USER MOD reduce.3.24.130724 H: found=0, std=0, add=1475, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1268 hydrogens (35 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 NoAdj-H: B 92 MK8 HNA : B 92 MK8 N : B 91 ALA C :(H bumps) USER MOD NoAdj-H: B 96 MK8 HNA : B 96 MK8 N : B 95 ASP C :(H bumps) USER MOD NoAdj-H: B 96 MK8 HN : B 96 MK8 N : B 95 ASP C :(H bumps) USER MOD NoAdj-H: B 97 NLE HN2 : B 97 NLE N : B 96 MK8 C :(H bumps) USER MOD NoAdj-H: B 97 NLE H : B 97 NLE N : B 96 MK8 C :(H bumps) USER MOD Set 1.1: A 31 THR OG1 : rot 87:sc= 1.85 USER MOD Set 1.2: A 162 MET CE :methyl 176:sc= -0.996 (180deg=-1.05) USER MOD Set 2.1: A 98 GLN :FLIP amide:sc= -0.0598 X(o=-0.3,f=-0.06) USER MOD Set 2.2: A 141 HIS :FLIP no HE2:sc= 0 X(o=-0.24,f=-0.06) USER MOD Set 3.1: A 103 THR OG1 : rot -166:sc= -0.517 USER MOD Set 3.2: A 106 ASN : amide:sc= -0.912 X(o=-1.4,f=-1) USER MOD Set 3.3: A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 63:sc= 0.136 USER MOD Single : A 23 SER OG : rot -149:sc= -0.978 USER MOD Single : A 26 GLN : amide:sc= -1.75! C(o=-1.8!,f=-2.8!) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 SER OG : rot -71:sc= -0.0343 USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 TYR OH : rot 30:sc= -0.615 USER MOD Single : A 43 HIS :FLIP no HD1:sc= -1.61 F(o=-2.1,f=-1.6) USER MOD Single : A 44 GLN : amide:sc= -0.051 X(o=-0.051,f=-0.39) USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 GLN : amide:sc= -0.503 X(o=-0.5,f=-0.011) USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot -92:sc= 1.29 USER MOD Single : A 66 GLN : amide:sc= -0.0189 X(o=-0.019,f=0) USER MOD Single : A 68 SER OG : rot 180:sc= -0.0345 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0.015 USER MOD Single : A 71 MET CE :methyl -153:sc= -0.476 (180deg=-2!) USER MOD Single : A 73 GLN : amide:sc= -0.126 K(o=-0.13,f=-0.66) USER MOD Single : A 77 GLN : amide:sc= -0.64 X(o=-0.64,f=-0.66) USER MOD Single : A 86 ASN :FLIP amide:sc= -0.0477 F(o=-0.9,f=-0.048) USER MOD Single : A 89 TYR OH : rot -15:sc= -0.61 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 94 GLN : amide:sc= -1.51 K(o=-1.5,f=-2.4!) USER MOD Single : A 95 THR OG1 : rot 96:sc= 1.27 USER MOD Single : A 96 MET CE :methyl -111:sc= -4.36 (180deg=-13.6!) USER MOD Single : A 99 HIS : no HD1:sc= -0.464 X(o=-0.46,f=-0.091) USER MOD Single : A 101 GLN : amide:sc=0.000894 K(o=0.00089,f=-1.3) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot -96:sc= 1.21 USER MOD Single : A 113 LYS NZ :NH3+ -159:sc= -2.03 (180deg=-3.03) USER MOD Single : A 116 THR OG1 : rot 99:sc= 1.23 USER MOD Single : A 117 SER OG : rot -119:sc= -0.663 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= -5.68 K(o=-5.7,f=-9.5!) USER MOD Single : A 136 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 145 HIS : no HD1:sc= -0.215 X(o=-0.22,f=-0.29) USER MOD Single : A 148 THR OG1 : rot 180:sc= 0 USER MOD Single : A 153 GLN : amide:sc= -0.0943 X(o=-0.094,f=-0.47) USER MOD Single : A 155 THR OG1 : rot 65:sc= -0.182 USER MOD Single : A 164 HIS : no HE2:sc= 0.00732 K(o=0.0073,f=-1.2) USER MOD Single : A 165 HIS : no HE2:sc= -0.238 K(o=-0.24,f=-2.9!) USER MOD Single : A 166 CYS SG : rot 180:sc=-0.00182 USER MOD Single : A 173 GLN : amide:sc= -0.0782 K(o=-0.078,f=-0.84) USER MOD Single : A 182 ASN : amide:sc= 0 X(o=0,f=-0.0069) USER MOD Single : A 185 ASN : amide:sc= 0 X(o=0,f=-0.0017) USER MOD Single : B 85 ASN :FLIP amide:sc= -0.062 F(o=-0.72,f=-0.062) USER MOD Single : B 89 HIS : no HD1:sc= -0.0909 X(o=-0.091,f=0) USER MOD Single : B 100 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 18 1.785 26.096 0.833 1.00 42.51 N ATOM 2 CA ALA A 18 0.608 25.237 0.781 1.00 13.34 C ATOM 3 C ALA A 18 0.066 25.136 -0.640 1.00 55.45 C ATOM 4 O ALA A 18 -1.145 25.047 -0.849 1.00 73.23 O ATOM 5 CB ALA A 18 -0.468 25.759 1.722 1.00 21.44 C ATOM 0 HA ALA A 18 0.903 24.238 1.102 1.00 13.34 H new ATOM 0 HB1 ALA A 18 -1.341 25.108 1.673 1.00 21.44 H new ATOM 0 HB2 ALA A 18 -0.083 25.774 2.742 1.00 21.44 H new ATOM 0 HB3 ALA A 18 -0.751 26.769 1.426 1.00 21.44 H new ATOM 11 N LEU A 19 0.967 25.150 -1.615 1.00 4.14 N ATOM 12 CA LEU A 19 0.579 25.059 -3.019 1.00 35.42 C ATOM 13 C LEU A 19 0.670 23.621 -3.518 1.00 72.01 C ATOM 14 O LEU A 19 1.365 22.782 -2.944 1.00 74.14 O ATOM 15 CB LEU A 19 1.467 25.965 -3.873 1.00 42.40 C ATOM 16 CG LEU A 19 1.060 27.437 -3.937 1.00 14.14 C ATOM 17 CD1 LEU A 19 -0.298 27.588 -4.603 1.00 13.32 C ATOM 18 CD2 LEU A 19 1.043 28.046 -2.542 1.00 74.02 C ATOM 0 H LEU A 19 1.972 25.224 -1.460 1.00 4.14 H new ATOM 0 HA LEU A 19 -0.456 25.388 -3.106 1.00 35.42 H new ATOM 0 HB2 LEU A 19 2.486 25.907 -3.490 1.00 42.40 H new ATOM 0 HB3 LEU A 19 1.485 25.569 -4.889 1.00 42.40 H new ATOM 0 HG LEU A 19 1.796 27.972 -4.537 1.00 14.14 H new ATOM 0 HD11 LEU A 19 -0.570 28.643 -4.639 1.00 13.32 H new ATOM 0 HD12 LEU A 19 -0.252 27.190 -5.617 1.00 13.32 H new ATOM 0 HD13 LEU A 19 -1.047 27.039 -4.031 1.00 13.32 H new ATOM 0 HD21 LEU A 19 0.751 29.094 -2.606 1.00 74.02 H new ATOM 0 HD22 LEU A 19 0.329 27.508 -1.919 1.00 74.02 H new ATOM 0 HD23 LEU A 19 2.037 27.972 -2.101 1.00 74.02 H new ATOM 29 N PRO A 20 -0.046 23.328 -4.613 1.00 71.43 N ATOM 30 CA PRO A 20 -0.060 21.991 -5.215 1.00 63.53 C ATOM 31 C PRO A 20 1.270 21.636 -5.870 1.00 55.34 C ATOM 32 O PRO A 20 2.176 22.465 -5.945 1.00 12.14 O ATOM 33 CB PRO A 20 -1.167 22.088 -6.269 1.00 20.10 C ATOM 34 CG PRO A 20 -1.237 23.536 -6.612 1.00 31.34 C ATOM 35 CD PRO A 20 -0.897 24.278 -5.348 1.00 15.52 C ATOM 0 HA PRO A 20 -0.227 21.211 -4.472 1.00 63.53 H new ATOM 0 HB2 PRO A 20 -0.933 21.484 -7.146 1.00 20.10 H new ATOM 0 HB3 PRO A 20 -2.118 21.727 -5.878 1.00 20.10 H new ATOM 0 HG2 PRO A 20 -0.536 23.782 -7.410 1.00 31.34 H new ATOM 0 HG3 PRO A 20 -2.232 23.805 -6.967 1.00 31.34 H new ATOM 0 HD2 PRO A 20 -0.371 25.209 -5.558 1.00 15.52 H new ATOM 0 HD3 PRO A 20 -1.791 24.538 -4.782 1.00 15.52 H new ATOM 40 N SER A 21 1.379 20.400 -6.345 1.00 42.32 N ATOM 41 CA SER A 21 2.601 19.934 -6.992 1.00 74.52 C ATOM 42 C SER A 21 2.454 18.488 -7.453 1.00 31.30 C ATOM 43 O SER A 21 1.446 17.836 -7.179 1.00 22.25 O ATOM 44 CB SER A 21 3.788 20.058 -6.035 1.00 12.31 C ATOM 45 OG SER A 21 4.692 21.060 -6.470 1.00 51.13 O ATOM 0 H SER A 21 0.636 19.703 -6.294 1.00 42.32 H new ATOM 0 HA SER A 21 2.781 20.559 -7.867 1.00 74.52 H new ATOM 0 HB2 SER A 21 3.429 20.298 -5.034 1.00 12.31 H new ATOM 0 HB3 SER A 21 4.306 19.101 -5.967 1.00 12.31 H new ATOM 0 HG SER A 21 4.243 21.931 -6.463 1.00 51.13 H new ATOM 50 N ALA A 22 3.466 17.992 -8.156 1.00 2.22 N ATOM 51 CA ALA A 22 3.452 16.623 -8.655 1.00 44.40 C ATOM 52 C ALA A 22 2.353 16.428 -9.694 1.00 64.12 C ATOM 53 O ALA A 22 1.305 17.071 -9.630 1.00 64.13 O ATOM 54 CB ALA A 22 3.274 15.643 -7.504 1.00 54.13 C ATOM 0 H ALA A 22 4.307 18.518 -8.393 1.00 2.22 H new ATOM 0 HA ALA A 22 4.410 16.429 -9.138 1.00 44.40 H new ATOM 0 HB1 ALA A 22 3.265 14.624 -7.892 1.00 54.13 H new ATOM 0 HB2 ALA A 22 4.098 15.756 -6.799 1.00 54.13 H new ATOM 0 HB3 ALA A 22 2.331 15.846 -6.996 1.00 54.13 H new ATOM 60 N SER A 23 2.599 15.538 -10.650 1.00 4.12 N ATOM 61 CA SER A 23 1.631 15.261 -11.705 1.00 34.44 C ATOM 62 C SER A 23 1.222 13.792 -11.696 1.00 63.54 C ATOM 63 O SER A 23 2.030 12.914 -11.400 1.00 23.43 O ATOM 64 CB SER A 23 2.213 15.632 -13.070 1.00 13.31 C ATOM 65 OG SER A 23 3.400 14.904 -13.333 1.00 24.34 O ATOM 0 H SER A 23 3.461 14.996 -10.716 1.00 4.12 H new ATOM 0 HA SER A 23 0.745 15.867 -11.519 1.00 34.44 H new ATOM 0 HB2 SER A 23 1.478 15.430 -13.849 1.00 13.31 H new ATOM 0 HB3 SER A 23 2.424 16.701 -13.101 1.00 13.31 H new ATOM 0 HG SER A 23 3.997 15.443 -13.893 1.00 24.34 H new ATOM 70 N GLU A 24 -0.041 13.534 -12.022 1.00 11.40 N ATOM 71 CA GLU A 24 -0.559 12.171 -12.052 1.00 33.44 C ATOM 72 C GLU A 24 0.361 11.256 -12.855 1.00 52.31 C ATOM 73 O GLU A 24 0.628 10.123 -12.458 1.00 0.42 O ATOM 74 CB GLU A 24 -1.967 12.149 -12.649 1.00 31.01 C ATOM 75 CG GLU A 24 -2.048 12.758 -14.038 1.00 71.13 C ATOM 76 CD GLU A 24 -3.323 13.551 -14.254 1.00 64.44 C ATOM 77 OE1 GLU A 24 -4.385 12.922 -14.453 1.00 24.42 O ATOM 78 OE2 GLU A 24 -3.261 14.796 -14.224 1.00 74.10 O ATOM 0 H GLU A 24 -0.724 14.250 -12.269 1.00 11.40 H new ATOM 0 HA GLU A 24 -0.602 11.804 -11.026 1.00 33.44 H new ATOM 0 HB2 GLU A 24 -2.318 11.118 -12.692 1.00 31.01 H new ATOM 0 HB3 GLU A 24 -2.643 12.688 -11.985 1.00 31.01 H new ATOM 0 HG2 GLU A 24 -1.188 13.409 -14.196 1.00 71.13 H new ATOM 0 HG3 GLU A 24 -1.988 11.964 -14.783 1.00 71.13 H new ATOM 83 N GLU A 25 0.842 11.759 -13.988 1.00 45.43 N ATOM 84 CA GLU A 25 1.731 10.987 -14.850 1.00 73.23 C ATOM 85 C GLU A 25 2.961 10.517 -14.080 1.00 54.30 C ATOM 86 O GLU A 25 3.320 9.340 -14.121 1.00 32.11 O ATOM 87 CB GLU A 25 2.159 11.821 -16.058 1.00 35.10 C ATOM 88 CG GLU A 25 2.634 13.219 -15.695 1.00 31.13 C ATOM 89 CD GLU A 25 4.140 13.363 -15.781 1.00 11.15 C ATOM 90 OE1 GLU A 25 4.842 12.334 -15.684 1.00 53.21 O ATOM 91 OE2 GLU A 25 4.620 14.505 -15.945 1.00 64.23 O ATOM 0 H GLU A 25 0.631 12.697 -14.330 1.00 45.43 H new ATOM 0 HA GLU A 25 1.185 10.110 -15.199 1.00 73.23 H new ATOM 0 HB2 GLU A 25 2.959 11.300 -16.584 1.00 35.10 H new ATOM 0 HB3 GLU A 25 1.321 11.899 -16.750 1.00 35.10 H new ATOM 0 HG2 GLU A 25 2.165 13.943 -16.362 1.00 31.13 H new ATOM 0 HG3 GLU A 25 2.307 13.459 -14.683 1.00 31.13 H new ATOM 96 N GLN A 26 3.604 11.446 -13.380 1.00 31.51 N ATOM 97 CA GLN A 26 4.795 11.128 -12.601 1.00 71.22 C ATOM 98 C GLN A 26 4.433 10.327 -11.355 1.00 23.34 C ATOM 99 O GLN A 26 5.238 9.540 -10.856 1.00 62.54 O ATOM 100 CB GLN A 26 5.528 12.410 -12.203 1.00 75.42 C ATOM 101 CG GLN A 26 5.168 12.908 -10.812 1.00 14.23 C ATOM 102 CD GLN A 26 5.997 12.253 -9.725 1.00 43.33 C ATOM 103 OE1 GLN A 26 7.110 11.788 -9.972 1.00 14.34 O ATOM 104 NE2 GLN A 26 5.457 12.213 -8.512 1.00 65.04 N ATOM 0 H GLN A 26 3.320 12.425 -13.336 1.00 31.51 H new ATOM 0 HA GLN A 26 5.453 10.520 -13.222 1.00 71.22 H new ATOM 0 HB2 GLN A 26 6.603 12.234 -12.250 1.00 75.42 H new ATOM 0 HB3 GLN A 26 5.300 13.190 -12.930 1.00 75.42 H new ATOM 0 HG2 GLN A 26 5.308 13.988 -10.769 1.00 14.23 H new ATOM 0 HG3 GLN A 26 4.112 12.716 -10.624 1.00 14.23 H new ATOM 0 HE21 GLN A 26 4.531 12.611 -8.352 1.00 65.04 H new ATOM 0 HE22 GLN A 26 5.968 11.784 -7.740 1.00 65.04 H new ATOM 111 N VAL A 27 3.218 10.532 -10.857 1.00 52.32 N ATOM 112 CA VAL A 27 2.749 9.829 -9.669 1.00 22.12 C ATOM 113 C VAL A 27 2.677 8.326 -9.914 1.00 71.55 C ATOM 114 O VAL A 27 3.077 7.529 -9.066 1.00 43.51 O ATOM 115 CB VAL A 27 1.362 10.333 -9.229 1.00 35.04 C ATOM 116 CG1 VAL A 27 0.796 9.448 -8.129 1.00 40.44 C ATOM 117 CG2 VAL A 27 1.444 11.781 -8.769 1.00 62.12 C ATOM 0 H VAL A 27 2.540 11.180 -11.258 1.00 52.32 H new ATOM 0 HA VAL A 27 3.469 10.032 -8.876 1.00 22.12 H new ATOM 0 HB VAL A 27 0.688 10.284 -10.085 1.00 35.04 H new ATOM 0 HG11 VAL A 27 -0.184 9.820 -7.831 1.00 40.44 H new ATOM 0 HG12 VAL A 27 0.700 8.426 -8.497 1.00 40.44 H new ATOM 0 HG13 VAL A 27 1.466 9.463 -7.269 1.00 40.44 H new ATOM 0 HG21 VAL A 27 0.455 12.122 -8.462 1.00 62.12 H new ATOM 0 HG22 VAL A 27 2.132 11.857 -7.927 1.00 62.12 H new ATOM 0 HG23 VAL A 27 1.803 12.403 -9.589 1.00 62.12 H new ATOM 127 N ALA A 28 2.164 7.946 -11.080 1.00 63.35 N ATOM 128 CA ALA A 28 2.042 6.538 -11.437 1.00 52.44 C ATOM 129 C ALA A 28 3.394 5.837 -11.379 1.00 5.43 C ATOM 130 O ALA A 28 3.531 4.785 -10.755 1.00 2.44 O ATOM 131 CB ALA A 28 1.430 6.396 -12.824 1.00 15.21 C ATOM 0 H ALA A 28 1.827 8.593 -11.793 1.00 63.35 H new ATOM 0 HA ALA A 28 1.384 6.061 -10.711 1.00 52.44 H new ATOM 0 HB1 ALA A 28 1.345 5.339 -13.078 1.00 15.21 H new ATOM 0 HB2 ALA A 28 0.440 6.852 -12.833 1.00 15.21 H new ATOM 0 HB3 ALA A 28 2.066 6.894 -13.555 1.00 15.21 H new ATOM 137 N GLN A 29 4.389 6.425 -12.036 1.00 70.41 N ATOM 138 CA GLN A 29 5.731 5.855 -12.060 1.00 75.33 C ATOM 139 C GLN A 29 6.295 5.731 -10.648 1.00 61.23 C ATOM 140 O GLN A 29 6.833 4.689 -10.273 1.00 64.34 O ATOM 141 CB GLN A 29 6.659 6.716 -12.918 1.00 53.04 C ATOM 142 CG GLN A 29 6.636 6.350 -14.393 1.00 31.24 C ATOM 143 CD GLN A 29 7.917 6.735 -15.109 1.00 51.11 C ATOM 144 OE1 GLN A 29 8.839 5.929 -15.233 1.00 63.30 O ATOM 145 NE2 GLN A 29 7.979 7.973 -15.586 1.00 73.20 N ATOM 0 H GLN A 29 4.291 7.296 -12.559 1.00 70.41 H new ATOM 0 HA GLN A 29 5.667 4.858 -12.495 1.00 75.33 H new ATOM 0 HB2 GLN A 29 6.376 7.763 -12.807 1.00 53.04 H new ATOM 0 HB3 GLN A 29 7.678 6.621 -12.544 1.00 53.04 H new ATOM 0 HG2 GLN A 29 6.476 5.277 -14.495 1.00 31.24 H new ATOM 0 HG3 GLN A 29 5.792 6.845 -14.874 1.00 31.24 H new ATOM 0 HE21 GLN A 29 7.191 8.608 -15.460 1.00 73.20 H new ATOM 0 HE22 GLN A 29 8.815 8.289 -16.078 1.00 73.20 H new ATOM 152 N ASP A 30 6.167 6.800 -9.870 1.00 23.43 N ATOM 153 CA ASP A 30 6.664 6.810 -8.498 1.00 51.31 C ATOM 154 C ASP A 30 5.914 5.796 -7.641 1.00 73.35 C ATOM 155 O ASP A 30 6.463 5.246 -6.686 1.00 3.14 O ATOM 156 CB ASP A 30 6.525 8.209 -7.894 1.00 4.31 C ATOM 157 CG ASP A 30 7.567 9.175 -8.425 1.00 42.13 C ATOM 158 OD1 ASP A 30 8.275 8.812 -9.388 1.00 30.44 O ATOM 159 OD2 ASP A 30 7.672 10.292 -7.879 1.00 10.22 O ATOM 0 H ASP A 30 5.724 7.670 -10.165 1.00 23.43 H new ATOM 0 HA ASP A 30 7.718 6.533 -8.517 1.00 51.31 H new ATOM 0 HB2 ASP A 30 5.530 8.598 -8.110 1.00 4.31 H new ATOM 0 HB3 ASP A 30 6.613 8.144 -6.810 1.00 4.31 H new ATOM 163 N THR A 31 4.652 5.553 -7.986 1.00 2.45 N ATOM 164 CA THR A 31 3.826 4.608 -7.248 1.00 63.25 C ATOM 165 C THR A 31 4.332 3.180 -7.425 1.00 53.33 C ATOM 166 O THR A 31 4.594 2.480 -6.448 1.00 10.31 O ATOM 167 CB THR A 31 2.354 4.678 -7.697 1.00 42.31 C ATOM 168 OG1 THR A 31 1.817 5.975 -7.415 1.00 0.23 O ATOM 169 CG2 THR A 31 1.522 3.615 -6.994 1.00 12.45 C ATOM 0 H THR A 31 4.181 5.999 -8.773 1.00 2.45 H new ATOM 0 HA THR A 31 3.891 4.886 -6.196 1.00 63.25 H new ATOM 0 HB THR A 31 2.316 4.495 -8.771 1.00 42.31 H new ATOM 0 HG1 THR A 31 2.010 6.579 -8.163 1.00 0.23 H new ATOM 0 HG21 THR A 31 0.486 3.684 -7.327 1.00 12.45 H new ATOM 0 HG22 THR A 31 1.915 2.627 -7.234 1.00 12.45 H new ATOM 0 HG23 THR A 31 1.568 3.771 -5.916 1.00 12.45 H new ATOM 177 N GLU A 32 4.466 2.756 -8.678 1.00 54.10 N ATOM 178 CA GLU A 32 4.941 1.411 -8.981 1.00 52.34 C ATOM 179 C GLU A 32 6.327 1.177 -8.390 1.00 23.54 C ATOM 180 O GLU A 32 6.591 0.132 -7.797 1.00 32.13 O ATOM 181 CB GLU A 32 4.975 1.188 -10.495 1.00 31.11 C ATOM 182 CG GLU A 32 5.718 2.275 -11.253 1.00 12.25 C ATOM 183 CD GLU A 32 5.717 2.045 -12.752 1.00 0.52 C ATOM 184 OE1 GLU A 32 5.031 1.106 -13.207 1.00 41.13 O ATOM 185 OE2 GLU A 32 6.402 2.804 -13.470 1.00 21.41 O ATOM 0 H GLU A 32 4.253 3.324 -9.498 1.00 54.10 H new ATOM 0 HA GLU A 32 4.249 0.699 -8.531 1.00 52.34 H new ATOM 0 HB2 GLU A 32 5.445 0.226 -10.702 1.00 31.11 H new ATOM 0 HB3 GLU A 32 3.953 1.130 -10.868 1.00 31.11 H new ATOM 0 HG2 GLU A 32 5.261 3.241 -11.037 1.00 12.25 H new ATOM 0 HG3 GLU A 32 6.747 2.323 -10.897 1.00 12.25 H new ATOM 190 N GLU A 33 7.209 2.158 -8.557 1.00 10.14 N ATOM 191 CA GLU A 33 8.569 2.057 -8.041 1.00 0.22 C ATOM 192 C GLU A 33 8.568 1.966 -6.518 1.00 62.43 C ATOM 193 O GLU A 33 9.156 1.053 -5.939 1.00 24.13 O ATOM 194 CB GLU A 33 9.399 3.263 -8.490 1.00 62.24 C ATOM 195 CG GLU A 33 9.610 3.329 -9.993 1.00 30.14 C ATOM 196 CD GLU A 33 9.969 4.724 -10.470 1.00 45.40 C ATOM 197 OE1 GLU A 33 10.931 5.308 -9.928 1.00 41.23 O ATOM 198 OE2 GLU A 33 9.288 5.230 -11.386 1.00 71.25 O ATOM 0 H GLU A 33 7.006 3.030 -9.045 1.00 10.14 H new ATOM 0 HA GLU A 33 9.016 1.147 -8.442 1.00 0.22 H new ATOM 0 HB2 GLU A 33 8.905 4.177 -8.160 1.00 62.24 H new ATOM 0 HB3 GLU A 33 10.370 3.230 -7.996 1.00 62.24 H new ATOM 0 HG2 GLU A 33 10.403 2.637 -10.276 1.00 30.14 H new ATOM 0 HG3 GLU A 33 8.703 2.998 -10.499 1.00 30.14 H new ATOM 203 N VAL A 34 7.902 2.920 -5.874 1.00 51.41 N ATOM 204 CA VAL A 34 7.823 2.948 -4.419 1.00 52.21 C ATOM 205 C VAL A 34 7.140 1.696 -3.882 1.00 61.45 C ATOM 206 O VAL A 34 7.480 1.203 -2.805 1.00 53.44 O ATOM 207 CB VAL A 34 7.059 4.190 -3.922 1.00 52.35 C ATOM 208 CG1 VAL A 34 6.757 4.072 -2.437 1.00 21.52 C ATOM 209 CG2 VAL A 34 7.850 5.455 -4.216 1.00 34.45 C ATOM 0 H VAL A 34 7.410 3.683 -6.338 1.00 51.41 H new ATOM 0 HA VAL A 34 8.847 2.988 -4.047 1.00 52.21 H new ATOM 0 HB VAL A 34 6.111 4.250 -4.457 1.00 52.35 H new ATOM 0 HG11 VAL A 34 6.217 4.958 -2.104 1.00 21.52 H new ATOM 0 HG12 VAL A 34 6.146 3.187 -2.259 1.00 21.52 H new ATOM 0 HG13 VAL A 34 7.691 3.986 -1.881 1.00 21.52 H new ATOM 0 HG21 VAL A 34 7.295 6.322 -3.858 1.00 34.45 H new ATOM 0 HG22 VAL A 34 8.814 5.407 -3.710 1.00 34.45 H new ATOM 0 HG23 VAL A 34 8.008 5.544 -5.291 1.00 34.45 H new ATOM 219 N PHE A 35 6.174 1.184 -4.638 1.00 70.04 N ATOM 220 CA PHE A 35 5.441 -0.011 -4.238 1.00 50.10 C ATOM 221 C PHE A 35 6.374 -1.215 -4.147 1.00 65.13 C ATOM 222 O PHE A 35 6.437 -1.890 -3.119 1.00 75.20 O ATOM 223 CB PHE A 35 4.313 -0.300 -5.230 1.00 52.44 C ATOM 224 CG PHE A 35 3.652 -1.632 -5.015 1.00 52.33 C ATOM 225 CD1 PHE A 35 2.583 -1.756 -4.142 1.00 3.51 C ATOM 226 CD2 PHE A 35 4.099 -2.758 -5.686 1.00 43.50 C ATOM 227 CE1 PHE A 35 1.972 -2.980 -3.943 1.00 32.25 C ATOM 228 CE2 PHE A 35 3.491 -3.984 -5.491 1.00 32.11 C ATOM 229 CZ PHE A 35 2.428 -4.095 -4.617 1.00 70.54 C ATOM 0 H PHE A 35 5.881 1.579 -5.532 1.00 70.04 H new ATOM 0 HA PHE A 35 5.011 0.170 -3.253 1.00 50.10 H new ATOM 0 HB2 PHE A 35 3.562 0.486 -5.153 1.00 52.44 H new ATOM 0 HB3 PHE A 35 4.712 -0.261 -6.243 1.00 52.44 H new ATOM 0 HD1 PHE A 35 2.223 -0.887 -3.611 1.00 3.51 H new ATOM 0 HD2 PHE A 35 4.932 -2.677 -6.369 1.00 43.50 H new ATOM 0 HE1 PHE A 35 1.139 -3.064 -3.261 1.00 32.25 H new ATOM 0 HE2 PHE A 35 3.847 -4.854 -6.022 1.00 32.11 H new ATOM 0 HZ PHE A 35 1.954 -5.053 -4.461 1.00 70.54 H new ATOM 238 N ARG A 36 7.097 -1.480 -5.230 1.00 52.32 N ATOM 239 CA ARG A 36 8.025 -2.604 -5.274 1.00 73.15 C ATOM 240 C ARG A 36 9.059 -2.499 -4.157 1.00 70.23 C ATOM 241 O ARG A 36 9.281 -3.454 -3.413 1.00 33.54 O ATOM 242 CB ARG A 36 8.728 -2.658 -6.631 1.00 12.53 C ATOM 243 CG ARG A 36 7.946 -3.411 -7.694 1.00 45.33 C ATOM 244 CD ARG A 36 7.824 -4.889 -7.354 1.00 74.53 C ATOM 245 NE ARG A 36 6.435 -5.339 -7.361 1.00 44.25 N ATOM 246 CZ ARG A 36 5.697 -5.429 -8.462 1.00 73.15 C ATOM 247 NH1 ARG A 36 6.212 -5.100 -9.638 1.00 23.41 N ATOM 248 NH2 ARG A 36 4.440 -5.848 -8.387 1.00 42.52 N ATOM 0 H ARG A 36 7.058 -0.932 -6.089 1.00 52.32 H new ATOM 0 HA ARG A 36 7.454 -3.521 -5.131 1.00 73.15 H new ATOM 0 HB2 ARG A 36 8.908 -1.640 -6.978 1.00 12.53 H new ATOM 0 HB3 ARG A 36 9.703 -3.130 -6.507 1.00 12.53 H new ATOM 0 HG2 ARG A 36 6.951 -2.976 -7.792 1.00 45.33 H new ATOM 0 HG3 ARG A 36 8.440 -3.298 -8.659 1.00 45.33 H new ATOM 0 HD2 ARG A 36 8.398 -5.475 -8.072 1.00 74.53 H new ATOM 0 HD3 ARG A 36 8.260 -5.072 -6.372 1.00 74.53 H new ATOM 0 HE ARG A 36 6.008 -5.598 -6.472 1.00 44.25 H new ATOM 0 HH11 ARG A 36 7.177 -4.777 -9.699 1.00 23.41 H new ATOM 0 HH12 ARG A 36 5.643 -5.170 -10.482 1.00 23.41 H new ATOM 0 HH21 ARG A 36 4.040 -6.101 -7.484 1.00 42.52 H new ATOM 0 HH22 ARG A 36 3.874 -5.917 -9.233 1.00 42.52 H new ATOM 259 N SER A 37 9.686 -1.333 -4.046 1.00 72.12 N ATOM 260 CA SER A 37 10.699 -1.104 -3.023 1.00 23.03 C ATOM 261 C SER A 37 10.088 -1.178 -1.626 1.00 3.52 C ATOM 262 O SER A 37 10.716 -1.667 -0.687 1.00 2.11 O ATOM 263 CB SER A 37 11.365 0.258 -3.228 1.00 74.13 C ATOM 264 OG SER A 37 10.410 1.304 -3.179 1.00 14.24 O ATOM 0 H SER A 37 9.510 -0.532 -4.652 1.00 72.12 H new ATOM 0 HA SER A 37 11.453 -1.886 -3.114 1.00 23.03 H new ATOM 0 HB2 SER A 37 12.122 0.416 -2.460 1.00 74.13 H new ATOM 0 HB3 SER A 37 11.878 0.275 -4.189 1.00 74.13 H new ATOM 0 HG SER A 37 9.846 1.270 -3.980 1.00 14.24 H new ATOM 269 N TYR A 38 8.859 -0.691 -1.499 1.00 12.13 N ATOM 270 CA TYR A 38 8.163 -0.699 -0.219 1.00 33.20 C ATOM 271 C TYR A 38 8.059 -2.116 0.335 1.00 73.54 C ATOM 272 O TYR A 38 8.532 -2.402 1.435 1.00 74.50 O ATOM 273 CB TYR A 38 6.765 -0.094 -0.371 1.00 23.55 C ATOM 274 CG TYR A 38 5.840 -0.412 0.782 1.00 20.24 C ATOM 275 CD1 TYR A 38 5.057 -1.559 0.774 1.00 41.15 C ATOM 276 CD2 TYR A 38 5.748 0.435 1.880 1.00 12.11 C ATOM 277 CE1 TYR A 38 4.208 -1.853 1.824 1.00 21.20 C ATOM 278 CE2 TYR A 38 4.904 0.148 2.935 1.00 33.24 C ATOM 279 CZ TYR A 38 4.137 -0.996 2.903 1.00 64.34 C ATOM 280 OH TYR A 38 3.294 -1.285 3.951 1.00 63.43 O ATOM 0 H TYR A 38 8.324 -0.286 -2.267 1.00 12.13 H new ATOM 0 HA TYR A 38 8.738 -0.095 0.483 1.00 33.20 H new ATOM 0 HB2 TYR A 38 6.855 0.988 -0.466 1.00 23.55 H new ATOM 0 HB3 TYR A 38 6.318 -0.459 -1.296 1.00 23.55 H new ATOM 0 HD1 TYR A 38 5.113 -2.233 -0.068 1.00 41.15 H new ATOM 0 HD2 TYR A 38 6.347 1.333 1.909 1.00 12.11 H new ATOM 0 HE1 TYR A 38 3.604 -2.748 1.800 1.00 21.20 H new ATOM 0 HE2 TYR A 38 4.846 0.817 3.781 1.00 33.24 H new ATOM 0 HH TYR A 38 3.364 -0.582 4.630 1.00 63.43 H new ATOM 289 N VAL A 39 7.434 -3.002 -0.435 1.00 32.32 N ATOM 290 CA VAL A 39 7.267 -4.391 -0.023 1.00 11.14 C ATOM 291 C VAL A 39 8.617 -5.081 0.140 1.00 35.32 C ATOM 292 O VAL A 39 8.815 -5.872 1.063 1.00 54.44 O ATOM 293 CB VAL A 39 6.420 -5.180 -1.039 1.00 55.41 C ATOM 294 CG1 VAL A 39 7.032 -5.090 -2.429 1.00 31.32 C ATOM 295 CG2 VAL A 39 6.278 -6.629 -0.602 1.00 65.21 C ATOM 0 H VAL A 39 7.035 -2.782 -1.348 1.00 32.32 H new ATOM 0 HA VAL A 39 6.750 -4.377 0.937 1.00 11.14 H new ATOM 0 HB VAL A 39 5.425 -4.737 -1.078 1.00 55.41 H new ATOM 0 HG11 VAL A 39 6.420 -5.653 -3.133 1.00 31.32 H new ATOM 0 HG12 VAL A 39 7.076 -4.046 -2.740 1.00 31.32 H new ATOM 0 HG13 VAL A 39 8.039 -5.506 -2.411 1.00 31.32 H new ATOM 0 HG21 VAL A 39 5.677 -7.172 -1.331 1.00 65.21 H new ATOM 0 HG22 VAL A 39 7.265 -7.087 -0.533 1.00 65.21 H new ATOM 0 HG23 VAL A 39 5.790 -6.669 0.372 1.00 65.21 H new ATOM 305 N PHE A 40 9.545 -4.775 -0.761 1.00 71.12 N ATOM 306 CA PHE A 40 10.877 -5.366 -0.717 1.00 1.34 C ATOM 307 C PHE A 40 11.607 -4.970 0.563 1.00 73.35 C ATOM 308 O PHE A 40 12.340 -5.770 1.145 1.00 13.35 O ATOM 309 CB PHE A 40 11.692 -4.930 -1.937 1.00 61.14 C ATOM 310 CG PHE A 40 13.169 -5.153 -1.783 1.00 63.31 C ATOM 311 CD1 PHE A 40 13.736 -6.375 -2.108 1.00 22.23 C ATOM 312 CD2 PHE A 40 13.991 -4.141 -1.313 1.00 64.02 C ATOM 313 CE1 PHE A 40 15.095 -6.584 -1.965 1.00 72.25 C ATOM 314 CE2 PHE A 40 15.350 -4.344 -1.169 1.00 23.42 C ATOM 315 CZ PHE A 40 15.903 -5.566 -1.496 1.00 3.23 C ATOM 0 H PHE A 40 9.399 -4.121 -1.530 1.00 71.12 H new ATOM 0 HA PHE A 40 10.766 -6.450 -0.730 1.00 1.34 H new ATOM 0 HB2 PHE A 40 11.340 -5.475 -2.813 1.00 61.14 H new ATOM 0 HB3 PHE A 40 11.510 -3.872 -2.126 1.00 61.14 H new ATOM 0 HD1 PHE A 40 13.109 -7.173 -2.477 1.00 22.23 H new ATOM 0 HD2 PHE A 40 13.564 -3.183 -1.056 1.00 64.02 H new ATOM 0 HE1 PHE A 40 15.525 -7.542 -2.220 1.00 72.25 H new ATOM 0 HE2 PHE A 40 15.979 -3.547 -0.801 1.00 23.42 H new ATOM 0 HZ PHE A 40 16.965 -5.726 -1.385 1.00 3.23 H new ATOM 324 N TYR A 41 11.399 -3.731 0.995 1.00 71.44 N ATOM 325 CA TYR A 41 12.038 -3.227 2.205 1.00 1.41 C ATOM 326 C TYR A 41 11.435 -3.871 3.449 1.00 61.44 C ATOM 327 O TYR A 41 12.152 -4.404 4.296 1.00 71.32 O ATOM 328 CB TYR A 41 11.897 -1.705 2.285 1.00 65.51 C ATOM 329 CG TYR A 41 13.147 -0.960 1.877 1.00 14.43 C ATOM 330 CD1 TYR A 41 14.375 -1.251 2.458 1.00 3.02 C ATOM 331 CD2 TYR A 41 13.100 0.037 0.910 1.00 72.03 C ATOM 332 CE1 TYR A 41 15.520 -0.572 2.088 1.00 53.11 C ATOM 333 CE2 TYR A 41 14.240 0.721 0.532 1.00 74.45 C ATOM 334 CZ TYR A 41 15.447 0.413 1.124 1.00 33.13 C ATOM 335 OH TYR A 41 16.584 1.093 0.753 1.00 52.43 O ATOM 0 H TYR A 41 10.793 -3.058 0.526 1.00 71.44 H new ATOM 0 HA TYR A 41 13.096 -3.486 2.161 1.00 1.41 H new ATOM 0 HB2 TYR A 41 11.072 -1.391 1.646 1.00 65.51 H new ATOM 0 HB3 TYR A 41 11.634 -1.426 3.305 1.00 65.51 H new ATOM 0 HD1 TYR A 41 14.436 -2.022 3.212 1.00 3.02 H new ATOM 0 HD2 TYR A 41 12.156 0.282 0.446 1.00 72.03 H new ATOM 0 HE1 TYR A 41 16.466 -0.811 2.550 1.00 53.11 H new ATOM 0 HE2 TYR A 41 14.186 1.492 -0.222 1.00 74.45 H new ATOM 0 HH TYR A 41 17.364 0.509 0.858 1.00 52.43 H new ATOM 344 N ARG A 42 10.111 -3.818 3.552 1.00 62.14 N ATOM 345 CA ARG A 42 9.409 -4.396 4.691 1.00 71.21 C ATOM 346 C ARG A 42 9.778 -5.866 4.870 1.00 12.52 C ATOM 347 O ARG A 42 10.079 -6.311 5.977 1.00 22.25 O ATOM 348 CB ARG A 42 7.896 -4.257 4.510 1.00 12.21 C ATOM 349 CG ARG A 42 7.090 -4.803 5.677 1.00 42.14 C ATOM 350 CD ARG A 42 5.812 -5.479 5.204 1.00 11.55 C ATOM 351 NE ARG A 42 5.754 -6.882 5.607 1.00 54.43 N ATOM 352 CZ ARG A 42 4.844 -7.739 5.157 1.00 14.31 C ATOM 353 NH1 ARG A 42 3.922 -7.338 4.292 1.00 73.25 N ATOM 354 NH2 ARG A 42 4.856 -8.999 5.570 1.00 54.12 N ATOM 0 H ARG A 42 9.503 -3.380 2.860 1.00 62.14 H new ATOM 0 HA ARG A 42 9.712 -3.852 5.586 1.00 71.21 H new ATOM 0 HB2 ARG A 42 7.651 -3.204 4.371 1.00 12.21 H new ATOM 0 HB3 ARG A 42 7.598 -4.777 3.599 1.00 12.21 H new ATOM 0 HG2 ARG A 42 7.695 -5.517 6.236 1.00 42.14 H new ATOM 0 HG3 ARG A 42 6.842 -3.991 6.361 1.00 42.14 H new ATOM 0 HD2 ARG A 42 4.950 -4.949 5.610 1.00 11.55 H new ATOM 0 HD3 ARG A 42 5.746 -5.411 4.118 1.00 11.55 H new ATOM 0 HE ARG A 42 6.450 -7.222 6.270 1.00 54.43 H new ATOM 0 HH11 ARG A 42 3.911 -6.370 3.971 1.00 73.25 H new ATOM 0 HH12 ARG A 42 3.224 -7.998 3.948 1.00 73.25 H new ATOM 0 HH21 ARG A 42 5.564 -9.311 6.234 1.00 54.12 H new ATOM 0 HH22 ARG A 42 4.157 -9.656 5.224 1.00 54.12 H new ATOM 365 N HIS A 43 9.751 -6.614 3.772 1.00 21.13 N ATOM 366 CA HIS A 43 10.083 -8.035 3.806 1.00 73.32 C ATOM 367 C HIS A 43 11.572 -8.238 4.071 1.00 41.32 C ATOM 368 O HIS A 43 11.963 -9.155 4.793 1.00 54.14 O ATOM 369 CB HIS A 43 9.691 -8.704 2.488 1.00 31.32 C ATOM 370 CG HIS A 43 8.431 -9.509 2.577 1.00 25.42 C ATOM 371 ND1 HIS A 43 8.193 -10.723 3.127 1.00 25.50 N flip ATOM 372 CD2 HIS A 43 7.227 -9.082 2.059 1.00 3.22 C flip ATOM 373 CE1 HIS A 43 6.863 -11.004 2.935 1.00 42.34 C flip ATOM 374 NE2 HIS A 43 6.303 -9.997 2.289 1.00 50.24 N flip ATOM 0 H HIS A 43 9.503 -6.261 2.848 1.00 21.13 H new ATOM 0 HA HIS A 43 9.521 -8.495 4.619 1.00 73.32 H new ATOM 0 HB2 HIS A 43 9.569 -7.937 1.723 1.00 31.32 H new ATOM 0 HB3 HIS A 43 10.505 -9.352 2.163 1.00 31.32 H new ATOM 0 HD2 HIS A 43 7.065 -8.146 1.546 1.00 3.22 H new ATOM 0 HE1 HIS A 43 6.357 -11.902 3.259 1.00 42.34 H new ATOM 0 HE2 HIS A 43 5.323 -9.936 2.014 1.00 50.24 H new ATOM 381 N GLN A 44 12.395 -7.379 3.481 1.00 11.21 N ATOM 382 CA GLN A 44 13.841 -7.466 3.652 1.00 72.04 C ATOM 383 C GLN A 44 14.211 -7.532 5.131 1.00 42.10 C ATOM 384 O GLN A 44 14.911 -8.447 5.564 1.00 72.42 O ATOM 385 CB GLN A 44 14.527 -6.266 2.996 1.00 4.31 C ATOM 386 CG GLN A 44 16.009 -6.160 3.321 1.00 74.14 C ATOM 387 CD GLN A 44 16.308 -5.059 4.319 1.00 25.25 C ATOM 388 OE1 GLN A 44 15.834 -3.931 4.179 1.00 40.01 O ATOM 389 NE2 GLN A 44 17.100 -5.380 5.336 1.00 4.13 N ATOM 0 H GLN A 44 12.086 -6.615 2.880 1.00 11.21 H new ATOM 0 HA GLN A 44 14.184 -8.381 3.169 1.00 72.04 H new ATOM 0 HB2 GLN A 44 14.404 -6.334 1.915 1.00 4.31 H new ATOM 0 HB3 GLN A 44 14.027 -5.352 3.317 1.00 4.31 H new ATOM 0 HG2 GLN A 44 16.359 -7.112 3.720 1.00 74.14 H new ATOM 0 HG3 GLN A 44 16.567 -5.975 2.403 1.00 74.14 H new ATOM 0 HE21 GLN A 44 17.471 -6.327 5.414 1.00 4.13 H new ATOM 0 HE22 GLN A 44 17.337 -4.680 6.039 1.00 4.13 H new ATOM 396 N GLN A 45 13.736 -6.555 5.898 1.00 24.13 N ATOM 397 CA GLN A 45 14.019 -6.503 7.328 1.00 60.21 C ATOM 398 C GLN A 45 13.205 -7.549 8.083 1.00 44.32 C ATOM 399 O GLN A 45 13.710 -8.204 8.994 1.00 12.35 O ATOM 400 CB GLN A 45 13.715 -5.109 7.878 1.00 30.50 C ATOM 401 CG GLN A 45 12.274 -4.671 7.665 1.00 5.31 C ATOM 402 CD GLN A 45 12.024 -3.247 8.121 1.00 64.13 C ATOM 403 OE1 GLN A 45 11.782 -2.995 9.302 1.00 4.33 O ATOM 404 NE2 GLN A 45 12.079 -2.308 7.184 1.00 13.31 N ATOM 0 H GLN A 45 13.155 -5.791 5.554 1.00 24.13 H new ATOM 0 HA GLN A 45 15.077 -6.720 7.472 1.00 60.21 H new ATOM 0 HB2 GLN A 45 13.937 -5.092 8.945 1.00 30.50 H new ATOM 0 HB3 GLN A 45 14.379 -4.387 7.403 1.00 30.50 H new ATOM 0 HG2 GLN A 45 12.024 -4.759 6.608 1.00 5.31 H new ATOM 0 HG3 GLN A 45 11.610 -5.344 8.207 1.00 5.31 H new ATOM 0 HE21 GLN A 45 12.283 -2.563 6.218 1.00 13.31 H new ATOM 0 HE22 GLN A 45 11.917 -1.332 7.430 1.00 13.31 H new ATOM 411 N GLU A 46 11.943 -7.702 7.695 1.00 70.13 N ATOM 412 CA GLU A 46 11.059 -8.668 8.338 1.00 40.25 C ATOM 413 C GLU A 46 11.676 -10.064 8.321 1.00 64.22 C ATOM 414 O GLU A 46 11.409 -10.881 9.201 1.00 61.32 O ATOM 415 CB GLU A 46 9.698 -8.691 7.638 1.00 65.21 C ATOM 416 CG GLU A 46 8.724 -7.651 8.165 1.00 12.34 C ATOM 417 CD GLU A 46 7.626 -8.258 9.015 1.00 54.24 C ATOM 418 OE1 GLU A 46 7.928 -9.171 9.811 1.00 43.40 O ATOM 419 OE2 GLU A 46 6.463 -7.821 8.883 1.00 11.15 O ATOM 0 H GLU A 46 11.510 -7.170 6.940 1.00 70.13 H new ATOM 0 HA GLU A 46 10.921 -8.363 9.375 1.00 40.25 H new ATOM 0 HB2 GLU A 46 9.846 -8.530 6.570 1.00 65.21 H new ATOM 0 HB3 GLU A 46 9.257 -9.681 7.753 1.00 65.21 H new ATOM 0 HG2 GLU A 46 9.269 -6.914 8.755 1.00 12.34 H new ATOM 0 HG3 GLU A 46 8.276 -7.119 7.325 1.00 12.34 H new ATOM 424 N GLN A 47 12.501 -10.328 7.313 1.00 45.52 N ATOM 425 CA GLN A 47 13.154 -11.625 7.180 1.00 34.20 C ATOM 426 C GLN A 47 13.885 -12.000 8.466 1.00 74.11 C ATOM 427 O GLN A 47 14.036 -13.179 8.783 1.00 11.41 O ATOM 428 CB GLN A 47 14.136 -11.608 6.008 1.00 33.15 C ATOM 429 CG GLN A 47 13.904 -12.723 5.003 1.00 64.23 C ATOM 430 CD GLN A 47 13.030 -12.290 3.842 1.00 32.21 C ATOM 431 OE1 GLN A 47 13.441 -12.354 2.683 1.00 64.41 O ATOM 432 NE2 GLN A 47 11.817 -11.845 4.148 1.00 64.31 N ATOM 0 H GLN A 47 12.733 -9.661 6.577 1.00 45.52 H new ATOM 0 HA GLN A 47 12.385 -12.373 6.989 1.00 34.20 H new ATOM 0 HB2 GLN A 47 14.062 -10.648 5.497 1.00 33.15 H new ATOM 0 HB3 GLN A 47 15.152 -11.685 6.395 1.00 33.15 H new ATOM 0 HG2 GLN A 47 14.865 -13.068 4.621 1.00 64.23 H new ATOM 0 HG3 GLN A 47 13.439 -13.570 5.507 1.00 64.23 H new ATOM 0 HE21 GLN A 47 11.518 -11.809 5.122 1.00 64.31 H new ATOM 0 HE22 GLN A 47 11.184 -11.539 3.409 1.00 64.31 H new ATOM 439 N GLU A 48 14.335 -10.989 9.202 1.00 13.14 N ATOM 440 CA GLU A 48 15.051 -11.213 10.452 1.00 70.31 C ATOM 441 C GLU A 48 14.161 -11.925 11.467 1.00 73.44 C ATOM 442 O GLU A 48 14.640 -12.704 12.290 1.00 62.10 O ATOM 443 CB GLU A 48 15.542 -9.885 11.030 1.00 13.03 C ATOM 444 CG GLU A 48 14.441 -9.053 11.666 1.00 72.24 C ATOM 445 CD GLU A 48 14.285 -9.327 13.150 1.00 4.43 C ATOM 446 OE1 GLU A 48 15.305 -9.295 13.870 1.00 11.53 O ATOM 447 OE2 GLU A 48 13.143 -9.573 13.590 1.00 61.53 O ATOM 0 H GLU A 48 14.216 -10.007 8.954 1.00 13.14 H new ATOM 0 HA GLU A 48 15.911 -11.848 10.240 1.00 70.31 H new ATOM 0 HB2 GLU A 48 16.311 -10.085 11.776 1.00 13.03 H new ATOM 0 HB3 GLU A 48 16.012 -9.304 10.236 1.00 13.03 H new ATOM 0 HG2 GLU A 48 14.658 -7.995 11.517 1.00 72.24 H new ATOM 0 HG3 GLU A 48 13.497 -9.259 11.161 1.00 72.24 H new ATOM 452 N ALA A 49 12.863 -11.649 11.403 1.00 74.23 N ATOM 453 CA ALA A 49 11.905 -12.263 12.316 1.00 53.44 C ATOM 454 C ALA A 49 11.548 -13.676 11.867 1.00 51.44 C ATOM 455 O ALA A 49 11.748 -14.639 12.605 1.00 64.13 O ATOM 456 CB ALA A 49 10.651 -11.407 12.419 1.00 3.31 C ATOM 0 H ALA A 49 12.450 -11.004 10.729 1.00 74.23 H new ATOM 0 HA ALA A 49 12.369 -12.329 13.300 1.00 53.44 H new ATOM 0 HB1 ALA A 49 9.945 -11.877 13.103 1.00 3.31 H new ATOM 0 HB2 ALA A 49 10.915 -10.418 12.793 1.00 3.31 H new ATOM 0 HB3 ALA A 49 10.193 -11.312 11.434 1.00 3.31 H new ATOM 462 N GLU A 50 11.018 -13.791 10.653 1.00 13.43 N ATOM 463 CA GLU A 50 10.633 -15.086 10.108 1.00 44.04 C ATOM 464 C GLU A 50 10.827 -15.121 8.595 1.00 14.03 C ATOM 465 O GLU A 50 11.267 -14.143 7.992 1.00 33.34 O ATOM 466 CB GLU A 50 9.174 -15.396 10.452 1.00 71.11 C ATOM 467 CG GLU A 50 8.331 -14.156 10.700 1.00 63.03 C ATOM 468 CD GLU A 50 6.882 -14.486 11.002 1.00 1.33 C ATOM 469 OE1 GLU A 50 6.638 -15.347 11.872 1.00 63.30 O ATOM 470 OE2 GLU A 50 5.992 -13.883 10.366 1.00 34.34 O ATOM 0 H GLU A 50 10.846 -13.003 10.029 1.00 13.43 H new ATOM 0 HA GLU A 50 11.275 -15.844 10.557 1.00 44.04 H new ATOM 0 HB2 GLU A 50 8.731 -15.969 9.637 1.00 71.11 H new ATOM 0 HB3 GLU A 50 9.145 -16.028 11.339 1.00 71.11 H new ATOM 0 HG2 GLU A 50 8.753 -13.595 11.534 1.00 63.03 H new ATOM 0 HG3 GLU A 50 8.377 -13.509 9.824 1.00 63.03 H new ATOM 475 N GLY A 51 10.496 -16.257 7.987 1.00 13.44 N ATOM 476 CA GLY A 51 10.642 -16.398 6.550 1.00 3.42 C ATOM 477 C GLY A 51 9.425 -17.027 5.902 1.00 23.51 C ATOM 478 O GLY A 51 9.550 -17.905 5.048 1.00 32.34 O ATOM 0 H GLY A 51 10.130 -17.081 8.464 1.00 13.44 H new ATOM 0 HA2 GLY A 51 10.819 -15.417 6.108 1.00 3.42 H new ATOM 0 HA3 GLY A 51 11.520 -17.007 6.335 1.00 3.42 H new ATOM 482 N VAL A 52 8.241 -16.581 6.311 1.00 21.32 N ATOM 483 CA VAL A 52 6.996 -17.107 5.766 1.00 52.33 C ATOM 484 C VAL A 52 6.427 -16.179 4.699 1.00 14.12 C ATOM 485 O VAL A 52 6.334 -14.968 4.901 1.00 40.13 O ATOM 486 CB VAL A 52 5.941 -17.309 6.870 1.00 73.35 C ATOM 487 CG1 VAL A 52 6.438 -18.303 7.909 1.00 43.10 C ATOM 488 CG2 VAL A 52 5.588 -15.978 7.519 1.00 65.42 C ATOM 0 H VAL A 52 8.119 -15.856 7.018 1.00 21.32 H new ATOM 0 HA VAL A 52 7.231 -18.072 5.316 1.00 52.33 H new ATOM 0 HB VAL A 52 5.038 -17.717 6.415 1.00 73.35 H new ATOM 0 HG11 VAL A 52 5.679 -18.433 8.681 1.00 43.10 H new ATOM 0 HG12 VAL A 52 6.636 -19.262 7.430 1.00 43.10 H new ATOM 0 HG13 VAL A 52 7.356 -17.928 8.362 1.00 43.10 H new ATOM 0 HG21 VAL A 52 4.841 -16.139 8.297 1.00 65.42 H new ATOM 0 HG22 VAL A 52 6.483 -15.540 7.960 1.00 65.42 H new ATOM 0 HG23 VAL A 52 5.186 -15.301 6.765 1.00 65.42 H new ATOM 498 N ALA A 53 6.048 -16.754 3.563 1.00 12.13 N ATOM 499 CA ALA A 53 5.486 -15.978 2.464 1.00 53.11 C ATOM 500 C ALA A 53 6.390 -14.805 2.101 1.00 5.33 C ATOM 501 O ALA A 53 5.915 -13.700 1.839 1.00 62.11 O ATOM 502 CB ALA A 53 4.094 -15.481 2.827 1.00 41.52 C ATOM 0 H ALA A 53 6.120 -17.755 3.379 1.00 12.13 H new ATOM 0 HA ALA A 53 5.412 -16.629 1.593 1.00 53.11 H new ATOM 0 HB1 ALA A 53 3.686 -14.903 1.998 1.00 41.52 H new ATOM 0 HB2 ALA A 53 3.445 -16.333 3.030 1.00 41.52 H new ATOM 0 HB3 ALA A 53 4.153 -14.851 3.714 1.00 41.52 H new ATOM 508 N ALA A 54 7.696 -15.053 2.088 1.00 34.14 N ATOM 509 CA ALA A 54 8.666 -14.017 1.756 1.00 2.23 C ATOM 510 C ALA A 54 9.070 -14.095 0.287 1.00 34.22 C ATOM 511 O ALA A 54 8.893 -15.116 -0.378 1.00 35.33 O ATOM 512 CB ALA A 54 9.892 -14.137 2.649 1.00 33.20 C ATOM 0 H ALA A 54 8.106 -15.962 2.303 1.00 34.14 H new ATOM 0 HA ALA A 54 8.199 -13.047 1.927 1.00 2.23 H new ATOM 0 HB1 ALA A 54 10.608 -13.357 2.390 1.00 33.20 H new ATOM 0 HB2 ALA A 54 9.595 -14.025 3.692 1.00 33.20 H new ATOM 0 HB3 ALA A 54 10.352 -15.115 2.506 1.00 33.20 H new ATOM 518 N PRO A 55 9.627 -12.991 -0.233 1.00 74.21 N ATOM 519 CA PRO A 55 10.068 -12.908 -1.629 1.00 61.34 C ATOM 520 C PRO A 55 11.294 -13.773 -1.901 1.00 53.33 C ATOM 521 O PRO A 55 11.987 -14.192 -0.976 1.00 64.50 O ATOM 522 CB PRO A 55 10.408 -11.427 -1.807 1.00 73.22 C ATOM 523 CG PRO A 55 10.739 -10.947 -0.436 1.00 33.35 C ATOM 524 CD PRO A 55 9.869 -11.737 0.502 1.00 12.31 C ATOM 0 HA PRO A 55 9.306 -13.270 -2.319 1.00 61.34 H new ATOM 0 HB2 PRO A 55 11.249 -11.293 -2.487 1.00 73.22 H new ATOM 0 HB3 PRO A 55 9.567 -10.875 -2.227 1.00 73.22 H new ATOM 0 HG2 PRO A 55 11.795 -11.102 -0.213 1.00 33.35 H new ATOM 0 HG3 PRO A 55 10.546 -9.878 -0.340 1.00 33.35 H new ATOM 0 HD2 PRO A 55 10.367 -11.919 1.455 1.00 12.31 H new ATOM 0 HD3 PRO A 55 8.938 -11.215 0.723 1.00 12.31 H new ATOM 529 N ALA A 56 11.554 -14.035 -3.178 1.00 23.11 N ATOM 530 CA ALA A 56 12.699 -14.847 -3.572 1.00 44.31 C ATOM 531 C ALA A 56 12.794 -14.962 -5.090 1.00 21.21 C ATOM 532 O ALA A 56 11.939 -15.574 -5.730 1.00 54.53 O ATOM 533 CB ALA A 56 12.606 -16.229 -2.942 1.00 24.12 C ATOM 0 H ALA A 56 10.988 -13.697 -3.956 1.00 23.11 H new ATOM 0 HA ALA A 56 13.603 -14.355 -3.213 1.00 44.31 H new ATOM 0 HB1 ALA A 56 13.467 -16.825 -3.244 1.00 24.12 H new ATOM 0 HB2 ALA A 56 12.594 -16.134 -1.856 1.00 24.12 H new ATOM 0 HB3 ALA A 56 11.691 -16.719 -3.274 1.00 24.12 H new ATOM 539 N ASP A 57 13.838 -14.369 -5.658 1.00 43.42 N ATOM 540 CA ASP A 57 14.045 -14.405 -7.102 1.00 32.43 C ATOM 541 C ASP A 57 15.312 -13.648 -7.487 1.00 3.52 C ATOM 542 O ASP A 57 15.274 -12.479 -7.871 1.00 62.23 O ATOM 543 CB ASP A 57 12.838 -13.807 -7.826 1.00 42.12 C ATOM 544 CG ASP A 57 12.345 -12.531 -7.173 1.00 41.12 C ATOM 545 OD1 ASP A 57 13.157 -11.849 -6.512 1.00 44.54 O ATOM 546 OD2 ASP A 57 11.147 -12.214 -7.323 1.00 61.03 O ATOM 0 H ASP A 57 14.554 -13.858 -5.142 1.00 43.42 H new ATOM 0 HA ASP A 57 14.160 -15.446 -7.403 1.00 32.43 H new ATOM 0 HB2 ASP A 57 13.105 -13.601 -8.863 1.00 42.12 H new ATOM 0 HB3 ASP A 57 12.030 -14.538 -7.844 1.00 42.12 H new ATOM 550 N PRO A 58 16.463 -14.329 -7.384 1.00 22.31 N ATOM 551 CA PRO A 58 17.763 -13.740 -7.716 1.00 4.23 C ATOM 552 C PRO A 58 17.926 -13.503 -9.214 1.00 21.30 C ATOM 553 O PRO A 58 18.932 -12.951 -9.657 1.00 11.52 O ATOM 554 CB PRO A 58 18.764 -14.793 -7.231 1.00 73.41 C ATOM 555 CG PRO A 58 18.009 -16.077 -7.260 1.00 53.42 C ATOM 556 CD PRO A 58 16.584 -15.726 -6.933 1.00 55.12 C ATOM 0 HA PRO A 58 17.896 -12.761 -7.256 1.00 4.23 H new ATOM 0 HB2 PRO A 58 19.640 -14.834 -7.879 1.00 73.41 H new ATOM 0 HB3 PRO A 58 19.121 -14.566 -6.226 1.00 73.41 H new ATOM 0 HG2 PRO A 58 18.080 -16.549 -8.240 1.00 53.42 H new ATOM 0 HG3 PRO A 58 18.413 -16.784 -6.535 1.00 53.42 H new ATOM 0 HD2 PRO A 58 15.881 -16.378 -7.452 1.00 55.12 H new ATOM 0 HD3 PRO A 58 16.381 -15.823 -5.866 1.00 55.12 H new ATOM 561 N GLU A 59 16.930 -13.923 -9.987 1.00 43.11 N ATOM 562 CA GLU A 59 16.964 -13.756 -11.435 1.00 12.32 C ATOM 563 C GLU A 59 16.598 -12.327 -11.826 1.00 20.50 C ATOM 564 O GLU A 59 16.566 -11.431 -10.984 1.00 31.32 O ATOM 565 CB GLU A 59 16.006 -14.742 -12.108 1.00 73.11 C ATOM 566 CG GLU A 59 16.624 -15.488 -13.278 1.00 71.42 C ATOM 567 CD GLU A 59 17.291 -16.783 -12.857 1.00 21.55 C ATOM 568 OE1 GLU A 59 16.567 -17.768 -12.602 1.00 1.52 O ATOM 569 OE2 GLU A 59 18.538 -16.811 -12.781 1.00 75.55 O ATOM 0 H GLU A 59 16.090 -14.381 -9.635 1.00 43.11 H new ATOM 0 HA GLU A 59 17.980 -13.959 -11.775 1.00 12.32 H new ATOM 0 HB2 GLU A 59 15.663 -15.465 -11.368 1.00 73.11 H new ATOM 0 HB3 GLU A 59 15.127 -14.201 -12.457 1.00 73.11 H new ATOM 0 HG2 GLU A 59 15.851 -15.705 -14.015 1.00 71.42 H new ATOM 0 HG3 GLU A 59 17.359 -14.847 -13.766 1.00 71.42 H new ATOM 574 N MET A 60 16.324 -12.123 -13.111 1.00 20.43 N ATOM 575 CA MET A 60 15.960 -10.804 -13.613 1.00 15.14 C ATOM 576 C MET A 60 14.759 -10.246 -12.857 1.00 33.34 C ATOM 577 O MET A 60 14.534 -9.035 -12.835 1.00 63.12 O ATOM 578 CB MET A 60 15.648 -10.873 -15.109 1.00 43.24 C ATOM 579 CG MET A 60 14.725 -12.022 -15.484 1.00 0.44 C ATOM 580 SD MET A 60 13.730 -11.665 -16.946 1.00 23.55 S ATOM 581 CE MET A 60 12.083 -11.680 -16.245 1.00 60.24 C ATOM 0 H MET A 60 16.347 -12.854 -13.822 1.00 20.43 H new ATOM 0 HA MET A 60 16.807 -10.137 -13.456 1.00 15.14 H new ATOM 0 HB2 MET A 60 15.191 -9.934 -15.420 1.00 43.24 H new ATOM 0 HB3 MET A 60 16.582 -10.972 -15.663 1.00 43.24 H new ATOM 0 HG2 MET A 60 15.320 -12.917 -15.664 1.00 0.44 H new ATOM 0 HG3 MET A 60 14.065 -12.242 -14.645 1.00 0.44 H new ATOM 0 HE1 MET A 60 11.353 -11.474 -17.028 1.00 60.24 H new ATOM 0 HE2 MET A 60 11.882 -12.659 -15.809 1.00 60.24 H new ATOM 0 HE3 MET A 60 12.010 -10.916 -15.471 1.00 60.24 H new ATOM 589 N VAL A 61 13.990 -11.135 -12.236 1.00 4.22 N ATOM 590 CA VAL A 61 12.812 -10.731 -11.477 1.00 0.45 C ATOM 591 C VAL A 61 13.207 -10.003 -10.197 1.00 14.30 C ATOM 592 O VAL A 61 12.355 -9.473 -9.483 1.00 24.32 O ATOM 593 CB VAL A 61 11.935 -11.943 -11.115 1.00 4.24 C ATOM 594 CG1 VAL A 61 10.567 -11.487 -10.632 1.00 44.23 C ATOM 595 CG2 VAL A 61 11.804 -12.880 -12.307 1.00 72.43 C ATOM 0 H VAL A 61 14.162 -12.140 -12.244 1.00 4.22 H new ATOM 0 HA VAL A 61 12.241 -10.056 -12.114 1.00 0.45 H new ATOM 0 HB VAL A 61 12.416 -12.489 -10.304 1.00 4.24 H new ATOM 0 HG11 VAL A 61 9.961 -12.358 -10.381 1.00 44.23 H new ATOM 0 HG12 VAL A 61 10.684 -10.859 -9.749 1.00 44.23 H new ATOM 0 HG13 VAL A 61 10.074 -10.917 -11.420 1.00 44.23 H new ATOM 0 HG21 VAL A 61 11.181 -13.732 -12.034 1.00 72.43 H new ATOM 0 HG22 VAL A 61 11.345 -12.347 -13.140 1.00 72.43 H new ATOM 0 HG23 VAL A 61 12.792 -13.233 -12.602 1.00 72.43 H new ATOM 605 N THR A 62 14.505 -9.978 -9.913 1.00 13.23 N ATOM 606 CA THR A 62 15.014 -9.315 -8.718 1.00 44.31 C ATOM 607 C THR A 62 14.387 -7.936 -8.546 1.00 44.31 C ATOM 608 O THR A 62 13.788 -7.395 -9.476 1.00 14.44 O ATOM 609 CB THR A 62 16.546 -9.168 -8.767 1.00 52.30 C ATOM 610 OG1 THR A 62 16.981 -9.020 -10.123 1.00 5.43 O ATOM 611 CG2 THR A 62 17.227 -10.374 -8.139 1.00 43.03 C ATOM 0 H THR A 62 15.224 -10.409 -10.494 1.00 13.23 H new ATOM 0 HA THR A 62 14.744 -9.942 -7.868 1.00 44.31 H new ATOM 0 HB THR A 62 16.821 -8.280 -8.199 1.00 52.30 H new ATOM 0 HG1 THR A 62 17.204 -9.900 -10.493 1.00 5.43 H new ATOM 0 HG21 THR A 62 18.309 -10.246 -8.186 1.00 43.03 H new ATOM 0 HG22 THR A 62 16.917 -10.466 -7.098 1.00 43.03 H new ATOM 0 HG23 THR A 62 16.944 -11.276 -8.682 1.00 43.03 H new ATOM 619 N LEU A 63 14.528 -7.373 -7.352 1.00 31.23 N ATOM 620 CA LEU A 63 13.977 -6.054 -7.057 1.00 45.13 C ATOM 621 C LEU A 63 15.086 -5.017 -6.926 1.00 34.03 C ATOM 622 O LEU A 63 15.560 -4.714 -5.831 1.00 72.22 O ATOM 623 CB LEU A 63 13.151 -6.102 -5.770 1.00 31.05 C ATOM 624 CG LEU A 63 11.966 -5.139 -5.698 1.00 30.11 C ATOM 625 CD1 LEU A 63 12.325 -3.801 -6.326 1.00 62.02 C ATOM 626 CD2 LEU A 63 10.746 -5.741 -6.381 1.00 12.04 C ATOM 0 H LEU A 63 15.019 -7.809 -6.571 1.00 31.23 H new ATOM 0 HA LEU A 63 13.331 -5.763 -7.885 1.00 45.13 H new ATOM 0 HB2 LEU A 63 12.777 -7.117 -5.640 1.00 31.05 H new ATOM 0 HB3 LEU A 63 13.813 -5.896 -4.929 1.00 31.05 H new ATOM 0 HG LEU A 63 11.724 -4.971 -4.649 1.00 30.11 H new ATOM 0 HD11 LEU A 63 11.469 -3.129 -6.265 1.00 62.02 H new ATOM 0 HD12 LEU A 63 13.169 -3.363 -5.792 1.00 62.02 H new ATOM 0 HD13 LEU A 63 12.595 -3.951 -7.371 1.00 62.02 H new ATOM 0 HD21 LEU A 63 9.912 -5.041 -6.320 1.00 12.04 H new ATOM 0 HD22 LEU A 63 10.976 -5.940 -7.428 1.00 12.04 H new ATOM 0 HD23 LEU A 63 10.474 -6.673 -5.885 1.00 12.04 H new ATOM 637 N PRO A 64 15.510 -4.455 -8.067 1.00 43.44 N ATOM 638 CA PRO A 64 16.567 -3.440 -8.106 1.00 50.44 C ATOM 639 C PRO A 64 16.117 -2.112 -7.506 1.00 31.33 C ATOM 640 O PRO A 64 15.671 -1.214 -8.222 1.00 21.05 O ATOM 641 CB PRO A 64 16.852 -3.281 -9.601 1.00 42.34 C ATOM 642 CG PRO A 64 15.588 -3.693 -10.274 1.00 74.02 C ATOM 643 CD PRO A 64 14.990 -4.768 -9.409 1.00 52.53 C ATOM 0 HA PRO A 64 17.438 -3.736 -7.521 1.00 50.44 H new ATOM 0 HB2 PRO A 64 17.114 -2.252 -9.847 1.00 42.34 H new ATOM 0 HB3 PRO A 64 17.689 -3.906 -9.913 1.00 42.34 H new ATOM 0 HG2 PRO A 64 14.906 -2.849 -10.374 1.00 74.02 H new ATOM 0 HG3 PRO A 64 15.785 -4.065 -11.279 1.00 74.02 H new ATOM 0 HD2 PRO A 64 13.901 -4.744 -9.433 1.00 52.53 H new ATOM 0 HD3 PRO A 64 15.294 -5.762 -9.736 1.00 52.53 H new ATOM 648 N LEU A 65 16.237 -1.993 -6.188 1.00 60.24 N ATOM 649 CA LEU A 65 15.843 -0.774 -5.491 1.00 73.13 C ATOM 650 C LEU A 65 16.478 0.453 -6.138 1.00 44.12 C ATOM 651 O LEU A 65 17.460 0.341 -6.870 1.00 10.40 O ATOM 652 CB LEU A 65 16.246 -0.853 -4.017 1.00 2.55 C ATOM 653 CG LEU A 65 15.363 -0.079 -3.038 1.00 73.33 C ATOM 654 CD1 LEU A 65 14.484 -1.033 -2.243 1.00 4.10 C ATOM 655 CD2 LEU A 65 16.216 0.766 -2.103 1.00 22.12 C ATOM 0 H LEU A 65 16.604 -2.726 -5.581 1.00 60.24 H new ATOM 0 HA LEU A 65 14.759 -0.679 -5.561 1.00 73.13 H new ATOM 0 HB2 LEU A 65 16.253 -1.901 -3.718 1.00 2.55 H new ATOM 0 HB3 LEU A 65 17.268 -0.487 -3.920 1.00 2.55 H new ATOM 0 HG LEU A 65 14.717 0.587 -3.610 1.00 73.33 H new ATOM 0 HD11 LEU A 65 13.862 -0.464 -1.551 1.00 4.10 H new ATOM 0 HD12 LEU A 65 13.847 -1.595 -2.926 1.00 4.10 H new ATOM 0 HD13 LEU A 65 15.112 -1.724 -1.682 1.00 4.10 H new ATOM 0 HD21 LEU A 65 15.570 1.310 -1.413 1.00 22.12 H new ATOM 0 HD22 LEU A 65 16.887 0.119 -1.538 1.00 22.12 H new ATOM 0 HD23 LEU A 65 16.802 1.475 -2.687 1.00 22.12 H new ATOM 666 N GLN A 66 15.909 1.622 -5.861 1.00 33.11 N ATOM 667 CA GLN A 66 16.421 2.869 -6.416 1.00 11.41 C ATOM 668 C GLN A 66 16.943 3.783 -5.312 1.00 52.23 C ATOM 669 O GLN A 66 16.382 4.844 -5.033 1.00 62.02 O ATOM 670 CB GLN A 66 15.328 3.585 -7.212 1.00 5.11 C ATOM 671 CG GLN A 66 15.862 4.424 -8.361 1.00 3.55 C ATOM 672 CD GLN A 66 15.696 3.745 -9.707 1.00 60.32 C ATOM 673 OE1 GLN A 66 14.973 4.233 -10.576 1.00 65.44 O ATOM 674 NE2 GLN A 66 16.367 2.613 -9.886 1.00 50.00 N ATOM 0 H GLN A 66 15.095 1.731 -5.257 1.00 33.11 H new ATOM 0 HA GLN A 66 17.248 2.627 -7.084 1.00 11.41 H new ATOM 0 HB2 GLN A 66 14.633 2.844 -7.607 1.00 5.11 H new ATOM 0 HB3 GLN A 66 14.761 4.227 -6.538 1.00 5.11 H new ATOM 0 HG2 GLN A 66 15.345 5.383 -8.376 1.00 3.55 H new ATOM 0 HG3 GLN A 66 16.918 4.634 -8.192 1.00 3.55 H new ATOM 0 HE21 GLN A 66 16.955 2.245 -9.138 1.00 50.00 H new ATOM 0 HE22 GLN A 66 16.295 2.112 -10.771 1.00 50.00 H new ATOM 681 N PRO A 67 18.041 3.365 -4.666 1.00 43.01 N ATOM 682 CA PRO A 67 18.662 4.131 -3.582 1.00 30.12 C ATOM 683 C PRO A 67 19.324 5.411 -4.081 1.00 23.43 C ATOM 684 O PRO A 67 19.771 6.239 -3.289 1.00 20.04 O ATOM 685 CB PRO A 67 19.713 3.168 -3.023 1.00 21.10 C ATOM 686 CG PRO A 67 20.035 2.259 -4.159 1.00 52.45 C ATOM 687 CD PRO A 67 18.762 2.111 -4.945 1.00 54.01 C ATOM 0 HA PRO A 67 17.930 4.459 -2.844 1.00 30.12 H new ATOM 0 HB2 PRO A 67 20.599 3.703 -2.681 1.00 21.10 H new ATOM 0 HB3 PRO A 67 19.327 2.612 -2.169 1.00 21.10 H new ATOM 0 HG2 PRO A 67 20.830 2.675 -4.778 1.00 52.45 H new ATOM 0 HG3 PRO A 67 20.385 1.292 -3.798 1.00 52.45 H new ATOM 0 HD2 PRO A 67 18.959 1.989 -6.010 1.00 54.01 H new ATOM 0 HD3 PRO A 67 18.191 1.239 -4.625 1.00 54.01 H new ATOM 692 N SER A 68 19.383 5.566 -5.400 1.00 64.24 N ATOM 693 CA SER A 68 19.992 6.743 -6.005 1.00 25.03 C ATOM 694 C SER A 68 18.961 7.848 -6.203 1.00 52.52 C ATOM 695 O SER A 68 19.308 8.992 -6.500 1.00 24.02 O ATOM 696 CB SER A 68 20.632 6.380 -7.347 1.00 22.31 C ATOM 697 OG SER A 68 20.406 7.393 -8.311 1.00 51.41 O ATOM 0 H SER A 68 19.016 4.890 -6.070 1.00 64.24 H new ATOM 0 HA SER A 68 20.765 7.109 -5.329 1.00 25.03 H new ATOM 0 HB2 SER A 68 21.704 6.233 -7.214 1.00 22.31 H new ATOM 0 HB3 SER A 68 20.223 5.435 -7.705 1.00 22.31 H new ATOM 0 HG SER A 68 20.826 7.138 -9.159 1.00 51.41 H new ATOM 702 N SER A 69 17.689 7.499 -6.038 1.00 14.01 N ATOM 703 CA SER A 69 16.604 8.460 -6.203 1.00 23.34 C ATOM 704 C SER A 69 15.794 8.589 -4.917 1.00 74.30 C ATOM 705 O SER A 69 15.928 7.779 -3.999 1.00 12.44 O ATOM 706 CB SER A 69 15.691 8.038 -7.354 1.00 4.52 C ATOM 707 OG SER A 69 15.648 9.033 -8.362 1.00 44.35 O ATOM 0 H SER A 69 17.384 6.558 -5.790 1.00 14.01 H new ATOM 0 HA SER A 69 17.043 9.430 -6.435 1.00 23.34 H new ATOM 0 HB2 SER A 69 16.047 7.100 -7.780 1.00 4.52 H new ATOM 0 HB3 SER A 69 14.685 7.855 -6.976 1.00 4.52 H new ATOM 0 HG SER A 69 15.059 8.738 -9.088 1.00 44.35 H new ATOM 712 N THR A 70 14.949 9.615 -4.857 1.00 43.40 N ATOM 713 CA THR A 70 14.117 9.852 -3.685 1.00 73.43 C ATOM 714 C THR A 70 13.110 8.725 -3.487 1.00 4.13 C ATOM 715 O THR A 70 12.772 8.374 -2.357 1.00 62.12 O ATOM 716 CB THR A 70 13.358 11.189 -3.797 1.00 21.40 C ATOM 717 OG1 THR A 70 14.164 12.154 -4.482 1.00 21.41 O ATOM 718 CG2 THR A 70 12.987 11.716 -2.419 1.00 72.13 C ATOM 0 H THR A 70 14.824 10.295 -5.607 1.00 43.40 H new ATOM 0 HA THR A 70 14.786 9.892 -2.826 1.00 73.43 H new ATOM 0 HB THR A 70 12.442 11.016 -4.362 1.00 21.40 H new ATOM 0 HG1 THR A 70 13.674 13.000 -4.551 1.00 21.41 H new ATOM 0 HG21 THR A 70 12.452 12.660 -2.522 1.00 72.13 H new ATOM 0 HG22 THR A 70 12.350 10.992 -1.912 1.00 72.13 H new ATOM 0 HG23 THR A 70 13.893 11.874 -1.834 1.00 72.13 H new ATOM 726 N MET A 71 12.637 8.160 -4.593 1.00 50.43 N ATOM 727 CA MET A 71 11.670 7.070 -4.540 1.00 24.30 C ATOM 728 C MET A 71 12.154 5.958 -3.615 1.00 24.22 C ATOM 729 O MET A 71 11.414 5.488 -2.752 1.00 54.22 O ATOM 730 CB MET A 71 11.423 6.510 -5.943 1.00 61.20 C ATOM 731 CG MET A 71 10.315 7.228 -6.696 1.00 41.13 C ATOM 732 SD MET A 71 10.925 8.610 -7.680 1.00 24.01 S ATOM 733 CE MET A 71 10.393 9.998 -6.683 1.00 62.25 C ATOM 0 H MET A 71 12.907 8.439 -5.536 1.00 50.43 H new ATOM 0 HA MET A 71 10.735 7.467 -4.144 1.00 24.30 H new ATOM 0 HB2 MET A 71 12.346 6.576 -6.520 1.00 61.20 H new ATOM 0 HB3 MET A 71 11.172 5.452 -5.864 1.00 61.20 H new ATOM 0 HG2 MET A 71 9.806 6.519 -7.349 1.00 41.13 H new ATOM 0 HG3 MET A 71 9.575 7.593 -5.984 1.00 41.13 H new ATOM 0 HE1 MET A 71 10.249 10.870 -7.321 1.00 62.25 H new ATOM 0 HE2 MET A 71 9.454 9.751 -6.188 1.00 62.25 H new ATOM 0 HE3 MET A 71 11.152 10.219 -5.932 1.00 62.25 H new ATOM 741 N GLY A 72 13.403 5.541 -3.801 1.00 23.32 N ATOM 742 CA GLY A 72 13.965 4.487 -2.976 1.00 14.14 C ATOM 743 C GLY A 72 13.964 4.842 -1.503 1.00 31.14 C ATOM 744 O GLY A 72 14.048 3.963 -0.646 1.00 41.54 O ATOM 0 H GLY A 72 14.036 5.914 -4.508 1.00 23.32 H new ATOM 0 HA2 GLY A 72 13.396 3.570 -3.126 1.00 14.14 H new ATOM 0 HA3 GLY A 72 14.987 4.284 -3.297 1.00 14.14 H new ATOM 748 N GLN A 73 13.871 6.135 -1.207 1.00 1.14 N ATOM 749 CA GLN A 73 13.863 6.603 0.174 1.00 12.02 C ATOM 750 C GLN A 73 12.441 6.654 0.723 1.00 51.11 C ATOM 751 O GLN A 73 12.231 6.615 1.935 1.00 71.42 O ATOM 752 CB GLN A 73 14.508 7.988 0.269 1.00 1.11 C ATOM 753 CG GLN A 73 14.335 8.647 1.627 1.00 51.20 C ATOM 754 CD GLN A 73 14.999 7.867 2.744 1.00 54.13 C ATOM 755 OE1 GLN A 73 16.144 7.433 2.618 1.00 4.11 O ATOM 756 NE2 GLN A 73 14.282 7.686 3.848 1.00 14.43 N ATOM 0 H GLN A 73 13.800 6.876 -1.904 1.00 1.14 H new ATOM 0 HA GLN A 73 14.440 5.899 0.773 1.00 12.02 H new ATOM 0 HB2 GLN A 73 15.572 7.900 0.050 1.00 1.11 H new ATOM 0 HB3 GLN A 73 14.077 8.634 -0.496 1.00 1.11 H new ATOM 0 HG2 GLN A 73 14.753 9.653 1.594 1.00 51.20 H new ATOM 0 HG3 GLN A 73 13.272 8.750 1.844 1.00 51.20 H new ATOM 0 HE21 GLN A 73 13.336 8.063 3.910 1.00 14.43 H new ATOM 0 HE22 GLN A 73 14.677 7.170 4.634 1.00 14.43 H new ATOM 763 N VAL A 74 11.467 6.742 -0.177 1.00 64.23 N ATOM 764 CA VAL A 74 10.064 6.796 0.216 1.00 34.41 C ATOM 765 C VAL A 74 9.582 5.441 0.722 1.00 33.31 C ATOM 766 O VAL A 74 9.057 5.330 1.830 1.00 1.34 O ATOM 767 CB VAL A 74 9.169 7.243 -0.954 1.00 64.10 C ATOM 768 CG1 VAL A 74 7.704 7.219 -0.546 1.00 12.24 C ATOM 769 CG2 VAL A 74 9.574 8.628 -1.436 1.00 23.54 C ATOM 0 H VAL A 74 11.624 6.777 -1.184 1.00 64.23 H new ATOM 0 HA VAL A 74 9.989 7.528 1.020 1.00 34.41 H new ATOM 0 HB VAL A 74 9.303 6.543 -1.779 1.00 64.10 H new ATOM 0 HG11 VAL A 74 7.087 7.538 -1.386 1.00 12.24 H new ATOM 0 HG12 VAL A 74 7.424 6.207 -0.254 1.00 12.24 H new ATOM 0 HG13 VAL A 74 7.549 7.895 0.295 1.00 12.24 H new ATOM 0 HG21 VAL A 74 8.931 8.928 -2.263 1.00 23.54 H new ATOM 0 HG22 VAL A 74 9.471 9.342 -0.619 1.00 23.54 H new ATOM 0 HG23 VAL A 74 10.611 8.608 -1.772 1.00 23.54 H new ATOM 779 N GLY A 75 9.765 4.410 -0.098 1.00 71.51 N ATOM 780 CA GLY A 75 9.343 3.075 0.284 1.00 2.25 C ATOM 781 C GLY A 75 9.882 2.662 1.639 1.00 73.22 C ATOM 782 O GLY A 75 9.216 1.945 2.387 1.00 2.14 O ATOM 0 H GLY A 75 10.198 4.476 -1.019 1.00 71.51 H new ATOM 0 HA2 GLY A 75 8.254 3.033 0.301 1.00 2.25 H new ATOM 0 HA3 GLY A 75 9.678 2.362 -0.469 1.00 2.25 H new ATOM 786 N ARG A 76 11.091 3.113 1.956 1.00 1.13 N ATOM 787 CA ARG A 76 11.721 2.784 3.229 1.00 70.53 C ATOM 788 C ARG A 76 10.864 3.262 4.398 1.00 33.15 C ATOM 789 O ARG A 76 10.454 2.468 5.245 1.00 15.33 O ATOM 790 CB ARG A 76 13.113 3.411 3.312 1.00 12.41 C ATOM 791 CG ARG A 76 13.762 3.274 4.679 1.00 33.24 C ATOM 792 CD ARG A 76 15.164 3.865 4.692 1.00 2.12 C ATOM 793 NE ARG A 76 15.313 4.898 5.713 1.00 53.11 N ATOM 794 CZ ARG A 76 16.394 5.661 5.834 1.00 54.14 C ATOM 795 NH1 ARG A 76 17.414 5.508 5.001 1.00 25.44 N ATOM 796 NH2 ARG A 76 16.455 6.581 6.788 1.00 32.33 N ATOM 0 H ARG A 76 11.654 3.708 1.348 1.00 1.13 H new ATOM 0 HA ARG A 76 11.816 1.700 3.289 1.00 70.53 H new ATOM 0 HB2 ARG A 76 13.757 2.946 2.565 1.00 12.41 H new ATOM 0 HB3 ARG A 76 13.042 4.468 3.057 1.00 12.41 H new ATOM 0 HG2 ARG A 76 13.148 3.776 5.427 1.00 33.24 H new ATOM 0 HG3 ARG A 76 13.807 2.221 4.958 1.00 33.24 H new ATOM 0 HD2 ARG A 76 15.890 3.072 4.870 1.00 2.12 H new ATOM 0 HD3 ARG A 76 15.388 4.288 3.713 1.00 2.12 H new ATOM 0 HE ARG A 76 14.545 5.042 6.369 1.00 53.11 H new ATOM 0 HH11 ARG A 76 17.370 4.803 4.265 1.00 25.44 H new ATOM 0 HH12 ARG A 76 18.243 6.095 5.096 1.00 25.44 H new ATOM 0 HH21 ARG A 76 15.671 6.703 7.430 1.00 32.33 H new ATOM 0 HH22 ARG A 76 17.285 7.166 6.880 1.00 32.33 H new ATOM 807 N GLN A 77 10.601 4.564 4.438 1.00 33.42 N ATOM 808 CA GLN A 77 9.796 5.148 5.504 1.00 73.24 C ATOM 809 C GLN A 77 8.402 4.530 5.535 1.00 5.02 C ATOM 810 O GLN A 77 7.917 4.119 6.591 1.00 40.43 O ATOM 811 CB GLN A 77 9.690 6.663 5.321 1.00 74.41 C ATOM 812 CG GLN A 77 9.345 7.408 6.600 1.00 22.43 C ATOM 813 CD GLN A 77 10.417 7.267 7.664 1.00 60.24 C ATOM 814 OE1 GLN A 77 11.608 7.403 7.385 1.00 50.32 O ATOM 815 NE2 GLN A 77 9.997 6.992 8.895 1.00 5.54 N ATOM 0 H GLN A 77 10.934 5.234 3.745 1.00 33.42 H new ATOM 0 HA GLN A 77 10.289 4.937 6.453 1.00 73.24 H new ATOM 0 HB2 GLN A 77 10.636 7.041 4.934 1.00 74.41 H new ATOM 0 HB3 GLN A 77 8.930 6.877 4.569 1.00 74.41 H new ATOM 0 HG2 GLN A 77 9.200 8.464 6.373 1.00 22.43 H new ATOM 0 HG3 GLN A 77 8.399 7.033 6.991 1.00 22.43 H new ATOM 0 HE21 GLN A 77 9.000 6.887 9.082 1.00 5.54 H new ATOM 0 HE22 GLN A 77 10.672 6.886 9.652 1.00 5.54 H new ATOM 822 N LEU A 78 7.763 4.464 4.372 1.00 34.05 N ATOM 823 CA LEU A 78 6.425 3.895 4.265 1.00 71.34 C ATOM 824 C LEU A 78 6.365 2.518 4.919 1.00 52.35 C ATOM 825 O LEU A 78 5.435 2.214 5.665 1.00 60.33 O ATOM 826 CB LEU A 78 6.007 3.794 2.798 1.00 4.32 C ATOM 827 CG LEU A 78 5.808 5.121 2.063 1.00 62.22 C ATOM 828 CD1 LEU A 78 5.291 4.878 0.654 1.00 63.13 C ATOM 829 CD2 LEU A 78 4.852 6.019 2.836 1.00 23.22 C ATOM 0 H LEU A 78 8.151 4.798 3.490 1.00 34.05 H new ATOM 0 HA LEU A 78 5.734 4.556 4.788 1.00 71.34 H new ATOM 0 HB2 LEU A 78 6.762 3.216 2.265 1.00 4.32 H new ATOM 0 HB3 LEU A 78 5.076 3.229 2.744 1.00 4.32 H new ATOM 0 HG LEU A 78 6.772 5.624 1.992 1.00 62.22 H new ATOM 0 HD11 LEU A 78 5.155 5.833 0.146 1.00 63.13 H new ATOM 0 HD12 LEU A 78 6.010 4.273 0.102 1.00 63.13 H new ATOM 0 HD13 LEU A 78 4.336 4.354 0.702 1.00 63.13 H new ATOM 0 HD21 LEU A 78 4.721 6.959 2.299 1.00 23.22 H new ATOM 0 HD22 LEU A 78 3.887 5.522 2.937 1.00 23.22 H new ATOM 0 HD23 LEU A 78 5.262 6.220 3.826 1.00 23.22 H new ATOM 840 N ALA A 79 7.364 1.689 4.635 1.00 11.32 N ATOM 841 CA ALA A 79 7.427 0.347 5.198 1.00 10.42 C ATOM 842 C ALA A 79 7.486 0.392 6.721 1.00 11.50 C ATOM 843 O ALA A 79 7.014 -0.523 7.397 1.00 15.34 O ATOM 844 CB ALA A 79 8.631 -0.402 4.643 1.00 62.51 C ATOM 0 H ALA A 79 8.141 1.924 4.018 1.00 11.32 H new ATOM 0 HA ALA A 79 6.519 -0.183 4.912 1.00 10.42 H new ATOM 0 HB1 ALA A 79 8.666 -1.403 5.072 1.00 62.51 H new ATOM 0 HB2 ALA A 79 8.546 -0.475 3.559 1.00 62.51 H new ATOM 0 HB3 ALA A 79 9.544 0.135 4.900 1.00 62.51 H new ATOM 850 N ILE A 80 8.068 1.461 7.254 1.00 41.11 N ATOM 851 CA ILE A 80 8.188 1.625 8.697 1.00 75.40 C ATOM 852 C ILE A 80 6.845 1.987 9.322 1.00 53.11 C ATOM 853 O ILE A 80 6.390 1.334 10.262 1.00 55.10 O ATOM 854 CB ILE A 80 9.219 2.711 9.057 1.00 14.32 C ATOM 855 CG1 ILE A 80 10.592 2.349 8.489 1.00 11.43 C ATOM 856 CG2 ILE A 80 9.293 2.890 10.566 1.00 35.15 C ATOM 857 CD1 ILE A 80 11.501 3.543 8.297 1.00 23.15 C ATOM 0 H ILE A 80 8.464 2.226 6.708 1.00 41.11 H new ATOM 0 HA ILE A 80 8.526 0.669 9.096 1.00 75.40 H new ATOM 0 HB ILE A 80 8.902 3.655 8.614 1.00 14.32 H new ATOM 0 HG12 ILE A 80 11.077 1.638 9.158 1.00 11.43 H new ATOM 0 HG13 ILE A 80 10.459 1.846 7.531 1.00 11.43 H new ATOM 0 HG21 ILE A 80 10.026 3.661 10.805 1.00 35.15 H new ATOM 0 HG22 ILE A 80 8.316 3.188 10.945 1.00 35.15 H new ATOM 0 HG23 ILE A 80 9.591 1.950 11.030 1.00 35.15 H new ATOM 0 HD11 ILE A 80 12.457 3.211 7.891 1.00 23.15 H new ATOM 0 HD12 ILE A 80 11.037 4.246 7.605 1.00 23.15 H new ATOM 0 HD13 ILE A 80 11.665 4.034 9.256 1.00 23.15 H new ATOM 868 N ILE A 81 6.215 3.031 8.794 1.00 53.32 N ATOM 869 CA ILE A 81 4.923 3.478 9.297 1.00 60.22 C ATOM 870 C ILE A 81 3.862 2.395 9.131 1.00 30.51 C ATOM 871 O ILE A 81 2.907 2.321 9.904 1.00 15.43 O ATOM 872 CB ILE A 81 4.450 4.757 8.581 1.00 51.40 C ATOM 873 CG1 ILE A 81 4.542 4.580 7.064 1.00 55.42 C ATOM 874 CG2 ILE A 81 5.276 5.952 9.031 1.00 11.33 C ATOM 875 CD1 ILE A 81 3.901 5.708 6.285 1.00 44.01 C ATOM 0 H ILE A 81 6.579 3.583 8.017 1.00 53.32 H new ATOM 0 HA ILE A 81 5.057 3.693 10.357 1.00 60.22 H new ATOM 0 HB ILE A 81 3.408 4.940 8.845 1.00 51.40 H new ATOM 0 HG12 ILE A 81 5.591 4.502 6.778 1.00 55.42 H new ATOM 0 HG13 ILE A 81 4.065 3.640 6.786 1.00 55.42 H new ATOM 0 HG21 ILE A 81 4.930 6.848 8.516 1.00 11.33 H new ATOM 0 HG22 ILE A 81 5.166 6.086 10.107 1.00 11.33 H new ATOM 0 HG23 ILE A 81 6.326 5.779 8.793 1.00 11.33 H new ATOM 0 HD11 ILE A 81 4.003 5.517 5.217 1.00 44.01 H new ATOM 0 HD12 ILE A 81 2.844 5.773 6.542 1.00 44.01 H new ATOM 0 HD13 ILE A 81 4.393 6.648 6.534 1.00 44.01 H new ATOM 886 N GLY A 82 4.039 1.553 8.118 1.00 44.33 N ATOM 887 CA GLY A 82 3.091 0.482 7.868 1.00 33.31 C ATOM 888 C GLY A 82 3.618 -0.871 8.300 1.00 22.10 C ATOM 889 O GLY A 82 3.006 -1.902 8.018 1.00 31.25 O ATOM 0 H GLY A 82 4.822 1.593 7.465 1.00 44.33 H new ATOM 0 HA2 GLY A 82 2.162 0.692 8.398 1.00 33.31 H new ATOM 0 HA3 GLY A 82 2.852 0.453 6.805 1.00 33.31 H new ATOM 893 N ASP A 83 4.757 -0.870 8.984 1.00 24.13 N ATOM 894 CA ASP A 83 5.367 -2.108 9.454 1.00 22.24 C ATOM 895 C ASP A 83 4.476 -2.798 10.482 1.00 22.13 C ATOM 896 O ASP A 83 3.827 -3.800 10.183 1.00 31.11 O ATOM 897 CB ASP A 83 6.743 -1.825 10.062 1.00 71.23 C ATOM 898 CG ASP A 83 7.212 -2.939 10.976 1.00 24.25 C ATOM 899 OD1 ASP A 83 7.160 -4.114 10.555 1.00 24.12 O ATOM 900 OD2 ASP A 83 7.632 -2.637 12.113 1.00 53.50 O ATOM 0 H ASP A 83 5.276 -0.026 9.225 1.00 24.13 H new ATOM 0 HA ASP A 83 5.485 -2.773 8.598 1.00 22.24 H new ATOM 0 HB2 ASP A 83 7.469 -1.686 9.261 1.00 71.23 H new ATOM 0 HB3 ASP A 83 6.704 -0.891 10.623 1.00 71.23 H new ATOM 904 N ASP A 84 4.450 -2.255 11.695 1.00 42.12 N ATOM 905 CA ASP A 84 3.639 -2.818 12.768 1.00 54.35 C ATOM 906 C ASP A 84 2.170 -2.881 12.361 1.00 53.44 C ATOM 907 O ASP A 84 1.486 -3.872 12.618 1.00 63.32 O ATOM 908 CB ASP A 84 3.792 -1.987 14.042 1.00 21.34 C ATOM 909 CG ASP A 84 5.142 -2.187 14.705 1.00 43.43 C ATOM 910 OD1 ASP A 84 5.985 -2.905 14.127 1.00 31.52 O ATOM 911 OD2 ASP A 84 5.354 -1.626 15.799 1.00 13.34 O ATOM 0 H ASP A 84 4.982 -1.425 11.959 1.00 42.12 H new ATOM 0 HA ASP A 84 3.989 -3.832 12.961 1.00 54.35 H new ATOM 0 HB2 ASP A 84 3.661 -0.932 13.802 1.00 21.34 H new ATOM 0 HB3 ASP A 84 3.002 -2.255 14.744 1.00 21.34 H new ATOM 915 N ILE A 85 1.689 -1.816 11.727 1.00 23.15 N ATOM 916 CA ILE A 85 0.302 -1.750 11.285 1.00 65.51 C ATOM 917 C ILE A 85 -0.052 -2.946 10.407 1.00 51.11 C ATOM 918 O ILE A 85 -1.038 -3.639 10.652 1.00 62.22 O ATOM 919 CB ILE A 85 0.019 -0.453 10.506 1.00 24.35 C ATOM 920 CG1 ILE A 85 0.347 0.767 11.369 1.00 30.15 C ATOM 921 CG2 ILE A 85 -1.432 -0.413 10.052 1.00 23.14 C ATOM 922 CD1 ILE A 85 -0.772 1.163 12.307 1.00 43.35 C ATOM 0 H ILE A 85 2.241 -0.987 11.508 1.00 23.15 H new ATOM 0 HA ILE A 85 -0.316 -1.765 12.183 1.00 65.51 H new ATOM 0 HB ILE A 85 0.656 -0.431 9.622 1.00 24.35 H new ATOM 0 HG12 ILE A 85 1.243 0.558 11.953 1.00 30.15 H new ATOM 0 HG13 ILE A 85 0.580 1.610 10.718 1.00 30.15 H new ATOM 0 HG21 ILE A 85 -1.616 0.510 9.503 1.00 23.14 H new ATOM 0 HG22 ILE A 85 -1.635 -1.267 9.405 1.00 23.14 H new ATOM 0 HG23 ILE A 85 -2.087 -0.454 10.922 1.00 23.14 H new ATOM 0 HD11 ILE A 85 -0.469 2.035 12.887 1.00 43.35 H new ATOM 0 HD12 ILE A 85 -1.664 1.404 11.728 1.00 43.35 H new ATOM 0 HD13 ILE A 85 -0.990 0.336 12.982 1.00 43.35 H new ATOM 933 N ASN A 86 0.762 -3.181 9.382 1.00 62.32 N ATOM 934 CA ASN A 86 0.535 -4.294 8.467 1.00 24.43 C ATOM 935 C ASN A 86 0.523 -5.622 9.218 1.00 24.14 C ATOM 936 O ASN A 86 -0.499 -6.307 9.272 1.00 2.21 O ATOM 937 CB ASN A 86 1.615 -4.318 7.383 1.00 72.41 C ATOM 938 CG ASN A 86 1.476 -5.509 6.455 1.00 60.31 C ATOM 939 OD1 ASN A 86 2.047 -6.640 6.854 1.00 72.03 O flip ATOM 940 ND2 ASN A 86 0.863 -5.414 5.392 1.00 74.22 N flip ATOM 0 H ASN A 86 1.583 -2.616 9.165 1.00 62.32 H new ATOM 0 HA ASN A 86 -0.439 -4.154 7.998 1.00 24.43 H new ATOM 0 HB2 ASN A 86 1.561 -3.398 6.800 1.00 72.41 H new ATOM 0 HB3 ASN A 86 2.598 -4.340 7.854 1.00 72.41 H new ATOM 0 HD21 ASN A 86 0.440 -4.525 5.125 1.00 74.22 H new ATOM 0 HD22 ASN A 86 0.778 -6.224 4.778 1.00 74.22 H new ATOM 946 N ARG A 87 1.665 -5.979 9.795 1.00 44.00 N ATOM 947 CA ARG A 87 1.787 -7.226 10.542 1.00 34.21 C ATOM 948 C ARG A 87 0.678 -7.345 11.584 1.00 41.00 C ATOM 949 O ARG A 87 0.229 -8.446 11.902 1.00 42.05 O ATOM 950 CB ARG A 87 3.153 -7.305 11.226 1.00 15.54 C ATOM 951 CG ARG A 87 3.353 -6.258 12.310 1.00 73.43 C ATOM 952 CD ARG A 87 4.768 -6.295 12.866 1.00 72.43 C ATOM 953 NE ARG A 87 4.786 -6.198 14.323 1.00 30.55 N ATOM 954 CZ ARG A 87 5.890 -5.989 15.032 1.00 4.05 C ATOM 955 NH1 ARG A 87 7.060 -5.856 14.420 1.00 72.31 N ATOM 956 NH2 ARG A 87 5.826 -5.912 16.355 1.00 2.24 N ATOM 0 H ARG A 87 2.519 -5.423 9.760 1.00 44.00 H new ATOM 0 HA ARG A 87 1.693 -8.053 9.838 1.00 34.21 H new ATOM 0 HB2 ARG A 87 3.274 -8.296 11.663 1.00 15.54 H new ATOM 0 HB3 ARG A 87 3.934 -7.191 10.474 1.00 15.54 H new ATOM 0 HG2 ARG A 87 3.146 -5.268 11.904 1.00 73.43 H new ATOM 0 HG3 ARG A 87 2.639 -6.427 13.117 1.00 73.43 H new ATOM 0 HD2 ARG A 87 5.254 -7.221 12.558 1.00 72.43 H new ATOM 0 HD3 ARG A 87 5.346 -5.475 12.441 1.00 72.43 H new ATOM 0 HE ARG A 87 3.903 -6.296 14.824 1.00 30.55 H new ATOM 0 HH11 ARG A 87 7.113 -5.914 13.403 1.00 72.31 H new ATOM 0 HH12 ARG A 87 7.906 -5.696 14.967 1.00 72.31 H new ATOM 0 HH21 ARG A 87 4.928 -6.013 16.829 1.00 2.24 H new ATOM 0 HH22 ARG A 87 6.674 -5.752 16.898 1.00 2.24 H new ATOM 967 N ARG A 88 0.242 -6.206 12.111 1.00 41.04 N ATOM 968 CA ARG A 88 -0.813 -6.183 13.116 1.00 23.51 C ATOM 969 C ARG A 88 -2.112 -6.752 12.554 1.00 23.50 C ATOM 970 O ARG A 88 -2.661 -7.717 13.088 1.00 24.11 O ATOM 971 CB ARG A 88 -1.042 -4.755 13.614 1.00 73.24 C ATOM 972 CG ARG A 88 -0.252 -4.412 14.866 1.00 61.51 C ATOM 973 CD ARG A 88 -0.377 -2.938 15.218 1.00 12.23 C ATOM 974 NE ARG A 88 0.265 -2.622 16.491 1.00 22.35 N ATOM 975 CZ ARG A 88 -0.250 -2.942 17.672 1.00 61.44 C ATOM 976 NH1 ARG A 88 -1.408 -3.584 17.743 1.00 35.31 N ATOM 977 NH2 ARG A 88 0.394 -2.620 18.788 1.00 44.24 N ATOM 0 H ARG A 88 0.604 -5.286 11.858 1.00 41.04 H new ATOM 0 HA ARG A 88 -0.496 -6.805 13.953 1.00 23.51 H new ATOM 0 HB2 ARG A 88 -0.773 -4.056 12.822 1.00 73.24 H new ATOM 0 HB3 ARG A 88 -2.104 -4.616 13.815 1.00 73.24 H new ATOM 0 HG2 ARG A 88 -0.608 -5.018 15.699 1.00 61.51 H new ATOM 0 HG3 ARG A 88 0.798 -4.663 14.715 1.00 61.51 H new ATOM 0 HD2 ARG A 88 0.072 -2.337 14.427 1.00 12.23 H new ATOM 0 HD3 ARG A 88 -1.431 -2.665 15.266 1.00 12.23 H new ATOM 0 HE ARG A 88 1.158 -2.129 16.472 1.00 22.35 H new ATOM 0 HH11 ARG A 88 -1.906 -3.834 16.889 1.00 35.31 H new ATOM 0 HH12 ARG A 88 -1.801 -3.828 18.652 1.00 35.31 H new ATOM 0 HH21 ARG A 88 1.285 -2.126 18.738 1.00 44.24 H new ATOM 0 HH22 ARG A 88 -0.003 -2.866 19.695 1.00 44.24 H new ATOM 988 N TYR A 89 -2.599 -6.148 11.476 1.00 22.44 N ATOM 989 CA TYR A 89 -3.835 -6.593 10.844 1.00 23.42 C ATOM 990 C TYR A 89 -3.543 -7.513 9.662 1.00 33.32 C ATOM 991 O TYR A 89 -4.373 -7.676 8.768 1.00 63.43 O ATOM 992 CB TYR A 89 -4.655 -5.389 10.377 1.00 44.20 C ATOM 993 CG TYR A 89 -5.100 -4.486 11.505 1.00 71.02 C ATOM 994 CD1 TYR A 89 -4.183 -3.712 12.205 1.00 41.30 C ATOM 995 CD2 TYR A 89 -6.439 -4.405 11.869 1.00 21.32 C ATOM 996 CE1 TYR A 89 -4.586 -2.885 13.236 1.00 64.40 C ATOM 997 CE2 TYR A 89 -6.850 -3.580 12.899 1.00 44.25 C ATOM 998 CZ TYR A 89 -5.920 -2.824 13.580 1.00 12.13 C ATOM 999 OH TYR A 89 -6.325 -2.001 14.605 1.00 32.14 O ATOM 0 H TYR A 89 -2.157 -5.349 11.022 1.00 22.44 H new ATOM 0 HA TYR A 89 -4.410 -7.152 11.582 1.00 23.42 H new ATOM 0 HB2 TYR A 89 -4.062 -4.808 9.670 1.00 44.20 H new ATOM 0 HB3 TYR A 89 -5.534 -5.745 9.839 1.00 44.20 H new ATOM 0 HD1 TYR A 89 -3.137 -3.757 11.939 1.00 41.30 H new ATOM 0 HD2 TYR A 89 -7.170 -4.996 11.338 1.00 21.32 H new ATOM 0 HE1 TYR A 89 -3.860 -2.290 13.770 1.00 64.40 H new ATOM 0 HE2 TYR A 89 -7.894 -3.528 13.169 1.00 44.25 H new ATOM 0 HH TYR A 89 -5.545 -1.724 15.130 1.00 32.14 H new ATOM 1008 N ASP A 90 -2.356 -8.109 9.666 1.00 42.13 N ATOM 1009 CA ASP A 90 -1.952 -9.014 8.595 1.00 71.42 C ATOM 1010 C ASP A 90 -2.522 -10.412 8.822 1.00 23.55 C ATOM 1011 O ASP A 90 -3.209 -10.960 7.961 1.00 64.24 O ATOM 1012 CB ASP A 90 -0.427 -9.080 8.501 1.00 72.43 C ATOM 1013 CG ASP A 90 0.053 -10.286 7.720 1.00 4.22 C ATOM 1014 OD1 ASP A 90 -0.600 -10.642 6.717 1.00 41.02 O ATOM 1015 OD2 ASP A 90 1.082 -10.876 8.112 1.00 32.33 O ATOM 0 H ASP A 90 -1.657 -7.982 10.398 1.00 42.13 H new ATOM 0 HA ASP A 90 -2.349 -8.627 7.656 1.00 71.42 H new ATOM 0 HB2 ASP A 90 -0.056 -8.172 8.026 1.00 72.43 H new ATOM 0 HB3 ASP A 90 -0.005 -9.110 9.506 1.00 72.43 H new ATOM 1019 N SER A 91 -2.228 -10.983 9.986 1.00 30.32 N ATOM 1020 CA SER A 91 -2.706 -12.318 10.325 1.00 42.42 C ATOM 1021 C SER A 91 -4.219 -12.414 10.150 1.00 22.40 C ATOM 1022 O SER A 91 -4.740 -13.444 9.723 1.00 73.55 O ATOM 1023 CB SER A 91 -2.323 -12.671 11.763 1.00 70.23 C ATOM 1024 OG SER A 91 -2.334 -14.074 11.965 1.00 51.31 O ATOM 0 H SER A 91 -1.661 -10.542 10.710 1.00 30.32 H new ATOM 0 HA SER A 91 -2.234 -13.029 9.647 1.00 42.42 H new ATOM 0 HB2 SER A 91 -1.332 -12.276 11.986 1.00 70.23 H new ATOM 0 HB3 SER A 91 -3.018 -12.196 12.455 1.00 70.23 H new ATOM 0 HG SER A 91 -2.084 -14.273 12.891 1.00 51.31 H new ATOM 1029 N GLU A 92 -4.916 -11.333 10.485 1.00 61.11 N ATOM 1030 CA GLU A 92 -6.369 -11.296 10.368 1.00 51.42 C ATOM 1031 C GLU A 92 -6.792 -11.129 8.910 1.00 71.54 C ATOM 1032 O GLU A 92 -7.892 -11.527 8.523 1.00 14.35 O ATOM 1033 CB GLU A 92 -6.943 -10.155 11.210 1.00 31.11 C ATOM 1034 CG GLU A 92 -6.387 -8.789 10.843 1.00 50.34 C ATOM 1035 CD GLU A 92 -6.975 -7.675 11.687 1.00 34.04 C ATOM 1036 OE1 GLU A 92 -8.028 -7.129 11.298 1.00 30.30 O ATOM 1037 OE2 GLU A 92 -6.380 -7.348 12.736 1.00 13.51 O ATOM 0 H GLU A 92 -4.499 -10.472 10.839 1.00 61.11 H new ATOM 0 HA GLU A 92 -6.762 -12.243 10.738 1.00 51.42 H new ATOM 0 HB2 GLU A 92 -8.027 -10.140 11.095 1.00 31.11 H new ATOM 0 HB3 GLU A 92 -6.736 -10.351 12.262 1.00 31.11 H new ATOM 0 HG2 GLU A 92 -5.304 -8.798 10.963 1.00 50.34 H new ATOM 0 HG3 GLU A 92 -6.590 -8.589 9.791 1.00 50.34 H new ATOM 1042 N PHE A 93 -5.912 -10.539 8.109 1.00 62.23 N ATOM 1043 CA PHE A 93 -6.194 -10.318 6.695 1.00 71.15 C ATOM 1044 C PHE A 93 -5.927 -11.582 5.883 1.00 41.15 C ATOM 1045 O PHE A 93 -6.662 -11.897 4.947 1.00 41.10 O ATOM 1046 CB PHE A 93 -5.345 -9.164 6.158 1.00 64.25 C ATOM 1047 CG PHE A 93 -5.798 -8.659 4.818 1.00 65.31 C ATOM 1048 CD1 PHE A 93 -6.918 -7.850 4.710 1.00 24.41 C ATOM 1049 CD2 PHE A 93 -5.105 -8.994 3.667 1.00 50.22 C ATOM 1050 CE1 PHE A 93 -7.337 -7.383 3.479 1.00 42.44 C ATOM 1051 CE2 PHE A 93 -5.520 -8.530 2.432 1.00 12.35 C ATOM 1052 CZ PHE A 93 -6.637 -7.725 2.338 1.00 42.12 C ATOM 0 H PHE A 93 -4.998 -10.205 8.414 1.00 62.23 H new ATOM 0 HA PHE A 93 -7.249 -10.060 6.597 1.00 71.15 H new ATOM 0 HB2 PHE A 93 -5.369 -8.342 6.874 1.00 64.25 H new ATOM 0 HB3 PHE A 93 -4.308 -9.491 6.082 1.00 64.25 H new ATOM 0 HD1 PHE A 93 -7.470 -7.581 5.599 1.00 24.41 H new ATOM 0 HD2 PHE A 93 -4.231 -9.625 3.734 1.00 50.22 H new ATOM 0 HE1 PHE A 93 -8.210 -6.752 3.409 1.00 42.44 H new ATOM 0 HE2 PHE A 93 -4.970 -8.797 1.542 1.00 12.35 H new ATOM 0 HZ PHE A 93 -6.963 -7.363 1.374 1.00 42.12 H new ATOM 1061 N GLN A 94 -4.870 -12.301 6.249 1.00 52.35 N ATOM 1062 CA GLN A 94 -4.505 -13.529 5.553 1.00 12.12 C ATOM 1063 C GLN A 94 -5.500 -14.645 5.860 1.00 15.22 C ATOM 1064 O GLN A 94 -5.849 -15.437 4.985 1.00 54.43 O ATOM 1065 CB GLN A 94 -3.093 -13.965 5.952 1.00 53.43 C ATOM 1066 CG GLN A 94 -2.936 -14.233 7.440 1.00 40.52 C ATOM 1067 CD GLN A 94 -1.507 -14.556 7.826 1.00 30.32 C ATOM 1068 OE1 GLN A 94 -0.695 -13.658 8.049 1.00 2.25 O ATOM 1069 NE2 GLN A 94 -1.192 -15.843 7.909 1.00 71.30 N ATOM 0 H GLN A 94 -4.252 -12.054 7.022 1.00 52.35 H new ATOM 0 HA GLN A 94 -4.528 -13.331 4.481 1.00 12.12 H new ATOM 0 HB2 GLN A 94 -2.831 -14.867 5.399 1.00 53.43 H new ATOM 0 HB3 GLN A 94 -2.385 -13.191 5.654 1.00 53.43 H new ATOM 0 HG2 GLN A 94 -3.271 -13.360 8.000 1.00 40.52 H new ATOM 0 HG3 GLN A 94 -3.582 -15.063 7.726 1.00 40.52 H new ATOM 0 HE21 GLN A 94 -1.897 -16.554 7.716 1.00 71.30 H new ATOM 0 HE22 GLN A 94 -0.245 -16.121 8.166 1.00 71.30 H new ATOM 1076 N THR A 95 -5.952 -14.701 7.108 1.00 14.14 N ATOM 1077 CA THR A 95 -6.905 -15.719 7.530 1.00 32.43 C ATOM 1078 C THR A 95 -8.111 -15.763 6.600 1.00 61.45 C ATOM 1079 O THR A 95 -8.465 -16.819 6.076 1.00 73.52 O ATOM 1080 CB THR A 95 -7.391 -15.471 8.971 1.00 22.20 C ATOM 1081 OG1 THR A 95 -6.281 -15.503 9.875 1.00 53.23 O ATOM 1082 CG2 THR A 95 -8.417 -16.515 9.384 1.00 41.15 C ATOM 0 H THR A 95 -5.673 -14.053 7.845 1.00 14.14 H new ATOM 0 HA THR A 95 -6.384 -16.675 7.490 1.00 32.43 H new ATOM 0 HB THR A 95 -7.861 -14.488 9.008 1.00 22.20 H new ATOM 0 HG1 THR A 95 -5.963 -14.590 10.035 1.00 53.23 H new ATOM 0 HG21 THR A 95 -8.745 -16.319 10.405 1.00 41.15 H new ATOM 0 HG22 THR A 95 -9.274 -16.468 8.712 1.00 41.15 H new ATOM 0 HG23 THR A 95 -7.968 -17.507 9.331 1.00 41.15 H new ATOM 1090 N MET A 96 -8.739 -14.609 6.397 1.00 22.23 N ATOM 1091 CA MET A 96 -9.906 -14.516 5.527 1.00 65.51 C ATOM 1092 C MET A 96 -9.498 -14.612 4.061 1.00 42.23 C ATOM 1093 O MET A 96 -10.212 -15.196 3.244 1.00 43.13 O ATOM 1094 CB MET A 96 -10.653 -13.205 5.777 1.00 0.35 C ATOM 1095 CG MET A 96 -9.745 -11.985 5.801 1.00 74.34 C ATOM 1096 SD MET A 96 -10.597 -10.477 5.301 1.00 74.32 S ATOM 1097 CE MET A 96 -11.066 -10.894 3.624 1.00 55.21 C ATOM 0 H MET A 96 -8.459 -13.725 6.823 1.00 22.23 H new ATOM 0 HA MET A 96 -10.568 -15.351 5.757 1.00 65.51 H new ATOM 0 HB2 MET A 96 -11.407 -13.072 5.001 1.00 0.35 H new ATOM 0 HB3 MET A 96 -11.182 -13.273 6.727 1.00 0.35 H new ATOM 0 HG2 MET A 96 -9.344 -11.855 6.806 1.00 74.34 H new ATOM 0 HG3 MET A 96 -8.896 -12.155 5.139 1.00 74.34 H new ATOM 0 HE1 MET A 96 -10.492 -10.287 2.924 1.00 55.21 H new ATOM 0 HE2 MET A 96 -10.863 -11.949 3.441 1.00 55.21 H new ATOM 0 HE3 MET A 96 -12.129 -10.700 3.485 1.00 55.21 H new ATOM 1105 N LEU A 97 -8.348 -14.034 3.731 1.00 64.24 N ATOM 1106 CA LEU A 97 -7.847 -14.055 2.362 1.00 1.14 C ATOM 1107 C LEU A 97 -7.660 -15.487 1.871 1.00 3.14 C ATOM 1108 O LEU A 97 -7.991 -15.810 0.731 1.00 64.02 O ATOM 1109 CB LEU A 97 -6.521 -13.296 2.273 1.00 41.33 C ATOM 1110 CG LEU A 97 -6.603 -11.862 1.746 1.00 23.33 C ATOM 1111 CD1 LEU A 97 -6.658 -11.854 0.227 1.00 21.33 C ATOM 1112 CD2 LEU A 97 -7.813 -11.148 2.331 1.00 3.34 C ATOM 0 H LEU A 97 -7.745 -13.545 4.393 1.00 64.24 H new ATOM 0 HA LEU A 97 -8.583 -13.566 1.724 1.00 1.14 H new ATOM 0 HB2 LEU A 97 -6.072 -13.272 3.266 1.00 41.33 H new ATOM 0 HB3 LEU A 97 -5.845 -13.860 1.631 1.00 41.33 H new ATOM 0 HG LEU A 97 -5.706 -11.328 2.058 1.00 23.33 H new ATOM 0 HD11 LEU A 97 -6.716 -10.826 -0.130 1.00 21.33 H new ATOM 0 HD12 LEU A 97 -5.760 -12.326 -0.172 1.00 21.33 H new ATOM 0 HD13 LEU A 97 -7.537 -12.404 -0.108 1.00 21.33 H new ATOM 0 HD21 LEU A 97 -7.856 -10.129 1.946 1.00 3.34 H new ATOM 0 HD22 LEU A 97 -8.721 -11.681 2.050 1.00 3.34 H new ATOM 0 HD23 LEU A 97 -7.730 -11.122 3.417 1.00 3.34 H new ATOM 1123 N GLN A 98 -7.129 -16.341 2.741 1.00 12.43 N ATOM 1124 CA GLN A 98 -6.900 -17.738 2.395 1.00 62.45 C ATOM 1125 C GLN A 98 -8.190 -18.400 1.919 1.00 30.14 C ATOM 1126 O GLN A 98 -8.158 -19.371 1.161 1.00 14.31 O ATOM 1127 CB GLN A 98 -6.339 -18.498 3.600 1.00 13.44 C ATOM 1128 CG GLN A 98 -5.084 -19.296 3.284 1.00 11.13 C ATOM 1129 CD GLN A 98 -4.149 -19.407 4.473 1.00 44.23 C ATOM 1130 OE1 GLN A 98 -3.793 -18.268 5.055 1.00 24.02 O flip ATOM 1131 NE2 GLN A 98 -3.752 -20.504 4.864 1.00 14.22 N flip ATOM 0 H GLN A 98 -6.850 -16.090 3.689 1.00 12.43 H new ATOM 0 HA GLN A 98 -6.174 -17.770 1.582 1.00 62.45 H new ATOM 0 HB2 GLN A 98 -6.117 -17.787 4.396 1.00 13.44 H new ATOM 0 HB3 GLN A 98 -7.104 -19.175 3.981 1.00 13.44 H new ATOM 0 HG2 GLN A 98 -5.367 -20.296 2.954 1.00 11.13 H new ATOM 0 HG3 GLN A 98 -4.557 -18.824 2.455 1.00 11.13 H new ATOM 0 HE21 GLN A 98 -4.051 -21.354 4.387 1.00 14.22 H new ATOM 0 HE22 GLN A 98 -3.124 -20.563 5.665 1.00 14.22 H new ATOM 1138 N HIS A 99 -9.322 -17.869 2.367 1.00 15.32 N ATOM 1139 CA HIS A 99 -10.622 -18.407 1.986 1.00 53.54 C ATOM 1140 C HIS A 99 -10.994 -17.978 0.569 1.00 72.43 C ATOM 1141 O HIS A 99 -11.417 -18.797 -0.249 1.00 33.45 O ATOM 1142 CB HIS A 99 -11.699 -17.944 2.969 1.00 23.45 C ATOM 1143 CG HIS A 99 -11.420 -18.337 4.387 1.00 73.53 C ATOM 1144 ND1 HIS A 99 -12.293 -18.081 5.424 1.00 14.21 N ATOM 1145 CD2 HIS A 99 -10.361 -18.974 4.940 1.00 55.22 C ATOM 1146 CE1 HIS A 99 -11.782 -18.540 6.552 1.00 10.22 C ATOM 1147 NE2 HIS A 99 -10.609 -19.087 6.286 1.00 51.51 N ATOM 0 H HIS A 99 -9.365 -17.066 2.995 1.00 15.32 H new ATOM 0 HA HIS A 99 -10.558 -19.495 2.014 1.00 53.54 H new ATOM 0 HB2 HIS A 99 -11.790 -16.859 2.912 1.00 23.45 H new ATOM 0 HB3 HIS A 99 -12.660 -18.361 2.667 1.00 23.45 H new ATOM 0 HD2 HIS A 99 -9.484 -19.328 4.419 1.00 55.22 H new ATOM 0 HE1 HIS A 99 -12.244 -18.479 7.526 1.00 10.22 H new ATOM 0 HE2 HIS A 99 -9.989 -19.522 6.969 1.00 51.51 H new ATOM 1154 N LEU A 100 -10.836 -16.690 0.285 1.00 33.44 N ATOM 1155 CA LEU A 100 -11.155 -16.151 -1.032 1.00 22.22 C ATOM 1156 C LEU A 100 -10.472 -16.960 -2.131 1.00 11.05 C ATOM 1157 O LEU A 100 -11.134 -17.542 -2.988 1.00 52.23 O ATOM 1158 CB LEU A 100 -10.729 -14.685 -1.123 1.00 21.01 C ATOM 1159 CG LEU A 100 -10.952 -14.003 -2.472 1.00 40.32 C ATOM 1160 CD1 LEU A 100 -12.309 -14.386 -3.045 1.00 15.33 C ATOM 1161 CD2 LEU A 100 -10.837 -12.492 -2.333 1.00 72.33 C ATOM 0 H LEU A 100 -10.489 -15.999 0.950 1.00 33.44 H new ATOM 0 HA LEU A 100 -12.234 -16.218 -1.173 1.00 22.22 H new ATOM 0 HB2 LEU A 100 -11.269 -14.123 -0.361 1.00 21.01 H new ATOM 0 HB3 LEU A 100 -9.669 -14.620 -0.876 1.00 21.01 H new ATOM 0 HG LEU A 100 -10.179 -14.343 -3.161 1.00 40.32 H new ATOM 0 HD11 LEU A 100 -12.451 -13.891 -4.006 1.00 15.33 H new ATOM 0 HD12 LEU A 100 -12.354 -15.466 -3.183 1.00 15.33 H new ATOM 0 HD13 LEU A 100 -13.095 -14.075 -2.357 1.00 15.33 H new ATOM 0 HD21 LEU A 100 -10.999 -12.024 -3.304 1.00 72.33 H new ATOM 0 HD22 LEU A 100 -11.587 -12.133 -1.628 1.00 72.33 H new ATOM 0 HD23 LEU A 100 -9.843 -12.235 -1.967 1.00 72.33 H new ATOM 1172 N GLN A 101 -9.144 -16.993 -2.095 1.00 10.23 N ATOM 1173 CA GLN A 101 -8.371 -17.731 -3.088 1.00 65.42 C ATOM 1174 C GLN A 101 -8.585 -17.154 -4.484 1.00 61.22 C ATOM 1175 O GLN A 101 -9.111 -17.814 -5.380 1.00 32.11 O ATOM 1176 CB GLN A 101 -8.761 -19.211 -3.069 1.00 11.02 C ATOM 1177 CG GLN A 101 -8.736 -19.829 -1.681 1.00 35.20 C ATOM 1178 CD GLN A 101 -9.357 -21.211 -1.647 1.00 72.55 C ATOM 1179 OE1 GLN A 101 -9.922 -21.676 -2.637 1.00 11.32 O ATOM 1180 NE2 GLN A 101 -9.258 -21.877 -0.502 1.00 72.42 N ATOM 0 H GLN A 101 -8.581 -16.518 -1.390 1.00 10.23 H new ATOM 0 HA GLN A 101 -7.315 -17.636 -2.835 1.00 65.42 H new ATOM 0 HB2 GLN A 101 -9.761 -19.320 -3.488 1.00 11.02 H new ATOM 0 HB3 GLN A 101 -8.082 -19.765 -3.717 1.00 11.02 H new ATOM 0 HG2 GLN A 101 -7.705 -19.889 -1.333 1.00 35.20 H new ATOM 0 HG3 GLN A 101 -9.269 -19.178 -0.988 1.00 35.20 H new ATOM 0 HE21 GLN A 101 -8.781 -21.454 0.294 1.00 72.42 H new ATOM 0 HE22 GLN A 101 -9.659 -22.811 -0.419 1.00 72.42 H new ATOM 1187 N PRO A 102 -8.168 -15.894 -4.673 1.00 51.44 N ATOM 1188 CA PRO A 102 -8.303 -15.200 -5.958 1.00 61.22 C ATOM 1189 C PRO A 102 -7.376 -15.771 -7.025 1.00 61.34 C ATOM 1190 O PRO A 102 -6.634 -16.721 -6.775 1.00 30.33 O ATOM 1191 CB PRO A 102 -7.913 -13.758 -5.626 1.00 23.50 C ATOM 1192 CG PRO A 102 -7.024 -13.872 -4.435 1.00 31.42 C ATOM 1193 CD PRO A 102 -7.533 -15.048 -3.649 1.00 43.13 C ATOM 0 HA PRO A 102 -9.307 -15.299 -6.371 1.00 61.22 H new ATOM 0 HB2 PRO A 102 -7.397 -13.285 -6.462 1.00 23.50 H new ATOM 0 HB3 PRO A 102 -8.791 -13.150 -5.408 1.00 23.50 H new ATOM 0 HG2 PRO A 102 -5.987 -14.023 -4.735 1.00 31.42 H new ATOM 0 HG3 PRO A 102 -7.054 -12.961 -3.837 1.00 31.42 H new ATOM 0 HD2 PRO A 102 -6.724 -15.572 -3.140 1.00 43.13 H new ATOM 0 HD3 PRO A 102 -8.245 -14.741 -2.883 1.00 43.13 H new ATOM 1198 N THR A 103 -7.423 -15.185 -8.217 1.00 42.41 N ATOM 1199 CA THR A 103 -6.587 -15.637 -9.323 1.00 11.20 C ATOM 1200 C THR A 103 -6.020 -14.455 -10.101 1.00 12.15 C ATOM 1201 O THR A 103 -6.313 -13.300 -9.795 1.00 72.32 O ATOM 1202 CB THR A 103 -7.375 -16.542 -10.290 1.00 32.33 C ATOM 1203 OG1 THR A 103 -8.489 -15.825 -10.834 1.00 4.33 O ATOM 1204 CG2 THR A 103 -7.867 -17.793 -9.578 1.00 55.25 C ATOM 0 H THR A 103 -8.030 -14.397 -8.442 1.00 42.41 H new ATOM 0 HA THR A 103 -5.768 -16.209 -8.887 1.00 11.20 H new ATOM 0 HB THR A 103 -6.708 -16.842 -11.099 1.00 32.33 H new ATOM 0 HG1 THR A 103 -9.104 -16.454 -11.265 1.00 4.33 H new ATOM 0 HG21 THR A 103 -8.421 -18.417 -10.280 1.00 55.25 H new ATOM 0 HG22 THR A 103 -7.014 -18.351 -9.191 1.00 55.25 H new ATOM 0 HG23 THR A 103 -8.519 -17.509 -8.752 1.00 55.25 H new ATOM 1212 N ALA A 104 -5.205 -14.751 -11.109 1.00 70.12 N ATOM 1213 CA ALA A 104 -4.599 -13.713 -11.932 1.00 10.32 C ATOM 1214 C ALA A 104 -5.607 -13.138 -12.922 1.00 72.24 C ATOM 1215 O ALA A 104 -5.546 -11.959 -13.270 1.00 24.41 O ATOM 1216 CB ALA A 104 -3.387 -14.264 -12.670 1.00 73.01 C ATOM 0 H ALA A 104 -4.950 -15.702 -11.375 1.00 70.12 H new ATOM 0 HA ALA A 104 -4.275 -12.907 -11.274 1.00 10.32 H new ATOM 0 HB1 ALA A 104 -2.944 -13.477 -13.281 1.00 73.01 H new ATOM 0 HB2 ALA A 104 -2.652 -14.619 -11.948 1.00 73.01 H new ATOM 0 HB3 ALA A 104 -3.696 -15.090 -13.310 1.00 73.01 H new ATOM 1222 N GLU A 105 -6.533 -13.980 -13.372 1.00 12.24 N ATOM 1223 CA GLU A 105 -7.553 -13.554 -14.323 1.00 42.11 C ATOM 1224 C GLU A 105 -8.570 -12.633 -13.655 1.00 41.04 C ATOM 1225 O GLU A 105 -9.045 -11.674 -14.260 1.00 42.21 O ATOM 1226 CB GLU A 105 -8.264 -14.771 -14.921 1.00 73.10 C ATOM 1227 CG GLU A 105 -8.930 -15.657 -13.881 1.00 4.31 C ATOM 1228 CD GLU A 105 -9.562 -16.895 -14.489 1.00 14.15 C ATOM 1229 OE1 GLU A 105 -9.233 -17.220 -15.649 1.00 51.04 O ATOM 1230 OE2 GLU A 105 -10.384 -17.537 -13.803 1.00 12.11 O ATOM 0 H GLU A 105 -6.597 -14.959 -13.094 1.00 12.24 H new ATOM 0 HA GLU A 105 -7.060 -13.001 -15.123 1.00 42.11 H new ATOM 0 HB2 GLU A 105 -9.017 -14.429 -15.631 1.00 73.10 H new ATOM 0 HB3 GLU A 105 -7.542 -15.364 -15.483 1.00 73.10 H new ATOM 0 HG2 GLU A 105 -8.191 -15.958 -13.138 1.00 4.31 H new ATOM 0 HG3 GLU A 105 -9.694 -15.084 -13.356 1.00 4.31 H new ATOM 1235 N ASN A 106 -8.899 -12.935 -12.403 1.00 15.41 N ATOM 1236 CA ASN A 106 -9.861 -12.135 -11.652 1.00 44.20 C ATOM 1237 C ASN A 106 -9.152 -11.253 -10.629 1.00 42.14 C ATOM 1238 O ASN A 106 -9.793 -10.626 -9.786 1.00 64.33 O ATOM 1239 CB ASN A 106 -10.870 -13.044 -10.948 1.00 1.00 C ATOM 1240 CG ASN A 106 -11.617 -13.939 -11.917 1.00 62.24 C ATOM 1241 OD1 ASN A 106 -12.285 -13.460 -12.833 1.00 54.45 O ATOM 1242 ND2 ASN A 106 -11.508 -15.248 -11.718 1.00 12.21 N ATOM 0 H ASN A 106 -8.514 -13.727 -11.887 1.00 15.41 H new ATOM 0 HA ASN A 106 -10.391 -11.492 -12.355 1.00 44.20 H new ATOM 0 HB2 ASN A 106 -10.350 -13.661 -10.215 1.00 1.00 H new ATOM 0 HB3 ASN A 106 -11.585 -12.432 -10.399 1.00 1.00 H new ATOM 0 HD21 ASN A 106 -11.989 -15.900 -12.338 1.00 12.21 H new ATOM 0 HD22 ASN A 106 -10.943 -15.601 -10.946 1.00 12.21 H new ATOM 1248 N ALA A 107 -7.827 -11.208 -10.711 1.00 73.21 N ATOM 1249 CA ALA A 107 -7.032 -10.400 -9.794 1.00 1.32 C ATOM 1250 C ALA A 107 -7.573 -8.977 -9.706 1.00 31.11 C ATOM 1251 O ALA A 107 -7.841 -8.471 -8.616 1.00 13.34 O ATOM 1252 CB ALA A 107 -5.575 -10.386 -10.231 1.00 1.21 C ATOM 0 H ALA A 107 -7.281 -11.721 -11.403 1.00 73.21 H new ATOM 0 HA ALA A 107 -7.099 -10.848 -8.803 1.00 1.32 H new ATOM 0 HB1 ALA A 107 -4.993 -9.779 -9.537 1.00 1.21 H new ATOM 0 HB2 ALA A 107 -5.187 -11.405 -10.236 1.00 1.21 H new ATOM 0 HB3 ALA A 107 -5.500 -9.964 -11.233 1.00 1.21 H new ATOM 1258 N TYR A 108 -7.732 -8.337 -10.859 1.00 1.41 N ATOM 1259 CA TYR A 108 -8.238 -6.970 -10.911 1.00 3.42 C ATOM 1260 C TYR A 108 -9.706 -6.918 -10.501 1.00 71.02 C ATOM 1261 O TYR A 108 -10.144 -5.974 -9.843 1.00 64.30 O ATOM 1262 CB TYR A 108 -8.069 -6.395 -12.318 1.00 61.12 C ATOM 1263 CG TYR A 108 -8.879 -7.119 -13.370 1.00 25.12 C ATOM 1264 CD1 TYR A 108 -8.351 -8.211 -14.051 1.00 73.22 C ATOM 1265 CD2 TYR A 108 -10.170 -6.713 -13.684 1.00 32.25 C ATOM 1266 CE1 TYR A 108 -9.087 -8.875 -15.012 1.00 43.32 C ATOM 1267 CE2 TYR A 108 -10.913 -7.372 -14.643 1.00 4.22 C ATOM 1268 CZ TYR A 108 -10.367 -8.453 -15.305 1.00 12.41 C ATOM 1269 OH TYR A 108 -11.103 -9.112 -16.263 1.00 73.53 O ATOM 0 H TYR A 108 -7.518 -8.743 -11.770 1.00 1.41 H new ATOM 0 HA TYR A 108 -7.661 -6.368 -10.208 1.00 3.42 H new ATOM 0 HB2 TYR A 108 -8.358 -5.344 -12.309 1.00 61.12 H new ATOM 0 HB3 TYR A 108 -7.015 -6.434 -12.593 1.00 61.12 H new ATOM 0 HD1 TYR A 108 -7.349 -8.545 -13.824 1.00 73.22 H new ATOM 0 HD2 TYR A 108 -10.600 -5.867 -13.169 1.00 32.25 H new ATOM 0 HE1 TYR A 108 -8.662 -9.721 -15.532 1.00 43.32 H new ATOM 0 HE2 TYR A 108 -11.916 -7.044 -14.874 1.00 4.22 H new ATOM 0 HH TYR A 108 -11.983 -8.690 -16.347 1.00 73.53 H new ATOM 1278 N GLU A 109 -10.461 -7.938 -10.895 1.00 3.22 N ATOM 1279 CA GLU A 109 -11.881 -8.009 -10.568 1.00 54.50 C ATOM 1280 C GLU A 109 -12.102 -7.850 -9.067 1.00 44.10 C ATOM 1281 O GLU A 109 -12.972 -7.094 -8.634 1.00 60.41 O ATOM 1282 CB GLU A 109 -12.471 -9.338 -11.045 1.00 60.12 C ATOM 1283 CG GLU A 109 -13.983 -9.410 -10.921 1.00 42.43 C ATOM 1284 CD GLU A 109 -14.539 -10.757 -11.343 1.00 52.53 C ATOM 1285 OE1 GLU A 109 -14.602 -11.016 -12.563 1.00 64.15 O ATOM 1286 OE2 GLU A 109 -14.910 -11.551 -10.454 1.00 72.41 O ATOM 0 H GLU A 109 -10.114 -8.727 -11.441 1.00 3.22 H new ATOM 0 HA GLU A 109 -12.387 -7.191 -11.080 1.00 54.50 H new ATOM 0 HB2 GLU A 109 -12.192 -9.497 -12.087 1.00 60.12 H new ATOM 0 HB3 GLU A 109 -12.028 -10.150 -10.469 1.00 60.12 H new ATOM 0 HG2 GLU A 109 -14.269 -9.210 -9.888 1.00 42.43 H new ATOM 0 HG3 GLU A 109 -14.432 -8.628 -11.533 1.00 42.43 H new ATOM 1291 N TYR A 110 -11.310 -8.569 -8.280 1.00 61.24 N ATOM 1292 CA TYR A 110 -11.421 -8.512 -6.827 1.00 15.03 C ATOM 1293 C TYR A 110 -10.640 -7.326 -6.267 1.00 4.05 C ATOM 1294 O TYR A 110 -11.125 -6.602 -5.399 1.00 22.24 O ATOM 1295 CB TYR A 110 -10.912 -9.812 -6.203 1.00 12.22 C ATOM 1296 CG TYR A 110 -11.442 -11.056 -6.880 1.00 13.25 C ATOM 1297 CD1 TYR A 110 -12.779 -11.155 -7.245 1.00 4.24 C ATOM 1298 CD2 TYR A 110 -10.606 -12.132 -7.153 1.00 61.11 C ATOM 1299 CE1 TYR A 110 -13.268 -12.290 -7.864 1.00 40.11 C ATOM 1300 CE2 TYR A 110 -11.086 -13.270 -7.772 1.00 71.24 C ATOM 1301 CZ TYR A 110 -12.418 -13.344 -8.125 1.00 4.11 C ATOM 1302 OH TYR A 110 -12.900 -14.477 -8.740 1.00 52.51 O ATOM 0 H TYR A 110 -10.584 -9.198 -8.623 1.00 61.24 H new ATOM 0 HA TYR A 110 -12.473 -8.384 -6.574 1.00 15.03 H new ATOM 0 HB2 TYR A 110 -9.823 -9.823 -6.243 1.00 12.22 H new ATOM 0 HB3 TYR A 110 -11.192 -9.834 -5.150 1.00 12.22 H new ATOM 0 HD1 TYR A 110 -13.447 -10.331 -7.042 1.00 4.24 H new ATOM 0 HD2 TYR A 110 -9.563 -12.078 -6.877 1.00 61.11 H new ATOM 0 HE1 TYR A 110 -14.310 -12.351 -8.142 1.00 40.11 H new ATOM 0 HE2 TYR A 110 -10.423 -14.097 -7.978 1.00 71.24 H new ATOM 0 HH TYR A 110 -12.172 -15.123 -8.852 1.00 52.51 H new ATOM 1311 N PHE A 111 -9.426 -7.135 -6.773 1.00 22.31 N ATOM 1312 CA PHE A 111 -8.575 -6.038 -6.326 1.00 32.44 C ATOM 1313 C PHE A 111 -9.318 -4.708 -6.400 1.00 72.31 C ATOM 1314 O PHE A 111 -9.398 -3.972 -5.416 1.00 35.01 O ATOM 1315 CB PHE A 111 -7.303 -5.972 -7.173 1.00 65.30 C ATOM 1316 CG PHE A 111 -6.450 -4.772 -6.880 1.00 11.55 C ATOM 1317 CD1 PHE A 111 -5.933 -4.564 -5.612 1.00 62.33 C ATOM 1318 CD2 PHE A 111 -6.163 -3.850 -7.876 1.00 64.53 C ATOM 1319 CE1 PHE A 111 -5.148 -3.459 -5.341 1.00 72.31 C ATOM 1320 CE2 PHE A 111 -5.379 -2.743 -7.610 1.00 24.25 C ATOM 1321 CZ PHE A 111 -4.870 -2.548 -6.341 1.00 21.11 C ATOM 0 H PHE A 111 -9.009 -7.726 -7.493 1.00 22.31 H new ATOM 0 HA PHE A 111 -8.302 -6.224 -5.287 1.00 32.44 H new ATOM 0 HB2 PHE A 111 -6.716 -6.875 -7.004 1.00 65.30 H new ATOM 0 HB3 PHE A 111 -7.578 -5.963 -8.228 1.00 65.30 H new ATOM 0 HD1 PHE A 111 -6.146 -5.273 -4.826 1.00 62.33 H new ATOM 0 HD2 PHE A 111 -6.557 -3.999 -8.871 1.00 64.53 H new ATOM 0 HE1 PHE A 111 -4.752 -3.308 -4.348 1.00 72.31 H new ATOM 0 HE2 PHE A 111 -5.165 -2.031 -8.394 1.00 24.25 H new ATOM 0 HZ PHE A 111 -4.256 -1.685 -6.131 1.00 21.11 H new ATOM 1330 N THR A 112 -9.861 -4.405 -7.575 1.00 64.21 N ATOM 1331 CA THR A 112 -10.596 -3.164 -7.780 1.00 74.13 C ATOM 1332 C THR A 112 -11.643 -2.958 -6.690 1.00 44.32 C ATOM 1333 O THR A 112 -11.852 -1.840 -6.218 1.00 25.33 O ATOM 1334 CB THR A 112 -11.291 -3.142 -9.155 1.00 65.52 C ATOM 1335 OG1 THR A 112 -12.129 -4.295 -9.297 1.00 41.43 O ATOM 1336 CG2 THR A 112 -10.267 -3.111 -10.279 1.00 25.52 C ATOM 0 H THR A 112 -9.805 -5.003 -8.399 1.00 64.21 H new ATOM 0 HA THR A 112 -9.867 -2.355 -7.737 1.00 74.13 H new ATOM 0 HB THR A 112 -11.900 -2.240 -9.216 1.00 65.52 H new ATOM 0 HG1 THR A 112 -11.643 -4.995 -9.782 1.00 41.43 H new ATOM 0 HG21 THR A 112 -10.782 -3.096 -11.240 1.00 25.52 H new ATOM 0 HG22 THR A 112 -9.649 -2.218 -10.184 1.00 25.52 H new ATOM 0 HG23 THR A 112 -9.635 -3.997 -10.220 1.00 25.52 H new ATOM 1344 N LYS A 113 -12.300 -4.044 -6.296 1.00 73.21 N ATOM 1345 CA LYS A 113 -13.325 -3.984 -5.261 1.00 32.50 C ATOM 1346 C LYS A 113 -12.722 -3.569 -3.922 1.00 21.51 C ATOM 1347 O LYS A 113 -13.239 -2.678 -3.248 1.00 21.41 O ATOM 1348 CB LYS A 113 -14.019 -5.341 -5.121 1.00 11.53 C ATOM 1349 CG LYS A 113 -15.101 -5.365 -4.056 1.00 31.43 C ATOM 1350 CD LYS A 113 -14.554 -5.831 -2.717 1.00 72.52 C ATOM 1351 CE LYS A 113 -15.406 -5.326 -1.561 1.00 2.31 C ATOM 1352 NZ LYS A 113 -15.480 -3.839 -1.536 1.00 72.30 N ATOM 0 H LYS A 113 -12.141 -4.976 -6.678 1.00 73.21 H new ATOM 0 HA LYS A 113 -14.061 -3.236 -5.556 1.00 32.50 H new ATOM 0 HB2 LYS A 113 -14.459 -5.615 -6.080 1.00 11.53 H new ATOM 0 HB3 LYS A 113 -13.272 -6.099 -4.885 1.00 11.53 H new ATOM 0 HG2 LYS A 113 -15.529 -4.368 -3.948 1.00 31.43 H new ATOM 0 HG3 LYS A 113 -15.908 -6.027 -4.371 1.00 31.43 H new ATOM 0 HD2 LYS A 113 -14.519 -6.920 -2.696 1.00 72.52 H new ATOM 0 HD3 LYS A 113 -13.530 -5.477 -2.598 1.00 72.52 H new ATOM 0 HE2 LYS A 113 -16.412 -5.738 -1.643 1.00 2.31 H new ATOM 0 HE3 LYS A 113 -14.990 -5.685 -0.619 1.00 2.31 H new ATOM 0 HZ1 LYS A 113 -15.746 -3.521 -0.582 1.00 72.30 H new ATOM 0 HZ2 LYS A 113 -14.553 -3.441 -1.788 1.00 72.30 H new ATOM 0 HZ3 LYS A 113 -16.193 -3.515 -2.220 1.00 72.30 H new ATOM 1362 N ILE A 114 -11.627 -4.219 -3.544 1.00 3.10 N ATOM 1363 CA ILE A 114 -10.953 -3.916 -2.288 1.00 12.11 C ATOM 1364 C ILE A 114 -10.590 -2.437 -2.202 1.00 64.41 C ATOM 1365 O ILE A 114 -10.944 -1.756 -1.241 1.00 75.45 O ATOM 1366 CB ILE A 114 -9.675 -4.757 -2.117 1.00 1.31 C ATOM 1367 CG1 ILE A 114 -9.912 -6.190 -2.599 1.00 72.12 C ATOM 1368 CG2 ILE A 114 -9.225 -4.749 -0.664 1.00 62.53 C ATOM 1369 CD1 ILE A 114 -11.254 -6.752 -2.184 1.00 74.31 C ATOM 0 H ILE A 114 -11.187 -4.960 -4.090 1.00 3.10 H new ATOM 0 HA ILE A 114 -11.651 -4.164 -1.488 1.00 12.11 H new ATOM 0 HB ILE A 114 -8.884 -4.316 -2.724 1.00 1.31 H new ATOM 0 HG12 ILE A 114 -9.836 -6.216 -3.686 1.00 72.12 H new ATOM 0 HG13 ILE A 114 -9.122 -6.832 -2.209 1.00 72.12 H new ATOM 0 HG21 ILE A 114 -8.320 -5.348 -0.560 1.00 62.53 H new ATOM 0 HG22 ILE A 114 -9.020 -3.725 -0.352 1.00 62.53 H new ATOM 0 HG23 ILE A 114 -10.012 -5.168 -0.037 1.00 62.53 H new ATOM 0 HD11 ILE A 114 -11.354 -7.770 -2.560 1.00 74.31 H new ATOM 0 HD12 ILE A 114 -11.325 -6.758 -1.096 1.00 74.31 H new ATOM 0 HD13 ILE A 114 -12.051 -6.133 -2.597 1.00 74.31 H new ATOM 1380 N ALA A 115 -9.884 -1.947 -3.215 1.00 4.24 N ATOM 1381 CA ALA A 115 -9.476 -0.548 -3.256 1.00 22.13 C ATOM 1382 C ALA A 115 -10.678 0.378 -3.109 1.00 4.32 C ATOM 1383 O ALA A 115 -10.707 1.243 -2.233 1.00 1.54 O ATOM 1384 CB ALA A 115 -8.734 -0.253 -4.551 1.00 71.10 C ATOM 0 H ALA A 115 -9.582 -2.498 -4.019 1.00 4.24 H new ATOM 0 HA ALA A 115 -8.805 -0.365 -2.417 1.00 22.13 H new ATOM 0 HB1 ALA A 115 -8.435 0.795 -4.568 1.00 71.10 H new ATOM 0 HB2 ALA A 115 -7.848 -0.884 -4.614 1.00 71.10 H new ATOM 0 HB3 ALA A 115 -9.387 -0.458 -5.399 1.00 71.10 H new ATOM 1390 N THR A 116 -11.671 0.193 -3.974 1.00 4.20 N ATOM 1391 CA THR A 116 -12.875 1.013 -3.943 1.00 23.41 C ATOM 1392 C THR A 116 -13.455 1.083 -2.534 1.00 44.24 C ATOM 1393 O THR A 116 -13.879 2.146 -2.080 1.00 62.33 O ATOM 1394 CB THR A 116 -13.950 0.470 -4.903 1.00 71.54 C ATOM 1395 OG1 THR A 116 -13.385 0.255 -6.200 1.00 10.40 O ATOM 1396 CG2 THR A 116 -15.121 1.435 -5.007 1.00 34.22 C ATOM 0 H THR A 116 -11.664 -0.518 -4.705 1.00 4.20 H new ATOM 0 HA THR A 116 -12.585 2.013 -4.264 1.00 23.41 H new ATOM 0 HB THR A 116 -14.315 -0.477 -4.505 1.00 71.54 H new ATOM 0 HG1 THR A 116 -13.158 -0.693 -6.305 1.00 10.40 H new ATOM 0 HG21 THR A 116 -15.867 1.030 -5.691 1.00 34.22 H new ATOM 0 HG22 THR A 116 -15.568 1.572 -4.022 1.00 34.22 H new ATOM 0 HG23 THR A 116 -14.769 2.396 -5.383 1.00 34.22 H new ATOM 1404 N SER A 117 -13.472 -0.055 -1.849 1.00 20.04 N ATOM 1405 CA SER A 117 -14.003 -0.123 -0.493 1.00 63.33 C ATOM 1406 C SER A 117 -13.205 0.772 0.450 1.00 1.25 C ATOM 1407 O SER A 117 -13.773 1.521 1.244 1.00 33.43 O ATOM 1408 CB SER A 117 -13.981 -1.566 0.015 1.00 65.53 C ATOM 1409 OG SER A 117 -13.389 -1.646 1.300 1.00 41.41 O ATOM 0 H SER A 117 -13.124 -0.943 -2.211 1.00 20.04 H new ATOM 0 HA SER A 117 -15.034 0.231 -0.516 1.00 63.33 H new ATOM 0 HB2 SER A 117 -14.998 -1.956 0.055 1.00 65.53 H new ATOM 0 HB3 SER A 117 -13.426 -2.192 -0.684 1.00 65.53 H new ATOM 0 HG SER A 117 -12.594 -2.218 1.259 1.00 41.41 H new ATOM 1414 N LEU A 118 -11.882 0.688 0.355 1.00 12.40 N ATOM 1415 CA LEU A 118 -11.003 1.490 1.198 1.00 30.35 C ATOM 1416 C LEU A 118 -11.120 2.972 0.854 1.00 64.11 C ATOM 1417 O LEU A 118 -11.458 3.793 1.706 1.00 65.21 O ATOM 1418 CB LEU A 118 -9.552 1.031 1.038 1.00 23.11 C ATOM 1419 CG LEU A 118 -9.011 0.120 2.141 1.00 5.12 C ATOM 1420 CD1 LEU A 118 -7.561 -0.247 1.866 1.00 72.32 C ATOM 1421 CD2 LEU A 118 -9.146 0.789 3.500 1.00 35.14 C ATOM 0 H LEU A 118 -11.395 0.073 -0.297 1.00 12.40 H new ATOM 0 HA LEU A 118 -11.310 1.352 2.235 1.00 30.35 H new ATOM 0 HB2 LEU A 118 -9.460 0.509 0.086 1.00 23.11 H new ATOM 0 HB3 LEU A 118 -8.917 1.915 0.980 1.00 23.11 H new ATOM 0 HG LEU A 118 -9.601 -0.797 2.151 1.00 5.12 H new ATOM 0 HD11 LEU A 118 -7.193 -0.895 2.661 1.00 72.32 H new ATOM 0 HD12 LEU A 118 -7.492 -0.769 0.911 1.00 72.32 H new ATOM 0 HD13 LEU A 118 -6.957 0.660 1.828 1.00 72.32 H new ATOM 0 HD21 LEU A 118 -8.756 0.126 4.272 1.00 35.14 H new ATOM 0 HD22 LEU A 118 -8.582 1.722 3.504 1.00 35.14 H new ATOM 0 HD23 LEU A 118 -10.197 0.999 3.699 1.00 35.14 H new ATOM 1432 N PHE A 119 -10.840 3.306 -0.402 1.00 34.31 N ATOM 1433 CA PHE A 119 -10.915 4.688 -0.859 1.00 74.01 C ATOM 1434 C PHE A 119 -12.291 4.994 -1.443 1.00 70.24 C ATOM 1435 O PHE A 119 -12.407 5.648 -2.478 1.00 33.23 O ATOM 1436 CB PHE A 119 -9.833 4.961 -1.906 1.00 2.43 C ATOM 1437 CG PHE A 119 -8.487 4.410 -1.534 1.00 3.33 C ATOM 1438 CD1 PHE A 119 -8.153 3.098 -1.831 1.00 62.53 C ATOM 1439 CD2 PHE A 119 -7.553 5.204 -0.887 1.00 60.33 C ATOM 1440 CE1 PHE A 119 -6.915 2.587 -1.490 1.00 15.13 C ATOM 1441 CE2 PHE A 119 -6.313 4.699 -0.545 1.00 32.41 C ATOM 1442 CZ PHE A 119 -5.994 3.389 -0.845 1.00 12.11 C ATOM 0 H PHE A 119 -10.559 2.639 -1.120 1.00 34.31 H new ATOM 0 HA PHE A 119 -10.752 5.338 0.001 1.00 74.01 H new ATOM 0 HB2 PHE A 119 -10.143 4.530 -2.858 1.00 2.43 H new ATOM 0 HB3 PHE A 119 -9.747 6.037 -2.056 1.00 2.43 H new ATOM 0 HD1 PHE A 119 -8.870 2.467 -2.335 1.00 62.53 H new ATOM 0 HD2 PHE A 119 -7.797 6.228 -0.648 1.00 60.33 H new ATOM 0 HE1 PHE A 119 -6.668 1.563 -1.727 1.00 15.13 H new ATOM 0 HE2 PHE A 119 -5.593 5.329 -0.043 1.00 32.41 H new ATOM 0 HZ PHE A 119 -5.026 2.993 -0.576 1.00 12.11 H new ATOM 1451 N GLU A 120 -13.333 4.514 -0.769 1.00 1.41 N ATOM 1452 CA GLU A 120 -14.701 4.735 -1.222 1.00 74.32 C ATOM 1453 C GLU A 120 -15.044 6.222 -1.212 1.00 41.22 C ATOM 1454 O GLU A 120 -15.608 6.746 -2.172 1.00 1.54 O ATOM 1455 CB GLU A 120 -15.685 3.967 -0.336 1.00 11.54 C ATOM 1456 CG GLU A 120 -16.650 3.090 -1.115 1.00 53.30 C ATOM 1457 CD GLU A 120 -17.287 2.017 -0.256 1.00 70.55 C ATOM 1458 OE1 GLU A 120 -17.009 1.990 0.962 1.00 45.23 O ATOM 1459 OE2 GLU A 120 -18.065 1.204 -0.799 1.00 1.11 O ATOM 0 H GLU A 120 -13.255 3.971 0.091 1.00 1.41 H new ATOM 0 HA GLU A 120 -14.782 4.368 -2.245 1.00 74.32 H new ATOM 0 HB2 GLU A 120 -15.124 3.345 0.361 1.00 11.54 H new ATOM 0 HB3 GLU A 120 -16.255 4.679 0.261 1.00 11.54 H new ATOM 0 HG2 GLU A 120 -17.431 3.713 -1.550 1.00 53.30 H new ATOM 0 HG3 GLU A 120 -16.120 2.620 -1.943 1.00 53.30 H new ATOM 1464 N SER A 121 -14.701 6.895 -0.118 1.00 44.04 N ATOM 1465 CA SER A 121 -14.977 8.321 0.020 1.00 4.12 C ATOM 1466 C SER A 121 -13.971 8.979 0.959 1.00 50.32 C ATOM 1467 O SER A 121 -14.253 10.015 1.559 1.00 71.40 O ATOM 1468 CB SER A 121 -16.399 8.539 0.541 1.00 10.35 C ATOM 1469 OG SER A 121 -17.091 9.490 -0.248 1.00 5.43 O ATOM 0 H SER A 121 -14.232 6.476 0.685 1.00 44.04 H new ATOM 0 HA SER A 121 -14.885 8.782 -0.964 1.00 4.12 H new ATOM 0 HB2 SER A 121 -16.941 7.593 0.535 1.00 10.35 H new ATOM 0 HB3 SER A 121 -16.362 8.878 1.576 1.00 10.35 H new ATOM 0 HG SER A 121 -17.997 9.610 0.105 1.00 5.43 H new ATOM 1474 N GLY A 122 -12.795 8.369 1.080 1.00 53.44 N ATOM 1475 CA GLY A 122 -11.765 8.910 1.947 1.00 74.41 C ATOM 1476 C GLY A 122 -10.368 8.551 1.482 1.00 64.11 C ATOM 1477 O GLY A 122 -10.039 7.372 1.338 1.00 54.55 O ATOM 0 H GLY A 122 -12.538 7.510 0.593 1.00 53.44 H new ATOM 0 HA2 GLY A 122 -11.863 9.995 1.989 1.00 74.41 H new ATOM 0 HA3 GLY A 122 -11.914 8.537 2.960 1.00 74.41 H new ATOM 1481 N ILE A 123 -9.546 9.566 1.245 1.00 33.20 N ATOM 1482 CA ILE A 123 -8.177 9.351 0.792 1.00 72.42 C ATOM 1483 C ILE A 123 -7.172 9.907 1.796 1.00 43.43 C ATOM 1484 O ILE A 123 -7.045 11.120 1.955 1.00 42.32 O ATOM 1485 CB ILE A 123 -7.929 10.003 -0.580 1.00 3.50 C ATOM 1486 CG1 ILE A 123 -9.111 9.739 -1.516 1.00 31.15 C ATOM 1487 CG2 ILE A 123 -6.637 9.477 -1.190 1.00 34.25 C ATOM 1488 CD1 ILE A 123 -8.947 10.359 -2.886 1.00 71.15 C ATOM 0 H ILE A 123 -9.803 10.546 1.359 1.00 33.20 H new ATOM 0 HA ILE A 123 -8.040 8.273 0.703 1.00 72.42 H new ATOM 0 HB ILE A 123 -7.832 11.080 -0.442 1.00 3.50 H new ATOM 0 HG12 ILE A 123 -9.243 8.663 -1.627 1.00 31.15 H new ATOM 0 HG13 ILE A 123 -10.021 10.126 -1.057 1.00 31.15 H new ATOM 0 HG21 ILE A 123 -6.475 9.947 -2.160 1.00 34.25 H new ATOM 0 HG22 ILE A 123 -5.802 9.710 -0.530 1.00 34.25 H new ATOM 0 HG23 ILE A 123 -6.708 8.397 -1.318 1.00 34.25 H new ATOM 0 HD11 ILE A 123 -9.822 10.131 -3.495 1.00 71.15 H new ATOM 0 HD12 ILE A 123 -8.845 11.440 -2.787 1.00 71.15 H new ATOM 0 HD13 ILE A 123 -8.056 9.953 -3.365 1.00 71.15 H new ATOM 1499 N ASN A 124 -6.459 9.010 2.470 1.00 75.32 N ATOM 1500 CA ASN A 124 -5.464 9.412 3.457 1.00 70.52 C ATOM 1501 C ASN A 124 -4.180 8.604 3.295 1.00 22.11 C ATOM 1502 O ASN A 124 -4.198 7.489 2.773 1.00 10.42 O ATOM 1503 CB ASN A 124 -6.017 9.230 4.873 1.00 53.25 C ATOM 1504 CG ASN A 124 -4.974 8.707 5.840 1.00 0.24 C ATOM 1505 OD1 ASN A 124 -4.080 9.440 6.263 1.00 20.01 O ATOM 1506 ND2 ASN A 124 -5.082 7.432 6.194 1.00 23.05 N ATOM 0 H ASN A 124 -6.552 8.001 2.351 1.00 75.32 H new ATOM 0 HA ASN A 124 -5.234 10.465 3.295 1.00 70.52 H new ATOM 0 HB2 ASN A 124 -6.398 10.184 5.236 1.00 53.25 H new ATOM 0 HB3 ASN A 124 -6.860 8.540 4.845 1.00 53.25 H new ATOM 0 HD21 ASN A 124 -4.408 7.024 6.841 1.00 23.05 H new ATOM 0 HD22 ASN A 124 -5.839 6.861 5.819 1.00 23.05 H new ATOM 1512 N TRP A 125 -3.068 9.174 3.746 1.00 0.30 N ATOM 1513 CA TRP A 125 -1.775 8.507 3.650 1.00 32.15 C ATOM 1514 C TRP A 125 -1.869 7.064 4.135 1.00 13.31 C ATOM 1515 O TRP A 125 -1.488 6.135 3.424 1.00 61.11 O ATOM 1516 CB TRP A 125 -0.726 9.265 4.466 1.00 23.14 C ATOM 1517 CG TRP A 125 -0.017 10.328 3.682 1.00 64.22 C ATOM 1518 CD1 TRP A 125 0.046 11.659 3.977 1.00 72.51 C ATOM 1519 CD2 TRP A 125 0.728 10.147 2.472 1.00 70.40 C ATOM 1520 NE1 TRP A 125 0.785 12.317 3.023 1.00 73.53 N ATOM 1521 CE2 TRP A 125 1.216 11.411 2.091 1.00 55.24 C ATOM 1522 CE3 TRP A 125 1.032 9.040 1.677 1.00 25.32 C ATOM 1523 CZ2 TRP A 125 1.988 11.597 0.947 1.00 13.01 C ATOM 1524 CZ3 TRP A 125 1.799 9.224 0.542 1.00 75.40 C ATOM 1525 CH2 TRP A 125 2.271 10.495 0.187 1.00 12.42 C ATOM 0 H TRP A 125 -3.036 10.096 4.181 1.00 0.30 H new ATOM 0 HA TRP A 125 -1.475 8.499 2.602 1.00 32.15 H new ATOM 0 HB2 TRP A 125 -1.209 9.722 5.330 1.00 23.14 H new ATOM 0 HB3 TRP A 125 0.008 8.556 4.849 1.00 23.14 H new ATOM 0 HD1 TRP A 125 -0.417 12.126 4.834 1.00 72.51 H new ATOM 0 HE1 TRP A 125 0.981 13.318 3.011 1.00 73.53 H new ATOM 0 HE3 TRP A 125 0.674 8.057 1.944 1.00 25.32 H new ATOM 0 HZ2 TRP A 125 2.350 12.576 0.670 1.00 13.01 H new ATOM 0 HZ3 TRP A 125 2.038 8.375 -0.081 1.00 75.40 H new ATOM 0 HH2 TRP A 125 2.870 10.607 -0.705 1.00 12.42 H new ATOM 1535 N GLY A 126 -2.379 6.885 5.350 1.00 41.01 N ATOM 1536 CA GLY A 126 -2.514 5.552 5.907 1.00 54.01 C ATOM 1537 C GLY A 126 -3.210 4.595 4.960 1.00 71.51 C ATOM 1538 O GLY A 126 -2.821 3.433 4.846 1.00 63.43 O ATOM 0 H GLY A 126 -2.701 7.639 5.958 1.00 41.01 H new ATOM 0 HA2 GLY A 126 -1.526 5.162 6.151 1.00 54.01 H new ATOM 0 HA3 GLY A 126 -3.075 5.607 6.840 1.00 54.01 H new ATOM 1542 N ARG A 127 -4.243 5.083 4.281 1.00 23.03 N ATOM 1543 CA ARG A 127 -4.996 4.261 3.341 1.00 12.43 C ATOM 1544 C ARG A 127 -4.125 3.850 2.158 1.00 11.53 C ATOM 1545 O ARG A 127 -4.170 2.705 1.707 1.00 74.05 O ATOM 1546 CB ARG A 127 -6.227 5.019 2.842 1.00 51.34 C ATOM 1547 CG ARG A 127 -7.308 5.190 3.898 1.00 4.32 C ATOM 1548 CD ARG A 127 -8.439 6.076 3.399 1.00 30.32 C ATOM 1549 NE ARG A 127 -9.744 5.602 3.851 1.00 25.00 N ATOM 1550 CZ ARG A 127 -10.135 5.620 5.120 1.00 23.32 C ATOM 1551 NH1 ARG A 127 -9.324 6.088 6.060 1.00 45.04 N ATOM 1552 NH2 ARG A 127 -11.339 5.171 5.452 1.00 4.15 N ATOM 0 H ARG A 127 -4.578 6.043 4.364 1.00 23.03 H new ATOM 0 HA ARG A 127 -5.318 3.360 3.863 1.00 12.43 H new ATOM 0 HB2 ARG A 127 -5.918 6.003 2.488 1.00 51.34 H new ATOM 0 HB3 ARG A 127 -6.647 4.490 1.987 1.00 51.34 H new ATOM 0 HG2 ARG A 127 -7.705 4.213 4.176 1.00 4.32 H new ATOM 0 HG3 ARG A 127 -6.873 5.625 4.798 1.00 4.32 H new ATOM 0 HD2 ARG A 127 -8.282 7.096 3.750 1.00 30.32 H new ATOM 0 HD3 ARG A 127 -8.422 6.107 2.310 1.00 30.32 H new ATOM 0 HE ARG A 127 -10.392 5.237 3.153 1.00 25.00 H new ATOM 0 HH11 ARG A 127 -8.398 6.435 5.809 1.00 45.04 H new ATOM 0 HH12 ARG A 127 -9.626 6.101 7.034 1.00 45.04 H new ATOM 0 HH21 ARG A 127 -11.966 4.811 4.732 1.00 4.15 H new ATOM 0 HH22 ARG A 127 -11.638 5.186 6.427 1.00 4.15 H new ATOM 1563 N VAL A 128 -3.330 4.792 1.659 1.00 55.21 N ATOM 1564 CA VAL A 128 -2.448 4.528 0.529 1.00 13.32 C ATOM 1565 C VAL A 128 -1.416 3.462 0.875 1.00 13.43 C ATOM 1566 O VAL A 128 -1.289 2.455 0.179 1.00 51.35 O ATOM 1567 CB VAL A 128 -1.717 5.808 0.077 1.00 44.34 C ATOM 1568 CG1 VAL A 128 -0.654 5.477 -0.960 1.00 64.21 C ATOM 1569 CG2 VAL A 128 -2.709 6.823 -0.470 1.00 71.00 C ATOM 0 H VAL A 128 -3.279 5.745 2.020 1.00 55.21 H new ATOM 0 HA VAL A 128 -3.076 4.170 -0.286 1.00 13.32 H new ATOM 0 HB VAL A 128 -1.222 6.248 0.943 1.00 44.34 H new ATOM 0 HG11 VAL A 128 -0.148 6.392 -1.268 1.00 64.21 H new ATOM 0 HG12 VAL A 128 0.073 4.788 -0.529 1.00 64.21 H new ATOM 0 HG13 VAL A 128 -1.124 5.013 -1.827 1.00 64.21 H new ATOM 0 HG21 VAL A 128 -2.176 7.720 -0.784 1.00 71.00 H new ATOM 0 HG22 VAL A 128 -3.234 6.395 -1.324 1.00 71.00 H new ATOM 0 HG23 VAL A 128 -3.429 7.082 0.306 1.00 71.00 H new ATOM 1579 N VAL A 129 -0.677 3.689 1.957 1.00 73.04 N ATOM 1580 CA VAL A 129 0.344 2.747 2.398 1.00 15.30 C ATOM 1581 C VAL A 129 -0.252 1.365 2.643 1.00 71.12 C ATOM 1582 O VAL A 129 0.328 0.351 2.258 1.00 22.11 O ATOM 1583 CB VAL A 129 1.035 3.232 3.687 1.00 5.31 C ATOM 1584 CG1 VAL A 129 1.893 4.456 3.405 1.00 52.15 C ATOM 1585 CG2 VAL A 129 0.004 3.528 4.765 1.00 0.24 C ATOM 0 H VAL A 129 -0.767 4.518 2.544 1.00 73.04 H new ATOM 0 HA VAL A 129 1.083 2.684 1.599 1.00 15.30 H new ATOM 0 HB VAL A 129 1.687 2.438 4.050 1.00 5.31 H new ATOM 0 HG11 VAL A 129 2.373 4.784 4.327 1.00 52.15 H new ATOM 0 HG12 VAL A 129 2.656 4.204 2.669 1.00 52.15 H new ATOM 0 HG13 VAL A 129 1.266 5.259 3.017 1.00 52.15 H new ATOM 0 HG21 VAL A 129 0.510 3.869 5.668 1.00 0.24 H new ATOM 0 HG22 VAL A 129 -0.676 4.304 4.415 1.00 0.24 H new ATOM 0 HG23 VAL A 129 -0.562 2.623 4.986 1.00 0.24 H new ATOM 1595 N ALA A 130 -1.415 1.334 3.285 1.00 55.34 N ATOM 1596 CA ALA A 130 -2.092 0.077 3.579 1.00 65.23 C ATOM 1597 C ALA A 130 -2.406 -0.691 2.299 1.00 13.34 C ATOM 1598 O ALA A 130 -2.238 -1.909 2.236 1.00 21.35 O ATOM 1599 CB ALA A 130 -3.367 0.336 4.368 1.00 22.10 C ATOM 0 H ALA A 130 -1.908 2.165 3.611 1.00 55.34 H new ATOM 0 HA ALA A 130 -1.422 -0.535 4.183 1.00 65.23 H new ATOM 0 HB1 ALA A 130 -3.862 -0.611 4.580 1.00 22.10 H new ATOM 0 HB2 ALA A 130 -3.120 0.835 5.305 1.00 22.10 H new ATOM 0 HB3 ALA A 130 -4.034 0.971 3.784 1.00 22.10 H new ATOM 1605 N LEU A 131 -2.863 0.030 1.280 1.00 20.24 N ATOM 1606 CA LEU A 131 -3.201 -0.583 0.001 1.00 44.30 C ATOM 1607 C LEU A 131 -2.048 -1.439 -0.514 1.00 42.50 C ATOM 1608 O LEU A 131 -2.246 -2.584 -0.924 1.00 2.31 O ATOM 1609 CB LEU A 131 -3.550 0.494 -1.027 1.00 11.10 C ATOM 1610 CG LEU A 131 -4.484 0.065 -2.159 1.00 74.24 C ATOM 1611 CD1 LEU A 131 -4.620 1.176 -3.189 1.00 20.23 C ATOM 1612 CD2 LEU A 131 -3.978 -1.212 -2.813 1.00 10.02 C ATOM 0 H LEU A 131 -3.008 1.039 1.315 1.00 20.24 H new ATOM 0 HA LEU A 131 -4.068 -1.226 0.152 1.00 44.30 H new ATOM 0 HB2 LEU A 131 -4.008 1.333 -0.503 1.00 11.10 H new ATOM 0 HB3 LEU A 131 -2.623 0.861 -1.467 1.00 11.10 H new ATOM 0 HG LEU A 131 -5.469 -0.133 -1.736 1.00 74.24 H new ATOM 0 HD11 LEU A 131 -5.288 0.853 -3.987 1.00 20.23 H new ATOM 0 HD12 LEU A 131 -5.029 2.067 -2.712 1.00 20.23 H new ATOM 0 HD13 LEU A 131 -3.640 1.406 -3.607 1.00 20.23 H new ATOM 0 HD21 LEU A 131 -4.655 -1.502 -3.616 1.00 10.02 H new ATOM 0 HD22 LEU A 131 -2.982 -1.041 -3.222 1.00 10.02 H new ATOM 0 HD23 LEU A 131 -3.934 -2.008 -2.070 1.00 10.02 H new ATOM 1623 N LEU A 132 -0.845 -0.878 -0.489 1.00 1.31 N ATOM 1624 CA LEU A 132 0.342 -1.591 -0.952 1.00 62.34 C ATOM 1625 C LEU A 132 0.669 -2.760 -0.027 1.00 13.31 C ATOM 1626 O LEU A 132 0.972 -3.860 -0.486 1.00 64.20 O ATOM 1627 CB LEU A 132 1.535 -0.638 -1.030 1.00 21.11 C ATOM 1628 CG LEU A 132 1.250 0.749 -1.606 1.00 53.13 C ATOM 1629 CD1 LEU A 132 2.546 1.451 -1.979 1.00 24.41 C ATOM 1630 CD2 LEU A 132 0.331 0.647 -2.815 1.00 63.55 C ATOM 0 H LEU A 132 -0.664 0.068 -0.153 1.00 1.31 H new ATOM 0 HA LEU A 132 0.135 -1.985 -1.947 1.00 62.34 H new ATOM 0 HB2 LEU A 132 1.943 -0.516 -0.027 1.00 21.11 H new ATOM 0 HB3 LEU A 132 2.311 -1.108 -1.634 1.00 21.11 H new ATOM 0 HG LEU A 132 0.748 1.341 -0.841 1.00 53.13 H new ATOM 0 HD11 LEU A 132 2.322 2.437 -2.387 1.00 24.41 H new ATOM 0 HD12 LEU A 132 3.170 1.559 -1.092 1.00 24.41 H new ATOM 0 HD13 LEU A 132 3.077 0.861 -2.726 1.00 24.41 H new ATOM 0 HD21 LEU A 132 0.139 1.644 -3.211 1.00 63.55 H new ATOM 0 HD22 LEU A 132 0.806 0.036 -3.583 1.00 63.55 H new ATOM 0 HD23 LEU A 132 -0.612 0.187 -2.518 1.00 63.55 H new ATOM 1641 N GLY A 133 0.605 -2.512 1.277 1.00 42.00 N ATOM 1642 CA GLY A 133 0.895 -3.554 2.245 1.00 71.32 C ATOM 1643 C GLY A 133 0.142 -4.838 1.959 1.00 14.22 C ATOM 1644 O GLY A 133 0.743 -5.906 1.845 1.00 43.53 O ATOM 0 H GLY A 133 0.358 -1.609 1.681 1.00 42.00 H new ATOM 0 HA2 GLY A 133 1.966 -3.757 2.245 1.00 71.32 H new ATOM 0 HA3 GLY A 133 0.637 -3.200 3.243 1.00 71.32 H new ATOM 1648 N PHE A 134 -1.179 -4.735 1.845 1.00 30.15 N ATOM 1649 CA PHE A 134 -2.016 -5.897 1.574 1.00 5.54 C ATOM 1650 C PHE A 134 -1.990 -6.250 0.090 1.00 10.41 C ATOM 1651 O PHE A 134 -2.268 -7.386 -0.295 1.00 11.22 O ATOM 1652 CB PHE A 134 -3.454 -5.633 2.022 1.00 34.42 C ATOM 1653 CG PHE A 134 -4.355 -5.179 0.910 1.00 34.41 C ATOM 1654 CD1 PHE A 134 -5.014 -6.102 0.114 1.00 33.41 C ATOM 1655 CD2 PHE A 134 -4.543 -3.828 0.660 1.00 65.52 C ATOM 1656 CE1 PHE A 134 -5.844 -5.687 -0.910 1.00 41.01 C ATOM 1657 CE2 PHE A 134 -5.372 -3.409 -0.362 1.00 40.41 C ATOM 1658 CZ PHE A 134 -6.023 -4.339 -1.149 1.00 62.33 C ATOM 0 H PHE A 134 -1.692 -3.858 1.936 1.00 30.15 H new ATOM 0 HA PHE A 134 -1.617 -6.740 2.138 1.00 5.54 H new ATOM 0 HB2 PHE A 134 -3.862 -6.543 2.461 1.00 34.42 H new ATOM 0 HB3 PHE A 134 -3.448 -4.876 2.806 1.00 34.42 H new ATOM 0 HD1 PHE A 134 -4.877 -7.158 0.296 1.00 33.41 H new ATOM 0 HD2 PHE A 134 -4.036 -3.096 1.271 1.00 65.52 H new ATOM 0 HE1 PHE A 134 -6.352 -6.417 -1.523 1.00 41.01 H new ATOM 0 HE2 PHE A 134 -5.511 -2.354 -0.546 1.00 40.41 H new ATOM 0 HZ PHE A 134 -6.670 -4.012 -1.949 1.00 62.33 H new ATOM 1667 N GLY A 135 -1.657 -5.268 -0.742 1.00 34.25 N ATOM 1668 CA GLY A 135 -1.602 -5.493 -2.173 1.00 42.43 C ATOM 1669 C GLY A 135 -0.658 -6.618 -2.548 1.00 1.40 C ATOM 1670 O GLY A 135 -1.057 -7.578 -3.208 1.00 63.43 O ATOM 0 H GLY A 135 -1.424 -4.319 -0.449 1.00 34.25 H new ATOM 0 HA2 GLY A 135 -2.602 -5.725 -2.540 1.00 42.43 H new ATOM 0 HA3 GLY A 135 -1.285 -4.576 -2.670 1.00 42.43 H new ATOM 1674 N TYR A 136 0.597 -6.501 -2.129 1.00 74.44 N ATOM 1675 CA TYR A 136 1.601 -7.514 -2.427 1.00 53.23 C ATOM 1676 C TYR A 136 1.267 -8.833 -1.736 1.00 72.35 C ATOM 1677 O TYR A 136 1.486 -9.910 -2.289 1.00 3.33 O ATOM 1678 CB TYR A 136 2.986 -7.034 -1.991 1.00 34.32 C ATOM 1679 CG TYR A 136 4.121 -7.832 -2.591 1.00 43.53 C ATOM 1680 CD1 TYR A 136 4.587 -8.986 -1.973 1.00 2.12 C ATOM 1681 CD2 TYR A 136 4.726 -7.434 -3.777 1.00 33.43 C ATOM 1682 CE1 TYR A 136 5.624 -9.719 -2.517 1.00 1.11 C ATOM 1683 CE2 TYR A 136 5.763 -8.161 -4.328 1.00 54.52 C ATOM 1684 CZ TYR A 136 6.208 -9.302 -3.696 1.00 30.54 C ATOM 1685 OH TYR A 136 7.242 -10.028 -4.242 1.00 43.45 O ATOM 0 H TYR A 136 0.943 -5.713 -1.581 1.00 74.44 H new ATOM 0 HA TYR A 136 1.604 -7.680 -3.504 1.00 53.23 H new ATOM 0 HB2 TYR A 136 3.103 -5.987 -2.270 1.00 34.32 H new ATOM 0 HB3 TYR A 136 3.053 -7.084 -0.904 1.00 34.32 H new ATOM 0 HD1 TYR A 136 4.131 -9.316 -1.051 1.00 2.12 H new ATOM 0 HD2 TYR A 136 4.379 -6.541 -4.276 1.00 33.43 H new ATOM 0 HE1 TYR A 136 5.975 -10.613 -2.023 1.00 1.11 H new ATOM 0 HE2 TYR A 136 6.223 -7.837 -5.250 1.00 54.52 H new ATOM 0 HH TYR A 136 7.540 -9.600 -5.072 1.00 43.45 H new ATOM 1694 N ARG A 137 0.734 -8.738 -0.522 1.00 41.12 N ATOM 1695 CA ARG A 137 0.370 -9.922 0.247 1.00 54.21 C ATOM 1696 C ARG A 137 -0.709 -10.726 -0.472 1.00 74.13 C ATOM 1697 O ARG A 137 -0.572 -11.934 -0.668 1.00 63.45 O ATOM 1698 CB ARG A 137 -0.121 -9.521 1.639 1.00 23.23 C ATOM 1699 CG ARG A 137 -0.125 -10.668 2.637 1.00 30.42 C ATOM 1700 CD ARG A 137 1.254 -10.889 3.238 1.00 30.31 C ATOM 1701 NE ARG A 137 1.198 -11.694 4.455 1.00 71.21 N ATOM 1702 CZ ARG A 137 1.070 -13.016 4.456 1.00 3.44 C ATOM 1703 NH1 ARG A 137 0.986 -13.678 3.310 1.00 31.21 N ATOM 1704 NH2 ARG A 137 1.027 -13.679 5.605 1.00 2.12 N ATOM 0 H ARG A 137 0.545 -7.854 -0.050 1.00 41.12 H new ATOM 0 HA ARG A 137 1.258 -10.546 0.348 1.00 54.21 H new ATOM 0 HB2 ARG A 137 0.512 -8.720 2.021 1.00 23.23 H new ATOM 0 HB3 ARG A 137 -1.131 -9.118 1.557 1.00 23.23 H new ATOM 0 HG2 ARG A 137 -0.840 -10.457 3.432 1.00 30.42 H new ATOM 0 HG3 ARG A 137 -0.458 -11.581 2.143 1.00 30.42 H new ATOM 0 HD2 ARG A 137 1.894 -11.382 2.506 1.00 30.31 H new ATOM 0 HD3 ARG A 137 1.711 -9.925 3.462 1.00 30.31 H new ATOM 0 HE ARG A 137 1.261 -11.215 5.353 1.00 71.21 H new ATOM 0 HH11 ARG A 137 1.020 -13.172 2.425 1.00 31.21 H new ATOM 0 HH12 ARG A 137 0.888 -14.693 3.314 1.00 31.21 H new ATOM 0 HH21 ARG A 137 1.092 -13.173 6.488 1.00 2.12 H new ATOM 0 HH22 ARG A 137 0.929 -14.694 5.605 1.00 2.12 H new ATOM 1715 N LEU A 138 -1.783 -10.048 -0.863 1.00 41.11 N ATOM 1716 CA LEU A 138 -2.887 -10.699 -1.561 1.00 73.21 C ATOM 1717 C LEU A 138 -2.422 -11.282 -2.892 1.00 70.53 C ATOM 1718 O LEU A 138 -2.790 -12.400 -3.253 1.00 15.02 O ATOM 1719 CB LEU A 138 -4.024 -9.704 -1.797 1.00 54.32 C ATOM 1720 CG LEU A 138 -5.052 -10.098 -2.859 1.00 34.51 C ATOM 1721 CD1 LEU A 138 -6.460 -9.773 -2.386 1.00 75.54 C ATOM 1722 CD2 LEU A 138 -4.755 -9.396 -4.175 1.00 1.51 C ATOM 0 H LEU A 138 -1.913 -9.048 -0.709 1.00 41.11 H new ATOM 0 HA LEU A 138 -3.250 -11.514 -0.935 1.00 73.21 H new ATOM 0 HB2 LEU A 138 -4.547 -9.550 -0.853 1.00 54.32 H new ATOM 0 HB3 LEU A 138 -3.588 -8.746 -2.080 1.00 54.32 H new ATOM 0 HG LEU A 138 -4.984 -11.174 -3.020 1.00 34.51 H new ATOM 0 HD11 LEU A 138 -7.177 -10.060 -3.155 1.00 75.54 H new ATOM 0 HD12 LEU A 138 -6.672 -10.322 -1.469 1.00 75.54 H new ATOM 0 HD13 LEU A 138 -6.542 -8.703 -2.195 1.00 75.54 H new ATOM 0 HD21 LEU A 138 -5.496 -9.688 -4.919 1.00 1.51 H new ATOM 0 HD22 LEU A 138 -4.794 -8.317 -4.028 1.00 1.51 H new ATOM 0 HD23 LEU A 138 -3.761 -9.679 -4.522 1.00 1.51 H new ATOM 1733 N ALA A 139 -1.610 -10.519 -3.615 1.00 14.14 N ATOM 1734 CA ALA A 139 -1.091 -10.962 -4.902 1.00 41.21 C ATOM 1735 C ALA A 139 -0.107 -12.115 -4.731 1.00 13.22 C ATOM 1736 O ALA A 139 0.027 -12.966 -5.611 1.00 14.43 O ATOM 1737 CB ALA A 139 -0.427 -9.803 -5.631 1.00 75.13 C ATOM 0 H ALA A 139 -1.297 -9.591 -3.331 1.00 14.14 H new ATOM 0 HA ALA A 139 -1.929 -11.320 -5.499 1.00 41.21 H new ATOM 0 HB1 ALA A 139 -0.044 -10.149 -6.591 1.00 75.13 H new ATOM 0 HB2 ALA A 139 -1.157 -9.011 -5.796 1.00 75.13 H new ATOM 0 HB3 ALA A 139 0.396 -9.418 -5.029 1.00 75.13 H new ATOM 1743 N LEU A 140 0.580 -12.135 -3.595 1.00 63.13 N ATOM 1744 CA LEU A 140 1.553 -13.184 -3.308 1.00 35.33 C ATOM 1745 C LEU A 140 0.854 -14.489 -2.938 1.00 34.32 C ATOM 1746 O LEU A 140 1.329 -15.575 -3.270 1.00 12.33 O ATOM 1747 CB LEU A 140 2.481 -12.750 -2.173 1.00 34.03 C ATOM 1748 CG LEU A 140 3.685 -13.653 -1.908 1.00 21.45 C ATOM 1749 CD1 LEU A 140 4.779 -13.400 -2.934 1.00 34.51 C ATOM 1750 CD2 LEU A 140 4.215 -13.436 -0.497 1.00 70.41 C ATOM 0 H LEU A 140 0.482 -11.437 -2.857 1.00 63.13 H new ATOM 0 HA LEU A 140 2.144 -13.352 -4.208 1.00 35.33 H new ATOM 0 HB2 LEU A 140 2.846 -11.747 -2.393 1.00 34.03 H new ATOM 0 HB3 LEU A 140 1.894 -12.682 -1.257 1.00 34.03 H new ATOM 0 HG LEU A 140 3.363 -14.690 -1.999 1.00 21.45 H new ATOM 0 HD11 LEU A 140 5.628 -14.052 -2.729 1.00 34.51 H new ATOM 0 HD12 LEU A 140 4.396 -13.607 -3.933 1.00 34.51 H new ATOM 0 HD13 LEU A 140 5.098 -12.359 -2.876 1.00 34.51 H new ATOM 0 HD21 LEU A 140 5.072 -14.087 -0.326 1.00 70.41 H new ATOM 0 HD22 LEU A 140 4.520 -12.396 -0.379 1.00 70.41 H new ATOM 0 HD23 LEU A 140 3.433 -13.669 0.225 1.00 70.41 H new ATOM 1761 N HIS A 141 -0.277 -14.374 -2.250 1.00 33.21 N ATOM 1762 CA HIS A 141 -1.043 -15.544 -1.837 1.00 43.11 C ATOM 1763 C HIS A 141 -1.392 -16.417 -3.039 1.00 12.13 C ATOM 1764 O HIS A 141 -1.602 -17.622 -2.904 1.00 63.22 O ATOM 1765 CB HIS A 141 -2.322 -15.115 -1.117 1.00 23.32 C ATOM 1766 CG HIS A 141 -2.332 -15.461 0.341 1.00 41.13 C ATOM 1767 ND1 HIS A 141 -1.649 -14.930 1.381 1.00 13.15 N flip ATOM 1768 CD2 HIS A 141 -3.115 -16.466 0.870 1.00 73.44 C flip ATOM 1769 CE1 HIS A 141 -2.027 -15.615 2.510 1.00 23.43 C flip ATOM 1770 NE2 HIS A 141 -2.913 -16.536 2.173 1.00 43.14 N flip ATOM 0 H HIS A 141 -0.683 -13.482 -1.967 1.00 33.21 H new ATOM 0 HA HIS A 141 -0.427 -16.127 -1.152 1.00 43.11 H new ATOM 0 HB2 HIS A 141 -2.448 -14.038 -1.228 1.00 23.32 H new ATOM 0 HB3 HIS A 141 -3.177 -15.587 -1.600 1.00 23.32 H new ATOM 0 HD1 HIS A 141 -0.978 -14.163 1.335 1.00 13.15 H new ATOM 0 HD2 HIS A 141 -3.787 -17.096 0.307 1.00 73.44 H new ATOM 0 HE1 HIS A 141 -1.660 -15.431 3.509 1.00 23.43 H new ATOM 1777 N VAL A 142 -1.452 -15.800 -4.216 1.00 31.21 N ATOM 1778 CA VAL A 142 -1.774 -16.521 -5.441 1.00 13.14 C ATOM 1779 C VAL A 142 -0.528 -16.742 -6.293 1.00 73.14 C ATOM 1780 O VAL A 142 -0.392 -17.768 -6.958 1.00 63.33 O ATOM 1781 CB VAL A 142 -2.826 -15.767 -6.275 1.00 14.35 C ATOM 1782 CG1 VAL A 142 -4.147 -15.688 -5.526 1.00 71.31 C ATOM 1783 CG2 VAL A 142 -2.323 -14.375 -6.633 1.00 42.15 C ATOM 0 H VAL A 142 -1.282 -14.803 -4.346 1.00 31.21 H new ATOM 0 HA VAL A 142 -2.182 -17.487 -5.142 1.00 13.14 H new ATOM 0 HB VAL A 142 -2.994 -16.318 -7.200 1.00 14.35 H new ATOM 0 HG11 VAL A 142 -4.877 -15.152 -6.132 1.00 71.31 H new ATOM 0 HG12 VAL A 142 -4.512 -16.695 -5.325 1.00 71.31 H new ATOM 0 HG13 VAL A 142 -4.000 -15.161 -4.584 1.00 71.31 H new ATOM 0 HG21 VAL A 142 -3.079 -13.856 -7.222 1.00 42.15 H new ATOM 0 HG22 VAL A 142 -2.126 -13.813 -5.720 1.00 42.15 H new ATOM 0 HG23 VAL A 142 -1.404 -14.458 -7.213 1.00 42.15 H new ATOM 1793 N TYR A 143 0.378 -15.771 -6.267 1.00 31.44 N ATOM 1794 CA TYR A 143 1.612 -15.858 -7.038 1.00 3.53 C ATOM 1795 C TYR A 143 2.528 -16.944 -6.481 1.00 41.24 C ATOM 1796 O TYR A 143 2.957 -17.841 -7.207 1.00 73.02 O ATOM 1797 CB TYR A 143 2.338 -14.511 -7.032 1.00 23.25 C ATOM 1798 CG TYR A 143 3.775 -14.596 -7.495 1.00 44.21 C ATOM 1799 CD1 TYR A 143 4.803 -14.842 -6.593 1.00 0.51 C ATOM 1800 CD2 TYR A 143 4.105 -14.429 -8.835 1.00 23.41 C ATOM 1801 CE1 TYR A 143 6.118 -14.919 -7.011 1.00 52.15 C ATOM 1802 CE2 TYR A 143 5.416 -14.506 -9.262 1.00 31.05 C ATOM 1803 CZ TYR A 143 6.419 -14.751 -8.347 1.00 62.14 C ATOM 1804 OH TYR A 143 7.726 -14.827 -8.768 1.00 0.44 O ATOM 0 H TYR A 143 0.281 -14.915 -5.721 1.00 31.44 H new ATOM 0 HA TYR A 143 1.351 -16.119 -8.064 1.00 3.53 H new ATOM 0 HB2 TYR A 143 1.799 -13.814 -7.674 1.00 23.25 H new ATOM 0 HB3 TYR A 143 2.314 -14.099 -6.023 1.00 23.25 H new ATOM 0 HD1 TYR A 143 4.570 -14.975 -5.547 1.00 0.51 H new ATOM 0 HD2 TYR A 143 3.323 -14.236 -9.554 1.00 23.41 H new ATOM 0 HE1 TYR A 143 6.905 -15.109 -6.296 1.00 52.15 H new ATOM 0 HE2 TYR A 143 5.655 -14.375 -10.307 1.00 31.05 H new ATOM 0 HH TYR A 143 7.766 -14.687 -9.737 1.00 0.44 H new ATOM 1813 N GLN A 144 2.821 -16.856 -5.188 1.00 55.32 N ATOM 1814 CA GLN A 144 3.685 -17.831 -4.533 1.00 33.24 C ATOM 1815 C GLN A 144 3.048 -19.216 -4.543 1.00 3.20 C ATOM 1816 O GLN A 144 3.742 -20.231 -4.462 1.00 71.21 O ATOM 1817 CB GLN A 144 3.975 -17.400 -3.094 1.00 1.03 C ATOM 1818 CG GLN A 144 5.443 -17.102 -2.832 1.00 43.11 C ATOM 1819 CD GLN A 144 6.081 -18.099 -1.886 1.00 23.22 C ATOM 1820 OE1 GLN A 144 5.846 -18.066 -0.678 1.00 42.35 O ATOM 1821 NE2 GLN A 144 6.897 -18.995 -2.432 1.00 61.51 N ATOM 0 H GLN A 144 2.473 -16.120 -4.573 1.00 55.32 H new ATOM 0 HA GLN A 144 4.623 -17.879 -5.087 1.00 33.24 H new ATOM 0 HB2 GLN A 144 3.386 -16.512 -2.864 1.00 1.03 H new ATOM 0 HB3 GLN A 144 3.646 -18.186 -2.415 1.00 1.03 H new ATOM 0 HG2 GLN A 144 5.985 -17.106 -3.778 1.00 43.11 H new ATOM 0 HG3 GLN A 144 5.537 -16.099 -2.415 1.00 43.11 H new ATOM 0 HE21 GLN A 144 7.064 -18.987 -3.438 1.00 61.51 H new ATOM 0 HE22 GLN A 144 7.356 -19.691 -1.845 1.00 61.51 H new ATOM 1828 N HIS A 145 1.723 -19.253 -4.643 1.00 31.00 N ATOM 1829 CA HIS A 145 0.992 -20.514 -4.664 1.00 64.12 C ATOM 1830 C HIS A 145 1.425 -21.373 -5.849 1.00 74.14 C ATOM 1831 O HIS A 145 1.359 -22.600 -5.795 1.00 0.01 O ATOM 1832 CB HIS A 145 -0.513 -20.256 -4.730 1.00 55.40 C ATOM 1833 CG HIS A 145 -1.287 -20.942 -3.647 1.00 52.30 C ATOM 1834 ND1 HIS A 145 -0.939 -22.176 -3.140 1.00 61.21 N ATOM 1835 CD2 HIS A 145 -2.397 -20.559 -2.973 1.00 55.02 C ATOM 1836 CE1 HIS A 145 -1.802 -22.523 -2.201 1.00 53.44 C ATOM 1837 NE2 HIS A 145 -2.696 -21.559 -2.081 1.00 73.22 N ATOM 0 H HIS A 145 1.134 -18.423 -4.711 1.00 31.00 H new ATOM 0 HA HIS A 145 1.220 -21.052 -3.744 1.00 64.12 H new ATOM 0 HB2 HIS A 145 -0.692 -19.183 -4.669 1.00 55.40 H new ATOM 0 HB3 HIS A 145 -0.888 -20.587 -5.698 1.00 55.40 H new ATOM 0 HD2 HIS A 145 -2.945 -19.639 -3.111 1.00 55.02 H new ATOM 0 HE1 HIS A 145 -1.780 -23.439 -1.629 1.00 53.44 H new ATOM 0 HE2 HIS A 145 -3.482 -21.557 -1.431 1.00 73.22 H new ATOM 1844 N GLY A 146 1.866 -20.718 -6.919 1.00 51.13 N ATOM 1845 CA GLY A 146 2.302 -21.438 -8.102 1.00 74.32 C ATOM 1846 C GLY A 146 1.981 -20.694 -9.383 1.00 41.24 C ATOM 1847 O GLY A 146 1.293 -21.220 -10.258 1.00 40.52 O ATOM 0 H GLY A 146 1.929 -19.702 -6.988 1.00 51.13 H new ATOM 0 HA2 GLY A 146 3.377 -21.609 -8.044 1.00 74.32 H new ATOM 0 HA3 GLY A 146 1.824 -22.417 -8.124 1.00 74.32 H new ATOM 1851 N LEU A 147 2.478 -19.468 -9.494 1.00 10.04 N ATOM 1852 CA LEU A 147 2.240 -18.649 -10.678 1.00 62.34 C ATOM 1853 C LEU A 147 3.394 -17.679 -10.911 1.00 64.04 C ATOM 1854 O LEU A 147 3.925 -17.090 -9.969 1.00 32.14 O ATOM 1855 CB LEU A 147 0.930 -17.875 -10.531 1.00 53.03 C ATOM 1856 CG LEU A 147 0.598 -16.895 -11.658 1.00 32.34 C ATOM 1857 CD1 LEU A 147 -0.252 -17.572 -12.720 1.00 43.21 C ATOM 1858 CD2 LEU A 147 -0.111 -15.667 -11.105 1.00 41.31 C ATOM 0 H LEU A 147 3.049 -19.018 -8.778 1.00 10.04 H new ATOM 0 HA LEU A 147 2.168 -19.312 -11.540 1.00 62.34 H new ATOM 0 HB2 LEU A 147 0.114 -18.593 -10.449 1.00 53.03 H new ATOM 0 HB3 LEU A 147 0.962 -17.321 -9.593 1.00 53.03 H new ATOM 0 HG LEU A 147 1.531 -16.573 -12.121 1.00 32.34 H new ATOM 0 HD11 LEU A 147 -0.478 -16.860 -13.513 1.00 43.21 H new ATOM 0 HD12 LEU A 147 0.293 -18.419 -13.137 1.00 43.21 H new ATOM 0 HD13 LEU A 147 -1.181 -17.924 -12.272 1.00 43.21 H new ATOM 0 HD21 LEU A 147 -0.340 -14.981 -11.920 1.00 41.31 H new ATOM 0 HD22 LEU A 147 -1.037 -15.971 -10.616 1.00 41.31 H new ATOM 0 HD23 LEU A 147 0.535 -15.169 -10.382 1.00 41.31 H new ATOM 1869 N THR A 148 3.777 -17.517 -12.174 1.00 32.12 N ATOM 1870 CA THR A 148 4.867 -16.618 -12.531 1.00 11.50 C ATOM 1871 C THR A 148 4.369 -15.464 -13.394 1.00 53.14 C ATOM 1872 O THR A 148 3.363 -15.589 -14.092 1.00 11.30 O ATOM 1873 CB THR A 148 5.985 -17.362 -13.285 1.00 3.13 C ATOM 1874 OG1 THR A 148 5.504 -17.806 -14.559 1.00 25.31 O ATOM 1875 CG2 THR A 148 6.480 -18.553 -12.480 1.00 23.33 C ATOM 0 H THR A 148 3.349 -17.996 -12.966 1.00 32.12 H new ATOM 0 HA THR A 148 5.268 -16.223 -11.598 1.00 11.50 H new ATOM 0 HB THR A 148 6.817 -16.673 -13.431 1.00 3.13 H new ATOM 0 HG1 THR A 148 6.221 -18.277 -15.033 1.00 25.31 H new ATOM 0 HG21 THR A 148 7.269 -19.063 -13.033 1.00 23.33 H new ATOM 0 HG22 THR A 148 6.872 -18.208 -11.523 1.00 23.33 H new ATOM 0 HG23 THR A 148 5.654 -19.243 -12.306 1.00 23.33 H new ATOM 1883 N GLY A 149 5.078 -14.341 -13.342 1.00 32.11 N ATOM 1884 CA GLY A 149 4.692 -13.182 -14.125 1.00 61.02 C ATOM 1885 C GLY A 149 3.419 -12.536 -13.614 1.00 43.21 C ATOM 1886 O GLY A 149 2.484 -12.298 -14.379 1.00 22.12 O ATOM 0 H GLY A 149 5.914 -14.213 -12.771 1.00 32.11 H new ATOM 0 HA2 GLY A 149 5.500 -12.450 -14.108 1.00 61.02 H new ATOM 0 HA3 GLY A 149 4.553 -13.479 -15.164 1.00 61.02 H new ATOM 1890 N PHE A 150 3.381 -12.252 -12.316 1.00 41.13 N ATOM 1891 CA PHE A 150 2.212 -11.633 -11.703 1.00 52.10 C ATOM 1892 C PHE A 150 2.556 -10.252 -11.150 1.00 43.32 C ATOM 1893 O PHE A 150 1.688 -9.389 -11.022 1.00 74.14 O ATOM 1894 CB PHE A 150 1.665 -12.521 -10.584 1.00 43.23 C ATOM 1895 CG PHE A 150 0.248 -12.201 -10.203 1.00 32.50 C ATOM 1896 CD1 PHE A 150 -0.718 -12.007 -11.176 1.00 54.30 C ATOM 1897 CD2 PHE A 150 -0.118 -12.093 -8.871 1.00 0.05 C ATOM 1898 CE1 PHE A 150 -2.023 -11.712 -10.829 1.00 41.11 C ATOM 1899 CE2 PHE A 150 -1.421 -11.799 -8.517 1.00 64.15 C ATOM 1900 CZ PHE A 150 -2.374 -11.607 -9.498 1.00 60.35 C ATOM 0 H PHE A 150 4.146 -12.441 -11.669 1.00 41.13 H new ATOM 0 HA PHE A 150 1.448 -11.518 -12.472 1.00 52.10 H new ATOM 0 HB2 PHE A 150 1.722 -13.563 -10.898 1.00 43.23 H new ATOM 0 HB3 PHE A 150 2.301 -12.417 -9.705 1.00 43.23 H new ATOM 0 HD1 PHE A 150 -0.448 -12.087 -12.219 1.00 54.30 H new ATOM 0 HD2 PHE A 150 0.624 -12.240 -8.100 1.00 0.05 H new ATOM 0 HE1 PHE A 150 -2.767 -11.564 -11.598 1.00 41.11 H new ATOM 0 HE2 PHE A 150 -1.694 -11.720 -7.475 1.00 64.15 H new ATOM 0 HZ PHE A 150 -3.393 -11.375 -9.224 1.00 60.35 H new ATOM 1909 N LEU A 151 3.828 -10.052 -10.824 1.00 70.11 N ATOM 1910 CA LEU A 151 4.288 -8.778 -10.283 1.00 1.22 C ATOM 1911 C LEU A 151 3.839 -7.618 -11.167 1.00 0.23 C ATOM 1912 O LEU A 151 3.154 -6.705 -10.710 1.00 34.15 O ATOM 1913 CB LEU A 151 5.812 -8.777 -10.155 1.00 32.04 C ATOM 1914 CG LEU A 151 6.583 -9.430 -11.302 1.00 64.33 C ATOM 1915 CD1 LEU A 151 7.473 -8.412 -11.997 1.00 72.45 C ATOM 1916 CD2 LEU A 151 7.410 -10.601 -10.790 1.00 43.25 C ATOM 0 H LEU A 151 4.559 -10.756 -10.925 1.00 70.11 H new ATOM 0 HA LEU A 151 3.847 -8.650 -9.295 1.00 1.22 H new ATOM 0 HB2 LEU A 151 6.148 -7.744 -10.060 1.00 32.04 H new ATOM 0 HB3 LEU A 151 6.079 -9.286 -9.229 1.00 32.04 H new ATOM 0 HG LEU A 151 5.863 -9.808 -12.028 1.00 64.33 H new ATOM 0 HD11 LEU A 151 8.013 -8.896 -12.810 1.00 72.45 H new ATOM 0 HD12 LEU A 151 6.859 -7.606 -12.399 1.00 72.45 H new ATOM 0 HD13 LEU A 151 8.186 -8.003 -11.281 1.00 72.45 H new ATOM 0 HD21 LEU A 151 7.952 -11.054 -11.620 1.00 43.25 H new ATOM 0 HD22 LEU A 151 8.120 -10.246 -10.043 1.00 43.25 H new ATOM 0 HD23 LEU A 151 6.751 -11.343 -10.340 1.00 43.25 H new ATOM 1927 N GLY A 152 4.230 -7.664 -12.438 1.00 73.13 N ATOM 1928 CA GLY A 152 3.857 -6.612 -13.366 1.00 5.31 C ATOM 1929 C GLY A 152 2.366 -6.336 -13.361 1.00 11.15 C ATOM 1930 O GLY A 152 1.944 -5.181 -13.410 1.00 43.12 O ATOM 0 H GLY A 152 4.797 -8.410 -12.841 1.00 73.13 H new ATOM 0 HA2 GLY A 152 4.393 -5.698 -13.109 1.00 5.31 H new ATOM 0 HA3 GLY A 152 4.168 -6.892 -14.372 1.00 5.31 H new ATOM 1934 N GLN A 153 1.570 -7.398 -13.302 1.00 34.32 N ATOM 1935 CA GLN A 153 0.118 -7.262 -13.293 1.00 5.11 C ATOM 1936 C GLN A 153 -0.348 -6.465 -12.079 1.00 0.54 C ATOM 1937 O GLN A 153 -1.107 -5.504 -12.208 1.00 4.21 O ATOM 1938 CB GLN A 153 -0.543 -8.642 -13.296 1.00 55.23 C ATOM 1939 CG GLN A 153 -0.001 -9.574 -14.368 1.00 43.03 C ATOM 1940 CD GLN A 153 -1.096 -10.345 -15.079 1.00 64.33 C ATOM 1941 OE1 GLN A 153 -2.143 -9.791 -15.417 1.00 21.13 O ATOM 1942 NE2 GLN A 153 -0.860 -11.632 -15.309 1.00 74.31 N ATOM 0 H GLN A 153 1.905 -8.361 -13.260 1.00 34.32 H new ATOM 0 HA GLN A 153 -0.177 -6.722 -14.193 1.00 5.11 H new ATOM 0 HB2 GLN A 153 -0.403 -9.105 -12.319 1.00 55.23 H new ATOM 0 HB3 GLN A 153 -1.617 -8.521 -13.440 1.00 55.23 H new ATOM 0 HG2 GLN A 153 0.562 -8.993 -15.098 1.00 43.03 H new ATOM 0 HG3 GLN A 153 0.697 -10.277 -13.914 1.00 43.03 H new ATOM 0 HE21 GLN A 153 0.022 -12.050 -15.012 1.00 74.31 H new ATOM 0 HE22 GLN A 153 -1.560 -12.202 -15.783 1.00 74.31 H new ATOM 1949 N VAL A 154 0.113 -6.870 -10.900 1.00 12.11 N ATOM 1950 CA VAL A 154 -0.256 -6.194 -9.662 1.00 15.43 C ATOM 1951 C VAL A 154 0.079 -4.707 -9.728 1.00 22.41 C ATOM 1952 O VAL A 154 -0.775 -3.855 -9.479 1.00 12.51 O ATOM 1953 CB VAL A 154 0.460 -6.815 -8.448 1.00 62.54 C ATOM 1954 CG1 VAL A 154 0.049 -6.107 -7.166 1.00 70.31 C ATOM 1955 CG2 VAL A 154 0.164 -8.305 -8.362 1.00 62.24 C ATOM 0 H VAL A 154 0.743 -7.663 -10.776 1.00 12.11 H new ATOM 0 HA VAL A 154 -1.332 -6.318 -9.542 1.00 15.43 H new ATOM 0 HB VAL A 154 1.535 -6.687 -8.576 1.00 62.54 H new ATOM 0 HG11 VAL A 154 0.565 -6.559 -6.319 1.00 70.31 H new ATOM 0 HG12 VAL A 154 0.315 -5.052 -7.232 1.00 70.31 H new ATOM 0 HG13 VAL A 154 -1.028 -6.202 -7.027 1.00 70.31 H new ATOM 0 HG21 VAL A 154 0.677 -8.729 -7.499 1.00 62.24 H new ATOM 0 HG22 VAL A 154 -0.910 -8.457 -8.256 1.00 62.24 H new ATOM 0 HG23 VAL A 154 0.512 -8.798 -9.269 1.00 62.24 H new ATOM 1965 N THR A 155 1.328 -4.402 -10.065 1.00 55.33 N ATOM 1966 CA THR A 155 1.776 -3.018 -10.164 1.00 4.00 C ATOM 1967 C THR A 155 0.935 -2.237 -11.167 1.00 63.03 C ATOM 1968 O THR A 155 0.573 -1.085 -10.925 1.00 4.25 O ATOM 1969 CB THR A 155 3.257 -2.936 -10.580 1.00 15.30 C ATOM 1970 OG1 THR A 155 3.695 -4.201 -11.087 1.00 42.23 O ATOM 1971 CG2 THR A 155 4.128 -2.528 -9.402 1.00 20.43 C ATOM 0 H THR A 155 2.047 -5.094 -10.274 1.00 55.33 H new ATOM 0 HA THR A 155 1.658 -2.577 -9.174 1.00 4.00 H new ATOM 0 HB THR A 155 3.350 -2.181 -11.360 1.00 15.30 H new ATOM 0 HG1 THR A 155 3.206 -4.411 -11.910 1.00 42.23 H new ATOM 0 HG21 THR A 155 5.169 -2.477 -9.720 1.00 20.43 H new ATOM 0 HG22 THR A 155 3.812 -1.551 -9.037 1.00 20.43 H new ATOM 0 HG23 THR A 155 4.028 -3.263 -8.604 1.00 20.43 H new ATOM 1979 N ARG A 156 0.625 -2.871 -12.292 1.00 43.44 N ATOM 1980 CA ARG A 156 -0.175 -2.236 -13.332 1.00 14.53 C ATOM 1981 C ARG A 156 -1.589 -1.952 -12.834 1.00 11.20 C ATOM 1982 O ARG A 156 -2.104 -0.845 -12.993 1.00 71.21 O ATOM 1983 CB ARG A 156 -0.229 -3.122 -14.579 1.00 72.44 C ATOM 1984 CG ARG A 156 1.046 -3.091 -15.404 1.00 34.04 C ATOM 1985 CD ARG A 156 1.098 -1.866 -16.303 1.00 60.31 C ATOM 1986 NE ARG A 156 1.843 -2.121 -17.534 1.00 73.25 N ATOM 1987 CZ ARG A 156 2.339 -1.160 -18.305 1.00 41.12 C ATOM 1988 NH1 ARG A 156 2.171 0.113 -17.974 1.00 42.52 N ATOM 1989 NH2 ARG A 156 3.005 -1.471 -19.409 1.00 31.10 N ATOM 0 H ARG A 156 0.916 -3.825 -12.507 1.00 43.44 H new ATOM 0 HA ARG A 156 0.298 -1.288 -13.590 1.00 14.53 H new ATOM 0 HB2 ARG A 156 -0.430 -4.149 -14.276 1.00 72.44 H new ATOM 0 HB3 ARG A 156 -1.064 -2.805 -15.204 1.00 72.44 H new ATOM 0 HG2 ARG A 156 1.910 -3.093 -14.740 1.00 34.04 H new ATOM 0 HG3 ARG A 156 1.109 -3.993 -16.012 1.00 34.04 H new ATOM 0 HD2 ARG A 156 0.083 -1.555 -16.551 1.00 60.31 H new ATOM 0 HD3 ARG A 156 1.561 -1.040 -15.764 1.00 60.31 H new ATOM 0 HE ARG A 156 1.990 -3.090 -17.817 1.00 73.25 H new ATOM 0 HH11 ARG A 156 1.660 0.356 -17.125 1.00 42.52 H new ATOM 0 HH12 ARG A 156 2.553 0.849 -18.568 1.00 42.52 H new ATOM 0 HH21 ARG A 156 3.137 -2.449 -19.667 1.00 31.10 H new ATOM 0 HH22 ARG A 156 3.385 -0.732 -20.000 1.00 31.10 H new ATOM 2000 N PHE A 157 -2.212 -2.960 -12.233 1.00 40.22 N ATOM 2001 CA PHE A 157 -3.567 -2.820 -11.713 1.00 63.01 C ATOM 2002 C PHE A 157 -3.652 -1.667 -10.718 1.00 53.02 C ATOM 2003 O PHE A 157 -4.562 -0.841 -10.785 1.00 34.43 O ATOM 2004 CB PHE A 157 -4.016 -4.121 -11.043 1.00 24.34 C ATOM 2005 CG PHE A 157 -4.189 -5.263 -12.003 1.00 14.34 C ATOM 2006 CD1 PHE A 157 -4.793 -5.063 -13.234 1.00 65.13 C ATOM 2007 CD2 PHE A 157 -3.746 -6.534 -11.676 1.00 14.32 C ATOM 2008 CE1 PHE A 157 -4.954 -6.112 -14.120 1.00 23.33 C ATOM 2009 CE2 PHE A 157 -3.904 -7.586 -12.558 1.00 61.14 C ATOM 2010 CZ PHE A 157 -4.508 -7.375 -13.782 1.00 54.34 C ATOM 0 H PHE A 157 -1.800 -3.883 -12.094 1.00 40.22 H new ATOM 0 HA PHE A 157 -4.230 -2.603 -12.551 1.00 63.01 H new ATOM 0 HB2 PHE A 157 -3.284 -4.401 -10.286 1.00 24.34 H new ATOM 0 HB3 PHE A 157 -4.959 -3.947 -10.525 1.00 24.34 H new ATOM 0 HD1 PHE A 157 -5.142 -4.077 -13.504 1.00 65.13 H new ATOM 0 HD2 PHE A 157 -3.272 -6.705 -10.721 1.00 14.32 H new ATOM 0 HE1 PHE A 157 -5.428 -5.944 -15.076 1.00 23.33 H new ATOM 0 HE2 PHE A 157 -3.555 -8.573 -12.290 1.00 61.14 H new ATOM 0 HZ PHE A 157 -4.631 -8.196 -14.473 1.00 54.34 H new ATOM 2019 N VAL A 158 -2.696 -1.617 -9.796 1.00 1.13 N ATOM 2020 CA VAL A 158 -2.661 -0.566 -8.787 1.00 35.25 C ATOM 2021 C VAL A 158 -2.509 0.808 -9.430 1.00 71.22 C ATOM 2022 O VAL A 158 -3.318 1.707 -9.199 1.00 43.45 O ATOM 2023 CB VAL A 158 -1.508 -0.783 -7.789 1.00 63.11 C ATOM 2024 CG1 VAL A 158 -1.567 0.247 -6.671 1.00 63.04 C ATOM 2025 CG2 VAL A 158 -1.551 -2.196 -7.226 1.00 35.15 C ATOM 0 H VAL A 158 -1.935 -2.293 -9.727 1.00 1.13 H new ATOM 0 HA VAL A 158 -3.609 -0.611 -8.251 1.00 35.25 H new ATOM 0 HB VAL A 158 -0.564 -0.655 -8.318 1.00 63.11 H new ATOM 0 HG11 VAL A 158 -0.745 0.077 -5.976 1.00 63.04 H new ATOM 0 HG12 VAL A 158 -1.484 1.248 -7.094 1.00 63.04 H new ATOM 0 HG13 VAL A 158 -2.515 0.155 -6.141 1.00 63.04 H new ATOM 0 HG21 VAL A 158 -0.730 -2.333 -6.523 1.00 35.15 H new ATOM 0 HG22 VAL A 158 -2.499 -2.354 -6.712 1.00 35.15 H new ATOM 0 HG23 VAL A 158 -1.455 -2.915 -8.040 1.00 35.15 H new ATOM 2035 N VAL A 159 -1.466 0.965 -10.239 1.00 10.32 N ATOM 2036 CA VAL A 159 -1.208 2.229 -10.918 1.00 30.04 C ATOM 2037 C VAL A 159 -2.417 2.670 -11.736 1.00 35.01 C ATOM 2038 O VAL A 159 -2.794 3.842 -11.720 1.00 50.54 O ATOM 2039 CB VAL A 159 0.017 2.128 -11.847 1.00 23.40 C ATOM 2040 CG1 VAL A 159 0.232 3.436 -12.591 1.00 11.42 C ATOM 2041 CG2 VAL A 159 1.258 1.746 -11.052 1.00 75.04 C ATOM 0 H VAL A 159 -0.786 0.232 -10.440 1.00 10.32 H new ATOM 0 HA VAL A 159 -1.007 2.969 -10.143 1.00 30.04 H new ATOM 0 HB VAL A 159 -0.170 1.346 -12.583 1.00 23.40 H new ATOM 0 HG11 VAL A 159 1.101 3.346 -13.242 1.00 11.42 H new ATOM 0 HG12 VAL A 159 -0.649 3.662 -13.192 1.00 11.42 H new ATOM 0 HG13 VAL A 159 0.398 4.240 -11.874 1.00 11.42 H new ATOM 0 HG21 VAL A 159 2.114 1.679 -11.724 1.00 75.04 H new ATOM 0 HG22 VAL A 159 1.451 2.504 -10.293 1.00 75.04 H new ATOM 0 HG23 VAL A 159 1.099 0.781 -10.570 1.00 75.04 H new ATOM 2051 N ASP A 160 -3.019 1.724 -12.448 1.00 34.15 N ATOM 2052 CA ASP A 160 -4.187 2.015 -13.271 1.00 14.10 C ATOM 2053 C ASP A 160 -5.349 2.504 -12.413 1.00 54.14 C ATOM 2054 O ASP A 160 -5.919 3.565 -12.667 1.00 34.13 O ATOM 2055 CB ASP A 160 -4.605 0.772 -14.058 1.00 65.40 C ATOM 2056 CG ASP A 160 -4.104 0.795 -15.488 1.00 52.30 C ATOM 2057 OD1 ASP A 160 -4.191 1.863 -16.130 1.00 15.33 O ATOM 2058 OD2 ASP A 160 -3.624 -0.254 -15.966 1.00 12.12 O ATOM 0 H ASP A 160 -2.718 0.750 -12.472 1.00 34.15 H new ATOM 0 HA ASP A 160 -3.919 2.806 -13.971 1.00 14.10 H new ATOM 0 HB2 ASP A 160 -4.223 -0.117 -13.557 1.00 65.40 H new ATOM 0 HB3 ASP A 160 -5.692 0.695 -14.059 1.00 65.40 H new ATOM 2062 N PHE A 161 -5.698 1.721 -11.396 1.00 12.35 N ATOM 2063 CA PHE A 161 -6.794 2.074 -10.501 1.00 2.04 C ATOM 2064 C PHE A 161 -6.538 3.421 -9.831 1.00 3.24 C ATOM 2065 O PHE A 161 -7.409 4.288 -9.806 1.00 33.12 O ATOM 2066 CB PHE A 161 -6.980 0.990 -9.438 1.00 44.42 C ATOM 2067 CG PHE A 161 -8.064 1.302 -8.446 1.00 2.03 C ATOM 2068 CD1 PHE A 161 -7.805 2.105 -7.347 1.00 60.11 C ATOM 2069 CD2 PHE A 161 -9.342 0.793 -8.614 1.00 21.32 C ATOM 2070 CE1 PHE A 161 -8.800 2.395 -6.433 1.00 41.23 C ATOM 2071 CE2 PHE A 161 -10.341 1.080 -7.704 1.00 20.32 C ATOM 2072 CZ PHE A 161 -10.070 1.881 -6.611 1.00 64.03 C ATOM 0 H PHE A 161 -5.238 0.839 -11.172 1.00 12.35 H new ATOM 0 HA PHE A 161 -7.705 2.152 -11.095 1.00 2.04 H new ATOM 0 HB2 PHE A 161 -7.210 0.045 -9.931 1.00 44.42 H new ATOM 0 HB3 PHE A 161 -6.040 0.850 -8.905 1.00 44.42 H new ATOM 0 HD1 PHE A 161 -6.814 2.509 -7.203 1.00 60.11 H new ATOM 0 HD2 PHE A 161 -9.559 0.165 -9.466 1.00 21.32 H new ATOM 0 HE1 PHE A 161 -8.585 3.023 -5.581 1.00 41.23 H new ATOM 0 HE2 PHE A 161 -11.333 0.679 -7.847 1.00 20.32 H new ATOM 0 HZ PHE A 161 -10.849 2.105 -5.897 1.00 64.03 H new ATOM 2081 N MET A 162 -5.335 3.586 -9.289 1.00 64.23 N ATOM 2082 CA MET A 162 -4.963 4.826 -8.618 1.00 41.43 C ATOM 2083 C MET A 162 -5.218 6.029 -9.521 1.00 5.32 C ATOM 2084 O MET A 162 -5.842 7.007 -9.107 1.00 13.43 O ATOM 2085 CB MET A 162 -3.490 4.786 -8.206 1.00 75.33 C ATOM 2086 CG MET A 162 -3.271 4.987 -6.715 1.00 13.45 C ATOM 2087 SD MET A 162 -2.167 3.753 -6.002 1.00 4.43 S ATOM 2088 CE MET A 162 -0.932 4.802 -5.239 1.00 52.25 C ATOM 0 H MET A 162 -4.602 2.877 -9.302 1.00 64.23 H new ATOM 0 HA MET A 162 -5.580 4.926 -7.725 1.00 41.43 H new ATOM 0 HB2 MET A 162 -3.064 3.827 -8.502 1.00 75.33 H new ATOM 0 HB3 MET A 162 -2.947 5.558 -8.752 1.00 75.33 H new ATOM 0 HG2 MET A 162 -2.858 5.981 -6.543 1.00 13.45 H new ATOM 0 HG3 MET A 162 -4.232 4.948 -6.202 1.00 13.45 H new ATOM 0 HE1 MET A 162 -0.217 4.185 -4.695 1.00 52.25 H new ATOM 0 HE2 MET A 162 -0.410 5.369 -6.010 1.00 52.25 H new ATOM 0 HE3 MET A 162 -1.417 5.491 -4.547 1.00 52.25 H new ATOM 2096 N LEU A 163 -4.732 5.950 -10.755 1.00 52.11 N ATOM 2097 CA LEU A 163 -4.907 7.033 -11.716 1.00 54.30 C ATOM 2098 C LEU A 163 -6.331 7.049 -12.266 1.00 22.33 C ATOM 2099 O LEU A 163 -6.694 7.925 -13.051 1.00 52.32 O ATOM 2100 CB LEU A 163 -3.907 6.890 -12.864 1.00 51.42 C ATOM 2101 CG LEU A 163 -2.897 8.028 -13.022 1.00 72.44 C ATOM 2102 CD1 LEU A 163 -1.568 7.654 -12.385 1.00 14.25 C ATOM 2103 CD2 LEU A 163 -2.708 8.375 -14.491 1.00 44.13 C ATOM 0 H LEU A 163 -4.214 5.148 -11.113 1.00 52.11 H new ATOM 0 HA LEU A 163 -4.726 7.976 -11.200 1.00 54.30 H new ATOM 0 HB2 LEU A 163 -3.357 5.959 -12.726 1.00 51.42 H new ATOM 0 HB3 LEU A 163 -4.465 6.795 -13.795 1.00 51.42 H new ATOM 0 HG LEU A 163 -3.287 8.908 -12.510 1.00 72.44 H new ATOM 0 HD11 LEU A 163 -0.862 8.475 -12.507 1.00 14.25 H new ATOM 0 HD12 LEU A 163 -1.716 7.458 -11.323 1.00 14.25 H new ATOM 0 HD13 LEU A 163 -1.172 6.760 -12.867 1.00 14.25 H new ATOM 0 HD21 LEU A 163 -1.986 9.186 -14.583 1.00 44.13 H new ATOM 0 HD22 LEU A 163 -2.341 7.500 -15.027 1.00 44.13 H new ATOM 0 HD23 LEU A 163 -3.662 8.688 -14.917 1.00 44.13 H new ATOM 2114 N HIS A 164 -7.132 6.075 -11.847 1.00 62.31 N ATOM 2115 CA HIS A 164 -8.517 5.978 -12.294 1.00 12.12 C ATOM 2116 C HIS A 164 -9.476 6.051 -11.111 1.00 61.14 C ATOM 2117 O HIS A 164 -10.548 5.442 -11.129 1.00 35.13 O ATOM 2118 CB HIS A 164 -8.736 4.676 -13.065 1.00 23.24 C ATOM 2119 CG HIS A 164 -8.286 4.742 -14.493 1.00 72.13 C ATOM 2120 ND1 HIS A 164 -7.369 3.867 -15.034 1.00 23.14 N ATOM 2121 CD2 HIS A 164 -8.637 5.585 -15.492 1.00 1.44 C ATOM 2122 CE1 HIS A 164 -7.172 4.170 -16.305 1.00 33.13 C ATOM 2123 NE2 HIS A 164 -7.929 5.208 -16.608 1.00 74.02 N ATOM 0 H HIS A 164 -6.846 5.342 -11.198 1.00 62.31 H new ATOM 0 HA HIS A 164 -8.720 6.821 -12.955 1.00 12.12 H new ATOM 0 HB2 HIS A 164 -8.201 3.871 -12.561 1.00 23.24 H new ATOM 0 HB3 HIS A 164 -9.795 4.421 -13.038 1.00 23.24 H new ATOM 0 HD1 HIS A 164 -6.914 3.105 -14.532 1.00 23.14 H new ATOM 0 HD2 HIS A 164 -9.341 6.401 -15.425 1.00 1.44 H new ATOM 0 HE1 HIS A 164 -6.505 3.656 -16.981 1.00 33.13 H new ATOM 2130 N HIS A 165 -9.086 6.797 -10.083 1.00 72.11 N ATOM 2131 CA HIS A 165 -9.912 6.948 -8.890 1.00 50.42 C ATOM 2132 C HIS A 165 -9.583 8.247 -8.162 1.00 31.15 C ATOM 2133 O HIS A 165 -9.847 8.384 -6.967 1.00 14.12 O ATOM 2134 CB HIS A 165 -9.713 5.758 -7.951 1.00 12.14 C ATOM 2135 CG HIS A 165 -10.959 4.960 -7.722 1.00 15.30 C ATOM 2136 ND1 HIS A 165 -11.666 4.360 -8.742 1.00 62.45 N ATOM 2137 CD2 HIS A 165 -11.622 4.663 -6.579 1.00 5.43 C ATOM 2138 CE1 HIS A 165 -12.712 3.730 -8.237 1.00 51.02 C ATOM 2139 NE2 HIS A 165 -12.708 3.898 -6.928 1.00 64.33 N ATOM 0 H HIS A 165 -8.203 7.307 -10.052 1.00 72.11 H new ATOM 0 HA HIS A 165 -10.955 6.982 -9.203 1.00 50.42 H new ATOM 0 HB2 HIS A 165 -8.944 5.105 -8.364 1.00 12.14 H new ATOM 0 HB3 HIS A 165 -9.342 6.120 -6.992 1.00 12.14 H new ATOM 0 HD1 HIS A 165 -11.420 4.397 -9.731 1.00 62.45 H new ATOM 0 HD2 HIS A 165 -11.348 4.970 -5.580 1.00 5.43 H new ATOM 0 HE1 HIS A 165 -13.446 3.172 -8.800 1.00 51.02 H new ATOM 2146 N CYS A 166 -9.004 9.197 -8.889 1.00 25.25 N ATOM 2147 CA CYS A 166 -8.636 10.485 -8.311 1.00 11.14 C ATOM 2148 C CYS A 166 -7.590 10.310 -7.214 1.00 51.44 C ATOM 2149 O CYS A 166 -7.374 11.209 -6.401 1.00 52.12 O ATOM 2150 CB CYS A 166 -9.873 11.186 -7.747 1.00 31.20 C ATOM 2151 SG CYS A 166 -9.720 12.984 -7.645 1.00 52.12 S ATOM 0 H CYS A 166 -8.779 9.100 -9.879 1.00 25.25 H new ATOM 0 HA CYS A 166 -8.207 11.101 -9.101 1.00 11.14 H new ATOM 0 HB2 CYS A 166 -10.733 10.940 -8.370 1.00 31.20 H new ATOM 0 HB3 CYS A 166 -10.078 10.792 -6.751 1.00 31.20 H new ATOM 0 HG CYS A 166 -10.816 13.486 -7.158 1.00 52.12 H new ATOM 2156 N ILE A 167 -6.946 9.148 -7.198 1.00 43.14 N ATOM 2157 CA ILE A 167 -5.924 8.856 -6.201 1.00 72.24 C ATOM 2158 C ILE A 167 -4.621 9.578 -6.522 1.00 15.33 C ATOM 2159 O ILE A 167 -4.035 10.235 -5.661 1.00 53.01 O ATOM 2160 CB ILE A 167 -5.649 7.344 -6.103 1.00 72.21 C ATOM 2161 CG1 ILE A 167 -6.965 6.562 -6.116 1.00 10.32 C ATOM 2162 CG2 ILE A 167 -4.854 7.031 -4.844 1.00 71.20 C ATOM 2163 CD1 ILE A 167 -7.915 6.960 -5.008 1.00 45.31 C ATOM 0 H ILE A 167 -7.114 8.394 -7.864 1.00 43.14 H new ATOM 0 HA ILE A 167 -6.307 9.210 -5.244 1.00 72.24 H new ATOM 0 HB ILE A 167 -5.059 7.040 -6.968 1.00 72.21 H new ATOM 0 HG12 ILE A 167 -7.457 6.711 -7.077 1.00 10.32 H new ATOM 0 HG13 ILE A 167 -6.747 5.497 -6.032 1.00 10.32 H new ATOM 0 HG21 ILE A 167 -4.667 5.959 -4.789 1.00 71.20 H new ATOM 0 HG22 ILE A 167 -3.903 7.564 -4.872 1.00 71.20 H new ATOM 0 HG23 ILE A 167 -5.421 7.346 -3.968 1.00 71.20 H new ATOM 0 HD11 ILE A 167 -8.826 6.366 -5.079 1.00 45.31 H new ATOM 0 HD12 ILE A 167 -7.441 6.785 -4.042 1.00 45.31 H new ATOM 0 HD13 ILE A 167 -8.163 8.017 -5.104 1.00 45.31 H new ATOM 2174 N ALA A 168 -4.173 9.455 -7.767 1.00 23.31 N ATOM 2175 CA ALA A 168 -2.941 10.099 -8.203 1.00 12.43 C ATOM 2176 C ALA A 168 -2.931 11.577 -7.828 1.00 22.41 C ATOM 2177 O ALA A 168 -1.970 12.070 -7.238 1.00 32.11 O ATOM 2178 CB ALA A 168 -2.762 9.933 -9.705 1.00 3.34 C ATOM 0 H ALA A 168 -4.646 8.915 -8.492 1.00 23.31 H new ATOM 0 HA ALA A 168 -2.108 9.616 -7.693 1.00 12.43 H new ATOM 0 HB1 ALA A 168 -1.838 10.419 -10.017 1.00 3.34 H new ATOM 0 HB2 ALA A 168 -2.715 8.872 -9.951 1.00 3.34 H new ATOM 0 HB3 ALA A 168 -3.605 10.389 -10.224 1.00 3.34 H new ATOM 2184 N ARG A 169 -4.006 12.277 -8.173 1.00 1.33 N ATOM 2185 CA ARG A 169 -4.119 13.699 -7.873 1.00 54.25 C ATOM 2186 C ARG A 169 -3.928 13.958 -6.381 1.00 42.32 C ATOM 2187 O ARG A 169 -3.242 14.901 -5.989 1.00 31.43 O ATOM 2188 CB ARG A 169 -5.482 14.230 -8.323 1.00 3.32 C ATOM 2189 CG ARG A 169 -5.751 14.040 -9.807 1.00 2.44 C ATOM 2190 CD ARG A 169 -5.339 15.264 -10.609 1.00 11.14 C ATOM 2191 NE ARG A 169 -6.107 15.394 -11.844 1.00 63.33 N ATOM 2192 CZ ARG A 169 -5.893 16.343 -12.747 1.00 35.12 C ATOM 2193 NH1 ARG A 169 -4.937 17.242 -12.555 1.00 32.15 N ATOM 2194 NH2 ARG A 169 -6.635 16.396 -13.846 1.00 0.43 N ATOM 0 H ARG A 169 -4.811 11.883 -8.660 1.00 1.33 H new ATOM 0 HA ARG A 169 -3.334 14.223 -8.418 1.00 54.25 H new ATOM 0 HB2 ARG A 169 -6.264 13.728 -7.754 1.00 3.32 H new ATOM 0 HB3 ARG A 169 -5.546 15.292 -8.084 1.00 3.32 H new ATOM 0 HG2 ARG A 169 -5.207 13.167 -10.168 1.00 2.44 H new ATOM 0 HG3 ARG A 169 -6.811 13.841 -9.963 1.00 2.44 H new ATOM 0 HD2 ARG A 169 -5.476 16.158 -10.001 1.00 11.14 H new ATOM 0 HD3 ARG A 169 -4.277 15.200 -10.848 1.00 11.14 H new ATOM 0 HE ARG A 169 -6.849 14.718 -12.023 1.00 63.33 H new ATOM 0 HH11 ARG A 169 -4.364 17.205 -11.712 1.00 32.15 H new ATOM 0 HH12 ARG A 169 -4.775 17.970 -13.250 1.00 32.15 H new ATOM 0 HH21 ARG A 169 -7.371 15.707 -13.998 1.00 0.43 H new ATOM 0 HH22 ARG A 169 -6.469 17.126 -14.539 1.00 0.43 H new ATOM 2205 N TRP A 170 -4.540 13.115 -5.558 1.00 72.22 N ATOM 2206 CA TRP A 170 -4.437 13.253 -4.110 1.00 21.20 C ATOM 2207 C TRP A 170 -2.981 13.207 -3.661 1.00 32.32 C ATOM 2208 O TRP A 170 -2.502 14.119 -2.984 1.00 43.22 O ATOM 2209 CB TRP A 170 -5.234 12.147 -3.414 1.00 11.04 C ATOM 2210 CG TRP A 170 -5.184 12.230 -1.918 1.00 35.12 C ATOM 2211 CD1 TRP A 170 -6.059 12.892 -1.106 1.00 35.53 C ATOM 2212 CD2 TRP A 170 -4.208 11.633 -1.059 1.00 13.05 C ATOM 2213 NE1 TRP A 170 -5.685 12.743 0.209 1.00 50.43 N ATOM 2214 CE2 TRP A 170 -4.553 11.973 0.264 1.00 61.21 C ATOM 2215 CE3 TRP A 170 -3.076 10.842 -1.277 1.00 71.00 C ATOM 2216 CZ2 TRP A 170 -3.806 11.550 1.360 1.00 74.20 C ATOM 2217 CZ3 TRP A 170 -2.336 10.423 -0.187 1.00 44.43 C ATOM 2218 CH2 TRP A 170 -2.704 10.776 1.118 1.00 15.30 C ATOM 0 H TRP A 170 -5.112 12.329 -5.868 1.00 72.22 H new ATOM 0 HA TRP A 170 -4.853 14.221 -3.831 1.00 21.20 H new ATOM 0 HB2 TRP A 170 -6.273 12.198 -3.739 1.00 11.04 H new ATOM 0 HB3 TRP A 170 -4.849 11.178 -3.730 1.00 11.04 H new ATOM 0 HD1 TRP A 170 -6.918 13.451 -1.446 1.00 35.53 H new ATOM 0 HE1 TRP A 170 -6.171 13.141 1.013 1.00 50.43 H new ATOM 0 HE3 TRP A 170 -2.785 10.563 -2.279 1.00 71.00 H new ATOM 0 HZ2 TRP A 170 -4.087 11.823 2.366 1.00 74.20 H new ATOM 0 HZ3 TRP A 170 -1.459 9.813 -0.344 1.00 44.43 H new ATOM 0 HH2 TRP A 170 -2.106 10.431 1.949 1.00 15.30 H new ATOM 2228 N ILE A 171 -2.282 12.142 -4.039 1.00 33.21 N ATOM 2229 CA ILE A 171 -0.880 11.981 -3.676 1.00 60.41 C ATOM 2230 C ILE A 171 -0.056 13.188 -4.110 1.00 54.13 C ATOM 2231 O ILE A 171 0.811 13.657 -3.374 1.00 73.02 O ATOM 2232 CB ILE A 171 -0.278 10.710 -4.305 1.00 73.32 C ATOM 2233 CG1 ILE A 171 -0.870 9.461 -3.650 1.00 62.35 C ATOM 2234 CG2 ILE A 171 1.236 10.718 -4.169 1.00 14.23 C ATOM 2235 CD1 ILE A 171 -0.255 8.170 -4.143 1.00 1.32 C ATOM 0 H ILE A 171 -2.664 11.378 -4.596 1.00 33.21 H new ATOM 0 HA ILE A 171 -0.844 11.892 -2.590 1.00 60.41 H new ATOM 0 HB ILE A 171 -0.528 10.694 -5.366 1.00 73.32 H new ATOM 0 HG12 ILE A 171 -0.736 9.529 -2.570 1.00 62.35 H new ATOM 0 HG13 ILE A 171 -1.944 9.437 -3.837 1.00 62.35 H new ATOM 0 HG21 ILE A 171 1.646 9.814 -4.618 1.00 14.23 H new ATOM 0 HG22 ILE A 171 1.642 11.592 -4.678 1.00 14.23 H new ATOM 0 HG23 ILE A 171 1.506 10.754 -3.114 1.00 14.23 H new ATOM 0 HD11 ILE A 171 -0.723 7.327 -3.635 1.00 1.32 H new ATOM 0 HD12 ILE A 171 -0.412 8.079 -5.218 1.00 1.32 H new ATOM 0 HD13 ILE A 171 0.814 8.172 -3.932 1.00 1.32 H new ATOM 2246 N ALA A 172 -0.336 13.687 -5.309 1.00 73.03 N ATOM 2247 CA ALA A 172 0.376 14.844 -5.840 1.00 60.12 C ATOM 2248 C ALA A 172 0.116 16.084 -4.994 1.00 74.11 C ATOM 2249 O ALA A 172 1.006 16.912 -4.799 1.00 2.54 O ATOM 2250 CB ALA A 172 -0.028 15.094 -7.286 1.00 21.44 C ATOM 0 H ALA A 172 -1.050 13.309 -5.931 1.00 73.03 H new ATOM 0 HA ALA A 172 1.444 14.630 -5.805 1.00 60.12 H new ATOM 0 HB1 ALA A 172 0.511 15.960 -7.670 1.00 21.44 H new ATOM 0 HB2 ALA A 172 0.216 14.219 -7.888 1.00 21.44 H new ATOM 0 HB3 ALA A 172 -1.100 15.282 -7.337 1.00 21.44 H new ATOM 2256 N GLN A 173 -1.109 16.208 -4.493 1.00 70.02 N ATOM 2257 CA GLN A 173 -1.485 17.350 -3.668 1.00 1.34 C ATOM 2258 C GLN A 173 -0.791 17.294 -2.311 1.00 63.30 C ATOM 2259 O GLN A 173 -0.432 18.326 -1.743 1.00 30.24 O ATOM 2260 CB GLN A 173 -3.002 17.390 -3.476 1.00 41.30 C ATOM 2261 CG GLN A 173 -3.778 17.484 -4.781 1.00 23.13 C ATOM 2262 CD GLN A 173 -4.377 18.858 -5.006 1.00 34.21 C ATOM 2263 OE1 GLN A 173 -3.874 19.860 -4.495 1.00 23.55 O ATOM 2264 NE2 GLN A 173 -5.459 18.914 -5.774 1.00 34.42 N ATOM 0 H GLN A 173 -1.858 15.532 -4.644 1.00 70.02 H new ATOM 0 HA GLN A 173 -1.166 18.257 -4.182 1.00 1.34 H new ATOM 0 HB2 GLN A 173 -3.316 16.494 -2.940 1.00 41.30 H new ATOM 0 HB3 GLN A 173 -3.258 18.243 -2.848 1.00 41.30 H new ATOM 0 HG2 GLN A 173 -3.116 17.240 -5.612 1.00 23.13 H new ATOM 0 HG3 GLN A 173 -4.575 16.740 -4.780 1.00 23.13 H new ATOM 0 HE21 GLN A 173 -5.843 18.059 -6.177 1.00 34.42 H new ATOM 0 HE22 GLN A 173 -5.906 19.812 -5.960 1.00 34.42 H new ATOM 2271 N ARG A 174 -0.606 16.083 -1.797 1.00 20.53 N ATOM 2272 CA ARG A 174 0.045 15.892 -0.505 1.00 41.40 C ATOM 2273 C ARG A 174 1.554 16.086 -0.623 1.00 62.22 C ATOM 2274 O ARG A 174 2.271 16.069 0.377 1.00 13.23 O ATOM 2275 CB ARG A 174 -0.260 14.496 0.042 1.00 33.30 C ATOM 2276 CG ARG A 174 -1.746 14.188 0.129 1.00 51.41 C ATOM 2277 CD ARG A 174 -2.306 14.525 1.502 1.00 20.22 C ATOM 2278 NE ARG A 174 -2.424 15.966 1.707 1.00 10.34 N ATOM 2279 CZ ARG A 174 -2.500 16.535 2.904 1.00 24.51 C ATOM 2280 NH1 ARG A 174 -2.470 15.788 4.000 1.00 0.11 N ATOM 2281 NH2 ARG A 174 -2.604 17.853 3.010 1.00 42.53 N ATOM 0 H ARG A 174 -0.897 15.219 -2.254 1.00 20.53 H new ATOM 0 HA ARG A 174 -0.347 16.639 0.186 1.00 41.40 H new ATOM 0 HB2 ARG A 174 0.220 13.753 -0.594 1.00 33.30 H new ATOM 0 HB3 ARG A 174 0.181 14.399 1.034 1.00 33.30 H new ATOM 0 HG2 ARG A 174 -2.281 14.755 -0.633 1.00 51.41 H new ATOM 0 HG3 ARG A 174 -1.913 13.132 -0.084 1.00 51.41 H new ATOM 0 HD2 ARG A 174 -3.286 14.061 1.618 1.00 20.22 H new ATOM 0 HD3 ARG A 174 -1.660 14.101 2.271 1.00 20.22 H new ATOM 0 HE ARG A 174 -2.449 16.569 0.885 1.00 10.34 H new ATOM 0 HH11 ARG A 174 -2.388 14.774 3.924 1.00 0.11 H new ATOM 0 HH12 ARG A 174 -2.529 16.228 4.919 1.00 0.11 H new ATOM 0 HH21 ARG A 174 -2.626 18.432 2.171 1.00 42.53 H new ATOM 0 HH22 ARG A 174 -2.662 18.288 3.931 1.00 42.53 H new ATOM 2292 N GLY A 175 2.028 16.269 -1.851 1.00 24.50 N ATOM 2293 CA GLY A 175 3.449 16.461 -2.077 1.00 74.41 C ATOM 2294 C GLY A 175 4.110 15.240 -2.684 1.00 10.44 C ATOM 2295 O GLY A 175 5.258 14.926 -2.369 1.00 64.31 O ATOM 0 H GLY A 175 1.454 16.288 -2.694 1.00 24.50 H new ATOM 0 HA2 GLY A 175 3.596 17.316 -2.737 1.00 74.41 H new ATOM 0 HA3 GLY A 175 3.935 16.701 -1.131 1.00 74.41 H new ATOM 2299 N GLY A 176 3.386 14.549 -3.558 1.00 42.14 N ATOM 2300 CA GLY A 176 3.925 13.363 -4.196 1.00 60.12 C ATOM 2301 C GLY A 176 4.451 12.354 -3.193 1.00 0.42 C ATOM 2302 O GLY A 176 4.324 12.546 -1.984 1.00 53.31 O ATOM 0 H GLY A 176 2.435 14.790 -3.836 1.00 42.14 H new ATOM 0 HA2 GLY A 176 3.149 12.897 -4.804 1.00 60.12 H new ATOM 0 HA3 GLY A 176 4.729 13.652 -4.873 1.00 60.12 H new ATOM 2306 N TRP A 177 5.044 11.277 -3.697 1.00 74.34 N ATOM 2307 CA TRP A 177 5.590 10.233 -2.837 1.00 34.33 C ATOM 2308 C TRP A 177 6.752 10.767 -2.004 1.00 42.40 C ATOM 2309 O TRP A 177 7.121 10.179 -0.988 1.00 22.12 O ATOM 2310 CB TRP A 177 6.053 9.042 -3.677 1.00 33.30 C ATOM 2311 CG TRP A 177 4.921 8.256 -4.266 1.00 30.40 C ATOM 2312 CD1 TRP A 177 4.394 8.392 -5.518 1.00 12.20 C ATOM 2313 CD2 TRP A 177 4.177 7.214 -3.626 1.00 2.14 C ATOM 2314 NE1 TRP A 177 3.366 7.498 -5.695 1.00 3.41 N ATOM 2315 CE2 TRP A 177 3.214 6.762 -4.550 1.00 70.02 C ATOM 2316 CE3 TRP A 177 4.232 6.616 -2.364 1.00 24.01 C ATOM 2317 CZ2 TRP A 177 2.315 5.743 -4.249 1.00 62.31 C ATOM 2318 CZ3 TRP A 177 3.338 5.604 -2.066 1.00 52.41 C ATOM 2319 CH2 TRP A 177 2.391 5.176 -3.006 1.00 70.12 C ATOM 0 H TRP A 177 5.159 11.104 -4.696 1.00 74.34 H new ATOM 0 HA TRP A 177 4.802 9.905 -2.159 1.00 34.33 H new ATOM 0 HB2 TRP A 177 6.694 9.401 -4.482 1.00 33.30 H new ATOM 0 HB3 TRP A 177 6.660 8.383 -3.056 1.00 33.30 H new ATOM 0 HD1 TRP A 177 4.735 9.099 -6.260 1.00 12.20 H new ATOM 0 HE1 TRP A 177 2.807 7.398 -6.542 1.00 3.41 H new ATOM 0 HE3 TRP A 177 4.960 6.939 -1.634 1.00 24.01 H new ATOM 0 HZ2 TRP A 177 1.583 5.412 -4.971 1.00 62.31 H new ATOM 0 HZ3 TRP A 177 3.370 5.136 -1.093 1.00 52.41 H new ATOM 0 HH2 TRP A 177 1.707 4.382 -2.744 1.00 70.12 H new ATOM 2329 N VAL A 178 7.324 11.884 -2.443 1.00 20.24 N ATOM 2330 CA VAL A 178 8.443 12.497 -1.737 1.00 24.32 C ATOM 2331 C VAL A 178 8.008 13.035 -0.379 1.00 24.02 C ATOM 2332 O VAL A 178 8.841 13.373 0.462 1.00 64.33 O ATOM 2333 CB VAL A 178 9.063 13.643 -2.557 1.00 35.15 C ATOM 2334 CG1 VAL A 178 10.339 14.144 -1.896 1.00 45.44 C ATOM 2335 CG2 VAL A 178 9.335 13.192 -3.984 1.00 62.35 C ATOM 0 H VAL A 178 7.031 12.382 -3.283 1.00 20.24 H new ATOM 0 HA VAL A 178 9.191 11.718 -1.592 1.00 24.32 H new ATOM 0 HB VAL A 178 8.351 14.468 -2.590 1.00 35.15 H new ATOM 0 HG11 VAL A 178 10.763 14.954 -2.490 1.00 45.44 H new ATOM 0 HG12 VAL A 178 10.111 14.509 -0.895 1.00 45.44 H new ATOM 0 HG13 VAL A 178 11.059 13.328 -1.829 1.00 45.44 H new ATOM 0 HG21 VAL A 178 9.773 14.015 -4.548 1.00 62.35 H new ATOM 0 HG22 VAL A 178 10.027 12.350 -3.974 1.00 62.35 H new ATOM 0 HG23 VAL A 178 8.400 12.887 -4.454 1.00 62.35 H new ATOM 2345 N ALA A 179 6.698 13.112 -0.171 1.00 15.41 N ATOM 2346 CA ALA A 179 6.151 13.607 1.086 1.00 71.22 C ATOM 2347 C ALA A 179 5.940 12.469 2.079 1.00 54.34 C ATOM 2348 O ALA A 179 5.588 12.699 3.236 1.00 44.25 O ATOM 2349 CB ALA A 179 4.843 14.345 0.840 1.00 4.42 C ATOM 0 H ALA A 179 5.995 12.838 -0.857 1.00 15.41 H new ATOM 0 HA ALA A 179 6.871 14.302 1.517 1.00 71.22 H new ATOM 0 HB1 ALA A 179 4.447 14.709 1.788 1.00 4.42 H new ATOM 0 HB2 ALA A 179 5.021 15.189 0.173 1.00 4.42 H new ATOM 0 HB3 ALA A 179 4.123 13.667 0.382 1.00 4.42 H new ATOM 2355 N ALA A 180 6.157 11.241 1.619 1.00 41.24 N ATOM 2356 CA ALA A 180 5.991 10.067 2.467 1.00 71.23 C ATOM 2357 C ALA A 180 7.235 9.822 3.314 1.00 61.14 C ATOM 2358 O ALA A 180 7.138 9.485 4.495 1.00 50.32 O ATOM 2359 CB ALA A 180 5.677 8.843 1.620 1.00 13.51 C ATOM 0 H ALA A 180 6.448 11.034 0.664 1.00 41.24 H new ATOM 0 HA ALA A 180 5.155 10.252 3.141 1.00 71.23 H new ATOM 0 HB1 ALA A 180 5.556 7.974 2.267 1.00 13.51 H new ATOM 0 HB2 ALA A 180 4.755 9.012 1.063 1.00 13.51 H new ATOM 0 HB3 ALA A 180 6.495 8.664 0.922 1.00 13.51 H new ATOM 2365 N LEU A 181 8.402 9.992 2.704 1.00 1.32 N ATOM 2366 CA LEU A 181 9.668 9.788 3.403 1.00 52.35 C ATOM 2367 C LEU A 181 9.761 10.686 4.632 1.00 61.20 C ATOM 2368 O LEU A 181 10.533 10.417 5.551 1.00 1.45 O ATOM 2369 CB LEU A 181 10.842 10.066 2.463 1.00 40.22 C ATOM 2370 CG LEU A 181 10.749 11.347 1.632 1.00 50.14 C ATOM 2371 CD1 LEU A 181 10.939 12.571 2.515 1.00 44.23 C ATOM 2372 CD2 LEU A 181 11.776 11.331 0.510 1.00 62.12 C ATOM 0 H LEU A 181 8.499 10.270 1.728 1.00 1.32 H new ATOM 0 HA LEU A 181 9.712 8.749 3.731 1.00 52.35 H new ATOM 0 HB2 LEU A 181 11.755 10.108 3.057 1.00 40.22 H new ATOM 0 HB3 LEU A 181 10.944 9.221 1.782 1.00 40.22 H new ATOM 0 HG LEU A 181 9.755 11.397 1.186 1.00 50.14 H new ATOM 0 HD11 LEU A 181 10.870 13.473 1.907 1.00 44.23 H new ATOM 0 HD12 LEU A 181 10.165 12.590 3.282 1.00 44.23 H new ATOM 0 HD13 LEU A 181 11.919 12.528 2.990 1.00 44.23 H new ATOM 0 HD21 LEU A 181 11.695 12.250 -0.070 1.00 62.12 H new ATOM 0 HD22 LEU A 181 12.777 11.257 0.934 1.00 62.12 H new ATOM 0 HD23 LEU A 181 11.593 10.475 -0.139 1.00 62.12 H new ATOM 2383 N ASN A 182 8.968 11.752 4.642 1.00 1.02 N ATOM 2384 CA ASN A 182 8.960 12.688 5.759 1.00 34.20 C ATOM 2385 C ASN A 182 7.854 12.343 6.752 1.00 44.54 C ATOM 2386 O ASN A 182 7.285 13.225 7.396 1.00 52.22 O ATOM 2387 CB ASN A 182 8.776 14.120 5.251 1.00 35.11 C ATOM 2388 CG ASN A 182 9.810 15.073 5.820 1.00 10.04 C ATOM 2389 OD1 ASN A 182 11.004 14.946 5.547 1.00 53.43 O ATOM 2390 ND2 ASN A 182 9.355 16.034 6.615 1.00 64.34 N ATOM 0 H ASN A 182 8.322 11.989 3.889 1.00 1.02 H new ATOM 0 HA ASN A 182 9.919 12.611 6.271 1.00 34.20 H new ATOM 0 HB2 ASN A 182 8.839 14.127 4.163 1.00 35.11 H new ATOM 0 HB3 ASN A 182 7.778 14.471 5.515 1.00 35.11 H new ATOM 0 HD21 ASN A 182 10.004 16.705 7.027 1.00 64.34 H new ATOM 0 HD22 ASN A 182 8.357 16.101 6.814 1.00 64.34 H new ATOM 2396 N LEU A 183 7.554 11.054 6.870 1.00 13.31 N ATOM 2397 CA LEU A 183 6.515 10.591 7.784 1.00 3.24 C ATOM 2398 C LEU A 183 7.104 9.687 8.863 1.00 11.33 C ATOM 2399 O LEU A 183 8.318 9.503 8.938 1.00 34.21 O ATOM 2400 CB LEU A 183 5.428 9.842 7.013 1.00 62.44 C ATOM 2401 CG LEU A 183 4.671 10.653 5.960 1.00 34.15 C ATOM 2402 CD1 LEU A 183 3.542 9.829 5.361 1.00 32.01 C ATOM 2403 CD2 LEU A 183 4.130 11.940 6.566 1.00 32.05 C ATOM 0 H LEU A 183 8.015 10.311 6.345 1.00 13.31 H new ATOM 0 HA LEU A 183 6.074 11.463 8.267 1.00 3.24 H new ATOM 0 HB2 LEU A 183 5.886 8.983 6.521 1.00 62.44 H new ATOM 0 HB3 LEU A 183 4.706 9.451 7.730 1.00 62.44 H new ATOM 0 HG LEU A 183 5.366 10.914 5.162 1.00 34.15 H new ATOM 0 HD11 LEU A 183 3.015 10.423 4.614 1.00 32.01 H new ATOM 0 HD12 LEU A 183 3.953 8.936 4.891 1.00 32.01 H new ATOM 0 HD13 LEU A 183 2.847 9.537 6.149 1.00 32.01 H new ATOM 0 HD21 LEU A 183 3.594 12.504 5.803 1.00 32.05 H new ATOM 0 HD22 LEU A 183 3.450 11.700 7.383 1.00 32.05 H new ATOM 0 HD23 LEU A 183 4.957 12.539 6.946 1.00 32.05 H new ATOM 2414 N GLY A 184 6.233 9.124 9.696 1.00 1.41 N ATOM 2415 CA GLY A 184 6.686 8.245 10.758 1.00 54.34 C ATOM 2416 C GLY A 184 7.699 8.910 11.667 1.00 24.41 C ATOM 2417 O GLY A 184 7.360 9.812 12.431 1.00 23.00 O ATOM 0 H GLY A 184 5.223 9.261 9.654 1.00 1.41 H new ATOM 0 HA2 GLY A 184 5.829 7.922 11.349 1.00 54.34 H new ATOM 0 HA3 GLY A 184 7.127 7.349 10.321 1.00 54.34 H new ATOM 2421 N ASN A 185 8.948 8.460 11.588 1.00 71.13 N ATOM 2422 CA ASN A 185 10.014 9.015 12.413 1.00 14.33 C ATOM 2423 C ASN A 185 11.000 9.812 11.564 1.00 60.32 C ATOM 2424 O ASN A 185 12.127 10.073 11.983 1.00 3.43 O ATOM 2425 CB ASN A 185 10.749 7.896 13.154 1.00 12.25 C ATOM 2426 CG ASN A 185 10.226 7.694 14.562 1.00 61.22 C ATOM 2427 OD1 ASN A 185 10.378 8.561 15.424 1.00 54.51 O ATOM 2428 ND2 ASN A 185 9.606 6.545 14.804 1.00 31.14 N ATOM 0 H ASN A 185 9.246 7.713 10.961 1.00 71.13 H new ATOM 0 HA ASN A 185 9.563 9.688 13.142 1.00 14.33 H new ATOM 0 HB2 ASN A 185 10.647 6.966 12.595 1.00 12.25 H new ATOM 0 HB3 ASN A 185 11.813 8.129 13.195 1.00 12.25 H new ATOM 0 HD21 ASN A 185 9.233 6.353 15.734 1.00 31.14 H new ATOM 0 HD22 ASN A 185 9.502 5.855 14.060 1.00 31.14 H new ATOM 2434 N GLY A 186 10.566 10.197 10.367 1.00 23.31 N ATOM 2435 CA GLY A 186 11.422 10.960 9.478 1.00 63.51 C ATOM 2436 C GLY A 186 12.363 10.078 8.682 1.00 12.35 C ATOM 2437 O GLY A 186 12.904 9.123 9.237 1.00 53.34 O ATOM 0 H GLY A 186 9.637 9.994 9.998 1.00 23.31 H new ATOM 0 HA2 GLY A 186 10.804 11.539 8.792 1.00 63.51 H new ATOM 0 HA3 GLY A 186 12.004 11.673 10.062 1.00 63.51 H new TER 2441 GLY A 186 ATOM 2442 N GLU B 80 -19.501 -14.922 -1.338 1.00 20.04 N ATOM 2443 CA GLU B 80 -20.235 -13.663 -1.347 1.00 11.53 C ATOM 2444 C GLU B 80 -19.981 -12.875 -0.065 1.00 42.42 C ATOM 2445 O GLU B 80 -19.865 -11.650 -0.090 1.00 74.02 O ATOM 2446 CB GLU B 80 -21.734 -13.922 -1.512 1.00 13.45 C ATOM 2447 CG GLU B 80 -22.447 -12.862 -2.335 1.00 73.34 C ATOM 2448 CD GLU B 80 -23.046 -11.763 -1.478 1.00 31.53 C ATOM 2449 OE1 GLU B 80 -23.571 -12.080 -0.390 1.00 2.00 O ATOM 2450 OE2 GLU B 80 -22.989 -10.588 -1.894 1.00 3.53 O ATOM 0 HA GLU B 80 -19.881 -13.072 -2.192 1.00 11.53 H new ATOM 0 HB2 GLU B 80 -21.877 -14.894 -1.985 1.00 13.45 H new ATOM 0 HB3 GLU B 80 -22.196 -13.976 -0.526 1.00 13.45 H new ATOM 0 HG2 GLU B 80 -21.744 -12.423 -3.043 1.00 73.34 H new ATOM 0 HG3 GLU B 80 -23.237 -13.332 -2.920 1.00 73.34 H new ATOM 2455 N ASP B 81 -19.897 -13.588 1.052 1.00 32.22 N ATOM 2456 CA ASP B 81 -19.656 -12.957 2.345 1.00 70.33 C ATOM 2457 C ASP B 81 -18.187 -12.577 2.499 1.00 75.21 C ATOM 2458 O ASP B 81 -17.829 -11.786 3.373 1.00 71.03 O ATOM 2459 CB ASP B 81 -20.076 -13.893 3.479 1.00 51.04 C ATOM 2460 CG ASP B 81 -21.152 -13.290 4.360 1.00 4.40 C ATOM 2461 OD1 ASP B 81 -22.210 -12.902 3.822 1.00 1.21 O ATOM 2462 OD2 ASP B 81 -20.937 -13.205 5.588 1.00 12.45 O ATOM 0 H ASP B 81 -19.992 -14.603 1.089 1.00 32.22 H new ATOM 0 HA ASP B 81 -20.254 -12.047 2.395 1.00 70.33 H new ATOM 0 HB2 ASP B 81 -20.439 -14.830 3.057 1.00 51.04 H new ATOM 0 HB3 ASP B 81 -19.205 -14.134 4.088 1.00 51.04 H new ATOM 2466 N ILE B 82 -17.342 -13.147 1.648 1.00 12.24 N ATOM 2467 CA ILE B 82 -15.911 -12.867 1.691 1.00 54.34 C ATOM 2468 C ILE B 82 -15.587 -11.554 0.986 1.00 23.31 C ATOM 2469 O ILE B 82 -14.728 -10.793 1.434 1.00 24.24 O ATOM 2470 CB ILE B 82 -15.096 -14.001 1.040 1.00 74.05 C ATOM 2471 CG1 ILE B 82 -13.598 -13.713 1.155 1.00 33.13 C ATOM 2472 CG2 ILE B 82 -15.497 -14.172 -0.417 1.00 65.14 C ATOM 2473 CD1 ILE B 82 -12.858 -14.702 2.029 1.00 74.05 C ATOM 0 H ILE B 82 -17.622 -13.805 0.921 1.00 12.24 H new ATOM 0 HA ILE B 82 -15.635 -12.790 2.743 1.00 54.34 H new ATOM 0 HB ILE B 82 -15.310 -14.931 1.567 1.00 74.05 H new ATOM 0 HG12 ILE B 82 -13.157 -13.721 0.158 1.00 33.13 H new ATOM 0 HG13 ILE B 82 -13.459 -12.710 1.557 1.00 33.13 H new ATOM 0 HG21 ILE B 82 -14.913 -14.977 -0.863 1.00 65.14 H new ATOM 0 HG22 ILE B 82 -16.557 -14.418 -0.476 1.00 65.14 H new ATOM 0 HG23 ILE B 82 -15.309 -13.244 -0.957 1.00 65.14 H new ATOM 0 HD11 ILE B 82 -11.801 -14.436 2.065 1.00 74.05 H new ATOM 0 HD12 ILE B 82 -13.273 -14.678 3.037 1.00 74.05 H new ATOM 0 HD13 ILE B 82 -12.966 -15.705 1.616 1.00 74.05 H new ATOM 2484 N ILE B 83 -16.279 -11.294 -0.118 1.00 30.33 N ATOM 2485 CA ILE B 83 -16.066 -10.071 -0.882 1.00 64.03 C ATOM 2486 C ILE B 83 -16.436 -8.840 -0.064 1.00 35.53 C ATOM 2487 O ILE B 83 -15.809 -7.787 -0.188 1.00 44.01 O ATOM 2488 CB ILE B 83 -16.887 -10.072 -2.186 1.00 23.31 C ATOM 2489 CG1 ILE B 83 -16.251 -11.011 -3.214 1.00 73.45 C ATOM 2490 CG2 ILE B 83 -16.997 -8.661 -2.743 1.00 3.14 C ATOM 2491 CD1 ILE B 83 -16.611 -12.465 -3.009 1.00 23.52 C ATOM 0 H ILE B 83 -16.992 -11.914 -0.503 1.00 30.33 H new ATOM 0 HA ILE B 83 -15.005 -10.035 -1.129 1.00 64.03 H new ATOM 0 HB ILE B 83 -17.892 -10.433 -1.966 1.00 23.31 H new ATOM 0 HG12 ILE B 83 -16.561 -10.706 -4.213 1.00 73.45 H new ATOM 0 HG13 ILE B 83 -15.167 -10.904 -3.170 1.00 73.45 H new ATOM 0 HG21 ILE B 83 -17.580 -8.678 -3.664 1.00 3.14 H new ATOM 0 HG22 ILE B 83 -17.490 -8.019 -2.013 1.00 3.14 H new ATOM 0 HG23 ILE B 83 -16.000 -8.273 -2.952 1.00 3.14 H new ATOM 0 HD11 ILE B 83 -16.125 -13.071 -3.773 1.00 23.52 H new ATOM 0 HD12 ILE B 83 -16.276 -12.787 -2.023 1.00 23.52 H new ATOM 0 HD13 ILE B 83 -17.692 -12.586 -3.083 1.00 23.52 H new ATOM 2502 N ARG B 84 -17.456 -8.978 0.777 1.00 23.11 N ATOM 2503 CA ARG B 84 -17.908 -7.877 1.618 1.00 54.45 C ATOM 2504 C ARG B 84 -17.121 -7.831 2.924 1.00 64.21 C ATOM 2505 O ARG B 84 -17.000 -6.779 3.551 1.00 42.14 O ATOM 2506 CB ARG B 84 -19.403 -8.015 1.915 1.00 33.23 C ATOM 2507 CG ARG B 84 -19.739 -9.195 2.811 1.00 41.21 C ATOM 2508 CD ARG B 84 -20.278 -8.736 4.157 1.00 30.12 C ATOM 2509 NE ARG B 84 -21.728 -8.564 4.138 1.00 22.22 N ATOM 2510 CZ ARG B 84 -22.483 -8.565 5.231 1.00 54.11 C ATOM 2511 NH1 ARG B 84 -21.928 -8.726 6.424 1.00 2.23 N ATOM 2512 NH2 ARG B 84 -23.796 -8.403 5.132 1.00 51.34 N ATOM 0 H ARG B 84 -17.985 -9.842 0.894 1.00 23.11 H new ATOM 0 HA ARG B 84 -17.736 -6.946 1.078 1.00 54.45 H new ATOM 0 HB2 ARG B 84 -19.757 -7.099 2.387 1.00 33.23 H new ATOM 0 HB3 ARG B 84 -19.944 -8.118 0.974 1.00 33.23 H new ATOM 0 HG2 ARG B 84 -20.477 -9.828 2.319 1.00 41.21 H new ATOM 0 HG3 ARG B 84 -18.847 -9.803 2.963 1.00 41.21 H new ATOM 0 HD2 ARG B 84 -20.010 -9.465 4.922 1.00 30.12 H new ATOM 0 HD3 ARG B 84 -19.805 -7.794 4.434 1.00 30.12 H new ATOM 0 HE ARG B 84 -22.186 -8.436 3.236 1.00 22.22 H new ATOM 0 HH11 ARG B 84 -20.919 -8.850 6.504 1.00 2.23 H new ATOM 0 HH12 ARG B 84 -22.510 -8.726 7.261 1.00 2.23 H new ATOM 0 HH21 ARG B 84 -24.227 -8.278 4.216 1.00 51.34 H new ATOM 0 HH22 ARG B 84 -24.375 -8.404 5.972 1.00 51.34 H new ATOM 2523 N ASN B 85 -16.588 -8.980 3.328 1.00 74.41 N ATOM 2524 CA ASN B 85 -15.814 -9.071 4.561 1.00 60.51 C ATOM 2525 C ASN B 85 -14.474 -8.355 4.416 1.00 41.35 C ATOM 2526 O ASN B 85 -14.102 -7.539 5.259 1.00 10.14 O ATOM 2527 CB ASN B 85 -15.584 -10.537 4.935 1.00 20.43 C ATOM 2528 CG ASN B 85 -16.530 -11.012 6.022 1.00 12.34 C ATOM 2529 OD1 ASN B 85 -17.806 -10.671 5.885 1.00 34.13 O flip ATOM 2530 ND2 ASN B 85 -16.117 -11.677 6.972 1.00 44.31 N flip ATOM 0 H ASN B 85 -16.678 -9.860 2.820 1.00 74.41 H new ATOM 0 HA ASN B 85 -16.381 -8.585 5.355 1.00 60.51 H new ATOM 0 HB2 ASN B 85 -15.711 -11.159 4.049 1.00 20.43 H new ATOM 0 HB3 ASN B 85 -14.555 -10.666 5.271 1.00 20.43 H new ATOM 0 HD21 ASN B 85 -15.127 -11.915 7.036 1.00 44.31 H new ATOM 0 HD22 ASN B 85 -16.764 -11.990 7.695 1.00 44.31 H new ATOM 2536 N ILE B 86 -13.756 -8.667 3.342 1.00 54.33 N ATOM 2537 CA ILE B 86 -12.460 -8.052 3.086 1.00 74.32 C ATOM 2538 C ILE B 86 -12.545 -6.532 3.177 1.00 13.41 C ATOM 2539 O ILE B 86 -11.633 -5.878 3.682 1.00 33.20 O ATOM 2540 CB ILE B 86 -11.915 -8.443 1.700 1.00 51.21 C ATOM 2541 CG1 ILE B 86 -10.483 -7.934 1.528 1.00 61.02 C ATOM 2542 CG2 ILE B 86 -12.814 -7.892 0.603 1.00 0.14 C ATOM 2543 CD1 ILE B 86 -9.872 -8.288 0.191 1.00 4.52 C ATOM 0 H ILE B 86 -14.050 -9.342 2.636 1.00 54.33 H new ATOM 0 HA ILE B 86 -11.779 -8.422 3.852 1.00 74.32 H new ATOM 0 HB ILE B 86 -11.905 -9.530 1.624 1.00 51.21 H new ATOM 0 HG12 ILE B 86 -10.475 -6.851 1.647 1.00 61.02 H new ATOM 0 HG13 ILE B 86 -9.862 -8.346 2.323 1.00 61.02 H new ATOM 0 HG21 ILE B 86 -12.416 -8.177 -0.371 1.00 0.14 H new ATOM 0 HG22 ILE B 86 -13.819 -8.299 0.717 1.00 0.14 H new ATOM 0 HG23 ILE B 86 -12.852 -6.805 0.676 1.00 0.14 H new ATOM 0 HD11 ILE B 86 -8.857 -7.895 0.140 1.00 4.52 H new ATOM 0 HD12 ILE B 86 -9.848 -9.372 0.077 1.00 4.52 H new ATOM 0 HD13 ILE B 86 -10.470 -7.853 -0.609 1.00 4.52 H new ATOM 2554 N ALA B 87 -13.647 -5.976 2.683 1.00 64.34 N ATOM 2555 CA ALA B 87 -13.854 -4.533 2.711 1.00 62.40 C ATOM 2556 C ALA B 87 -14.166 -4.051 4.124 1.00 43.03 C ATOM 2557 O ALA B 87 -13.831 -2.925 4.494 1.00 25.54 O ATOM 2558 CB ALA B 87 -14.973 -4.142 1.758 1.00 73.21 C ATOM 0 H ALA B 87 -14.410 -6.503 2.259 1.00 64.34 H new ATOM 0 HA ALA B 87 -12.931 -4.052 2.387 1.00 62.40 H new ATOM 0 HB1 ALA B 87 -15.117 -3.062 1.789 1.00 73.21 H new ATOM 0 HB2 ALA B 87 -14.710 -4.444 0.744 1.00 73.21 H new ATOM 0 HB3 ALA B 87 -15.896 -4.640 2.057 1.00 73.21 H new ATOM 2564 N ARG B 88 -14.810 -4.909 4.909 1.00 1.40 N ATOM 2565 CA ARG B 88 -15.169 -4.569 6.281 1.00 50.32 C ATOM 2566 C ARG B 88 -13.936 -4.564 7.180 1.00 23.02 C ATOM 2567 O ARG B 88 -13.800 -3.712 8.059 1.00 44.20 O ATOM 2568 CB ARG B 88 -16.203 -5.559 6.820 1.00 3.24 C ATOM 2569 CG ARG B 88 -16.662 -5.249 8.235 1.00 10.13 C ATOM 2570 CD ARG B 88 -17.031 -6.517 8.991 1.00 31.42 C ATOM 2571 NE ARG B 88 -15.910 -7.032 9.774 1.00 41.43 N ATOM 2572 CZ ARG B 88 -16.051 -7.884 10.784 1.00 70.22 C ATOM 2573 NH1 ARG B 88 -17.256 -8.314 11.131 1.00 52.12 N ATOM 2574 NH2 ARG B 88 -14.983 -8.308 11.448 1.00 61.23 N ATOM 0 H ARG B 88 -15.094 -5.845 4.618 1.00 1.40 H new ATOM 0 HA ARG B 88 -15.601 -3.568 6.280 1.00 50.32 H new ATOM 0 HB2 ARG B 88 -17.069 -5.563 6.159 1.00 3.24 H new ATOM 0 HB3 ARG B 88 -15.779 -6.563 6.796 1.00 3.24 H new ATOM 0 HG2 ARG B 88 -15.870 -4.723 8.769 1.00 10.13 H new ATOM 0 HG3 ARG B 88 -17.522 -4.581 8.202 1.00 10.13 H new ATOM 0 HD2 ARG B 88 -17.872 -6.313 9.653 1.00 31.42 H new ATOM 0 HD3 ARG B 88 -17.360 -7.278 8.284 1.00 31.42 H new ATOM 0 HE ARG B 88 -14.969 -6.721 9.532 1.00 41.43 H new ATOM 0 HH11 ARG B 88 -18.079 -7.991 10.622 1.00 52.12 H new ATOM 0 HH12 ARG B 88 -17.360 -8.968 11.907 1.00 52.12 H new ATOM 0 HH21 ARG B 88 -14.054 -7.980 11.183 1.00 61.23 H new ATOM 0 HH22 ARG B 88 -15.091 -8.962 12.223 1.00 61.23 H new ATOM 2585 N HIS B 89 -13.041 -5.520 6.954 1.00 64.23 N ATOM 2586 CA HIS B 89 -11.819 -5.626 7.744 1.00 2.00 C ATOM 2587 C HIS B 89 -10.886 -4.453 7.460 1.00 4.22 C ATOM 2588 O HIS B 89 -9.994 -4.150 8.254 1.00 1.45 O ATOM 2589 CB HIS B 89 -11.106 -6.946 7.444 1.00 73.31 C ATOM 2590 CG HIS B 89 -11.653 -8.110 8.212 1.00 33.42 C ATOM 2591 ND1 HIS B 89 -11.379 -8.326 9.546 1.00 2.51 N ATOM 2592 CD2 HIS B 89 -12.463 -9.123 7.826 1.00 73.13 C ATOM 2593 CE1 HIS B 89 -11.995 -9.423 9.947 1.00 60.42 C ATOM 2594 NE2 HIS B 89 -12.662 -9.926 8.923 1.00 1.53 N ATOM 0 H HIS B 89 -13.139 -6.232 6.231 1.00 64.23 H new ATOM 0 HA HIS B 89 -12.093 -5.602 8.799 1.00 2.00 H new ATOM 0 HB2 HIS B 89 -11.183 -7.157 6.377 1.00 73.31 H new ATOM 0 HB3 HIS B 89 -10.046 -6.837 7.672 1.00 73.31 H new ATOM 0 HD2 HIS B 89 -12.876 -9.272 6.839 1.00 73.13 H new ATOM 0 HE1 HIS B 89 -11.960 -9.839 10.943 1.00 60.42 H new ATOM 0 HE2 HIS B 89 -13.231 -10.772 8.944 1.00 1.53 H new ATOM 2601 N LEU B 90 -11.095 -3.799 6.323 1.00 73.53 N ATOM 2602 CA LEU B 90 -10.272 -2.659 5.934 1.00 54.52 C ATOM 2603 C LEU B 90 -10.832 -1.361 6.507 1.00 25.20 C ATOM 2604 O LEU B 90 -10.767 -0.310 5.869 1.00 64.33 O ATOM 2605 CB LEU B 90 -10.189 -2.562 4.410 1.00 5.44 C ATOM 2606 CG LEU B 90 -9.535 -3.747 3.697 1.00 52.44 C ATOM 2607 CD1 LEU B 90 -10.073 -3.879 2.280 1.00 2.13 C ATOM 2608 CD2 LEU B 90 -8.021 -3.593 3.683 1.00 52.23 C ATOM 0 H LEU B 90 -11.827 -4.038 5.654 1.00 73.53 H new ATOM 0 HA LEU B 90 -9.271 -2.811 6.338 1.00 54.52 H new ATOM 0 HB2 LEU B 90 -11.199 -2.440 4.018 1.00 5.44 H new ATOM 0 HB3 LEU B 90 -9.636 -1.659 4.153 1.00 5.44 H new ATOM 0 HG LEU B 90 -9.781 -4.657 4.244 1.00 52.44 H new ATOM 0 HD11 LEU B 90 -9.597 -4.727 1.788 1.00 2.13 H new ATOM 0 HD12 LEU B 90 -11.151 -4.037 2.313 1.00 2.13 H new ATOM 0 HD13 LEU B 90 -9.857 -2.968 1.722 1.00 2.13 H new ATOM 0 HD21 LEU B 90 -7.573 -4.445 3.172 1.00 52.23 H new ATOM 0 HD22 LEU B 90 -7.754 -2.675 3.160 1.00 52.23 H new ATOM 0 HD23 LEU B 90 -7.650 -3.549 4.707 1.00 52.23 H new ATOM 2619 N ALA B 91 -11.380 -1.442 7.715 1.00 10.11 N ATOM 2620 CA ALA B 91 -11.947 -0.273 8.376 1.00 23.13 C ATOM 2621 C ALA B 91 -10.956 0.335 9.362 1.00 21.44 C ATOM 2622 O ALA B 91 -11.252 1.047 10.306 1.00 64.43 O ATOM 2623 CB ALA B 91 -13.240 -0.644 9.088 1.00 45.43 C ATOM 0 H ALA B 91 -11.443 -2.305 8.256 1.00 10.11 H new ATOM 0 HA ALA B 91 -12.166 0.474 7.613 1.00 23.13 H new ATOM 0 HB1 ALA B 91 -13.652 0.239 9.577 1.00 45.43 H new ATOM 0 HB2 ALA B 91 -13.958 -1.026 8.362 1.00 45.43 H new ATOM 0 HB3 ALA B 91 -13.037 -1.411 9.835 1.00 45.43 H new HETATM 2629 C MK8 B 92 -7.431 -0.315 9.818 1.00 50.01 C HETATM 2630 N MK8 B 92 -9.668 0.052 9.154 1.00 31.15 N HETATM 2631 O MK8 B 92 -6.586 -0.268 10.713 1.00 63.24 O HETATM 2632 CA MK8 B 92 -8.865 -0.421 10.318 1.00 74.14 C HETATM 2633 CB MK8 B 92 -9.175 -1.909 10.695 1.00 4.11 C HETATM 2634 CD MK8 B 92 -11.210 -1.446 12.204 1.00 73.33 C HETATM 2635 CE MK8 B 92 -10.089 -0.991 13.108 1.00 13.45 C HETATM 2636 CG MK8 B 92 -10.671 -2.230 10.976 1.00 15.15 C HETATM 2637 CB1 MK8 B 92 -8.823 0.509 11.570 1.00 10.51 C HETATM 0 HB1B MK8 B 92 -8.088 0.130 12.280 1.00 10.51 H new HETATM 0 HB1A MK8 B 92 -8.545 1.518 11.265 1.00 10.51 H new HETATM 0 HN MK8 B 92 -9.200 0.343 8.296 1.00 31.15 H new HETATM 0 HGA MK8 B 92 -11.267 -1.983 10.097 1.00 15.15 H new HETATM 0 HG MK8 B 92 -10.787 -3.300 11.149 1.00 15.15 H new HETATM 0 HEB MK8 B 92 -9.538 -1.859 13.469 1.00 13.45 H new HETATM 0 HEA MK8 B 92 -9.415 -0.339 12.552 1.00 13.45 H new HETATM 0 HE MK8 B 92 -10.504 -0.446 13.956 1.00 13.45 H new HETATM 0 HDA MK8 B 92 -11.898 -2.077 12.766 1.00 73.33 H new HETATM 0 HD MK8 B 92 -11.778 -0.580 11.863 1.00 73.33 H new HETATM 0 HBA MK8 B 92 -8.830 -2.551 9.884 1.00 4.11 H new HETATM 0 HB1 MK8 B 92 -9.806 0.530 12.041 1.00 10.51 H new HETATM 0 HB MK8 B 92 -8.593 -2.171 11.579 1.00 4.11 H new ATOM 2649 N VAL B 93 -7.119 -0.269 8.526 1.00 22.34 N ATOM 2650 CA VAL B 93 -5.736 -0.159 8.077 1.00 31.21 C ATOM 2651 C VAL B 93 -5.453 1.227 7.509 1.00 31.12 C ATOM 2652 O VAL B 93 -4.297 1.630 7.375 1.00 75.45 O ATOM 2653 CB VAL B 93 -5.407 -1.217 7.007 1.00 72.41 C ATOM 2654 CG1 VAL B 93 -3.918 -1.524 7.001 1.00 12.12 C ATOM 2655 CG2 VAL B 93 -6.220 -2.482 7.243 1.00 31.15 C ATOM 0 H VAL B 93 -7.805 -0.306 7.772 1.00 22.34 H new ATOM 0 HA VAL B 93 -5.105 -0.328 8.950 1.00 31.21 H new ATOM 0 HB VAL B 93 -5.675 -0.817 6.029 1.00 72.41 H new ATOM 0 HG11 VAL B 93 -3.704 -2.273 6.239 1.00 12.12 H new ATOM 0 HG12 VAL B 93 -3.360 -0.614 6.782 1.00 12.12 H new ATOM 0 HG13 VAL B 93 -3.621 -1.905 7.978 1.00 12.12 H new ATOM 0 HG21 VAL B 93 -5.976 -3.219 6.478 1.00 31.15 H new ATOM 0 HG22 VAL B 93 -5.984 -2.888 8.227 1.00 31.15 H new ATOM 0 HG23 VAL B 93 -7.283 -2.246 7.193 1.00 31.15 H new ATOM 2665 N GLY B 94 -6.515 1.954 7.176 1.00 44.35 N ATOM 2666 CA GLY B 94 -6.359 3.287 6.626 1.00 14.22 C ATOM 2667 C GLY B 94 -6.130 4.334 7.699 1.00 11.45 C ATOM 2668 O GLY B 94 -5.119 5.037 7.684 1.00 41.40 O ATOM 0 H GLY B 94 -7.481 1.643 7.278 1.00 44.35 H new ATOM 0 HA2 GLY B 94 -5.519 3.294 5.931 1.00 14.22 H new ATOM 0 HA3 GLY B 94 -7.249 3.547 6.053 1.00 14.22 H new ATOM 2672 N ASP B 95 -7.070 4.439 8.631 1.00 31.44 N ATOM 2673 CA ASP B 95 -6.966 5.407 9.716 1.00 15.31 C ATOM 2674 C ASP B 95 -5.623 5.284 10.428 1.00 61.23 C ATOM 2675 O ASP B 95 -4.764 6.148 10.463 1.00 55.41 O ATOM 2676 CB ASP B 95 -8.108 5.211 10.715 1.00 21.54 C ATOM 2677 CG ASP B 95 -8.626 6.523 11.267 1.00 34.31 C ATOM 2678 OD1 ASP B 95 -7.803 7.425 11.526 1.00 1.14 O ATOM 2679 OD2 ASP B 95 -9.857 6.650 11.443 1.00 5.24 O ATOM 0 H ASP B 95 -7.913 3.865 8.657 1.00 31.44 H new ATOM 0 HA ASP B 95 -7.038 6.406 9.286 1.00 15.31 H new ATOM 0 HB2 ASP B 95 -8.925 4.677 10.229 1.00 21.54 H new ATOM 0 HB3 ASP B 95 -7.763 4.585 11.538 1.00 21.54 H new HETATM 2683 C MK8 B 96 -3.420 4.508 12.298 1.00 53.42 C HETATM 2684 N MK8 B 96 -5.394 4.129 11.057 1.00 23.50 N HETATM 2685 O MK8 B 96 -2.898 4.889 13.344 1.00 60.31 O HETATM 2686 CA MK8 B 96 -4.901 4.191 12.463 1.00 11.34 C HETATM 2687 CB MK8 B 96 -5.059 2.826 13.215 1.00 21.12 C HETATM 2688 CD MK8 B 96 -6.656 1.043 14.164 1.00 43.25 C HETATM 2689 CE MK8 B 96 -8.104 0.625 14.270 1.00 32.23 C HETATM 2690 CG MK8 B 96 -6.462 2.163 13.107 1.00 2.33 C HETATM 2691 CB1 MK8 B 96 -5.519 5.380 13.261 1.00 14.14 C HETATM 0 HB1B MK8 B 96 -5.027 5.462 14.230 1.00 14.14 H new HETATM 0 HB1A MK8 B 96 -5.378 6.305 12.703 1.00 14.14 H new HETATM 0 HGA MK8 B 96 -7.233 2.922 13.237 1.00 2.33 H new HETATM 0 HG MK8 B 96 -6.590 1.746 12.108 1.00 2.33 H new HETATM 0 HEB MK8 B 96 -8.710 1.483 14.562 1.00 32.23 H new HETATM 0 HEA MK8 B 96 -8.446 0.251 13.305 1.00 32.23 H new HETATM 0 HE MK8 B 96 -8.202 -0.161 15.019 1.00 32.23 H new HETATM 0 HDA MK8 B 96 -6.306 1.393 15.135 1.00 43.25 H new HETATM 0 HD MK8 B 96 -6.046 0.180 13.897 1.00 43.25 H new HETATM 0 HBA MK8 B 96 -4.316 2.129 12.828 1.00 21.12 H new HETATM 0 HB1 MK8 B 96 -6.585 5.204 13.409 1.00 14.14 H new HETATM 0 HB MK8 B 96 -4.830 2.983 14.269 1.00 21.12 H new HETATM 2703 N NLE B 97 -2.783 4.385 11.143 1.00 53.44 N HETATM 2704 CA NLE B 97 -1.372 4.706 11.030 1.00 14.45 C HETATM 2705 C NLE B 97 -1.169 6.193 10.726 1.00 61.52 C HETATM 2706 O NLE B 97 -0.156 6.797 11.076 1.00 72.30 O HETATM 2707 CB NLE B 97 -0.735 3.859 9.913 1.00 34.13 C HETATM 2708 CG NLE B 97 -1.422 4.179 8.574 1.00 21.25 C HETATM 2709 CD NLE B 97 -1.732 2.867 7.833 1.00 33.44 C HETATM 2710 CE NLE B 97 -0.424 2.088 7.603 1.00 74.14 C HETATM 0 HG3 NLE B 97 -2.342 4.737 8.749 1.00 21.25 H new HETATM 0 HG2 NLE B 97 -0.777 4.811 7.963 1.00 21.25 H new HETATM 0 HE3 NLE B 97 0.258 2.691 7.004 1.00 74.14 H new HETATM 0 HE2 NLE B 97 0.039 1.862 8.564 1.00 74.14 H new HETATM 0 HE1 NLE B 97 -0.642 1.158 7.078 1.00 74.14 H new HETATM 0 HD3 NLE B 97 -2.430 2.264 8.414 1.00 33.44 H new HETATM 0 HD2 NLE B 97 -2.214 3.080 6.879 1.00 33.44 H new HETATM 0 HB3 NLE B 97 0.332 4.069 9.846 1.00 34.13 H new HETATM 0 HB2 NLE B 97 -0.837 2.798 10.142 1.00 34.13 H new HETATM 0 HA NLE B 97 -0.893 4.481 11.983 1.00 14.45 H new ATOM 2722 N ASP B 98 -2.165 6.771 10.064 1.00 5.35 N ATOM 2723 CA ASP B 98 -2.122 8.183 9.700 1.00 32.40 C ATOM 2724 C ASP B 98 -1.882 9.052 10.930 1.00 74.51 C ATOM 2725 O ASP B 98 -1.355 10.160 10.826 1.00 1.05 O ATOM 2726 CB ASP B 98 -3.427 8.594 9.016 1.00 12.42 C ATOM 2727 CG ASP B 98 -3.585 10.099 8.928 1.00 34.31 C ATOM 2728 OD1 ASP B 98 -2.749 10.747 8.262 1.00 64.41 O ATOM 2729 OD2 ASP B 98 -4.544 10.631 9.525 1.00 31.52 O ATOM 0 H ASP B 98 -3.011 6.284 9.769 1.00 5.35 H new ATOM 0 HA ASP B 98 -1.295 8.331 9.006 1.00 32.40 H new ATOM 0 HB2 ASP B 98 -3.457 8.169 8.013 1.00 12.42 H new ATOM 0 HB3 ASP B 98 -4.270 8.175 9.566 1.00 12.42 H new ATOM 2733 N ARG B 99 -2.274 8.545 12.094 1.00 3.22 N ATOM 2734 CA ARG B 99 -2.103 9.276 13.344 1.00 42.44 C ATOM 2735 C ARG B 99 -0.751 8.963 13.976 1.00 71.41 C ATOM 2736 O ARG B 99 -0.282 9.689 14.853 1.00 25.45 O ATOM 2737 CB ARG B 99 -3.229 8.929 14.320 1.00 11.01 C ATOM 2738 CG ARG B 99 -4.617 9.022 13.708 1.00 23.44 C ATOM 2739 CD ARG B 99 -4.859 10.386 13.082 1.00 13.34 C ATOM 2740 NE ARG B 99 -4.625 11.473 14.029 1.00 71.31 N ATOM 2741 CZ ARG B 99 -4.973 12.734 13.800 1.00 30.20 C ATOM 2742 NH1 ARG B 99 -5.567 13.066 12.663 1.00 45.51 N ATOM 2743 NH2 ARG B 99 -4.726 13.668 14.711 1.00 44.23 N ATOM 0 H ARG B 99 -2.713 7.630 12.198 1.00 3.22 H new ATOM 0 HA ARG B 99 -2.141 10.342 13.121 1.00 42.44 H new ATOM 0 HB2 ARG B 99 -3.074 7.917 14.695 1.00 11.01 H new ATOM 0 HB3 ARG B 99 -3.174 9.599 15.178 1.00 11.01 H new ATOM 0 HG2 ARG B 99 -4.735 8.247 12.951 1.00 23.44 H new ATOM 0 HG3 ARG B 99 -5.368 8.834 14.476 1.00 23.44 H new ATOM 0 HD2 ARG B 99 -4.205 10.510 12.219 1.00 13.34 H new ATOM 0 HD3 ARG B 99 -5.884 10.440 12.715 1.00 13.34 H new ATOM 0 HE ARG B 99 -4.170 11.252 14.914 1.00 71.31 H new ATOM 0 HH11 ARG B 99 -5.758 12.352 11.960 1.00 45.51 H new ATOM 0 HH12 ARG B 99 -5.833 14.036 12.491 1.00 45.51 H new ATOM 0 HH21 ARG B 99 -4.269 13.417 15.588 1.00 44.23 H new ATOM 0 HH22 ARG B 99 -4.994 14.636 14.534 1.00 44.23 H new ATOM 2754 N SER B 100 -0.130 7.877 13.526 1.00 31.32 N ATOM 2755 CA SER B 100 1.167 7.466 14.052 1.00 73.21 C ATOM 2756 C SER B 100 2.276 7.746 13.043 1.00 53.13 C ATOM 2757 O SER B 100 3.346 7.140 13.096 1.00 12.01 O ATOM 2758 CB SER B 100 1.148 5.978 14.405 1.00 65.13 C ATOM 2759 OG SER B 100 -0.101 5.600 14.959 1.00 22.10 O ATOM 0 H SER B 100 -0.504 7.266 12.799 1.00 31.32 H new ATOM 0 HA SER B 100 1.366 8.045 14.954 1.00 73.21 H new ATOM 0 HB2 SER B 100 1.347 5.387 13.511 1.00 65.13 H new ATOM 0 HB3 SER B 100 1.945 5.760 15.115 1.00 65.13 H new ATOM 0 HG SER B 100 -0.087 4.644 15.174 1.00 22.10 H new ATOM 2764 N ILE B 101 2.011 8.670 12.124 1.00 42.12 N ATOM 2765 CA ILE B 101 2.987 9.032 11.103 1.00 43.11 C ATOM 2766 C ILE B 101 3.347 10.512 11.187 1.00 72.45 C ATOM 2767 O ILE B 101 4.387 10.910 10.666 1.00 0.13 O ATOM 2768 CB ILE B 101 2.462 8.722 9.688 1.00 33.31 C ATOM 2769 CG1 ILE B 101 1.178 9.507 9.414 1.00 15.20 C ATOM 2770 CG2 ILE B 101 2.221 7.229 9.528 1.00 21.44 C ATOM 2771 CD1 ILE B 101 0.906 9.724 7.942 1.00 43.23 C ATOM 0 H ILE B 101 1.130 9.181 12.066 1.00 42.12 H new ATOM 0 HA ILE B 101 3.878 8.433 11.291 1.00 43.11 H new ATOM 0 HB ILE B 101 3.215 9.028 8.962 1.00 33.31 H new ATOM 0 HG12 ILE B 101 0.335 8.976 9.857 1.00 15.20 H new ATOM 0 HG13 ILE B 101 1.241 10.475 9.910 1.00 15.20 H new ATOM 0 HG21 ILE B 101 1.850 7.026 8.523 1.00 21.44 H new ATOM 0 HG22 ILE B 101 3.156 6.691 9.686 1.00 21.44 H new ATOM 0 HG23 ILE B 101 1.484 6.899 10.260 1.00 21.44 H new ATOM 0 HD11 ILE B 101 -0.020 10.287 7.822 1.00 43.23 H new ATOM 0 HD12 ILE B 101 1.730 10.282 7.498 1.00 43.23 H new ATOM 0 HD13 ILE B 101 0.811 8.759 7.443 1.00 43.23 H new HETATM 2782 N NH2 B 102 2.488 11.286 11.835 1.00 22.41 N TER 2785 NH2 B 102