRP A 71 -86.349 -8.888 -49.473 1.00 0.00 C ATOM 759 CH2 TRP A 71 -86.347 -7.502 -49.277 1.00 0.00 C ATOM 0 H TRP A 71 -87.601 -11.975 -47.088 1.00 0.00 H new ATOM 0 HA TRP A 71 -89.667 -11.166 -45.213 1.00 0.00 H new ATOM 0 HB2 TRP A 71 -89.611 -11.543 -48.236 1.00 0.00 H new ATOM 0 HB3 TRP A 71 -91.030 -11.025 -47.349 1.00 0.00 H new ATOM 0 HD1 TRP A 71 -90.971 -8.523 -46.271 1.00 0.00 H new ATOM 0 HE1 TRP A 71 -89.625 -6.410 -46.899 1.00 0.00 H new ATOM 0 HE3 TRP A 71 -87.326 -10.755 -49.074 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 -87.315 -5.819 -48.382 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 -85.570 -9.342 -50.067 1.00 0.00 H new ATOM 0 HH2 TRP A 71 -85.565 -6.905 -49.723 1.00 0.00 H new ATOM 770 N GLU A 72 -90.477 -13.477 -44.778 1.00 0.00 N ATOM 771 CA GLU A 72 -91.370 -14.605 -44.564 1.00 0.00 C ATOM 772 C GLU A 72 -92.802 -14.077 -44.557 1.00 0.00 C ATOM 773 O GLU A 72 -93.635 -14.485 -45.365 1.00 0.00 O ATOM 774 CB GLU A 72 -91.047 -15.313 -43.245 1.00 0.00 C ATOM 775 CG GLU A 72 -91.742 -16.658 -43.085 1.00 0.00 C ATOM 776 CD GLU A 72 -91.220 -17.706 -44.050 1.00 0.00 C ATOM 777 OE1 GLU A 72 -91.689 -17.748 -45.207 1.00 0.00 O ATOM 778 OE2 GLU A 72 -90.329 -18.489 -43.653 1.00 0.00 O ATOM 0 H GLU A 72 -90.148 -13.028 -43.923 1.00 0.00 H new ATOM 0 HA GLU A 72 -91.244 -15.337 -45.362 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -89.969 -15.461 -43.177 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -91.333 -14.666 -42.416 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -91.608 -17.012 -42.063 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -92.813 -16.529 -43.240 1.00 0.00 H new ATOM 785 N ASP A 73 -93.062 -13.157 -43.636 1.00 0.00 N ATOM 786 CA ASP A 73 -94.303 -12.390 -43.614 1.00 0.00 C ATOM 787 C ASP A 73 -94.054 -11.066 -42.903 1.00 0.00 C ATOM 788 O ASP A 73 -93.799 -11.035 -41.701 1.00 0.00 O ATOM 789 CB ASP A 73 -95.434 -13.147 -42.919 1.00 0.00 C ATOM 790 CG ASP A 73 -96.753 -12.406 -43.034 1.00 0.00 C ATOM 791 OD1 ASP A 73 -96.988 -11.461 -42.251 1.00 0.00 O ATOM 792 OD2 ASP A 73 -97.562 -12.758 -43.922 1.00 0.00 O ATOM 0 H ASP A 73 -92.417 -12.921 -42.882 1.00 0.00 H new ATOM 0 HA ASP A 73 -94.614 -12.217 -44.644 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -95.533 -14.139 -43.359 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -95.186 -13.289 -41.867 1.00 0.00 H new ATOM 797 N PRO A 74 -94.085 -9.959 -43.649 1.00 0.00 N ATOM 798 CA PRO A 74 -93.735 -8.636 -43.143 1.00 0.00 C ATOM 799 C PRO A 74 -94.937 -7.800 -42.683 1.00 0.00 C ATOM 800 O PRO A 74 -94.887 -6.570 -42.723 1.00 0.00 O ATOM 801 CB PRO A 74 -93.121 -8.026 -44.385 1.00 0.00 C ATOM 802 CG PRO A 74 -94.032 -8.489 -45.451 1.00 0.00 C ATOM 803 CD PRO A 74 -94.427 -9.896 -45.079 1.00 0.00 C ATOM 0 HA PRO A 74 -93.103 -8.678 -42.256 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -93.084 -6.938 -44.327 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -92.100 -8.372 -44.545 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -94.908 -7.844 -45.523 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -93.539 -8.466 -46.423 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -95.488 -10.078 -45.250 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -93.879 -10.638 -45.660 1.00 0.00 H new ATOM 811 N SER A 75 -96.013 -8.446 -42.243 1.00 0.00 N ATOM 812 CA SER A 75 -97.217 -7.712 -41.877 1.00 0.00 C ATOM 813 C SER A 75 -97.465 -7.767 -40.366 1.00 0.00 C ATOM 814 O SER A 75 -96.524 -7.687 -39.576 1.00 0.00 O ATOM 815 CB SER A 75 -98.421 -8.257 -42.657 1.00 0.00 C ATOM 816 OG SER A 75 -98.745 -9.584 -42.279 1.00 0.00 O ATOM 0 H SER A 75 -96.075 -9.458 -42.133 1.00 0.00 H new ATOM 0 HA SER A 75 -97.077 -6.664 -42.142 1.00 0.00 H new ATOM 0 HB2 SER A 75 -99.283 -7.612 -42.489 1.00 0.00 H new ATOM 0 HB3 SER A 75 -98.204 -8.227 -43.725 1.00 0.00 H new ATOM 0 HG SER A 75 -97.964 -10.162 -42.411 1.00 0.00 H new ATOM 822 N GLN A 76 -98.745 -7.867 -39.986 1.00 0.00 N ATOM 823 CA GLN A 76 -99.180 -7.973 -38.594 1.00 0.00 C ATOM 824 C GLN A 76 -99.068 -6.652 -37.824 1.00 0.00 C ATOM 825 O GLN A 76 -100.074 -6.118 -37.363 1.00 0.00 O ATOM 826 CB GLN A 76 -98.416 -9.078 -37.870 1.00 0.00 C ATOM 827 CG GLN A 76 -98.716 -10.476 -38.389 1.00 0.00 C ATOM 828 CD GLN A 76 -100.165 -10.883 -38.184 1.00 0.00 C ATOM 829 OE1 GLN A 76 -100.722 -11.651 -38.970 1.00 0.00 O ATOM 830 NE2 GLN A 76 -100.784 -10.373 -37.128 1.00 0.00 N ATOM 0 H GLN A 76 -99.518 -7.876 -40.651 1.00 0.00 H new ATOM 0 HA GLN A 76 -100.239 -8.228 -38.624 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -97.347 -8.888 -37.963 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -98.656 -9.036 -36.808 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -98.477 -10.523 -39.452 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -98.068 -11.192 -37.885 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -100.286 -9.740 -36.501 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -101.758 -10.613 -36.942 1.00 0.00 H new ATOM 839 N ALA A 77 -97.860 -6.123 -37.697 1.00 0.00 N ATOM 840 CA ALA A 77 -97.612 -4.946 -36.862 1.00 0.00 C ATOM 841 C ALA A 77 -97.941 -3.639 -37.587 1.00 0.00 C ATOM 842 O ALA A 77 -97.300 -2.610 -37.354 1.00 0.00 O ATOM 843 CB ALA A 77 -96.160 -4.941 -36.407 1.00 0.00 C ATOM 0 H ALA A 77 -97.029 -6.489 -38.162 1.00 0.00 H new ATOM 0 HA ALA A 77 -98.273 -5.008 -35.998 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -95.976 -4.065 -35.786 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -95.956 -5.844 -35.831 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -95.506 -4.911 -37.278 1.00 0.00 H new ATOM 849 N SER A 78 -98.961 -3.672 -38.435 1.00 0.00 N ATOM 850 CA SER A 78 -99.337 -2.512 -39.229 1.00 0.00 C ATOM 851 C SER A 78 -99.750 -1.347 -38.337 1.00 0.00 C ATOM 852 O SER A 78 -99.300 -0.219 -38.526 1.00 0.00 O ATOM 853 CB SER A 78 -100.464 -2.889 -40.188 1.00 0.00 C ATOM 854 OG SER A 78 -101.444 -3.674 -39.530 1.00 0.00 O ATOM 0 H SER A 78 -99.544 -4.494 -38.590 1.00 0.00 H new ATOM 0 HA SER A 78 -98.472 -2.190 -39.809 1.00 0.00 H new ATOM 0 HB2 SER A 78 -100.924 -1.986 -40.588 1.00 0.00 H new ATOM 0 HB3 SER A 78 -100.057 -3.442 -41.035 1.00 0.00 H new ATOM 0 HG SER A 78 -102.158 -3.903 -40.161 1.00 0.00 H new ATOM 860 N LYS A 79 -100.578 -1.638 -37.345 1.00 0.00 N ATOM 861 CA LYS A 79 -101.053 -0.629 -36.409 1.00 0.00 C ATOM 862 C LYS A 79 -99.886 0.019 -35.659 1.00 0.00 C ATOM 863 O LYS A 79 -99.949 1.190 -35.282 1.00 0.00 O ATOM 864 CB LYS A 79 -102.043 -1.265 -35.424 1.00 0.00 C ATOM 865 CG LYS A 79 -102.650 -0.293 -34.421 1.00 0.00 C ATOM 866 CD LYS A 79 -103.337 0.884 -35.106 1.00 0.00 C ATOM 867 CE LYS A 79 -104.437 0.438 -36.057 1.00 0.00 C ATOM 868 NZ LYS A 79 -105.529 -0.283 -35.360 1.00 0.00 N ATOM 0 H LYS A 79 -100.938 -2.575 -37.166 1.00 0.00 H new ATOM 0 HA LYS A 79 -101.561 0.156 -36.970 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -102.848 -1.733 -35.990 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -101.533 -2.059 -34.878 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -103.372 -0.820 -33.797 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -101.868 0.079 -33.759 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -103.760 1.545 -34.350 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -102.596 1.463 -35.657 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -104.848 1.309 -36.567 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -104.010 -0.208 -36.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -106.293 -0.492 -36.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -105.162 -1.173 -34.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -105.900 0.309 -34.590 1.00 0.00 H new ATOM 882 N VAL A 80 -98.812 -0.739 -35.476 1.00 0.00 N ATOM 883 CA VAL A 80 -97.653 -0.256 -34.745 1.00 0.00 C ATOM 884 C VAL A 80 -96.921 0.823 -35.543 1.00 0.00 C ATOM 885 O VAL A 80 -96.806 1.966 -35.103 1.00 0.00 O ATOM 886 CB VAL A 80 -96.685 -1.410 -34.404 1.00 0.00 C ATOM 887 CG1 VAL A 80 -95.508 -0.912 -33.584 1.00 0.00 C ATOM 888 CG2 VAL A 80 -97.416 -2.518 -33.661 1.00 0.00 C ATOM 0 H VAL A 80 -98.722 -1.693 -35.826 1.00 0.00 H new ATOM 0 HA VAL A 80 -98.010 0.178 -33.811 1.00 0.00 H new ATOM 0 HB VAL A 80 -96.300 -1.812 -35.341 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -94.843 -1.746 -33.358 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -94.964 -0.157 -34.151 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -95.871 -0.476 -32.654 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -96.718 -3.322 -33.429 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -97.833 -2.122 -32.735 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -98.221 -2.905 -34.285 1.00 0.00 H new ATOM 898 N CYS A 81 -96.454 0.480 -36.732 1.00 0.00 N ATOM 899 CA CYS A 81 -95.736 1.449 -37.552 1.00 0.00 C ATOM 900 C CYS A 81 -96.660 2.582 -37.981 1.00 0.00 C ATOM 901 O CYS A 81 -96.212 3.705 -38.190 1.00 0.00 O ATOM 902 CB CYS A 81 -95.094 0.771 -38.758 1.00 0.00 C ATOM 903 SG CYS A 81 -93.823 -0.439 -38.288 1.00 0.00 S ATOM 0 H CYS A 81 -96.555 -0.446 -37.148 1.00 0.00 H new ATOM 0 HA CYS A 81 -94.936 1.880 -36.950 1.00 0.00 H new ATOM 0 HB2 CYS A 81 -95.867 0.272 -39.343 1.00 0.00 H new ATOM 0 HB3 CYS A 81 -94.648 1.529 -39.401 1.00 0.00 H new ATOM 908 N GLN A 82 -97.953 2.294 -38.074 1.00 0.00 N ATOM 909 CA GLN A 82 -98.931 3.317 -38.409 1.00 0.00 C ATOM 910 C GLN A 82 -99.036 4.354 -37.289 1.00 0.00 C ATOM 911 O GLN A 82 -99.210 5.543 -37.553 1.00 0.00 O ATOM 912 CB GLN A 82 -100.296 2.683 -38.691 1.00 0.00 C ATOM 913 CG GLN A 82 -101.373 3.686 -39.077 1.00 0.00 C ATOM 914 CD GLN A 82 -102.618 3.029 -39.636 1.00 0.00 C ATOM 915 OE1 GLN A 82 -103.335 3.620 -40.443 1.00 0.00 O ATOM 916 NE2 GLN A 82 -102.875 1.796 -39.229 1.00 0.00 N ATOM 0 H GLN A 82 -98.345 1.365 -37.923 1.00 0.00 H new ATOM 0 HA GLN A 82 -98.597 3.827 -39.312 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -100.188 1.953 -39.494 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -100.622 2.137 -37.806 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -101.642 4.277 -38.202 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -100.970 4.377 -39.817 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -102.256 1.341 -38.559 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -103.692 1.301 -39.586 1.00 0.00 H new ATOM 925 N ARG A 83 -98.906 3.916 -36.036 1.00 0.00 N ATOM 926 CA ARG A 83 -98.935 4.854 -34.918 1.00 0.00 C ATOM 927 C ARG A 83 -97.593 5.580 -34.807 1.00 0.00 C ATOM 928 O ARG A 83 -97.474 6.583 -34.105 1.00 0.00 O ATOM 929 CB ARG A 83 -99.302 4.161 -33.593 1.00 0.00 C ATOM 930 CG ARG A 83 -98.171 3.373 -32.951 1.00 0.00 C ATOM 931 CD ARG A 83 -98.593 2.754 -31.624 1.00 0.00 C ATOM 932 NE ARG A 83 -99.001 3.764 -30.647 1.00 0.00 N ATOM 933 CZ ARG A 83 -99.379 3.488 -29.397 1.00 0.00 C ATOM 934 NH1 ARG A 83 -99.347 2.236 -28.943 1.00 0.00 N ATOM 935 NH2 ARG A 83 -99.774 4.471 -28.598 1.00 0.00 N ATOM 0 H ARG A 83 -98.782 2.938 -35.775 1.00 0.00 H new ATOM 0 HA ARG A 83 -99.717 5.587 -35.116 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -99.646 4.917 -32.887 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -100.140 3.487 -33.772 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -97.845 2.586 -33.631 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -97.316 4.030 -32.790 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -99.418 2.062 -31.794 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -97.766 2.171 -31.218 1.00 0.00 H new ATOM 0 HE ARG A 83 -98.996 4.741 -30.940 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -99.032 1.481 -29.552 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -99.637 2.033 -27.987 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -99.788 5.432 -28.940 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -100.064 4.266 -27.642 1.00 0.00 H new ATOM 949 N LEU A 84 -96.581 5.064 -35.503 1.00 0.00 N ATOM 950 CA LEU A 84 -95.300 5.756 -35.625 1.00 0.00 C ATOM 951 C LEU A 84 -95.230 6.519 -36.945 1.00 0.00 C ATOM 952 O LEU A 84 -94.161 6.982 -37.345 1.00 0.00 O ATOM 953 CB LEU A 84 -94.129 4.780 -35.525 1.00 0.00 C ATOM 954 CG LEU A 84 -93.668 4.469 -34.099 1.00 0.00 C ATOM 955 CD1 LEU A 84 -94.601 3.486 -33.414 1.00 0.00 C ATOM 956 CD2 LEU A 84 -92.246 3.949 -34.115 1.00 0.00 C ATOM 0 H LEU A 84 -96.624 4.169 -35.991 1.00 0.00 H new ATOM 0 HA LEU A 84 -95.226 6.463 -34.799 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -94.411 3.846 -36.012 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -93.286 5.188 -36.083 1.00 0.00 H new ATOM 0 HG LEU A 84 -93.696 5.394 -33.522 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -94.243 3.288 -32.404 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -95.604 3.909 -33.367 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -94.626 2.554 -33.979 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -91.927 3.731 -33.096 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -92.198 3.039 -34.713 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -91.588 4.703 -34.548 1.00 0.00 H new ATOM 968 N ASN A 85 -96.395 6.656 -37.594 1.00 0.00 N ATOM 969 CA ASN A 85 -96.538 7.309 -38.907 1.00 0.00 C ATOM 970 C ASN A 85 -95.453 6.877 -39.890 1.00 0.00 C ATOM 971 O ASN A 85 -94.794 7.703 -40.520 1.00 0.00 O ATOM 972 CB ASN A 85 -96.617 8.851 -38.798 1.00 0.00 C ATOM 973 CG ASN A 85 -95.454 9.500 -38.067 1.00 0.00 C ATOM 974 OD1 ASN A 85 -94.427 9.833 -38.660 1.00 0.00 O ATOM 975 ND2 ASN A 85 -95.620 9.712 -36.772 1.00 0.00 N ATOM 0 H ASN A 85 -97.278 6.312 -37.218 1.00 0.00 H new ATOM 0 HA ASN A 85 -97.493 6.968 -39.308 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -96.675 9.269 -39.803 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -97.543 9.118 -38.288 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -94.884 10.165 -36.231 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -96.484 9.422 -36.315 1.00 0.00 H new ATOM 982 N CYS A 86 -95.290 5.570 -40.025 1.00 0.00 N ATOM 983 CA CYS A 86 -94.345 5.008 -40.978 1.00 0.00 C ATOM 984 C CYS A 86 -95.068 4.131 -41.995 1.00 0.00 C ATOM 985 O CYS A 86 -94.440 3.465 -42.819 1.00 0.00 O ATOM 986 CB CYS A 86 -93.259 4.212 -40.247 1.00 0.00 C ATOM 987 SG CYS A 86 -92.225 5.223 -39.145 1.00 0.00 S ATOM 0 H CYS A 86 -95.803 4.875 -39.483 1.00 0.00 H new ATOM 0 HA CYS A 86 -93.866 5.826 -41.516 1.00 0.00 H new ATOM 0 HB2 CYS A 86 -93.731 3.422 -39.663 1.00 0.00 H new ATOM 0 HB3 CYS A 86 -92.620 3.725 -40.984 1.00 0.00 H new ATOM 992 N GLY A 87 -96.396 4.151 -41.942 1.00 0.00 N ATOM 993 CA GLY A 87 -97.197 3.422 -42.904 1.00 0.00 C ATOM 994 C GLY A 87 -97.461 1.993 -42.486 1.00 0.00 C ATOM 995 O GLY A 87 -97.923 1.737 -41.373 1.00 0.00 O ATOM 0 H GLY A 87 -96.934 4.664 -41.243 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -98.148 3.937 -43.042 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -96.690 3.425 -43.869 1.00 0.00 H new ATOM 999 N ASP A 88 -97.143 1.066 -43.376 1.00 0.00 N ATOM 1000 CA ASP A 88 -97.348 -0.356 -43.133 1.00 0.00 C ATOM 1001 C ASP A 88 -96.245 -0.875 -42.219 1.00 0.00 C ATOM 1002 O ASP A 88 -95.291 -0.145 -41.937 1.00 0.00 O ATOM 1003 CB ASP A 88 -97.363 -1.112 -44.466 1.00 0.00 C ATOM 1004 CG ASP A 88 -98.680 -0.972 -45.199 1.00 0.00 C ATOM 1005 OD1 ASP A 88 -98.856 0.016 -45.939 1.00 0.00 O ATOM 1006 OD2 ASP A 88 -99.548 -1.857 -45.042 1.00 0.00 O ATOM 0 H ASP A 88 -96.736 1.277 -44.287 1.00 0.00 H new ATOM 0 HA ASP A 88 -98.308 -0.515 -42.642 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -96.557 -0.740 -45.099 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -97.164 -2.168 -44.283 1.00 0.00 H new ATOM 1011 N PRO A 89 -96.340 -2.112 -41.706 1.00 0.00 N ATOM 1012 CA PRO A 89 -95.369 -2.595 -40.749 1.00 0.00 C ATOM 1013 C PRO A 89 -94.027 -2.895 -41.348 1.00 0.00 C ATOM 1014 O PRO A 89 -93.895 -3.226 -42.530 1.00 0.00 O ATOM 1015 CB PRO A 89 -95.960 -3.873 -40.208 1.00 0.00 C ATOM 1016 CG PRO A 89 -96.884 -4.352 -41.265 1.00 0.00 C ATOM 1017 CD PRO A 89 -97.373 -3.127 -41.997 1.00 0.00 C ATOM 0 HA PRO A 89 -95.188 -1.829 -39.995 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -95.183 -4.609 -40.001 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -96.490 -3.697 -39.272 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -96.374 -5.033 -41.946 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -97.718 -4.902 -40.830 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -97.465 -3.310 -43.068 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -98.355 -2.813 -41.642 1.00 0.00 H new ATOM 1025 N LEU A 90 -93.045 -2.703 -40.505 1.00 0.00 N ATOM 1026 CA LEU A 90 -91.704 -3.152 -40.709 1.00 0.00 C ATOM 1027 C LEU A 90 -91.658 -4.470 -41.445 1.00 0.00 C ATOM 1028 O LEU A 90 -92.082 -5.506 -40.944 1.00 0.00 O ATOM 1029 CB LEU A 90 -90.951 -3.252 -39.374 1.00 0.00 C ATOM 1030 CG LEU A 90 -91.778 -3.072 -38.077 1.00 0.00 C ATOM 1031 CD1 LEU A 90 -92.989 -3.985 -38.016 1.00 0.00 C ATOM 1032 CD2 LEU A 90 -90.910 -3.313 -36.861 1.00 0.00 C ATOM 0 H LEU A 90 -93.170 -2.208 -39.622 1.00 0.00 H new ATOM 0 HA LEU A 90 -91.207 -2.410 -41.333 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -90.466 -4.227 -39.332 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -90.160 -2.503 -39.376 1.00 0.00 H new ATOM 0 HG LEU A 90 -92.141 -2.044 -38.084 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -93.528 -3.813 -37.084 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -93.646 -3.775 -38.860 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -92.664 -5.024 -38.060 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -91.505 -3.183 -35.957 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -90.514 -4.328 -36.892 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -90.084 -2.602 -36.857 1.00 0.00 H new ATOM 1044 N SER A 91 -91.193 -4.388 -42.662 1.00 0.00 N ATOM 1045 CA SER A 91 -90.912 -5.567 -43.445 1.00 0.00 C ATOM 1046 C SER A 91 -89.653 -6.235 -42.914 1.00 0.00 C ATOM 1047 O SER A 91 -88.748 -5.564 -42.412 1.00 0.00 O ATOM 1048 CB SER A 91 -90.765 -5.198 -44.918 1.00 0.00 C ATOM 1049 OG SER A 91 -91.973 -4.650 -45.415 1.00 0.00 O ATOM 0 H SER A 91 -90.998 -3.508 -43.140 1.00 0.00 H new ATOM 0 HA SER A 91 -91.740 -6.271 -43.361 1.00 0.00 H new ATOM 0 HB2 SER A 91 -89.955 -4.479 -45.040 1.00 0.00 H new ATOM 0 HB3 SER A 91 -90.495 -6.082 -45.495 1.00 0.00 H new ATOM 0 HG SER A 91 -91.824 -3.720 -45.684 1.00 0.00 H new ATOM 1055 N LEU A 92 -89.609 -7.549 -43.011 1.00 0.00 N ATOM 1056 CA LEU A 92 -88.529 -8.323 -42.431 1.00 0.00 C ATOM 1057 C LEU A 92 -87.341 -8.439 -43.377 1.00 0.00 C ATOM 1058 O LEU A 92 -87.486 -8.812 -44.540 1.00 0.00 O ATOM 1059 CB LEU A 92 -89.044 -9.705 -42.035 1.00 0.00 C ATOM 1060 CG LEU A 92 -89.647 -9.786 -40.634 1.00 0.00 C ATOM 1061 CD1 LEU A 92 -90.443 -11.063 -40.473 1.00 0.00 C ATOM 1062 CD2 LEU A 92 -88.552 -9.716 -39.581 1.00 0.00 C ATOM 0 H LEU A 92 -90.315 -8.107 -43.490 1.00 0.00 H new ATOM 0 HA LEU A 92 -88.176 -7.801 -41.542 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -89.797 -10.018 -42.758 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -88.222 -10.417 -42.103 1.00 0.00 H new ATOM 0 HG LEU A 92 -90.318 -8.938 -40.499 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -90.865 -11.104 -39.469 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -91.249 -11.085 -41.207 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -89.789 -11.921 -40.627 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -88.998 -9.775 -38.588 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -87.861 -10.548 -39.719 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -88.011 -8.775 -39.681 1.00 0.00 H new ATOM 1074 N GLY A 93 -86.173 -8.097 -42.860 1.00 0.00 N ATOM 1075 CA GLY A 93 -84.947 -8.184 -43.621 1.00 0.00 C ATOM 1076 C GLY A 93 -83.752 -7.976 -42.719 1.00 0.00 C ATOM 1077 O GLY A 93 -83.761 -7.056 -41.906 1.00 0.00 O ATOM 0 H GLY A 93 -86.052 -7.754 -41.907 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -84.880 -9.158 -44.105 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -84.948 -7.434 -44.412 1.00 0.00 H new ATOM 1081 N PRO A 94 -82.712 -8.817 -42.816 1.00 0.00 N ATOM 1082 CA PRO A 94 -81.565 -8.750 -41.908 1.00 0.00 C ATOM 1083 C PRO A 94 -80.870 -7.390 -41.955 1.00 0.00 C ATOM 1084 O PRO A 94 -80.621 -6.834 -43.027 1.00 0.00 O ATOM 1085 CB PRO A 94 -80.643 -9.877 -42.389 1.00 0.00 C ATOM 1086 CG PRO A 94 -81.073 -10.149 -43.789 1.00 0.00 C ATOM 1087 CD PRO A 94 -82.551 -9.870 -43.827 1.00 0.00 C ATOM 0 HA PRO A 94 -81.860 -8.868 -40.865 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -79.596 -9.576 -42.348 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -80.744 -10.765 -41.765 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -80.537 -9.513 -44.493 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -80.863 -11.181 -44.069 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -82.874 -9.536 -44.813 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -83.136 -10.757 -43.583 1.00 0.00 H new ATOM 1095 N PHE A 95 -80.581 -6.868 -40.776 1.00 0.00 N ATOM 1096 CA PHE A 95 -80.036 -5.533 -40.615 1.00 0.00 C ATOM 1097 C PHE A 95 -78.634 -5.635 -40.016 1.00 0.00 C ATOM 1098 O PHE A 95 -78.247 -6.699 -39.535 1.00 0.00 O ATOM 1099 CB PHE A 95 -80.966 -4.726 -39.699 1.00 0.00 C ATOM 1100 CG PHE A 95 -80.801 -3.234 -39.779 1.00 0.00 C ATOM 1101 CD1 PHE A 95 -80.996 -2.563 -40.975 1.00 0.00 C ATOM 1102 CD2 PHE A 95 -80.476 -2.501 -38.649 1.00 0.00 C ATOM 1103 CE1 PHE A 95 -80.868 -1.188 -41.042 1.00 0.00 C ATOM 1104 CE2 PHE A 95 -80.342 -1.128 -38.711 1.00 0.00 C ATOM 1105 CZ PHE A 95 -80.539 -0.470 -39.908 1.00 0.00 C ATOM 0 H PHE A 95 -80.720 -7.364 -39.896 1.00 0.00 H new ATOM 0 HA PHE A 95 -79.966 -5.027 -41.578 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -81.998 -4.976 -39.944 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -80.798 -5.040 -38.669 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -81.251 -3.120 -41.865 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -80.326 -3.010 -37.708 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -81.025 -0.676 -41.980 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -80.083 -0.570 -37.824 1.00 0.00 H new ATOM 0 HZ PHE A 95 -80.436 0.604 -39.958 1.00 0.00 H new ATOM 1115 N LEU A 96 -77.879 -4.543 -40.048 1.00 0.00 N ATOM 1116 CA LEU A 96 -76.514 -4.554 -39.528 1.00 0.00 C ATOM 1117 C LEU A 96 -76.498 -4.490 -38.000 1.00 0.00 C ATOM 1118 O LEU A 96 -75.513 -4.875 -37.370 1.00 0.00 O ATOM 1119 CB LEU A 96 -75.667 -3.411 -40.116 1.00 0.00 C ATOM 1120 CG LEU A 96 -76.180 -1.986 -39.875 1.00 0.00 C ATOM 1121 CD1 LEU A 96 -75.028 -0.997 -39.947 1.00 0.00 C ATOM 1122 CD2 LEU A 96 -77.247 -1.611 -40.893 1.00 0.00 C ATOM 0 H LEU A 96 -78.184 -3.645 -40.425 1.00 0.00 H new ATOM 0 HA LEU A 96 -76.068 -5.499 -39.839 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -74.660 -3.486 -39.704 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -75.584 -3.566 -41.192 1.00 0.00 H new ATOM 0 HG LEU A 96 -76.625 -1.949 -38.881 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -75.403 0.012 -39.775 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -74.288 -1.244 -39.186 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -74.565 -1.048 -40.933 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -77.594 -0.596 -40.700 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -76.827 -1.666 -41.897 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -78.086 -2.302 -40.812 1.00 0.00 H new ATOM 1134 N LYS A 97 -77.583 -4.010 -37.404 1.00 0.00 N ATOM 1135 CA LYS A 97 -77.682 -3.964 -35.951 1.00 0.00 C ATOM 1136 C LYS A 97 -77.848 -5.378 -35.396 1.00 0.00 C ATOM 1137 O LYS A 97 -78.829 -6.064 -35.697 1.00 0.00 O ATOM 1138 CB LYS A 97 -78.846 -3.063 -35.515 1.00 0.00 C ATOM 1139 CG LYS A 97 -79.006 -2.949 -34.004 1.00 0.00 C ATOM 1140 CD LYS A 97 -77.699 -2.579 -33.319 1.00 0.00 C ATOM 1141 CE LYS A 97 -77.176 -1.234 -33.789 1.00 0.00 C ATOM 1142 NZ LYS A 97 -75.783 -0.999 -33.336 1.00 0.00 N ATOM 0 H LYS A 97 -78.399 -3.650 -37.899 1.00 0.00 H new ATOM 0 HA LYS A 97 -76.763 -3.538 -35.548 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -78.697 -2.067 -35.931 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -79.772 -3.451 -35.940 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -79.761 -2.197 -33.775 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -79.369 -3.896 -33.605 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -77.849 -2.553 -32.240 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -76.954 -3.349 -33.519 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -77.218 -1.187 -34.877 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -77.821 -0.440 -33.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -75.459 -0.071 -33.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -75.748 -1.019 -32.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -75.164 -1.742 -33.718 1.00 0.00 H new ATOM 1156 N THR A 98 -76.876 -5.803 -34.600 1.00 0.00 N ATOM 1157 CA THR A 98 -76.818 -7.172 -34.111 1.00 0.00 C ATOM 1158 C THR A 98 -77.625 -7.392 -32.830 1.00 0.00 C ATOM 1159 O THR A 98 -78.216 -6.465 -32.274 1.00 0.00 O ATOM 1160 CB THR A 98 -75.359 -7.596 -33.876 1.00 0.00 C ATOM 1161 OG1 THR A 98 -74.617 -6.505 -33.304 1.00 0.00 O ATOM 1162 CG2 THR A 98 -74.709 -8.037 -35.178 1.00 0.00 C ATOM 0 H THR A 98 -76.110 -5.212 -34.277 1.00 0.00 H new ATOM 0 HA THR A 98 -77.270 -7.790 -34.886 1.00 0.00 H new ATOM 0 HB THR A 98 -75.353 -8.438 -33.184 1.00 0.00 H new ATOM 0 HG1 THR A 98 -73.689 -6.783 -33.155 1.00 0.00 H new ATOM 0 HG21 THR A 98 -73.677 -8.333 -34.988 1.00 0.00 H new ATOM 0 HG22 THR A 98 -75.259 -8.883 -35.591 1.00 0.00 H new ATOM 0 HG23 THR A 98 -74.725 -7.212 -35.890 1.00 0.00 H new ATOM 1170 N TYR A 99 -77.623 -8.640 -32.377 1.00 0.00 N ATOM 1171 CA TYR A 99 -78.390 -9.067 -31.216 1.00 0.00 C ATOM 1172 C TYR A 99 -77.481 -9.160 -29.981 1.00 0.00 C ATOM 1173 O TYR A 99 -76.256 -9.105 -30.100 1.00 0.00 O ATOM 1174 CB TYR A 99 -79.041 -10.422 -31.542 1.00 0.00 C ATOM 1175 CG TYR A 99 -79.727 -11.114 -30.384 1.00 0.00 C ATOM 1176 CD1 TYR A 99 -80.980 -10.712 -29.941 1.00 0.00 C ATOM 1177 CD2 TYR A 99 -79.114 -12.181 -29.739 1.00 0.00 C ATOM 1178 CE1 TYR A 99 -81.600 -11.354 -28.885 1.00 0.00 C ATOM 1179 CE2 TYR A 99 -79.728 -12.825 -28.687 1.00 0.00 C ATOM 1180 CZ TYR A 99 -80.969 -12.411 -28.262 1.00 0.00 C ATOM 1181 OH TYR A 99 -81.584 -13.057 -27.212 1.00 0.00 O ATOM 0 H TYR A 99 -77.084 -9.390 -32.810 1.00 0.00 H new ATOM 0 HA TYR A 99 -79.169 -8.341 -30.985 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -79.772 -10.272 -32.337 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -78.274 -11.088 -31.937 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -81.477 -9.886 -30.428 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -78.140 -12.511 -30.068 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -82.574 -11.030 -28.549 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -79.236 -13.653 -28.197 1.00 0.00 H new ATOM 0 HH TYR A 99 -81.109 -12.854 -26.379 1.00 0.00 H new ATOM 1191 N THR A 100 -78.084 -9.280 -28.803 1.00 0.00 N ATOM 1192 CA THR A 100 -77.346 -9.375 -27.556 1.00 0.00 C ATOM 1193 C THR A 100 -78.135 -10.233 -26.570 1.00 0.00 C ATOM 1194 O THR A 100 -79.319 -9.994 -26.344 1.00 0.00 O ATOM 1195 CB THR A 100 -77.044 -7.980 -26.954 1.00 0.00 C ATOM 1196 OG1 THR A 100 -76.493 -8.110 -25.636 1.00 0.00 O ATOM 1197 CG2 THR A 100 -78.291 -7.114 -26.900 1.00 0.00 C ATOM 0 H THR A 100 -79.097 -9.314 -28.690 1.00 0.00 H new ATOM 0 HA THR A 100 -76.383 -9.844 -27.760 1.00 0.00 H new ATOM 0 HB THR A 100 -76.317 -7.495 -27.605 1.00 0.00 H new ATOM 0 HG1 THR A 100 -76.306 -7.220 -25.270 1.00 0.00 H new ATOM 0 HG21 THR A 100 -78.041 -6.143 -26.472 1.00 0.00 H new ATOM 0 HG22 THR A 100 -78.683 -6.977 -27.908 1.00 0.00 H new ATOM 0 HG23 THR A 100 -79.045 -7.600 -26.281 1.00 0.00 H new ATOM 1205 N PRO A 101 -77.497 -11.248 -25.973 1.00 0.00 N ATOM 1206 CA PRO A 101 -78.179 -12.244 -25.139 1.00 0.00 C ATOM 1207 C PRO A 101 -78.541 -11.734 -23.752 1.00 0.00 C ATOM 1208 O PRO A 101 -78.960 -12.501 -22.882 1.00 0.00 O ATOM 1209 CB PRO A 101 -77.158 -13.390 -25.028 1.00 0.00 C ATOM 1210 CG PRO A 101 -76.008 -13.010 -25.908 1.00 0.00 C ATOM 1211 CD PRO A 101 -76.061 -11.519 -26.061 1.00 0.00 C ATOM 0 HA PRO A 101 -79.132 -12.532 -25.583 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -76.832 -13.522 -23.996 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -77.597 -14.335 -25.347 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -75.062 -13.321 -25.465 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -76.083 -13.502 -26.878 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -75.502 -11.009 -25.276 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -75.643 -11.193 -27.013 1.00 0.00 H new ATOM 1219 N GLN A 102 -78.414 -10.444 -23.558 1.00 0.00 N ATOM 1220 CA GLN A 102 -78.657 -9.859 -22.252 1.00 0.00 C ATOM 1221 C GLN A 102 -79.648 -8.706 -22.341 1.00 0.00 C ATOM 1222 O GLN A 102 -80.676 -8.711 -21.664 1.00 0.00 O ATOM 1223 CB GLN A 102 -77.343 -9.393 -21.623 1.00 0.00 C ATOM 1224 CG GLN A 102 -77.432 -9.174 -20.119 1.00 0.00 C ATOM 1225 CD GLN A 102 -77.500 -10.469 -19.316 1.00 0.00 C ATOM 1226 OE1 GLN A 102 -77.066 -10.516 -18.168 1.00 0.00 O ATOM 1227 NE2 GLN A 102 -78.037 -11.528 -19.904 1.00 0.00 N ATOM 0 H GLN A 102 -78.145 -9.777 -24.281 1.00 0.00 H new ATOM 0 HA GLN A 102 -79.095 -10.627 -21.614 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -76.569 -10.132 -21.829 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -77.031 -8.464 -22.099 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -76.566 -8.599 -19.792 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -78.315 -8.573 -19.899 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -78.389 -11.458 -20.859 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -78.099 -12.414 -19.402 1.00 0.00 H new ATOM 1236 N SER A 103 -79.342 -7.720 -23.171 1.00 0.00 N ATOM 1237 CA SER A 103 -80.224 -6.573 -23.337 1.00 0.00 C ATOM 1238 C SER A 103 -81.409 -6.930 -24.236 1.00 0.00 C ATOM 1239 O SER A 103 -82.480 -6.321 -24.154 1.00 0.00 O ATOM 1240 CB SER A 103 -79.445 -5.398 -23.926 1.00 0.00 C ATOM 1241 OG SER A 103 -78.271 -5.134 -23.171 1.00 0.00 O ATOM 0 H SER A 103 -78.494 -7.690 -23.738 1.00 0.00 H new ATOM 0 HA SER A 103 -80.612 -6.286 -22.359 1.00 0.00 H new ATOM 0 HB2 SER A 103 -79.175 -5.618 -24.959 1.00 0.00 H new ATOM 0 HB3 SER A 103 -80.077 -4.510 -23.943 1.00 0.00 H new ATOM 0 HG SER A 103 -77.789 -4.379 -23.569 1.00 0.00 H new ATOM 1247 N SER A 104 -81.212 -7.925 -25.089 1.00 0.00 N ATOM 1248 CA SER A 104 -82.262 -8.394 -25.976 1.00 0.00 C ATOM 1249 C SER A 104 -82.643 -9.831 -25.624 1.00 0.00 C ATOM 1250 O SER A 104 -81.938 -10.498 -24.862 1.00 0.00 O ATOM 1251 CB SER A 104 -81.797 -8.306 -27.428 1.00 0.00 C ATOM 1252 OG SER A 104 -81.355 -6.997 -27.739 1.00 0.00 O ATOM 0 H SER A 104 -80.328 -8.425 -25.184 1.00 0.00 H new ATOM 0 HA SER A 104 -83.141 -7.761 -25.852 1.00 0.00 H new ATOM 0 HB2 SER A 104 -80.989 -9.017 -27.599 1.00 0.00 H new ATOM 0 HB3 SER A 104 -82.614 -8.586 -28.093 1.00 0.00 H new ATOM 0 HG SER A 104 -81.061 -6.964 -28.673 1.00 0.00 H new ATOM 1258 N ILE A 105 -83.754 -10.302 -26.169 1.00 0.00 N ATOM 1259 CA ILE A 105 -84.243 -11.640 -25.880 1.00 0.00 C ATOM 1260 C ILE A 105 -84.787 -12.329 -27.134 1.00 0.00 C ATOM 1261 O ILE A 105 -85.129 -11.680 -28.122 1.00 0.00 O ATOM 1262 CB ILE A 105 -85.336 -11.625 -24.772 1.00 0.00 C ATOM 1263 CG1 ILE A 105 -86.300 -10.440 -24.930 1.00 0.00 C ATOM 1264 CG2 ILE A 105 -84.705 -11.582 -23.390 1.00 0.00 C ATOM 1265 CD1 ILE A 105 -87.210 -10.521 -26.132 1.00 0.00 C ATOM 0 H ILE A 105 -84.337 -9.773 -26.818 1.00 0.00 H new ATOM 0 HA ILE A 105 -83.387 -12.209 -25.517 1.00 0.00 H new ATOM 0 HB ILE A 105 -85.907 -12.547 -24.882 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -86.913 -10.366 -24.032 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -85.717 -9.521 -24.994 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -85.489 -11.572 -22.632 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -84.076 -12.461 -23.250 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -84.097 -10.682 -23.295 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -87.854 -9.642 -26.161 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -86.610 -10.561 -27.041 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -87.824 -11.419 -26.063 1.00 0.00 H new ATOM 1277 N ILE A 106 -84.836 -13.651 -27.081 1.00 0.00 N ATOM 1278 CA ILE A 106 -85.479 -14.456 -28.113 1.00 0.00 C ATOM 1279 C ILE A 106 -86.787 -14.995 -27.541 1.00 0.00 C ATOM 1280 O ILE A 106 -86.762 -15.906 -26.713 1.00 0.00 O ATOM 1281 CB ILE A 106 -84.644 -15.690 -28.507 1.00 0.00 C ATOM 1282 CG1 ILE A 106 -83.284 -15.288 -29.037 1.00 0.00 C ATOM 1283 CG2 ILE A 106 -85.386 -16.512 -29.557 1.00 0.00 C ATOM 1284 CD1 ILE A 106 -82.367 -16.463 -29.307 1.00 0.00 C ATOM 0 H ILE A 106 -84.431 -14.198 -26.321 1.00 0.00 H new ATOM 0 HA ILE A 106 -85.612 -13.819 -28.988 1.00 0.00 H new ATOM 0 HB ILE A 106 -84.496 -16.294 -27.612 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -83.416 -14.721 -29.959 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -82.806 -14.622 -28.319 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -84.787 -17.381 -29.828 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -86.342 -16.842 -29.151 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -85.559 -15.900 -30.442 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -81.411 -16.099 -29.684 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -82.205 -17.018 -28.383 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -82.824 -17.118 -30.048 1.00 0.00 H new ATOM 1296 N CYS A 107 -87.919 -14.454 -27.922 1.00 0.00 N ATOM 1297 CA CYS A 107 -89.165 -15.006 -27.414 1.00 0.00 C ATOM 1298 C CYS A 107 -89.583 -16.207 -28.256 1.00 0.00 C ATOM 1299 O CYS A 107 -89.032 -16.440 -29.332 1.00 0.00 O ATOM 1300 CB CYS A 107 -90.289 -13.974 -27.389 1.00 0.00 C ATOM 1301 SG CYS A 107 -89.884 -12.386 -26.625 1.00 0.00 S ATOM 0 H CYS A 107 -88.011 -13.662 -28.558 1.00 0.00 H new ATOM 0 HA CYS A 107 -88.986 -15.318 -26.385 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -90.611 -13.791 -28.414 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -91.139 -14.404 -26.860 1.00 0.00 H new ATOM 1306 N TYR A 108 -90.556 -16.965 -27.767 1.00 0.00 N ATOM 1307 CA TYR A 108 -91.015 -18.165 -28.456 1.00 0.00 C ATOM 1308 C TYR A 108 -92.530 -18.285 -28.336 1.00 0.00 C ATOM 1309 O TYR A 108 -93.170 -17.477 -27.663 1.00 0.00 O ATOM 1310 CB TYR A 108 -90.367 -19.418 -27.859 1.00 0.00 C ATOM 1311 CG TYR A 108 -88.860 -19.496 -27.994 1.00 0.00 C ATOM 1312 CD1 TYR A 108 -88.268 -19.968 -29.162 1.00 0.00 C ATOM 1313 CD2 TYR A 108 -88.030 -19.114 -26.946 1.00 0.00 C ATOM 1314 CE1 TYR A 108 -86.893 -20.053 -29.281 1.00 0.00 C ATOM 1315 CE2 TYR A 108 -86.655 -19.198 -27.057 1.00 0.00 C ATOM 1316 CZ TYR A 108 -86.092 -19.667 -28.226 1.00 0.00 C ATOM 1317 OH TYR A 108 -84.723 -19.757 -28.337 1.00 0.00 O ATOM 0 H TYR A 108 -91.044 -16.769 -26.893 1.00 0.00 H new ATOM 0 HA TYR A 108 -90.730 -18.083 -29.505 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -90.623 -19.470 -26.801 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -90.804 -20.295 -28.336 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -88.893 -20.273 -29.989 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -88.467 -18.745 -26.030 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -86.449 -20.419 -30.195 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -86.025 -18.898 -26.233 1.00 0.00 H new ATOM 0 HH TYR A 108 -84.482 -20.626 -28.721 1.00 0.00 H new ATOM 1327 N GLY A 109 -93.101 -19.292 -28.981 1.00 0.00 N ATOM 1328 CA GLY A 109 -94.526 -19.527 -28.871 1.00 0.00 C ATOM 1329 C GLY A 109 -95.263 -19.193 -30.144 1.00 0.00 C ATOM 1330 O GLY A 109 -94.853 -19.588 -31.234 1.00 0.00 O ATOM 0 H GLY A 109 -92.602 -19.951 -29.579 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -94.701 -20.572 -28.617 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -94.928 -18.929 -28.054 1.00 0.00 H new ATOM 1334 N GLN A 110 -96.364 -18.479 -30.001 1.00 0.00 N ATOM 1335 CA GLN A 110 -97.142 -18.027 -31.144 1.00 0.00 C ATOM 1336 C GLN A 110 -96.798 -16.582 -31.473 1.00 0.00 C ATOM 1337 O GLN A 110 -96.761 -15.733 -30.579 1.00 0.00 O ATOM 1338 CB GLN A 110 -98.642 -18.138 -30.856 1.00 0.00 C ATOM 1339 CG GLN A 110 -99.122 -19.554 -30.577 1.00 0.00 C ATOM 1340 CD GLN A 110 -100.608 -19.615 -30.278 1.00 0.00 C ATOM 1341 OE1 GLN A 110 -101.275 -20.602 -30.586 1.00 0.00 O ATOM 1342 NE2 GLN A 110 -101.140 -18.563 -29.672 1.00 0.00 N ATOM 0 H GLN A 110 -96.744 -18.197 -29.097 1.00 0.00 H new ATOM 0 HA GLN A 110 -96.897 -18.663 -31.994 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -98.883 -17.509 -29.999 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -99.194 -17.741 -31.708 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -98.902 -20.185 -31.438 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -98.568 -19.962 -29.732 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -100.555 -17.763 -29.432 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -102.134 -18.554 -29.446 1.00 0.00 H new ATOM 1351 N LEU A 111 -96.529 -16.308 -32.742 1.00 0.00 N ATOM 1352 CA LEU A 111 -96.295 -14.946 -33.197 1.00 0.00 C ATOM 1353 C LEU A 111 -97.546 -14.105 -32.957 1.00 0.00 C ATOM 1354 O LEU A 111 -98.517 -14.181 -33.710 1.00 0.00 O ATOM 1355 CB LEU A 111 -95.916 -14.934 -34.682 1.00 0.00 C ATOM 1356 CG LEU A 111 -95.525 -13.569 -35.245 1.00 0.00 C ATOM 1357 CD1 LEU A 111 -94.265 -13.048 -34.569 1.00 0.00 C ATOM 1358 CD2 LEU A 111 -95.325 -13.658 -36.749 1.00 0.00 C ATOM 0 H LEU A 111 -96.467 -17.014 -33.476 1.00 0.00 H new ATOM 0 HA LEU A 111 -95.466 -14.519 -32.633 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -95.085 -15.623 -34.833 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -96.758 -15.319 -35.258 1.00 0.00 H new ATOM 0 HG LEU A 111 -96.334 -12.868 -35.042 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -94.005 -12.075 -34.985 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -94.441 -12.949 -33.498 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -93.446 -13.746 -34.739 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -95.047 -12.678 -37.138 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -94.533 -14.374 -36.969 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -96.252 -13.985 -37.221 1.00 0.00 H new ATOM 1370 N GLY A 112 -97.521 -13.327 -31.887 1.00 0.00 N ATOM 1371 CA GLY A 112 -98.688 -12.573 -31.493 1.00 0.00 C ATOM 1372 C GLY A 112 -99.111 -12.885 -30.069 1.00 0.00 C ATOM 1373 O GLY A 112 -100.181 -12.474 -29.623 1.00 0.00 O ATOM 0 H GLY A 112 -96.708 -13.205 -31.283 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -98.479 -11.507 -31.584 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -99.510 -12.796 -32.173 1.00 0.00 H new ATOM 1377 N SER A 113 -98.287 -13.647 -29.365 1.00 0.00 N ATOM 1378 CA SER A 113 -98.509 -13.902 -27.953 1.00 0.00 C ATOM 1379 C SER A 113 -97.227 -13.632 -27.164 1.00 0.00 C ATOM 1380 O SER A 113 -96.383 -14.510 -26.995 1.00 0.00 O ATOM 1381 CB SER A 113 -98.977 -15.343 -27.742 1.00 0.00 C ATOM 1382 OG SER A 113 -100.127 -15.622 -28.527 1.00 0.00 O ATOM 0 H SER A 113 -97.458 -14.099 -29.751 1.00 0.00 H new ATOM 0 HA SER A 113 -99.288 -13.231 -27.591 1.00 0.00 H new ATOM 0 HB2 SER A 113 -98.175 -16.032 -28.006 1.00 0.00 H new ATOM 0 HB3 SER A 113 -99.203 -15.506 -26.688 1.00 0.00 H new ATOM 0 HG SER A 113 -100.677 -16.295 -28.074 1.00 0.00 H new ATOM 1388 N PHE A 114 -97.098 -12.403 -26.689 1.00 0.00 N ATOM 1389 CA PHE A 114 -95.883 -11.923 -26.028 1.00 0.00 C ATOM 1390 C PHE A 114 -95.846 -12.331 -24.556 1.00 0.00 C ATOM 1391 O PHE A 114 -95.252 -11.648 -23.726 1.00 0.00 O ATOM 1392 CB PHE A 114 -95.805 -10.394 -26.142 1.00 0.00 C ATOM 1393 CG PHE A 114 -95.500 -9.885 -27.529 1.00 0.00 C ATOM 1394 CD1 PHE A 114 -96.121 -10.424 -28.649 1.00 0.00 C ATOM 1395 CD2 PHE A 114 -94.580 -8.867 -27.711 1.00 0.00 C ATOM 1396 CE1 PHE A 114 -95.828 -9.957 -29.914 1.00 0.00 C ATOM 1397 CE2 PHE A 114 -94.283 -8.399 -28.976 1.00 0.00 C ATOM 1398 CZ PHE A 114 -94.908 -8.945 -30.078 1.00 0.00 C ATOM 0 H PHE A 114 -97.836 -11.701 -26.749 1.00 0.00 H new ATOM 0 HA PHE A 114 -95.026 -12.378 -26.525 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -96.753 -9.969 -25.813 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -95.038 -10.030 -25.458 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -96.842 -11.219 -28.528 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -94.088 -8.433 -26.853 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -96.320 -10.385 -30.775 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -93.561 -7.605 -29.103 1.00 0.00 H new ATOM 0 HZ PHE A 114 -94.676 -8.580 -31.068 1.00 0.00 H new ATOM 1408 N SER A 115 -96.462 -13.456 -24.241 1.00 0.00 N ATOM 1409 CA SER A 115 -96.521 -13.927 -22.869 1.00 0.00 C ATOM 1410 C SER A 115 -95.410 -14.941 -22.592 1.00 0.00 C ATOM 1411 O SER A 115 -95.273 -15.442 -21.473 1.00 0.00 O ATOM 1412 CB SER A 115 -97.893 -14.550 -22.606 1.00 0.00 C ATOM 1413 OG SER A 115 -98.929 -13.696 -23.067 1.00 0.00 O ATOM 0 H SER A 115 -96.929 -14.061 -24.917 1.00 0.00 H new ATOM 0 HA SER A 115 -96.374 -13.081 -22.198 1.00 0.00 H new ATOM 0 HB2 SER A 115 -97.961 -15.516 -23.107 1.00 0.00 H new ATOM 0 HB3 SER A 115 -98.015 -14.735 -21.539 1.00 0.00 H new ATOM 0 HG SER A 115 -99.551 -14.208 -23.626 1.00 0.00 H new ATOM 1419 N ASN A 116 -94.607 -15.229 -23.613 1.00 0.00 N ATOM 1420 CA ASN A 116 -93.546 -16.221 -23.490 1.00 0.00 C ATOM 1421 C ASN A 116 -92.285 -15.758 -24.209 1.00 0.00 C ATOM 1422 O ASN A 116 -92.247 -15.684 -25.439 1.00 0.00 O ATOM 1423 CB ASN A 116 -94.010 -17.568 -24.059 1.00 0.00 C ATOM 1424 CG ASN A 116 -93.066 -18.713 -23.734 1.00 0.00 C ATOM 1425 OD1 ASN A 116 -91.860 -18.529 -23.576 1.00 0.00 O ATOM 1426 ND2 ASN A 116 -93.613 -19.913 -23.635 1.00 0.00 N ATOM 0 H ASN A 116 -94.671 -14.790 -24.532 1.00 0.00 H new ATOM 0 HA ASN A 116 -93.315 -16.342 -22.432 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -95.000 -17.799 -23.666 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -94.109 -17.483 -25.141 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -93.031 -20.723 -23.421 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -94.617 -20.029 -23.772 1.00 0.00 H new ATOM 1433 N CYS A 117 -91.257 -15.439 -23.440 1.00 0.00 N ATOM 1434 CA CYS A 117 -89.971 -15.082 -24.011 1.00 0.00 C ATOM 1435 C CYS A 117 -88.848 -15.814 -23.281 1.00 0.00 C ATOM 1436 O CYS A 117 -89.071 -16.411 -22.227 1.00 0.00 O ATOM 1437 CB CYS A 117 -89.721 -13.574 -23.939 1.00 0.00 C ATOM 1438 SG CYS A 117 -90.869 -12.534 -24.875 1.00 0.00 S ATOM 0 H CYS A 117 -91.289 -15.420 -22.421 1.00 0.00 H new ATOM 0 HA CYS A 117 -89.986 -15.379 -25.060 1.00 0.00 H new ATOM 0 HB2 CYS A 117 -89.756 -13.269 -22.893 1.00 0.00 H new ATOM 0 HB3 CYS A 117 -88.710 -13.376 -24.295 1.00 0.00 H new ATOM 1443 N SER A 118 -87.650 -15.774 -23.846 1.00 0.00 N ATOM 1444 CA SER A 118 -86.475 -16.375 -23.227 1.00 0.00 C ATOM 1445 C SER A 118 -85.223 -15.639 -23.692 1.00 0.00 C ATOM 1446 O SER A 118 -85.292 -14.795 -24.581 1.00 0.00 O ATOM 1447 CB SER A 118 -86.379 -17.865 -23.582 1.00 0.00 C ATOM 1448 OG SER A 118 -87.502 -18.583 -23.092 1.00 0.00 O ATOM 0 H SER A 118 -87.464 -15.326 -24.743 1.00 0.00 H new ATOM 0 HA SER A 118 -86.562 -16.289 -22.144 1.00 0.00 H new ATOM 0 HB2 SER A 118 -86.314 -17.980 -24.664 1.00 0.00 H new ATOM 0 HB3 SER A 118 -85.465 -18.284 -23.161 1.00 0.00 H new ATOM 0 HG SER A 118 -87.416 -19.529 -23.333 1.00 0.00 H new ATOM 1454 N HIS A 119 -84.086 -15.935 -23.084 1.00 0.00 N ATOM 1455 CA HIS A 119 -82.824 -15.341 -23.514 1.00 0.00 C ATOM 1456 C HIS A 119 -82.162 -16.200 -24.585 1.00 0.00 C ATOM 1457 O HIS A 119 -82.515 -17.368 -24.753 1.00 0.00 O ATOM 1458 CB HIS A 119 -81.873 -15.147 -22.327 1.00 0.00 C ATOM 1459 CG HIS A 119 -82.220 -13.971 -21.460 1.00 0.00 C ATOM 1460 ND1 HIS A 119 -81.498 -12.795 -21.467 1.00 0.00 N ATOM 1461 CD2 HIS A 119 -83.209 -13.795 -20.548 1.00 0.00 C ATOM 1462 CE1 HIS A 119 -82.031 -11.949 -20.604 1.00 0.00 C ATOM 1463 NE2 HIS A 119 -83.067 -12.530 -20.030 1.00 0.00 N ATOM 0 H HIS A 119 -84.007 -16.578 -22.296 1.00 0.00 H new ATOM 0 HA HIS A 119 -83.044 -14.362 -23.939 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -81.878 -16.051 -21.717 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -80.858 -15.022 -22.703 1.00 0.00 H new ATOM 0 HD1 HIS A 119 -80.681 -12.608 -22.048 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -83.967 -14.515 -20.279 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -81.678 -10.949 -20.402 1.00 0.00 H new ATOM 1472 N SER A 120 -81.208 -15.607 -25.302 1.00 0.00 N ATOM 1473 CA SER A 120 -80.495 -16.275 -26.392 1.00 0.00 C ATOM 1474 C SER A 120 -80.015 -17.673 -25.992 1.00 0.00 C ATOM 1475 O SER A 120 -79.126 -17.821 -25.152 1.00 0.00 O ATOM 1476 CB SER A 120 -79.302 -15.417 -26.828 1.00 0.00 C ATOM 1477 OG SER A 120 -78.555 -16.049 -27.849 1.00 0.00 O ATOM 0 H SER A 120 -80.906 -14.646 -25.143 1.00 0.00 H new ATOM 0 HA SER A 120 -81.191 -16.394 -27.222 1.00 0.00 H new ATOM 0 HB2 SER A 120 -79.658 -14.450 -27.182 1.00 0.00 H new ATOM 0 HB3 SER A 120 -78.658 -15.225 -25.970 1.00 0.00 H new ATOM 0 HG SER A 120 -78.500 -15.457 -28.628 1.00 0.00 H new ATOM 1483 N ARG A 121 -80.614 -18.695 -26.597 1.00 0.00 N ATOM 1484 CA ARG A 121 -80.256 -20.076 -26.296 1.00 0.00 C ATOM 1485 C ARG A 121 -79.734 -20.789 -27.545 1.00 0.00 C ATOM 1486 O ARG A 121 -78.528 -20.971 -27.702 1.00 0.00 O ATOM 1487 CB ARG A 121 -81.455 -20.817 -25.701 1.00 0.00 C ATOM 1488 CG ARG A 121 -81.128 -22.213 -25.193 1.00 0.00 C ATOM 1489 CD ARG A 121 -82.226 -22.733 -24.279 1.00 0.00 C ATOM 1490 NE ARG A 121 -82.401 -21.876 -23.105 1.00 0.00 N ATOM 1491 CZ ARG A 121 -83.573 -21.639 -22.518 1.00 0.00 C ATOM 1492 NH1 ARG A 121 -84.679 -22.233 -22.957 1.00 0.00 N ATOM 1493 NH2 ARG A 121 -83.632 -20.815 -21.481 1.00 0.00 N ATOM 0 H ARG A 121 -81.348 -18.592 -27.297 1.00 0.00 H new ATOM 0 HA ARG A 121 -79.454 -20.072 -25.557 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -81.862 -20.228 -24.879 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -82.236 -20.890 -26.458 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -81.002 -22.891 -26.037 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -80.180 -22.195 -24.655 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -83.164 -22.790 -24.832 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -81.983 -23.746 -23.958 1.00 0.00 H new ATOM 0 HE ARG A 121 -81.572 -21.432 -22.711 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -84.633 -22.875 -23.748 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -85.573 -22.047 -22.502 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -82.783 -20.367 -21.137 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -84.526 -20.629 -21.027 1.00 0.00 H new ATOM 1507 N ASN A 122 -80.637 -21.182 -28.440 1.00 0.00 N ATOM 1508 CA ASN A 122 -80.236 -21.839 -29.678 1.00 0.00 C ATOM 1509 C ASN A 122 -80.457 -20.910 -30.865 1.00 0.00 C ATOM 1510 O ASN A 122 -81.349 -20.059 -30.835 1.00 0.00 O ATOM 1511 CB ASN A 122 -80.983 -23.168 -29.882 1.00 0.00 C ATOM 1512 CG ASN A 122 -82.486 -23.015 -30.042 1.00 0.00 C ATOM 1513 OD1 ASN A 122 -83.108 -22.139 -29.442 1.00 0.00 O ATOM 1514 ND2 ASN A 122 -83.082 -23.884 -30.845 1.00 0.00 N ATOM 0 H ASN A 122 -81.644 -21.058 -28.331 1.00 0.00 H new ATOM 0 HA ASN A 122 -79.173 -22.070 -29.605 1.00 0.00 H new ATOM 0 HB2 ASN A 122 -80.583 -23.666 -30.765 1.00 0.00 H new ATOM 0 HB3 ASN A 122 -80.783 -23.819 -29.031 1.00 0.00 H new ATOM 0 HD21 ASN A 122 -84.092 -23.841 -30.983 1.00 0.00 H new ATOM 0 HD22 ASN A 122 -82.531 -24.596 -31.325 1.00 0.00 H new ATOM 1521 N ASP A 123 -79.607 -21.067 -31.886 1.00 0.00 N ATOM 1522 CA ASP A 123 -79.591 -20.208 -33.085 1.00 0.00 C ATOM 1523 C ASP A 123 -79.054 -18.815 -32.749 1.00 0.00 C ATOM 1524 O ASP A 123 -78.230 -18.265 -33.482 1.00 0.00 O ATOM 1525 CB ASP A 123 -80.979 -20.098 -33.739 1.00 0.00 C ATOM 1526 CG ASP A 123 -80.957 -19.314 -35.046 1.00 0.00 C ATOM 1527 OD1 ASP A 123 -80.438 -19.842 -36.055 1.00 0.00 O ATOM 1528 OD2 ASP A 123 -81.457 -18.168 -35.069 1.00 0.00 O ATOM 0 H ASP A 123 -78.900 -21.802 -31.907 1.00 0.00 H new ATOM 0 HA ASP A 123 -78.924 -20.682 -33.805 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -81.367 -21.099 -33.928 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -81.666 -19.616 -33.043 1.00 0.00 H new ATOM 1533 N MET A 124 -79.534 -18.266 -31.630 1.00 0.00 N ATOM 1534 CA MET A 124 -79.102 -16.963 -31.117 1.00 0.00 C ATOM 1535 C MET A 124 -79.609 -15.837 -32.004 1.00 0.00 C ATOM 1536 O MET A 124 -79.164 -14.701 -31.875 1.00 0.00 O ATOM 1537 CB MET A 124 -77.574 -16.894 -30.980 1.00 0.00 C ATOM 1538 CG MET A 124 -77.003 -17.874 -29.966 1.00 0.00 C ATOM 1539 SD MET A 124 -75.232 -17.648 -29.687 1.00 0.00 S ATOM 1540 CE MET A 124 -75.196 -15.964 -29.072 1.00 0.00 C ATOM 0 H MET A 124 -80.240 -18.718 -31.049 1.00 0.00 H new ATOM 0 HA MET A 124 -79.534 -16.841 -30.124 1.00 0.00 H new ATOM 0 HB2 MET A 124 -77.122 -17.088 -31.953 1.00 0.00 H new ATOM 0 HB3 MET A 124 -77.290 -15.882 -30.693 1.00 0.00 H new ATOM 0 HG2 MET A 124 -77.532 -17.759 -29.020 1.00 0.00 H new ATOM 0 HG3 MET A 124 -77.184 -18.892 -30.311 1.00 0.00 H new ATOM 0 HE1 MET A 124 -74.462 -15.885 -28.270 1.00 0.00 H new ATOM 0 HE2 MET A 124 -74.923 -15.287 -29.881 1.00 0.00 H new ATOM 0 HE3 MET A 124 -76.181 -15.695 -28.690 1.00 0.00 H new ATOM 1550 N CYS A 125 -80.566 -16.185 -32.870 1.00 0.00 N ATOM 1551 CA CYS A 125 -81.182 -15.275 -33.847 1.00 0.00 C ATOM 1552 C CYS A 125 -80.193 -14.408 -34.613 1.00 0.00 C ATOM 1553 O CYS A 125 -79.546 -13.513 -34.064 1.00 0.00 O ATOM 1554 CB CYS A 125 -82.293 -14.403 -33.238 1.00 0.00 C ATOM 1555 SG CYS A 125 -82.133 -13.994 -31.477 1.00 0.00 S ATOM 0 H CYS A 125 -80.945 -17.131 -32.914 1.00 0.00 H new ATOM 0 HA CYS A 125 -81.634 -15.950 -34.574 1.00 0.00 H new ATOM 0 HB2 CYS A 125 -82.341 -13.471 -33.801 1.00 0.00 H new ATOM 0 HB3 CYS A 125 -83.245 -14.913 -33.384 1.00 0.00 H new ATOM 1560 N HIS A 126 -80.106 -14.662 -35.912 1.00 0.00 N ATOM 1561 CA HIS A 126 -79.347 -13.799 -36.806 1.00 0.00 C ATOM 1562 C HIS A 126 -79.901 -12.384 -36.709 1.00 0.00 C ATOM 1563 O HIS A 126 -81.009 -12.188 -36.203 1.00 0.00 O ATOM 1564 CB HIS A 126 -79.432 -14.296 -38.253 1.00 0.00 C ATOM 1565 CG HIS A 126 -79.034 -15.732 -38.423 1.00 0.00 C ATOM 1566 ND1 HIS A 126 -77.797 -16.215 -38.062 1.00 0.00 N ATOM 1567 CD2 HIS A 126 -79.731 -16.798 -38.886 1.00 0.00 C ATOM 1568 CE1 HIS A 126 -77.746 -17.511 -38.298 1.00 0.00 C ATOM 1569 NE2 HIS A 126 -78.906 -17.892 -38.797 1.00 0.00 N ATOM 0 H HIS A 126 -80.551 -15.458 -36.369 1.00 0.00 H new ATOM 0 HA HIS A 126 -78.298 -13.813 -36.509 1.00 0.00 H new ATOM 0 HB2 HIS A 126 -80.453 -14.166 -38.613 1.00 0.00 H new ATOM 0 HB3 HIS A 126 -78.792 -13.674 -38.879 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -80.746 -16.789 -39.256 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -76.897 -18.153 -38.114 1.00 0.00 H new ATOM 0 HE2 HIS A 126 -79.150 -18.843 -39.072 1.00 0.00 H new ATOM 1578 N SER A 127 -79.151 -11.407 -37.184 1.00 0.00 N ATOM 1579 CA SER A 127 -79.571 -10.020 -37.075 1.00 0.00 C ATOM 1580 C SER A 127 -80.712 -9.704 -38.040 1.00 0.00 C ATOM 1581 O SER A 127 -80.553 -8.922 -38.972 1.00 0.00 O ATOM 1582 CB SER A 127 -78.381 -9.089 -37.315 1.00 0.00 C ATOM 1583 OG SER A 127 -77.664 -9.466 -38.480 1.00 0.00 O ATOM 0 H SER A 127 -78.253 -11.545 -37.647 1.00 0.00 H new ATOM 0 HA SER A 127 -79.945 -9.857 -36.064 1.00 0.00 H new ATOM 0 HB2 SER A 127 -78.733 -8.063 -37.417 1.00 0.00 H new ATOM 0 HB3 SER A 127 -77.716 -9.113 -36.451 1.00 0.00 H new ATOM 0 HG SER A 127 -77.654 -8.719 -39.114 1.00 0.00 H new ATOM 1589 N LEU A 128 -81.857 -10.340 -37.826 1.00 0.00 N ATOM 1590 CA LEU A 128 -83.050 -10.033 -38.593 1.00 0.00 C ATOM 1591 C LEU A 128 -83.543 -8.652 -38.211 1.00 0.00 C ATOM 1592 O LEU A 128 -83.665 -8.338 -37.026 1.00 0.00 O ATOM 1593 CB LEU A 128 -84.164 -11.064 -38.356 1.00 0.00 C ATOM 1594 CG LEU A 128 -84.064 -12.365 -39.162 1.00 0.00 C ATOM 1595 CD1 LEU A 128 -83.942 -12.070 -40.652 1.00 0.00 C ATOM 1596 CD2 LEU A 128 -82.896 -13.214 -38.687 1.00 0.00 C ATOM 0 H LEU A 128 -81.981 -11.072 -37.126 1.00 0.00 H new ATOM 0 HA LEU A 128 -82.791 -10.065 -39.651 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -84.176 -11.318 -37.296 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -85.121 -10.593 -38.582 1.00 0.00 H new ATOM 0 HG LEU A 128 -84.981 -12.931 -38.998 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -83.872 -13.007 -41.204 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -84.819 -11.516 -40.986 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -83.047 -11.475 -40.833 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -82.849 -14.130 -39.276 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -81.967 -12.656 -38.809 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -83.033 -13.465 -37.635 1.00 0.00 H new ATOM 1608 N GLY A 129 -83.808 -7.830 -39.203 1.00 0.00 N ATOM 1609 CA GLY A 129 -84.221 -6.481 -38.939 1.00 0.00 C ATOM 1610 C GLY A 129 -85.654 -6.252 -39.337 1.00 0.00 C ATOM 1611 O GLY A 129 -86.297 -7.129 -39.920 1.00 0.00 O ATOM 0 H GLY A 129 -83.744 -8.075 -40.191 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -84.098 -6.263 -37.878 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -83.577 -5.790 -39.483 1.00 0.00 H new ATOM 1615 N LEU A 130 -86.136 -5.067 -39.050 1.00 0.00 N ATOM 1616 CA LEU A 130 -87.505 -4.705 -39.299 1.00 0.00 C ATOM 1617 C LEU A 130 -87.541 -3.236 -39.675 1.00 0.00 C ATOM 1618 O LEU A 130 -86.913 -2.401 -39.026 1.00 0.00 O ATOM 1619 CB LEU A 130 -88.360 -4.980 -38.063 1.00 0.00 C ATOM 1620 CG LEU A 130 -88.962 -6.387 -37.986 1.00 0.00 C ATOM 1621 CD1 LEU A 130 -89.521 -6.660 -36.600 1.00 0.00 C ATOM 1622 CD2 LEU A 130 -90.054 -6.560 -39.036 1.00 0.00 C ATOM 0 H LEU A 130 -85.580 -4.321 -38.632 1.00 0.00 H new ATOM 0 HA LEU A 130 -87.915 -5.301 -40.114 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -87.750 -4.814 -37.175 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -89.171 -4.253 -38.033 1.00 0.00 H new ATOM 0 HG LEU A 130 -88.167 -7.106 -38.185 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -89.943 -7.665 -36.569 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -88.722 -6.579 -35.863 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -90.300 -5.932 -36.372 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -90.470 -7.565 -38.966 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -90.843 -5.828 -38.864 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -89.631 -6.411 -40.029 1.00 0.00 H new ATOM 1634 N THR A 131 -88.232 -2.929 -40.741 1.00 0.00 N ATOM 1635 CA THR A 131 -88.246 -1.587 -41.274 1.00 0.00 C ATOM 1636 C THR A 131 -89.646 -1.232 -41.776 1.00 0.00 C ATOM 1637 O THR A 131 -90.092 -1.747 -42.804 1.00 0.00 O ATOM 1638 CB THR A 131 -87.209 -1.508 -42.395 1.00 0.00 C ATOM 1639 OG1 THR A 131 -85.895 -1.588 -41.836 1.00 0.00 O ATOM 1640 CG2 THR A 131 -87.342 -0.239 -43.220 1.00 0.00 C ATOM 0 H THR A 131 -88.799 -3.596 -41.264 1.00 0.00 H new ATOM 0 HA THR A 131 -87.991 -0.864 -40.499 1.00 0.00 H new ATOM 0 HB THR A 131 -87.386 -2.348 -43.066 1.00 0.00 H new ATOM 0 HG1 THR A 131 -85.230 -1.539 -42.554 1.00 0.00 H new ATOM 0 HG21 THR A 131 -86.583 -0.232 -44.002 1.00 0.00 H new ATOM 0 HG22 THR A 131 -88.332 -0.203 -43.675 1.00 0.00 H new ATOM 0 HG23 THR A 131 -87.207 0.630 -42.576 1.00 0.00 H new ATOM 1648 N CYS A 132 -90.338 -0.386 -41.006 1.00 0.00 N ATOM 1649 CA CYS A 132 -91.764 -0.098 -41.205 1.00 0.00 C ATOM 1650 C CYS A 132 -92.100 0.192 -42.655 1.00 0.00 C ATOM 1651 O CYS A 132 -91.742 1.235 -43.205 1.00 0.00 O ATOM 1652 CB CYS A 132 -92.205 1.046 -40.300 1.00 0.00 C ATOM 1653 SG CYS A 132 -92.118 0.618 -38.541 1.00 0.00 S ATOM 0 H CYS A 132 -89.924 0.121 -40.224 1.00 0.00 H new ATOM 0 HA CYS A 132 -92.318 -0.996 -40.932 1.00 0.00 H new ATOM 0 HB2 CYS A 132 -91.577 1.917 -40.490 1.00 0.00 H new ATOM 0 HB3 CYS A 132 -93.227 1.329 -40.551 1.00 0.00 H new ATOM 1658 N LEU A 133 -92.774 -0.786 -43.244 1.00 0.00 N ATOM 1659 CA LEU A 133 -93.241 -0.760 -44.613 1.00 0.00 C ATOM 1660 C LEU A 133 -92.095 -0.875 -45.617 1.00 0.00 C ATOM 1661 O LEU A 133 -91.932 -1.902 -46.271 1.00 0.00 O ATOM 1662 CB LEU A 133 -94.084 0.492 -44.901 1.00 0.00 C ATOM 1663 CG LEU A 133 -94.430 0.732 -46.377 1.00 0.00 C ATOM 1664 CD1 LEU A 133 -95.192 -0.445 -46.965 1.00 0.00 C ATOM 1665 CD2 LEU A 133 -95.236 2.008 -46.524 1.00 0.00 C ATOM 0 H LEU A 133 -93.017 -1.650 -42.759 1.00 0.00 H new ATOM 0 HA LEU A 133 -93.878 -1.636 -44.737 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -95.013 0.421 -44.335 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -93.548 1.364 -44.525 1.00 0.00 H new ATOM 0 HG LEU A 133 -93.496 0.835 -46.930 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -95.422 -0.243 -48.011 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -94.582 -1.345 -46.894 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -96.119 -0.591 -46.411 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -95.476 2.168 -47.575 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -96.159 1.924 -45.950 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -94.654 2.851 -46.152 1.00 0.00 H new ATOM 1677 N GLU A 134 -91.310 0.177 -45.735 1.00 0.00 N ATOM 1678 CA GLU A 134 -90.239 0.224 -46.719 1.00 0.00 C ATOM 1679 C GLU A 134 -88.957 -0.393 -46.172 1.00 0.00 C ATOM 1680 O GLU A 134 -88.066 -0.788 -46.931 1.00 0.00 O ATOM 1681 CB GLU A 134 -89.989 1.668 -47.154 1.00 0.00 C ATOM 1682 CG GLU A 134 -89.688 2.618 -46.004 1.00 0.00 C ATOM 1683 CD GLU A 134 -89.393 4.023 -46.482 1.00 0.00 C ATOM 1684 OE1 GLU A 134 -90.347 4.753 -46.833 1.00 0.00 O ATOM 1685 OE2 GLU A 134 -88.206 4.405 -46.519 1.00 0.00 O ATOM 0 H GLU A 134 -91.392 1.016 -45.161 1.00 0.00 H new ATOM 0 HA GLU A 134 -90.549 -0.361 -47.585 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -89.154 1.686 -47.855 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -90.865 2.031 -47.692 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -90.538 2.640 -45.322 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -88.835 2.242 -45.439 1.00 0.00 H new TER 1692 GLU A 134