USER MOD reduce.3.24.130724 H: found=0, std=0, add=1822, rem=0, adj=62 USER MOD reduce.3.24.130724 removed 1828 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 85 GLN : amide:sc= 0.122 K(o=-2.2,f=-3) USER MOD Set 1.2: B 114 MET CE :methyl -102:sc= -2.3! (180deg=-3.2!) USER MOD Set 2.1: B 81 CYS SG : rot 81:sc= 0.756 USER MOD Set 2.2: B 110 THR OG1 : rot 69:sc= 0.879 USER MOD Set 3.1: A 101 LYS NZ :NH3+ -177:sc= 1.04 (180deg=0.972) USER MOD Set 3.2: B 101 LYS NZ :NH3+ -174:sc= 1.01 (180deg=0.899) USER MOD Set 4.1: B 62 HIS : +bothHN:sc= -0.0587 K(o=-0.13,f=-3.4) USER MOD Set 4.2: B 63 GLN : amide:sc= -0.0705 X(o=-0.13,f=-0.58) USER MOD Set 5.1: B 23 MET CE :methyl -172:sc= -0.706 (180deg=-0.848) USER MOD Set 5.2: B 61 HIS : no HD1:sc= -0.484 K(o=-1.2,f=-3.1) USER MOD Set 6.1: B 28 LYS NZ :NH3+ -125:sc= 1.89 (180deg=0.217) USER MOD Set 6.2: B 29 ASN : amide:sc= 0.972 K(o=2.9,f=-5.5) USER MOD Set 7.1: A 85 GLN : amide:sc= 0.179 K(o=-2.1,f=-2.9) USER MOD Set 7.2: A 114 MET CE :methyl -106:sc= -2.29! (180deg=-3.25!) USER MOD Set 8.1: A 81 CYS SG : rot 81:sc= 0.612 USER MOD Set 8.2: A 110 THR OG1 : rot 68:sc= 0.807 USER MOD Set 9.1: A 62 HIS : +bothHN:sc= -0.0377 K(o=-0.11,f=-3.9!) USER MOD Set 9.2: A 63 GLN : amide:sc= -0.0745 X(o=-0.11,f=-0.46) USER MOD Set10.1: A 28 LYS NZ :NH3+ -121:sc= 1.77 (180deg=0.214) USER MOD Set10.2: A 29 ASN : amide:sc= 1.13 K(o=2.9,f=-6) USER MOD Set11.1: A 23 MET CE :methyl -174:sc= -0.57 (180deg=-0.769) USER MOD Set11.2: A 61 HIS : no HD1:sc= -0.364 K(o=-0.93,f=-2.7) USER MOD Single : A 2 SER OG : rot 32:sc= 0.165 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 SER OG : rot -86:sc= 0.00613 USER MOD Single : A 9 SER OG : rot 97:sc= 0.199 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 CYS SG : rot 76:sc= 1.15 USER MOD Single : A 24 SER OG : rot -160:sc= -0.42 USER MOD Single : A 26 THR OG1 : rot -139:sc= 0.0377 USER MOD Single : A 30 MET CE :methyl 175:sc= 0 (180deg=-0.0587) USER MOD Single : A 37 SER OG : rot 67:sc= 0.188 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0.00112 USER MOD Single : A 48 SER OG : rot -150:sc= 0.453 USER MOD Single : A 49 THR OG1 : rot 180:sc= -0.0318 USER MOD Single : A 53 LYS NZ :NH3+ 128:sc= 0.0022 (180deg=-0.0798) USER MOD Single : A 57 TYR OH : rot 130:sc= -0.513 USER MOD Single : A 58 CYS SG : rot 84:sc= -3.29! USER MOD Single : A 60 HIS : no HE2:sc= 0.0385 X(o=0.039,f=-0.39) USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 76 TYR OH : rot 58:sc= 0.474 USER MOD Single : A 82 LYS NZ :NH3+ -171:sc= 0.492 (180deg=0.447) USER MOD Single : A 87 THR OG1 : rot 180:sc= -0.127 USER MOD Single : A 96 ASN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 97 TYR OH : rot 180:sc=-0.000526 USER MOD Single : A 107 THR OG1 : rot 78:sc= 0.788 USER MOD Single : A 108 CYS SG : rot 82:sc= -0.0234 USER MOD Single : A 109 LYS NZ :NH3+ -115:sc= 0.257 (180deg=-0.106) USER MOD Single : A 113 ASN : amide:sc= -0.0827 K(o=-0.083,f=-0.65) USER MOD Single : B 2 SER OG : rot 31:sc= 0.173 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 8 SER OG : rot -86:sc= 0.0131 USER MOD Single : B 9 SER OG : rot 97:sc= 0.13 USER MOD Single : B 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 22 CYS SG : rot 63:sc= 1.17 USER MOD Single : B 24 SER OG : rot -160:sc= -0.371 USER MOD Single : B 26 THR OG1 : rot -139:sc= 0.0445 USER MOD Single : B 30 MET CE :methyl 174:sc= 0 (180deg=-0.0651) USER MOD Single : B 37 SER OG : rot 67:sc= 0.18 USER MOD Single : B 39 SER OG : rot 180:sc= 0 USER MOD Single : B 45 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 47 THR OG1 : rot 180:sc= 0 USER MOD Single : B 48 SER OG : rot -148:sc= 0.443 USER MOD Single : B 49 THR OG1 : rot 180:sc= -0.0428 USER MOD Single : B 53 LYS NZ :NH3+ 131:sc= 0.0352 (180deg=-0.105) USER MOD Single : B 57 TYR OH : rot 130:sc= -0.497 USER MOD Single : B 58 CYS SG : rot 82:sc= -3.27! USER MOD Single : B 60 HIS : no HE2:sc= 0.0689 K(o=0.069,f=-0.48) USER MOD Single : B 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 68 SER OG : rot 180:sc= 0 USER MOD Single : B 76 TYR OH : rot 58:sc= 0.447 USER MOD Single : B 82 LYS NZ :NH3+ -171:sc= 0.544 (180deg=0.495) USER MOD Single : B 87 THR OG1 : rot 180:sc= -0.217 USER MOD Single : B 96 ASN : amide:sc= -0.0816 X(o=-0.082,f=-0.51) USER MOD Single : B 97 TYR OH : rot 180:sc= 0 USER MOD Single : B 107 THR OG1 : rot 77:sc= 0.796 USER MOD Single : B 108 CYS SG : rot 81:sc= 0.49 USER MOD Single : B 109 LYS NZ :NH3+ -116:sc= 0.23 (180deg=-0.123) USER MOD Single : B 113 ASN : amide:sc= -0.0953 K(o=-0.095,f=-0.64) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 -17.078 -13.785 -18.298 1.00 54.41 N ATOM 2 CA SER A 2 -18.181 -13.216 -17.501 1.00 73.33 C ATOM 3 C SER A 2 -17.691 -12.021 -16.671 1.00 23.42 C ATOM 4 O SER A 2 -16.525 -11.978 -16.244 1.00 23.31 O ATOM 5 CB SER A 2 -18.783 -14.302 -16.591 1.00 24.22 C ATOM 6 OG SER A 2 -19.136 -15.449 -17.349 1.00 22.11 O ATOM 0 HA SER A 2 -18.956 -12.857 -18.179 1.00 73.33 H new ATOM 0 HB2 SER A 2 -18.064 -14.577 -15.819 1.00 24.22 H new ATOM 0 HB3 SER A 2 -19.664 -13.911 -16.082 1.00 24.22 H new ATOM 0 HG SER A 2 -18.522 -15.542 -18.107 1.00 22.11 H new ATOM 14 N LEU A 3 -18.601 -11.065 -16.444 1.00 50.25 N ATOM 15 CA LEU A 3 -18.334 -9.853 -15.660 1.00 61.24 C ATOM 16 C LEU A 3 -18.762 -10.056 -14.192 1.00 73.43 C ATOM 17 O LEU A 3 -19.909 -10.437 -13.930 1.00 11.20 O ATOM 18 CB LEU A 3 -19.107 -8.649 -16.265 1.00 3.24 C ATOM 19 CG LEU A 3 -18.819 -8.318 -17.764 1.00 34.51 C ATOM 20 CD1 LEU A 3 -19.667 -7.121 -18.245 1.00 10.35 C ATOM 21 CD2 LEU A 3 -17.319 -8.067 -18.000 1.00 1.14 C ATOM 0 H LEU A 3 -19.554 -11.112 -16.804 1.00 50.25 H new ATOM 0 HA LEU A 3 -17.264 -9.649 -15.691 1.00 61.24 H new ATOM 0 HB2 LEU A 3 -20.175 -8.840 -16.157 1.00 3.24 H new ATOM 0 HB3 LEU A 3 -18.880 -7.764 -15.670 1.00 3.24 H new ATOM 0 HG LEU A 3 -19.107 -9.187 -18.356 1.00 34.51 H new ATOM 0 HD11 LEU A 3 -19.444 -6.915 -19.292 1.00 10.35 H new ATOM 0 HD12 LEU A 3 -20.725 -7.359 -18.139 1.00 10.35 H new ATOM 0 HD13 LEU A 3 -19.431 -6.243 -17.644 1.00 10.35 H new ATOM 0 HD21 LEU A 3 -17.149 -7.839 -19.052 1.00 1.14 H new ATOM 0 HD22 LEU A 3 -16.990 -7.226 -17.389 1.00 1.14 H new ATOM 0 HD23 LEU A 3 -16.754 -8.958 -17.726 1.00 1.14 H new ATOM 33 N VAL A 4 -17.835 -9.818 -13.247 1.00 14.45 N ATOM 34 CA VAL A 4 -18.159 -9.785 -11.809 1.00 31.53 C ATOM 35 C VAL A 4 -18.752 -8.408 -11.443 1.00 61.52 C ATOM 36 O VAL A 4 -18.163 -7.361 -11.745 1.00 73.22 O ATOM 37 CB VAL A 4 -16.919 -10.123 -10.892 1.00 14.52 C ATOM 38 CG1 VAL A 4 -16.537 -11.616 -11.022 1.00 52.24 C ATOM 39 CG2 VAL A 4 -15.707 -9.210 -11.207 1.00 65.14 C ATOM 0 H VAL A 4 -16.851 -9.645 -13.454 1.00 14.45 H new ATOM 0 HA VAL A 4 -18.897 -10.565 -11.622 1.00 31.53 H new ATOM 0 HB VAL A 4 -17.209 -9.930 -9.859 1.00 14.52 H new ATOM 0 HG11 VAL A 4 -15.680 -11.829 -10.383 1.00 52.24 H new ATOM 0 HG12 VAL A 4 -17.381 -12.235 -10.717 1.00 52.24 H new ATOM 0 HG13 VAL A 4 -16.280 -11.837 -12.058 1.00 52.24 H new ATOM 0 HG21 VAL A 4 -14.874 -9.474 -10.555 1.00 65.14 H new ATOM 0 HG22 VAL A 4 -15.411 -9.345 -12.247 1.00 65.14 H new ATOM 0 HG23 VAL A 4 -15.983 -8.169 -11.040 1.00 65.14 H new ATOM 49 N LYS A 5 -19.933 -8.436 -10.826 1.00 12.30 N ATOM 50 CA LYS A 5 -20.697 -7.238 -10.468 1.00 14.02 C ATOM 51 C LYS A 5 -20.228 -6.730 -9.097 1.00 23.32 C ATOM 52 O LYS A 5 -20.562 -7.313 -8.060 1.00 11.21 O ATOM 53 CB LYS A 5 -22.211 -7.580 -10.477 1.00 61.32 C ATOM 54 CG LYS A 5 -22.700 -8.197 -11.809 1.00 44.02 C ATOM 55 CD LYS A 5 -24.218 -8.475 -11.839 1.00 24.02 C ATOM 56 CE LYS A 5 -24.667 -9.030 -13.205 1.00 25.32 C ATOM 57 NZ LYS A 5 -26.131 -9.272 -13.259 1.00 4.51 N ATOM 0 H LYS A 5 -20.394 -9.305 -10.556 1.00 12.30 H new ATOM 0 HA LYS A 5 -20.530 -6.441 -11.192 1.00 14.02 H new ATOM 0 HB2 LYS A 5 -22.422 -8.276 -9.665 1.00 61.32 H new ATOM 0 HB3 LYS A 5 -22.781 -6.673 -10.276 1.00 61.32 H new ATOM 0 HG2 LYS A 5 -22.446 -7.523 -12.627 1.00 44.02 H new ATOM 0 HG3 LYS A 5 -22.164 -9.130 -11.986 1.00 44.02 H new ATOM 0 HD2 LYS A 5 -24.473 -9.187 -11.055 1.00 24.02 H new ATOM 0 HD3 LYS A 5 -24.761 -7.555 -11.623 1.00 24.02 H new ATOM 0 HE2 LYS A 5 -24.388 -8.328 -13.990 1.00 25.32 H new ATOM 0 HE3 LYS A 5 -24.139 -9.962 -13.408 1.00 25.32 H new ATOM 0 HZ1 LYS A 5 -26.387 -9.645 -14.196 1.00 4.51 H new ATOM 0 HZ2 LYS A 5 -26.396 -9.962 -12.528 1.00 4.51 H new ATOM 0 HZ3 LYS A 5 -26.637 -8.379 -13.092 1.00 4.51 H new ATOM 71 N LEU A 6 -19.386 -5.688 -9.116 1.00 3.24 N ATOM 72 CA LEU A 6 -18.760 -5.119 -7.913 1.00 15.40 C ATOM 73 C LEU A 6 -19.353 -3.735 -7.629 1.00 33.01 C ATOM 74 O LEU A 6 -18.960 -2.750 -8.264 1.00 43.34 O ATOM 75 CB LEU A 6 -17.220 -5.031 -8.118 1.00 71.41 C ATOM 76 CG LEU A 6 -16.505 -6.375 -8.473 1.00 72.32 C ATOM 77 CD1 LEU A 6 -15.015 -6.146 -8.791 1.00 73.35 C ATOM 78 CD2 LEU A 6 -16.695 -7.425 -7.351 1.00 71.04 C ATOM 0 H LEU A 6 -19.117 -5.211 -9.976 1.00 3.24 H new ATOM 0 HA LEU A 6 -18.959 -5.762 -7.055 1.00 15.40 H new ATOM 0 HB2 LEU A 6 -17.018 -4.313 -8.913 1.00 71.41 H new ATOM 0 HB3 LEU A 6 -16.773 -4.633 -7.207 1.00 71.41 H new ATOM 0 HG LEU A 6 -16.972 -6.774 -9.373 1.00 72.32 H new ATOM 0 HD11 LEU A 6 -14.544 -7.099 -9.034 1.00 73.35 H new ATOM 0 HD12 LEU A 6 -14.924 -5.469 -9.640 1.00 73.35 H new ATOM 0 HD13 LEU A 6 -14.521 -5.708 -7.924 1.00 73.35 H new ATOM 0 HD21 LEU A 6 -16.186 -8.349 -7.627 1.00 71.04 H new ATOM 0 HD22 LEU A 6 -16.274 -7.043 -6.421 1.00 71.04 H new ATOM 0 HD23 LEU A 6 -17.758 -7.623 -7.214 1.00 71.04 H new ATOM 90 N GLU A 7 -20.322 -3.665 -6.703 1.00 24.44 N ATOM 91 CA GLU A 7 -20.957 -2.388 -6.331 1.00 52.25 C ATOM 92 C GLU A 7 -20.013 -1.575 -5.446 1.00 73.10 C ATOM 93 O GLU A 7 -19.183 -2.131 -4.724 1.00 0.42 O ATOM 94 CB GLU A 7 -22.317 -2.576 -5.606 1.00 23.34 C ATOM 95 CG GLU A 7 -23.413 -3.273 -6.434 1.00 71.21 C ATOM 96 CD GLU A 7 -23.097 -4.742 -6.773 1.00 44.52 C ATOM 97 OE1 GLU A 7 -22.925 -5.544 -5.829 1.00 74.44 O ATOM 98 OE2 GLU A 7 -23.036 -5.097 -7.970 1.00 34.34 O ATOM 0 H GLU A 7 -20.683 -4.475 -6.198 1.00 24.44 H new ATOM 0 HA GLU A 7 -21.159 -1.855 -7.260 1.00 52.25 H new ATOM 0 HB2 GLU A 7 -22.149 -3.154 -4.697 1.00 23.34 H new ATOM 0 HB3 GLU A 7 -22.684 -1.597 -5.298 1.00 23.34 H new ATOM 0 HG2 GLU A 7 -24.353 -3.231 -5.884 1.00 71.21 H new ATOM 0 HG3 GLU A 7 -23.562 -2.720 -7.361 1.00 71.21 H new ATOM 105 N SER A 8 -20.145 -0.261 -5.535 1.00 31.43 N ATOM 106 CA SER A 8 -19.398 0.680 -4.707 1.00 4.03 C ATOM 107 C SER A 8 -20.209 1.068 -3.459 1.00 50.03 C ATOM 108 O SER A 8 -21.326 0.578 -3.238 1.00 12.33 O ATOM 109 CB SER A 8 -19.079 1.911 -5.569 1.00 65.24 C ATOM 110 OG SER A 8 -20.255 2.430 -6.178 1.00 10.13 O ATOM 0 H SER A 8 -20.781 0.190 -6.192 1.00 31.43 H new ATOM 0 HA SER A 8 -18.472 0.225 -4.354 1.00 4.03 H new ATOM 0 HB2 SER A 8 -18.616 2.681 -4.952 1.00 65.24 H new ATOM 0 HB3 SER A 8 -18.356 1.642 -6.339 1.00 65.24 H new ATOM 0 HG SER A 8 -20.423 1.958 -7.020 1.00 10.13 H new ATOM 116 N SER A 9 -19.614 1.954 -2.647 1.00 51.13 N ATOM 117 CA SER A 9 -20.295 2.636 -1.535 1.00 24.11 C ATOM 118 C SER A 9 -21.433 3.534 -2.075 1.00 24.03 C ATOM 119 O SER A 9 -22.419 3.802 -1.386 1.00 15.24 O ATOM 120 CB SER A 9 -19.265 3.479 -0.746 1.00 71.10 C ATOM 121 OG SER A 9 -19.832 4.055 0.416 1.00 2.12 O ATOM 0 H SER A 9 -18.634 2.221 -2.745 1.00 51.13 H new ATOM 0 HA SER A 9 -20.735 1.894 -0.868 1.00 24.11 H new ATOM 0 HB2 SER A 9 -18.421 2.850 -0.464 1.00 71.10 H new ATOM 0 HB3 SER A 9 -18.874 4.268 -1.388 1.00 71.10 H new ATOM 0 HG SER A 9 -19.634 3.490 1.191 1.00 2.12 H new ATOM 127 N ASP A 10 -21.269 3.966 -3.342 1.00 51.43 N ATOM 128 CA ASP A 10 -22.243 4.797 -4.076 1.00 53.43 C ATOM 129 C ASP A 10 -23.223 3.906 -4.892 1.00 70.34 C ATOM 130 O ASP A 10 -23.969 4.393 -5.747 1.00 30.21 O ATOM 131 CB ASP A 10 -21.451 5.774 -4.976 1.00 2.33 C ATOM 132 CG ASP A 10 -22.317 6.821 -5.707 1.00 51.42 C ATOM 133 OD1 ASP A 10 -22.927 7.674 -5.036 1.00 23.12 O ATOM 134 OD2 ASP A 10 -22.378 6.804 -6.955 1.00 11.12 O ATOM 0 H ASP A 10 -20.440 3.742 -3.893 1.00 51.43 H new ATOM 0 HA ASP A 10 -22.859 5.370 -3.383 1.00 53.43 H new ATOM 0 HB2 ASP A 10 -20.714 6.295 -4.364 1.00 2.33 H new ATOM 0 HB3 ASP A 10 -20.899 5.197 -5.718 1.00 2.33 H new ATOM 139 N GLU A 11 -23.174 2.581 -4.624 1.00 13.21 N ATOM 140 CA GLU A 11 -24.185 1.590 -5.065 1.00 53.40 C ATOM 141 C GLU A 11 -24.094 1.261 -6.585 1.00 52.22 C ATOM 142 O GLU A 11 -24.829 0.400 -7.082 1.00 50.30 O ATOM 143 CB GLU A 11 -25.617 2.071 -4.635 1.00 44.25 C ATOM 144 CG GLU A 11 -26.751 1.036 -4.777 1.00 14.42 C ATOM 145 CD GLU A 11 -28.115 1.587 -4.332 1.00 43.42 C ATOM 146 OE1 GLU A 11 -28.579 1.253 -3.216 1.00 21.42 O ATOM 147 OE2 GLU A 11 -28.717 2.383 -5.084 1.00 31.43 O ATOM 0 H GLU A 11 -22.416 2.162 -4.085 1.00 13.21 H new ATOM 0 HA GLU A 11 -23.973 0.645 -4.564 1.00 53.40 H new ATOM 0 HB2 GLU A 11 -25.573 2.391 -3.594 1.00 44.25 H new ATOM 0 HB3 GLU A 11 -25.877 2.948 -5.228 1.00 44.25 H new ATOM 0 HG2 GLU A 11 -26.815 0.714 -5.816 1.00 14.42 H new ATOM 0 HG3 GLU A 11 -26.509 0.154 -4.184 1.00 14.42 H new ATOM 154 N LYS A 12 -23.155 1.907 -7.315 1.00 12.53 N ATOM 155 CA LYS A 12 -22.978 1.669 -8.765 1.00 73.14 C ATOM 156 C LYS A 12 -22.382 0.272 -9.018 1.00 15.42 C ATOM 157 O LYS A 12 -21.314 -0.047 -8.491 1.00 43.44 O ATOM 158 CB LYS A 12 -22.071 2.739 -9.418 1.00 25.35 C ATOM 159 CG LYS A 12 -22.653 4.168 -9.456 1.00 32.52 C ATOM 160 CD LYS A 12 -21.827 5.094 -10.384 1.00 13.04 C ATOM 161 CE LYS A 12 -22.325 6.541 -10.399 1.00 70.32 C ATOM 162 NZ LYS A 12 -21.470 7.400 -11.257 1.00 62.40 N ATOM 0 H LYS A 12 -22.511 2.595 -6.924 1.00 12.53 H new ATOM 0 HA LYS A 12 -23.966 1.733 -9.220 1.00 73.14 H new ATOM 0 HB2 LYS A 12 -21.124 2.765 -8.880 1.00 25.35 H new ATOM 0 HB3 LYS A 12 -21.849 2.428 -10.439 1.00 25.35 H new ATOM 0 HG2 LYS A 12 -23.686 4.132 -9.802 1.00 32.52 H new ATOM 0 HG3 LYS A 12 -22.669 4.582 -8.448 1.00 32.52 H new ATOM 0 HD2 LYS A 12 -20.785 5.080 -10.065 1.00 13.04 H new ATOM 0 HD3 LYS A 12 -21.855 4.697 -11.399 1.00 13.04 H new ATOM 0 HE2 LYS A 12 -23.352 6.570 -10.762 1.00 70.32 H new ATOM 0 HE3 LYS A 12 -22.335 6.934 -9.383 1.00 70.32 H new ATOM 0 HZ1 LYS A 12 -21.834 8.374 -11.246 1.00 62.40 H new ATOM 0 HZ2 LYS A 12 -20.495 7.391 -10.895 1.00 62.40 H new ATOM 0 HZ3 LYS A 12 -21.481 7.038 -12.232 1.00 62.40 H new ATOM 176 N VAL A 13 -23.090 -0.531 -9.829 1.00 71.03 N ATOM 177 CA VAL A 13 -22.680 -1.892 -10.218 1.00 50.12 C ATOM 178 C VAL A 13 -21.540 -1.828 -11.267 1.00 62.15 C ATOM 179 O VAL A 13 -21.778 -1.450 -12.423 1.00 53.21 O ATOM 180 CB VAL A 13 -23.911 -2.686 -10.816 1.00 24.04 C ATOM 181 CG1 VAL A 13 -23.537 -4.140 -11.183 1.00 64.33 C ATOM 182 CG2 VAL A 13 -25.125 -2.642 -9.851 1.00 45.50 C ATOM 0 H VAL A 13 -23.979 -0.248 -10.241 1.00 71.03 H new ATOM 0 HA VAL A 13 -22.320 -2.412 -9.330 1.00 50.12 H new ATOM 0 HB VAL A 13 -24.199 -2.188 -11.742 1.00 24.04 H new ATOM 0 HG11 VAL A 13 -24.411 -4.649 -11.590 1.00 64.33 H new ATOM 0 HG12 VAL A 13 -22.741 -4.134 -11.928 1.00 64.33 H new ATOM 0 HG13 VAL A 13 -23.195 -4.664 -10.291 1.00 64.33 H new ATOM 0 HG21 VAL A 13 -25.957 -3.195 -10.287 1.00 45.50 H new ATOM 0 HG22 VAL A 13 -24.849 -3.093 -8.898 1.00 45.50 H new ATOM 0 HG23 VAL A 13 -25.424 -1.606 -9.689 1.00 45.50 H new ATOM 192 N PHE A 14 -20.304 -2.162 -10.859 1.00 73.45 N ATOM 193 CA PHE A 14 -19.134 -2.161 -11.762 1.00 75.12 C ATOM 194 C PHE A 14 -18.840 -3.584 -12.240 1.00 64.41 C ATOM 195 O PHE A 14 -18.144 -4.360 -11.576 1.00 1.13 O ATOM 196 CB PHE A 14 -17.903 -1.522 -11.071 1.00 11.24 C ATOM 197 CG PHE A 14 -18.105 -0.039 -10.783 1.00 51.35 C ATOM 198 CD1 PHE A 14 -18.212 0.871 -11.837 1.00 3.31 C ATOM 199 CD2 PHE A 14 -18.215 0.446 -9.482 1.00 45.13 C ATOM 200 CE1 PHE A 14 -18.422 2.210 -11.594 1.00 42.32 C ATOM 201 CE2 PHE A 14 -18.419 1.790 -9.245 1.00 0.14 C ATOM 202 CZ PHE A 14 -18.524 2.669 -10.302 1.00 15.54 C ATOM 0 H PHE A 14 -20.086 -2.439 -9.902 1.00 73.45 H new ATOM 0 HA PHE A 14 -19.363 -1.552 -12.636 1.00 75.12 H new ATOM 0 HB2 PHE A 14 -17.700 -2.047 -10.137 1.00 11.24 H new ATOM 0 HB3 PHE A 14 -17.026 -1.650 -11.705 1.00 11.24 H new ATOM 0 HD1 PHE A 14 -18.129 0.520 -12.855 1.00 3.31 H new ATOM 0 HD2 PHE A 14 -18.140 -0.238 -8.649 1.00 45.13 H new ATOM 0 HE1 PHE A 14 -18.507 2.901 -12.420 1.00 42.32 H new ATOM 0 HE2 PHE A 14 -18.496 2.154 -8.231 1.00 0.14 H new ATOM 0 HZ PHE A 14 -18.687 3.720 -10.115 1.00 15.54 H new ATOM 212 N GLU A 15 -19.427 -3.915 -13.394 1.00 61.15 N ATOM 213 CA GLU A 15 -19.275 -5.215 -14.040 1.00 55.03 C ATOM 214 C GLU A 15 -17.968 -5.232 -14.849 1.00 54.22 C ATOM 215 O GLU A 15 -17.921 -4.741 -15.985 1.00 25.20 O ATOM 216 CB GLU A 15 -20.499 -5.490 -14.939 1.00 51.13 C ATOM 217 CG GLU A 15 -21.849 -5.354 -14.224 1.00 63.33 C ATOM 218 CD GLU A 15 -23.046 -5.609 -15.149 1.00 43.44 C ATOM 219 OE1 GLU A 15 -23.352 -6.786 -15.428 1.00 34.44 O ATOM 220 OE2 GLU A 15 -23.673 -4.629 -15.617 1.00 71.32 O ATOM 0 H GLU A 15 -20.030 -3.275 -13.911 1.00 61.15 H new ATOM 0 HA GLU A 15 -19.222 -6.004 -13.290 1.00 55.03 H new ATOM 0 HB2 GLU A 15 -20.477 -4.801 -15.784 1.00 51.13 H new ATOM 0 HB3 GLU A 15 -20.417 -6.497 -15.347 1.00 51.13 H new ATOM 0 HG2 GLU A 15 -21.885 -6.056 -13.391 1.00 63.33 H new ATOM 0 HG3 GLU A 15 -21.931 -4.353 -13.801 1.00 63.33 H new ATOM 227 N ILE A 16 -16.900 -5.734 -14.227 1.00 34.11 N ATOM 228 CA ILE A 16 -15.563 -5.827 -14.847 1.00 74.32 C ATOM 229 C ILE A 16 -15.209 -7.305 -15.088 1.00 33.10 C ATOM 230 O ILE A 16 -15.756 -8.188 -14.421 1.00 2.01 O ATOM 231 CB ILE A 16 -14.475 -5.120 -13.941 1.00 21.02 C ATOM 232 CG1 ILE A 16 -13.077 -5.098 -14.646 1.00 73.34 C ATOM 233 CG2 ILE A 16 -14.396 -5.773 -12.538 1.00 72.14 C ATOM 234 CD1 ILE A 16 -11.974 -4.411 -13.869 1.00 62.10 C ATOM 0 H ILE A 16 -16.931 -6.092 -13.272 1.00 34.11 H new ATOM 0 HA ILE A 16 -15.577 -5.310 -15.806 1.00 74.32 H new ATOM 0 HB ILE A 16 -14.786 -4.085 -13.799 1.00 21.02 H new ATOM 0 HG12 ILE A 16 -12.773 -6.125 -14.846 1.00 73.34 H new ATOM 0 HG13 ILE A 16 -13.182 -4.603 -15.611 1.00 73.34 H new ATOM 0 HG21 ILE A 16 -13.639 -5.263 -11.942 1.00 72.14 H new ATOM 0 HG22 ILE A 16 -15.364 -5.691 -12.043 1.00 72.14 H new ATOM 0 HG23 ILE A 16 -14.129 -6.825 -12.641 1.00 72.14 H new ATOM 0 HD11 ILE A 16 -11.047 -4.449 -14.442 1.00 62.10 H new ATOM 0 HD12 ILE A 16 -12.248 -3.371 -13.691 1.00 62.10 H new ATOM 0 HD13 ILE A 16 -11.832 -4.917 -12.914 1.00 62.10 H new ATOM 246 N GLU A 17 -14.317 -7.558 -16.067 1.00 63.45 N ATOM 247 CA GLU A 17 -13.816 -8.903 -16.388 1.00 35.13 C ATOM 248 C GLU A 17 -13.180 -9.530 -15.128 1.00 61.32 C ATOM 249 O GLU A 17 -12.337 -8.897 -14.471 1.00 74.11 O ATOM 250 CB GLU A 17 -12.778 -8.855 -17.549 1.00 34.54 C ATOM 251 CG GLU A 17 -13.303 -8.362 -18.925 1.00 51.12 C ATOM 252 CD GLU A 17 -13.725 -6.875 -18.994 1.00 22.02 C ATOM 253 OE1 GLU A 17 -14.786 -6.569 -19.578 1.00 60.10 O ATOM 254 OE2 GLU A 17 -12.996 -6.007 -18.470 1.00 53.15 O ATOM 0 H GLU A 17 -13.923 -6.827 -16.659 1.00 63.45 H new ATOM 0 HA GLU A 17 -14.655 -9.517 -16.717 1.00 35.13 H new ATOM 0 HB2 GLU A 17 -11.955 -8.207 -17.245 1.00 34.54 H new ATOM 0 HB3 GLU A 17 -12.365 -9.855 -17.679 1.00 34.54 H new ATOM 0 HG2 GLU A 17 -12.527 -8.534 -19.671 1.00 51.12 H new ATOM 0 HG3 GLU A 17 -14.158 -8.976 -19.207 1.00 51.12 H new ATOM 261 N LYS A 18 -13.607 -10.766 -14.812 1.00 1.34 N ATOM 262 CA LYS A 18 -13.205 -11.489 -13.591 1.00 54.05 C ATOM 263 C LYS A 18 -11.679 -11.680 -13.516 1.00 3.41 C ATOM 264 O LYS A 18 -11.085 -11.545 -12.445 1.00 61.34 O ATOM 265 CB LYS A 18 -13.930 -12.857 -13.527 1.00 31.42 C ATOM 266 CG LYS A 18 -13.643 -13.684 -12.245 1.00 53.31 C ATOM 267 CD LYS A 18 -14.409 -15.031 -12.208 1.00 2.15 C ATOM 268 CE LYS A 18 -14.011 -15.977 -13.356 1.00 32.02 C ATOM 269 NZ LYS A 18 -14.756 -17.262 -13.303 1.00 22.32 N ATOM 0 H LYS A 18 -14.247 -11.297 -15.403 1.00 1.34 H new ATOM 0 HA LYS A 18 -13.497 -10.887 -12.731 1.00 54.05 H new ATOM 0 HB2 LYS A 18 -15.004 -12.687 -13.601 1.00 31.42 H new ATOM 0 HB3 LYS A 18 -13.640 -13.447 -14.396 1.00 31.42 H new ATOM 0 HG2 LYS A 18 -12.573 -13.879 -12.177 1.00 53.31 H new ATOM 0 HG3 LYS A 18 -13.915 -13.094 -11.370 1.00 53.31 H new ATOM 0 HD2 LYS A 18 -14.220 -15.525 -11.255 1.00 2.15 H new ATOM 0 HD3 LYS A 18 -15.480 -14.836 -12.259 1.00 2.15 H new ATOM 0 HE2 LYS A 18 -14.200 -15.487 -14.311 1.00 32.02 H new ATOM 0 HE3 LYS A 18 -12.941 -16.176 -13.307 1.00 32.02 H new ATOM 0 HZ1 LYS A 18 -14.458 -17.869 -14.093 1.00 22.32 H new ATOM 0 HZ2 LYS A 18 -14.556 -17.742 -12.403 1.00 22.32 H new ATOM 0 HZ3 LYS A 18 -15.776 -17.075 -13.376 1.00 22.32 H new ATOM 283 N GLU A 19 -11.070 -11.944 -14.685 1.00 3.53 N ATOM 284 CA GLU A 19 -9.609 -12.136 -14.832 1.00 22.34 C ATOM 285 C GLU A 19 -8.809 -10.900 -14.348 1.00 35.14 C ATOM 286 O GLU A 19 -7.698 -11.032 -13.822 1.00 53.41 O ATOM 287 CB GLU A 19 -9.279 -12.454 -16.315 1.00 70.25 C ATOM 288 CG GLU A 19 -9.721 -11.364 -17.318 1.00 12.11 C ATOM 289 CD GLU A 19 -9.567 -11.793 -18.787 1.00 63.00 C ATOM 290 OE1 GLU A 19 -10.554 -12.284 -19.383 1.00 63.11 O ATOM 291 OE2 GLU A 19 -8.458 -11.644 -19.347 1.00 43.33 O ATOM 0 H GLU A 19 -11.579 -12.032 -15.565 1.00 3.53 H new ATOM 0 HA GLU A 19 -9.310 -12.973 -14.201 1.00 22.34 H new ATOM 0 HB2 GLU A 19 -8.204 -12.603 -16.411 1.00 70.25 H new ATOM 0 HB3 GLU A 19 -9.757 -13.395 -16.587 1.00 70.25 H new ATOM 0 HG2 GLU A 19 -10.763 -11.107 -17.129 1.00 12.11 H new ATOM 0 HG3 GLU A 19 -9.134 -10.462 -17.146 1.00 12.11 H new ATOM 298 N ILE A 20 -9.399 -9.711 -14.532 1.00 20.23 N ATOM 299 CA ILE A 20 -8.801 -8.429 -14.125 1.00 30.33 C ATOM 300 C ILE A 20 -9.023 -8.190 -12.621 1.00 44.45 C ATOM 301 O ILE A 20 -8.128 -7.708 -11.916 1.00 21.23 O ATOM 302 CB ILE A 20 -9.418 -7.254 -14.963 1.00 54.32 C ATOM 303 CG1 ILE A 20 -9.285 -7.544 -16.494 1.00 64.12 C ATOM 304 CG2 ILE A 20 -8.762 -5.910 -14.588 1.00 34.44 C ATOM 305 CD1 ILE A 20 -9.871 -6.487 -17.412 1.00 21.32 C ATOM 0 H ILE A 20 -10.314 -9.610 -14.972 1.00 20.23 H new ATOM 0 HA ILE A 20 -7.728 -8.466 -14.315 1.00 30.33 H new ATOM 0 HB ILE A 20 -10.479 -7.181 -14.726 1.00 54.32 H new ATOM 0 HG12 ILE A 20 -8.228 -7.663 -16.733 1.00 64.12 H new ATOM 0 HG13 ILE A 20 -9.769 -8.496 -16.709 1.00 64.12 H new ATOM 0 HG21 ILE A 20 -9.206 -5.111 -15.181 1.00 34.44 H new ATOM 0 HG22 ILE A 20 -8.924 -5.709 -13.529 1.00 34.44 H new ATOM 0 HG23 ILE A 20 -7.692 -5.959 -14.788 1.00 34.44 H new ATOM 0 HD11 ILE A 20 -9.726 -6.786 -18.450 1.00 21.32 H new ATOM 0 HD12 ILE A 20 -10.937 -6.381 -17.211 1.00 21.32 H new ATOM 0 HD13 ILE A 20 -9.372 -5.534 -17.235 1.00 21.32 H new ATOM 317 N ALA A 21 -10.228 -8.547 -12.142 1.00 43.01 N ATOM 318 CA ALA A 21 -10.593 -8.455 -10.714 1.00 63.42 C ATOM 319 C ALA A 21 -9.759 -9.425 -9.843 1.00 23.13 C ATOM 320 O ALA A 21 -9.633 -9.232 -8.631 1.00 43.34 O ATOM 321 CB ALA A 21 -12.096 -8.721 -10.545 1.00 43.24 C ATOM 0 H ALA A 21 -10.977 -8.908 -12.733 1.00 43.01 H new ATOM 0 HA ALA A 21 -10.367 -7.446 -10.370 1.00 63.42 H new ATOM 0 HB1 ALA A 21 -12.361 -8.652 -9.490 1.00 43.24 H new ATOM 0 HB2 ALA A 21 -12.662 -7.981 -11.111 1.00 43.24 H new ATOM 0 HB3 ALA A 21 -12.333 -9.719 -10.914 1.00 43.24 H new ATOM 327 N CYS A 22 -9.191 -10.465 -10.488 1.00 13.44 N ATOM 328 CA CYS A 22 -8.277 -11.421 -9.839 1.00 74.01 C ATOM 329 C CYS A 22 -6.918 -10.780 -9.483 1.00 31.15 C ATOM 330 O CYS A 22 -6.228 -11.273 -8.595 1.00 23.12 O ATOM 331 CB CYS A 22 -8.061 -12.647 -10.745 1.00 51.14 C ATOM 332 SG CYS A 22 -9.566 -13.591 -11.052 1.00 33.51 S ATOM 0 H CYS A 22 -9.355 -10.664 -11.475 1.00 13.44 H new ATOM 0 HA CYS A 22 -8.745 -11.734 -8.906 1.00 74.01 H new ATOM 0 HB2 CYS A 22 -7.649 -12.316 -11.698 1.00 51.14 H new ATOM 0 HB3 CYS A 22 -7.319 -13.301 -10.287 1.00 51.14 H new ATOM 0 HG CYS A 22 -10.307 -12.959 -11.913 1.00 33.51 H new ATOM 338 N MET A 23 -6.535 -9.694 -10.193 1.00 64.02 N ATOM 339 CA MET A 23 -5.262 -8.979 -9.928 1.00 63.20 C ATOM 340 C MET A 23 -5.327 -8.248 -8.575 1.00 10.25 C ATOM 341 O MET A 23 -4.305 -8.091 -7.890 1.00 52.13 O ATOM 342 CB MET A 23 -4.921 -7.987 -11.059 1.00 63.10 C ATOM 343 CG MET A 23 -4.901 -8.587 -12.477 1.00 71.51 C ATOM 344 SD MET A 23 -4.016 -7.549 -13.671 1.00 32.42 S ATOM 345 CE MET A 23 -4.531 -5.897 -13.192 1.00 3.12 C ATOM 0 H MET A 23 -7.086 -9.293 -10.952 1.00 64.02 H new ATOM 0 HA MET A 23 -4.467 -9.724 -9.890 1.00 63.20 H new ATOM 0 HB2 MET A 23 -5.646 -7.173 -11.037 1.00 63.10 H new ATOM 0 HB3 MET A 23 -3.944 -7.549 -10.854 1.00 63.10 H new ATOM 0 HG2 MET A 23 -4.434 -9.571 -12.443 1.00 71.51 H new ATOM 0 HG3 MET A 23 -5.926 -8.732 -12.819 1.00 71.51 H new ATOM 0 HE1 MET A 23 -4.145 -5.173 -13.910 1.00 3.12 H new ATOM 0 HE2 MET A 23 -5.620 -5.846 -13.175 1.00 3.12 H new ATOM 0 HE3 MET A 23 -4.141 -5.668 -12.200 1.00 3.12 H new ATOM 355 N SER A 24 -6.541 -7.801 -8.209 1.00 3.41 N ATOM 356 CA SER A 24 -6.848 -7.394 -6.839 1.00 65.44 C ATOM 357 C SER A 24 -6.790 -8.636 -5.945 1.00 2.51 C ATOM 358 O SER A 24 -7.623 -9.539 -6.094 1.00 33.51 O ATOM 359 CB SER A 24 -8.252 -6.777 -6.751 1.00 10.12 C ATOM 360 OG SER A 24 -8.370 -5.612 -7.515 1.00 2.33 O ATOM 0 H SER A 24 -7.327 -7.714 -8.853 1.00 3.41 H new ATOM 0 HA SER A 24 -6.124 -6.646 -6.517 1.00 65.44 H new ATOM 0 HB2 SER A 24 -8.988 -7.506 -7.089 1.00 10.12 H new ATOM 0 HB3 SER A 24 -8.482 -6.551 -5.710 1.00 10.12 H new ATOM 0 HG SER A 24 -9.135 -5.089 -7.197 1.00 2.33 H new ATOM 366 N VAL A 25 -5.801 -8.679 -5.044 1.00 5.31 N ATOM 367 CA VAL A 25 -5.620 -9.799 -4.110 1.00 23.52 C ATOM 368 C VAL A 25 -6.857 -9.953 -3.199 1.00 41.20 C ATOM 369 O VAL A 25 -7.255 -11.066 -2.889 1.00 55.33 O ATOM 370 CB VAL A 25 -4.307 -9.621 -3.259 1.00 24.21 C ATOM 371 CG1 VAL A 25 -4.089 -10.791 -2.260 1.00 55.52 C ATOM 372 CG2 VAL A 25 -3.077 -9.442 -4.191 1.00 4.31 C ATOM 0 H VAL A 25 -5.105 -7.941 -4.941 1.00 5.31 H new ATOM 0 HA VAL A 25 -5.513 -10.713 -4.694 1.00 23.52 H new ATOM 0 HB VAL A 25 -4.425 -8.718 -2.661 1.00 24.21 H new ATOM 0 HG11 VAL A 25 -3.171 -10.622 -1.697 1.00 55.52 H new ATOM 0 HG12 VAL A 25 -4.933 -10.844 -1.572 1.00 55.52 H new ATOM 0 HG13 VAL A 25 -4.010 -11.729 -2.810 1.00 55.52 H new ATOM 0 HG21 VAL A 25 -2.178 -9.320 -3.587 1.00 4.31 H new ATOM 0 HG22 VAL A 25 -2.971 -10.321 -4.827 1.00 4.31 H new ATOM 0 HG23 VAL A 25 -3.218 -8.559 -4.814 1.00 4.31 H new ATOM 382 N THR A 26 -7.497 -8.820 -2.853 1.00 30.01 N ATOM 383 CA THR A 26 -8.687 -8.802 -1.979 1.00 42.14 C ATOM 384 C THR A 26 -9.908 -9.462 -2.665 1.00 50.22 C ATOM 385 O THR A 26 -10.522 -10.371 -2.091 1.00 72.14 O ATOM 386 CB THR A 26 -9.015 -7.340 -1.544 1.00 71.02 C ATOM 387 OG1 THR A 26 -7.909 -6.822 -0.790 1.00 62.42 O ATOM 388 CG2 THR A 26 -10.299 -7.218 -0.705 1.00 1.13 C ATOM 0 H THR A 26 -7.206 -7.895 -3.169 1.00 30.01 H new ATOM 0 HA THR A 26 -8.460 -9.389 -1.089 1.00 42.14 H new ATOM 0 HB THR A 26 -9.184 -6.768 -2.456 1.00 71.02 H new ATOM 0 HG1 THR A 26 -8.246 -6.306 -0.028 1.00 62.42 H new ATOM 0 HG21 THR A 26 -10.462 -6.174 -0.440 1.00 1.13 H new ATOM 0 HG22 THR A 26 -11.148 -7.582 -1.284 1.00 1.13 H new ATOM 0 HG23 THR A 26 -10.198 -7.812 0.204 1.00 1.13 H new ATOM 396 N ILE A 27 -10.220 -9.027 -3.904 1.00 71.24 N ATOM 397 CA ILE A 27 -11.386 -9.536 -4.665 1.00 50.34 C ATOM 398 C ILE A 27 -11.186 -11.029 -5.001 1.00 64.31 C ATOM 399 O ILE A 27 -12.112 -11.833 -4.852 1.00 25.41 O ATOM 400 CB ILE A 27 -11.621 -8.718 -5.991 1.00 33.12 C ATOM 401 CG1 ILE A 27 -11.810 -7.196 -5.683 1.00 43.34 C ATOM 402 CG2 ILE A 27 -12.831 -9.272 -6.797 1.00 24.22 C ATOM 403 CD1 ILE A 27 -11.860 -6.309 -6.920 1.00 51.24 C ATOM 0 H ILE A 27 -9.679 -8.321 -4.403 1.00 71.24 H new ATOM 0 HA ILE A 27 -12.269 -9.415 -4.037 1.00 50.34 H new ATOM 0 HB ILE A 27 -10.731 -8.834 -6.609 1.00 33.12 H new ATOM 0 HG12 ILE A 27 -12.732 -7.063 -5.117 1.00 43.34 H new ATOM 0 HG13 ILE A 27 -10.993 -6.862 -5.043 1.00 43.34 H new ATOM 0 HG21 ILE A 27 -12.963 -8.684 -7.705 1.00 24.22 H new ATOM 0 HG22 ILE A 27 -12.645 -10.313 -7.063 1.00 24.22 H new ATOM 0 HG23 ILE A 27 -13.733 -9.208 -6.189 1.00 24.22 H new ATOM 0 HD11 ILE A 27 -11.993 -5.270 -6.618 1.00 51.24 H new ATOM 0 HD12 ILE A 27 -10.928 -6.408 -7.477 1.00 51.24 H new ATOM 0 HD13 ILE A 27 -12.695 -6.613 -7.552 1.00 51.24 H new ATOM 415 N LYS A 28 -9.951 -11.372 -5.428 1.00 44.42 N ATOM 416 CA LYS A 28 -9.546 -12.754 -5.753 1.00 54.14 C ATOM 417 C LYS A 28 -9.751 -13.682 -4.541 1.00 13.25 C ATOM 418 O LYS A 28 -10.406 -14.720 -4.650 1.00 51.51 O ATOM 419 CB LYS A 28 -8.055 -12.779 -6.184 1.00 42.33 C ATOM 420 CG LYS A 28 -7.526 -14.167 -6.617 1.00 15.33 C ATOM 421 CD LYS A 28 -6.002 -14.172 -6.890 1.00 52.44 C ATOM 422 CE LYS A 28 -5.162 -13.825 -5.644 1.00 61.22 C ATOM 423 NZ LYS A 28 -5.350 -14.802 -4.540 1.00 41.10 N ATOM 0 H LYS A 28 -9.203 -10.691 -5.557 1.00 44.42 H new ATOM 0 HA LYS A 28 -10.168 -13.111 -6.574 1.00 54.14 H new ATOM 0 HB2 LYS A 28 -7.919 -12.081 -7.010 1.00 42.33 H new ATOM 0 HB3 LYS A 28 -7.446 -12.416 -5.356 1.00 42.33 H new ATOM 0 HG2 LYS A 28 -7.753 -14.896 -5.839 1.00 15.33 H new ATOM 0 HG3 LYS A 28 -8.052 -14.487 -7.516 1.00 15.33 H new ATOM 0 HD2 LYS A 28 -5.708 -15.156 -7.256 1.00 52.44 H new ATOM 0 HD3 LYS A 28 -5.779 -13.457 -7.682 1.00 52.44 H new ATOM 0 HE2 LYS A 28 -4.108 -13.791 -5.919 1.00 61.22 H new ATOM 0 HE3 LYS A 28 -5.433 -12.829 -5.293 1.00 61.22 H new ATOM 0 HZ1 LYS A 28 -5.705 -14.308 -3.696 1.00 41.10 H new ATOM 0 HZ2 LYS A 28 -6.036 -15.527 -4.831 1.00 41.10 H new ATOM 0 HZ3 LYS A 28 -4.440 -15.255 -4.319 1.00 41.10 H new ATOM 437 N ASN A 29 -9.217 -13.251 -3.380 1.00 12.45 N ATOM 438 CA ASN A 29 -9.307 -14.002 -2.109 1.00 71.23 C ATOM 439 C ASN A 29 -10.761 -14.151 -1.643 1.00 42.33 C ATOM 440 O ASN A 29 -11.077 -15.114 -0.970 1.00 34.25 O ATOM 441 CB ASN A 29 -8.445 -13.333 -0.992 1.00 22.05 C ATOM 442 CG ASN A 29 -6.931 -13.569 -1.142 1.00 73.21 C ATOM 443 OD1 ASN A 29 -6.416 -13.785 -2.241 1.00 22.13 O ATOM 444 ND2 ASN A 29 -6.200 -13.499 -0.036 1.00 64.51 N ATOM 0 H ASN A 29 -8.710 -12.370 -3.296 1.00 12.45 H new ATOM 0 HA ASN A 29 -8.909 -14.999 -2.299 1.00 71.23 H new ATOM 0 HB2 ASN A 29 -8.637 -12.260 -0.993 1.00 22.05 H new ATOM 0 HB3 ASN A 29 -8.767 -13.713 -0.023 1.00 22.05 H new ATOM 0 HD21 ASN A 29 -5.189 -13.625 -0.084 1.00 64.51 H new ATOM 0 HD22 ASN A 29 -6.649 -13.319 0.862 1.00 64.51 H new ATOM 451 N MET A 30 -11.635 -13.188 -1.997 1.00 63.01 N ATOM 452 CA MET A 30 -13.083 -13.283 -1.701 1.00 2.11 C ATOM 453 C MET A 30 -13.737 -14.401 -2.537 1.00 3.41 C ATOM 454 O MET A 30 -14.494 -15.213 -2.006 1.00 62.53 O ATOM 455 CB MET A 30 -13.808 -11.925 -1.943 1.00 2.44 C ATOM 456 CG MET A 30 -13.497 -10.846 -0.897 1.00 22.01 C ATOM 457 SD MET A 30 -14.379 -9.300 -1.214 1.00 0.24 S ATOM 458 CE MET A 30 -13.873 -8.305 0.190 1.00 34.12 C ATOM 0 H MET A 30 -11.366 -12.335 -2.488 1.00 63.01 H new ATOM 0 HA MET A 30 -13.187 -13.531 -0.645 1.00 2.11 H new ATOM 0 HB2 MET A 30 -13.531 -11.550 -2.928 1.00 2.44 H new ATOM 0 HB3 MET A 30 -14.884 -12.099 -1.959 1.00 2.44 H new ATOM 0 HG2 MET A 30 -13.764 -11.216 0.093 1.00 22.01 H new ATOM 0 HG3 MET A 30 -12.424 -10.653 -0.887 1.00 22.01 H new ATOM 0 HE1 MET A 30 -14.269 -7.295 0.082 1.00 34.12 H new ATOM 0 HE2 MET A 30 -14.258 -8.749 1.108 1.00 34.12 H new ATOM 0 HE3 MET A 30 -12.785 -8.265 0.234 1.00 34.12 H new ATOM 468 N ILE A 31 -13.408 -14.448 -3.841 1.00 2.50 N ATOM 469 CA ILE A 31 -13.946 -15.468 -4.773 1.00 41.15 C ATOM 470 C ILE A 31 -13.452 -16.878 -4.367 1.00 12.42 C ATOM 471 O ILE A 31 -14.177 -17.863 -4.490 1.00 22.14 O ATOM 472 CB ILE A 31 -13.535 -15.156 -6.270 1.00 21.25 C ATOM 473 CG1 ILE A 31 -14.000 -13.718 -6.686 1.00 3.33 C ATOM 474 CG2 ILE A 31 -14.110 -16.223 -7.244 1.00 62.31 C ATOM 475 CD1 ILE A 31 -13.548 -13.270 -8.071 1.00 3.51 C ATOM 0 H ILE A 31 -12.767 -13.787 -4.280 1.00 2.50 H new ATOM 0 HA ILE A 31 -15.034 -15.438 -4.710 1.00 41.15 H new ATOM 0 HB ILE A 31 -12.448 -15.196 -6.333 1.00 21.25 H new ATOM 0 HG12 ILE A 31 -15.089 -13.679 -6.645 1.00 3.33 H new ATOM 0 HG13 ILE A 31 -13.627 -13.005 -5.950 1.00 3.33 H new ATOM 0 HG21 ILE A 31 -13.812 -15.983 -8.264 1.00 62.31 H new ATOM 0 HG22 ILE A 31 -13.724 -17.206 -6.975 1.00 62.31 H new ATOM 0 HG23 ILE A 31 -15.198 -16.229 -7.176 1.00 62.31 H new ATOM 0 HD11 ILE A 31 -13.919 -12.264 -8.267 1.00 3.51 H new ATOM 0 HD12 ILE A 31 -12.459 -13.271 -8.116 1.00 3.51 H new ATOM 0 HD13 ILE A 31 -13.943 -13.955 -8.822 1.00 3.51 H new ATOM 487 N GLU A 32 -12.211 -16.953 -3.874 1.00 20.44 N ATOM 488 CA GLU A 32 -11.589 -18.222 -3.455 1.00 3.15 C ATOM 489 C GLU A 32 -12.106 -18.700 -2.076 1.00 24.13 C ATOM 490 O GLU A 32 -12.445 -19.879 -1.916 1.00 44.15 O ATOM 491 CB GLU A 32 -10.051 -18.071 -3.446 1.00 71.52 C ATOM 492 CG GLU A 32 -9.445 -17.761 -4.833 1.00 23.31 C ATOM 493 CD GLU A 32 -7.933 -17.508 -4.785 1.00 13.10 C ATOM 494 OE1 GLU A 32 -7.149 -18.259 -5.422 1.00 60.35 O ATOM 495 OE2 GLU A 32 -7.516 -16.563 -4.083 1.00 12.52 O ATOM 0 H GLU A 32 -11.607 -16.140 -3.753 1.00 20.44 H new ATOM 0 HA GLU A 32 -11.871 -18.988 -4.177 1.00 3.15 H new ATOM 0 HB2 GLU A 32 -9.778 -17.274 -2.755 1.00 71.52 H new ATOM 0 HB3 GLU A 32 -9.608 -18.990 -3.064 1.00 71.52 H new ATOM 0 HG2 GLU A 32 -9.647 -18.594 -5.506 1.00 23.31 H new ATOM 0 HG3 GLU A 32 -9.941 -16.886 -5.252 1.00 23.31 H new ATOM 502 N ASP A 33 -12.184 -17.769 -1.100 1.00 32.33 N ATOM 503 CA ASP A 33 -12.478 -18.097 0.325 1.00 42.32 C ATOM 504 C ASP A 33 -13.977 -18.340 0.559 1.00 11.41 C ATOM 505 O ASP A 33 -14.362 -19.307 1.223 1.00 51.13 O ATOM 506 CB ASP A 33 -11.978 -16.952 1.252 1.00 44.30 C ATOM 507 CG ASP A 33 -12.179 -17.239 2.752 1.00 22.11 C ATOM 508 OD1 ASP A 33 -13.175 -16.770 3.345 1.00 71.32 O ATOM 509 OD2 ASP A 33 -11.332 -17.937 3.350 1.00 24.42 O ATOM 0 H ASP A 33 -12.047 -16.773 -1.269 1.00 32.33 H new ATOM 0 HA ASP A 33 -11.949 -19.020 0.565 1.00 42.32 H new ATOM 0 HB2 ASP A 33 -10.919 -16.779 1.063 1.00 44.30 H new ATOM 0 HB3 ASP A 33 -12.502 -16.032 0.994 1.00 44.30 H new ATOM 514 N ILE A 34 -14.812 -17.442 0.018 1.00 60.22 N ATOM 515 CA ILE A 34 -16.286 -17.549 0.103 1.00 23.22 C ATOM 516 C ILE A 34 -16.778 -18.648 -0.858 1.00 24.34 C ATOM 517 O ILE A 34 -17.721 -19.396 -0.558 1.00 72.50 O ATOM 518 CB ILE A 34 -16.963 -16.164 -0.244 1.00 1.22 C ATOM 519 CG1 ILE A 34 -16.413 -15.044 0.705 1.00 31.13 C ATOM 520 CG2 ILE A 34 -18.510 -16.247 -0.176 1.00 3.42 C ATOM 521 CD1 ILE A 34 -16.886 -13.637 0.380 1.00 74.32 C ATOM 0 H ILE A 34 -14.491 -16.619 -0.492 1.00 60.22 H new ATOM 0 HA ILE A 34 -16.566 -17.815 1.122 1.00 23.22 H new ATOM 0 HB ILE A 34 -16.705 -15.909 -1.272 1.00 1.22 H new ATOM 0 HG12 ILE A 34 -16.703 -15.281 1.729 1.00 31.13 H new ATOM 0 HG13 ILE A 34 -15.324 -15.062 0.670 1.00 31.13 H new ATOM 0 HG21 ILE A 34 -18.938 -15.275 -0.421 1.00 3.42 H new ATOM 0 HG22 ILE A 34 -18.866 -16.990 -0.889 1.00 3.42 H new ATOM 0 HG23 ILE A 34 -18.815 -16.534 0.830 1.00 3.42 H new ATOM 0 HD11 ILE A 34 -16.452 -12.934 1.091 1.00 74.32 H new ATOM 0 HD12 ILE A 34 -16.572 -13.372 -0.630 1.00 74.32 H new ATOM 0 HD13 ILE A 34 -17.973 -13.595 0.445 1.00 74.32 H new ATOM 533 N GLY A 35 -16.085 -18.757 -2.000 1.00 24.20 N ATOM 534 CA GLY A 35 -16.441 -19.701 -3.058 1.00 2.04 C ATOM 535 C GLY A 35 -17.002 -18.987 -4.272 1.00 45.24 C ATOM 536 O GLY A 35 -17.115 -17.746 -4.273 1.00 33.22 O ATOM 0 H GLY A 35 -15.263 -18.192 -2.212 1.00 24.20 H new ATOM 0 HA2 GLY A 35 -15.561 -20.275 -3.347 1.00 2.04 H new ATOM 0 HA3 GLY A 35 -17.176 -20.412 -2.681 1.00 2.04 H new ATOM 540 N GLU A 36 -17.338 -19.767 -5.312 1.00 75.11 N ATOM 541 CA GLU A 36 -17.916 -19.245 -6.557 1.00 15.41 C ATOM 542 C GLU A 36 -19.320 -18.678 -6.283 1.00 61.20 C ATOM 543 O GLU A 36 -20.324 -19.400 -6.313 1.00 41.10 O ATOM 544 CB GLU A 36 -17.950 -20.348 -7.649 1.00 53.43 C ATOM 545 CG GLU A 36 -16.569 -20.908 -8.027 1.00 43.13 C ATOM 546 CD GLU A 36 -16.644 -21.964 -9.140 1.00 54.53 C ATOM 547 OE1 GLU A 36 -16.560 -21.595 -10.334 1.00 32.43 O ATOM 548 OE2 GLU A 36 -16.796 -23.170 -8.831 1.00 62.12 O ATOM 0 H GLU A 36 -17.215 -20.780 -5.311 1.00 75.11 H new ATOM 0 HA GLU A 36 -17.289 -18.436 -6.931 1.00 15.41 H new ATOM 0 HB2 GLU A 36 -18.579 -21.168 -7.301 1.00 53.43 H new ATOM 0 HB3 GLU A 36 -18.422 -19.942 -8.544 1.00 53.43 H new ATOM 0 HG2 GLU A 36 -15.925 -20.090 -8.350 1.00 43.13 H new ATOM 0 HG3 GLU A 36 -16.106 -21.348 -7.144 1.00 43.13 H new ATOM 555 N SER A 37 -19.356 -17.384 -5.945 1.00 15.25 N ATOM 556 CA SER A 37 -20.586 -16.663 -5.614 1.00 54.32 C ATOM 557 C SER A 37 -21.126 -15.966 -6.873 1.00 54.25 C ATOM 558 O SER A 37 -20.465 -15.084 -7.432 1.00 54.31 O ATOM 559 CB SER A 37 -20.294 -15.646 -4.487 1.00 44.21 C ATOM 560 OG SER A 37 -19.728 -16.299 -3.356 1.00 62.25 O ATOM 0 H SER A 37 -18.520 -16.802 -5.894 1.00 15.25 H new ATOM 0 HA SER A 37 -21.347 -17.358 -5.259 1.00 54.32 H new ATOM 0 HB2 SER A 37 -19.610 -14.879 -4.850 1.00 44.21 H new ATOM 0 HB3 SER A 37 -21.216 -15.141 -4.198 1.00 44.21 H new ATOM 0 HG SER A 37 -18.838 -16.639 -3.586 1.00 62.25 H new ATOM 566 N ASP A 38 -22.312 -16.401 -7.332 1.00 13.42 N ATOM 567 CA ASP A 38 -23.025 -15.776 -8.471 1.00 51.33 C ATOM 568 C ASP A 38 -23.693 -14.461 -8.036 1.00 11.33 C ATOM 569 O ASP A 38 -24.023 -13.628 -8.881 1.00 50.40 O ATOM 570 CB ASP A 38 -24.069 -16.756 -9.070 1.00 64.44 C ATOM 571 CG ASP A 38 -25.111 -17.243 -8.048 1.00 54.35 C ATOM 572 OD1 ASP A 38 -24.783 -18.144 -7.244 1.00 52.40 O ATOM 573 OD2 ASP A 38 -26.251 -16.742 -8.043 1.00 43.54 O ATOM 0 H ASP A 38 -22.807 -17.195 -6.927 1.00 13.42 H new ATOM 0 HA ASP A 38 -22.295 -15.545 -9.247 1.00 51.33 H new ATOM 0 HB2 ASP A 38 -24.584 -16.266 -9.896 1.00 64.44 H new ATOM 0 HB3 ASP A 38 -23.549 -17.619 -9.486 1.00 64.44 H new ATOM 578 N SER A 39 -23.892 -14.304 -6.712 1.00 24.02 N ATOM 579 CA SER A 39 -24.380 -13.056 -6.106 1.00 11.25 C ATOM 580 C SER A 39 -23.343 -11.920 -6.296 1.00 33.23 C ATOM 581 O SER A 39 -22.132 -12.184 -6.245 1.00 41.33 O ATOM 582 CB SER A 39 -24.658 -13.279 -4.599 1.00 23.24 C ATOM 583 OG SER A 39 -25.618 -14.304 -4.405 1.00 44.22 O ATOM 0 H SER A 39 -23.717 -15.045 -6.033 1.00 24.02 H new ATOM 0 HA SER A 39 -25.306 -12.763 -6.600 1.00 11.25 H new ATOM 0 HB2 SER A 39 -23.731 -13.543 -4.090 1.00 23.24 H new ATOM 0 HB3 SER A 39 -25.015 -12.352 -4.150 1.00 23.24 H new ATOM 0 HG SER A 39 -25.775 -14.427 -3.446 1.00 44.22 H new ATOM 589 N PRO A 40 -23.796 -10.644 -6.516 1.00 13.50 N ATOM 590 CA PRO A 40 -22.880 -9.492 -6.701 1.00 33.45 C ATOM 591 C PRO A 40 -22.229 -9.062 -5.361 1.00 61.55 C ATOM 592 O PRO A 40 -22.821 -9.252 -4.292 1.00 10.13 O ATOM 593 CB PRO A 40 -23.821 -8.409 -7.287 1.00 63.02 C ATOM 594 CG PRO A 40 -25.170 -8.712 -6.713 1.00 63.32 C ATOM 595 CD PRO A 40 -25.233 -10.220 -6.587 1.00 41.31 C ATOM 0 HA PRO A 40 -22.028 -9.703 -7.347 1.00 33.45 H new ATOM 0 HB2 PRO A 40 -23.491 -7.408 -7.010 1.00 63.02 H new ATOM 0 HB3 PRO A 40 -23.838 -8.449 -8.376 1.00 63.02 H new ATOM 0 HG2 PRO A 40 -25.299 -8.232 -5.743 1.00 63.32 H new ATOM 0 HG3 PRO A 40 -25.964 -8.340 -7.361 1.00 63.32 H new ATOM 0 HD2 PRO A 40 -25.782 -10.522 -5.695 1.00 41.31 H new ATOM 0 HD3 PRO A 40 -25.739 -10.670 -7.441 1.00 41.31 H new ATOM 603 N ILE A 41 -20.995 -8.526 -5.421 1.00 31.21 N ATOM 604 CA ILE A 41 -20.213 -8.158 -4.225 1.00 70.21 C ATOM 605 C ILE A 41 -20.239 -6.615 -4.053 1.00 0.30 C ATOM 606 O ILE A 41 -19.551 -5.901 -4.797 1.00 72.14 O ATOM 607 CB ILE A 41 -18.706 -8.669 -4.291 1.00 31.32 C ATOM 608 CG1 ILE A 41 -18.600 -10.239 -4.473 1.00 64.33 C ATOM 609 CG2 ILE A 41 -17.909 -8.214 -3.031 1.00 4.41 C ATOM 610 CD1 ILE A 41 -18.895 -10.770 -5.875 1.00 74.34 C ATOM 0 H ILE A 41 -20.512 -8.336 -6.299 1.00 31.21 H new ATOM 0 HA ILE A 41 -20.675 -8.648 -3.368 1.00 70.21 H new ATOM 0 HB ILE A 41 -18.263 -8.213 -5.176 1.00 31.32 H new ATOM 0 HG12 ILE A 41 -17.594 -10.551 -4.192 1.00 64.33 H new ATOM 0 HG13 ILE A 41 -19.288 -10.714 -3.774 1.00 64.33 H new ATOM 0 HG21 ILE A 41 -16.883 -8.575 -3.100 1.00 4.41 H new ATOM 0 HG22 ILE A 41 -17.908 -7.125 -2.975 1.00 4.41 H new ATOM 0 HG23 ILE A 41 -18.379 -8.623 -2.136 1.00 4.41 H new ATOM 0 HD11 ILE A 41 -18.792 -11.855 -5.882 1.00 74.34 H new ATOM 0 HD12 ILE A 41 -19.912 -10.500 -6.160 1.00 74.34 H new ATOM 0 HD13 ILE A 41 -18.191 -10.334 -6.585 1.00 74.34 H new ATOM 622 N PRO A 42 -21.068 -6.069 -3.103 1.00 54.13 N ATOM 623 CA PRO A 42 -21.068 -4.632 -2.785 1.00 34.14 C ATOM 624 C PRO A 42 -19.977 -4.257 -1.753 1.00 11.34 C ATOM 625 O PRO A 42 -20.027 -4.683 -0.589 1.00 13.33 O ATOM 626 CB PRO A 42 -22.500 -4.407 -2.242 1.00 22.35 C ATOM 627 CG PRO A 42 -22.888 -5.710 -1.595 1.00 24.14 C ATOM 628 CD PRO A 42 -22.090 -6.804 -2.299 1.00 33.54 C ATOM 0 HA PRO A 42 -20.832 -4.002 -3.643 1.00 34.14 H new ATOM 0 HB2 PRO A 42 -22.524 -3.588 -1.523 1.00 22.35 H new ATOM 0 HB3 PRO A 42 -23.189 -4.146 -3.045 1.00 22.35 H new ATOM 0 HG2 PRO A 42 -22.665 -5.694 -0.528 1.00 24.14 H new ATOM 0 HG3 PRO A 42 -23.959 -5.887 -1.694 1.00 24.14 H new ATOM 0 HD2 PRO A 42 -21.621 -7.476 -1.581 1.00 33.54 H new ATOM 0 HD3 PRO A 42 -22.731 -7.414 -2.935 1.00 33.54 H new ATOM 636 N LEU A 43 -18.959 -3.512 -2.215 1.00 42.32 N ATOM 637 CA LEU A 43 -17.911 -2.928 -1.354 1.00 4.22 C ATOM 638 C LEU A 43 -18.397 -1.549 -0.835 1.00 65.32 C ATOM 639 O LEU A 43 -18.326 -0.561 -1.574 1.00 54.13 O ATOM 640 CB LEU A 43 -16.556 -2.759 -2.122 1.00 13.45 C ATOM 641 CG LEU A 43 -15.850 -4.059 -2.652 1.00 32.43 C ATOM 642 CD1 LEU A 43 -15.665 -5.108 -1.533 1.00 71.44 C ATOM 643 CD2 LEU A 43 -16.577 -4.656 -3.886 1.00 31.11 C ATOM 0 H LEU A 43 -18.837 -3.295 -3.204 1.00 42.32 H new ATOM 0 HA LEU A 43 -17.733 -3.607 -0.520 1.00 4.22 H new ATOM 0 HB2 LEU A 43 -16.733 -2.102 -2.974 1.00 13.45 H new ATOM 0 HB3 LEU A 43 -15.858 -2.244 -1.462 1.00 13.45 H new ATOM 0 HG LEU A 43 -14.855 -3.764 -2.984 1.00 32.43 H new ATOM 0 HD11 LEU A 43 -15.173 -5.992 -1.940 1.00 71.44 H new ATOM 0 HD12 LEU A 43 -15.052 -4.686 -0.737 1.00 71.44 H new ATOM 0 HD13 LEU A 43 -16.639 -5.387 -1.132 1.00 71.44 H new ATOM 0 HD21 LEU A 43 -16.054 -5.553 -4.218 1.00 31.11 H new ATOM 0 HD22 LEU A 43 -17.601 -4.912 -3.616 1.00 31.11 H new ATOM 0 HD23 LEU A 43 -16.587 -3.923 -4.692 1.00 31.11 H new ATOM 655 N PRO A 44 -18.876 -1.446 0.449 1.00 31.14 N ATOM 656 CA PRO A 44 -19.476 -0.202 0.991 1.00 64.54 C ATOM 657 C PRO A 44 -18.425 0.801 1.536 1.00 61.34 C ATOM 658 O PRO A 44 -18.781 1.785 2.196 1.00 45.11 O ATOM 659 CB PRO A 44 -20.382 -0.752 2.111 1.00 53.34 C ATOM 660 CG PRO A 44 -19.641 -1.937 2.651 1.00 33.14 C ATOM 661 CD PRO A 44 -18.856 -2.521 1.484 1.00 63.31 C ATOM 0 HA PRO A 44 -20.001 0.381 0.234 1.00 64.54 H new ATOM 0 HB2 PRO A 44 -20.552 -0.004 2.886 1.00 53.34 H new ATOM 0 HB3 PRO A 44 -21.360 -1.039 1.724 1.00 53.34 H new ATOM 0 HG2 PRO A 44 -18.973 -1.642 3.460 1.00 33.14 H new ATOM 0 HG3 PRO A 44 -20.332 -2.673 3.061 1.00 33.14 H new ATOM 0 HD2 PRO A 44 -17.836 -2.772 1.777 1.00 63.31 H new ATOM 0 HD3 PRO A 44 -19.316 -3.437 1.114 1.00 63.31 H new ATOM 669 N ASN A 45 -17.138 0.545 1.232 1.00 71.31 N ATOM 670 CA ASN A 45 -16.011 1.387 1.674 1.00 2.55 C ATOM 671 C ASN A 45 -15.562 2.337 0.547 1.00 24.12 C ATOM 672 O ASN A 45 -15.563 3.557 0.719 1.00 21.14 O ATOM 673 CB ASN A 45 -14.836 0.486 2.139 1.00 12.10 C ATOM 674 CG ASN A 45 -13.585 1.268 2.566 1.00 62.32 C ATOM 675 OD1 ASN A 45 -12.670 1.489 1.770 1.00 63.13 O ATOM 676 ND2 ASN A 45 -13.548 1.708 3.815 1.00 52.34 N ATOM 0 H ASN A 45 -16.850 -0.256 0.670 1.00 71.31 H new ATOM 0 HA ASN A 45 -16.337 2.001 2.514 1.00 2.55 H new ATOM 0 HB2 ASN A 45 -15.171 -0.129 2.974 1.00 12.10 H new ATOM 0 HB3 ASN A 45 -14.569 -0.193 1.329 1.00 12.10 H new ATOM 0 HD21 ASN A 45 -12.746 2.247 4.142 1.00 52.34 H new ATOM 0 HD22 ASN A 45 -14.321 1.508 4.449 1.00 52.34 H new ATOM 683 N VAL A 46 -15.192 1.762 -0.608 1.00 63.13 N ATOM 684 CA VAL A 46 -14.640 2.529 -1.747 1.00 54.02 C ATOM 685 C VAL A 46 -15.783 3.151 -2.593 1.00 62.03 C ATOM 686 O VAL A 46 -16.744 2.465 -2.947 1.00 4.42 O ATOM 687 CB VAL A 46 -13.689 1.625 -2.629 1.00 32.21 C ATOM 688 CG1 VAL A 46 -14.405 0.354 -3.148 1.00 2.21 C ATOM 689 CG2 VAL A 46 -13.051 2.437 -3.787 1.00 32.11 C ATOM 0 H VAL A 46 -15.264 0.760 -0.783 1.00 63.13 H new ATOM 0 HA VAL A 46 -14.037 3.347 -1.352 1.00 54.02 H new ATOM 0 HB VAL A 46 -12.881 1.286 -1.981 1.00 32.21 H new ATOM 0 HG11 VAL A 46 -13.712 -0.235 -3.748 1.00 2.21 H new ATOM 0 HG12 VAL A 46 -14.748 -0.241 -2.302 1.00 2.21 H new ATOM 0 HG13 VAL A 46 -15.260 0.642 -3.759 1.00 2.21 H new ATOM 0 HG21 VAL A 46 -12.403 1.786 -4.374 1.00 32.11 H new ATOM 0 HG22 VAL A 46 -13.837 2.838 -4.426 1.00 32.11 H new ATOM 0 HG23 VAL A 46 -12.464 3.258 -3.375 1.00 32.11 H new ATOM 699 N THR A 47 -15.667 4.463 -2.894 1.00 24.35 N ATOM 700 CA THR A 47 -16.678 5.228 -3.663 1.00 63.32 C ATOM 701 C THR A 47 -16.678 4.839 -5.155 1.00 40.45 C ATOM 702 O THR A 47 -15.749 4.180 -5.625 1.00 0.21 O ATOM 703 CB THR A 47 -16.418 6.761 -3.520 1.00 3.44 C ATOM 704 OG1 THR A 47 -15.050 7.045 -3.854 1.00 11.13 O ATOM 705 CG2 THR A 47 -16.710 7.262 -2.098 1.00 23.15 C ATOM 0 H THR A 47 -14.865 5.026 -2.609 1.00 24.35 H new ATOM 0 HA THR A 47 -17.656 4.982 -3.251 1.00 63.32 H new ATOM 0 HB THR A 47 -17.092 7.279 -4.202 1.00 3.44 H new ATOM 0 HG1 THR A 47 -14.885 8.007 -3.767 1.00 11.13 H new ATOM 0 HG21 THR A 47 -16.516 8.333 -2.043 1.00 23.15 H new ATOM 0 HG22 THR A 47 -17.754 7.069 -1.851 1.00 23.15 H new ATOM 0 HG23 THR A 47 -16.067 6.740 -1.389 1.00 23.15 H new ATOM 713 N SER A 48 -17.717 5.282 -5.893 1.00 32.12 N ATOM 714 CA SER A 48 -17.936 4.885 -7.297 1.00 22.20 C ATOM 715 C SER A 48 -16.876 5.457 -8.234 1.00 20.45 C ATOM 716 O SER A 48 -16.325 4.728 -9.057 1.00 12.40 O ATOM 717 CB SER A 48 -19.323 5.332 -7.767 1.00 73.22 C ATOM 718 OG SER A 48 -19.486 6.738 -7.635 1.00 74.30 O ATOM 0 H SER A 48 -18.424 5.922 -5.533 1.00 32.12 H new ATOM 0 HA SER A 48 -17.863 3.798 -7.333 1.00 22.20 H new ATOM 0 HB2 SER A 48 -19.467 5.043 -8.808 1.00 73.22 H new ATOM 0 HB3 SER A 48 -20.089 4.819 -7.185 1.00 73.22 H new ATOM 0 HG SER A 48 -20.430 6.944 -7.469 1.00 74.30 H new ATOM 724 N THR A 49 -16.610 6.764 -8.085 1.00 31.21 N ATOM 725 CA THR A 49 -15.653 7.496 -8.918 1.00 52.52 C ATOM 726 C THR A 49 -14.265 6.841 -8.867 1.00 43.32 C ATOM 727 O THR A 49 -13.649 6.572 -9.900 1.00 74.44 O ATOM 728 CB THR A 49 -15.551 8.984 -8.448 1.00 31.42 C ATOM 729 OG1 THR A 49 -15.200 9.021 -7.055 1.00 50.21 O ATOM 730 CG2 THR A 49 -16.872 9.746 -8.651 1.00 0.45 C ATOM 0 H THR A 49 -17.059 7.344 -7.376 1.00 31.21 H new ATOM 0 HA THR A 49 -16.013 7.467 -9.946 1.00 52.52 H new ATOM 0 HB THR A 49 -14.785 9.469 -9.053 1.00 31.42 H new ATOM 0 HG1 THR A 49 -15.134 9.953 -6.759 1.00 50.21 H new ATOM 0 HG21 THR A 49 -16.755 10.775 -8.311 1.00 0.45 H new ATOM 0 HG22 THR A 49 -17.136 9.741 -9.709 1.00 0.45 H new ATOM 0 HG23 THR A 49 -17.663 9.262 -8.078 1.00 0.45 H new ATOM 738 N ILE A 50 -13.828 6.536 -7.643 1.00 62.54 N ATOM 739 CA ILE A 50 -12.490 6.014 -7.371 1.00 71.11 C ATOM 740 C ILE A 50 -12.390 4.538 -7.774 1.00 21.51 C ATOM 741 O ILE A 50 -11.412 4.140 -8.403 1.00 25.13 O ATOM 742 CB ILE A 50 -12.127 6.214 -5.858 1.00 21.13 C ATOM 743 CG1 ILE A 50 -12.260 7.725 -5.474 1.00 14.13 C ATOM 744 CG2 ILE A 50 -10.715 5.678 -5.528 1.00 33.40 C ATOM 745 CD1 ILE A 50 -11.418 8.680 -6.320 1.00 33.03 C ATOM 0 H ILE A 50 -14.400 6.646 -6.806 1.00 62.54 H new ATOM 0 HA ILE A 50 -11.770 6.570 -7.971 1.00 71.11 H new ATOM 0 HB ILE A 50 -12.831 5.634 -5.261 1.00 21.13 H new ATOM 0 HG12 ILE A 50 -13.307 8.015 -5.558 1.00 14.13 H new ATOM 0 HG13 ILE A 50 -11.979 7.845 -4.428 1.00 14.13 H new ATOM 0 HG21 ILE A 50 -10.504 5.836 -4.470 1.00 33.40 H new ATOM 0 HG22 ILE A 50 -10.669 4.612 -5.752 1.00 33.40 H new ATOM 0 HG23 ILE A 50 -9.975 6.207 -6.129 1.00 33.40 H new ATOM 0 HD11 ILE A 50 -11.576 9.703 -5.980 1.00 33.03 H new ATOM 0 HD12 ILE A 50 -10.364 8.423 -6.218 1.00 33.03 H new ATOM 0 HD13 ILE A 50 -11.713 8.596 -7.366 1.00 33.03 H new ATOM 757 N LEU A 51 -13.428 3.747 -7.433 1.00 53.15 N ATOM 758 CA LEU A 51 -13.475 2.308 -7.762 1.00 71.40 C ATOM 759 C LEU A 51 -13.460 2.095 -9.289 1.00 5.25 C ATOM 760 O LEU A 51 -12.746 1.222 -9.780 1.00 1.52 O ATOM 761 CB LEU A 51 -14.717 1.618 -7.127 1.00 34.10 C ATOM 762 CG LEU A 51 -14.805 0.062 -7.300 1.00 64.54 C ATOM 763 CD1 LEU A 51 -13.543 -0.641 -6.743 1.00 2.00 C ATOM 764 CD2 LEU A 51 -16.093 -0.507 -6.654 1.00 24.34 C ATOM 0 H LEU A 51 -14.248 4.083 -6.928 1.00 53.15 H new ATOM 0 HA LEU A 51 -12.584 1.845 -7.338 1.00 71.40 H new ATOM 0 HB2 LEU A 51 -14.729 1.846 -6.061 1.00 34.10 H new ATOM 0 HB3 LEU A 51 -15.614 2.062 -7.558 1.00 34.10 H new ATOM 0 HG LEU A 51 -14.853 -0.144 -8.369 1.00 64.54 H new ATOM 0 HD11 LEU A 51 -13.637 -1.718 -6.879 1.00 2.00 H new ATOM 0 HD12 LEU A 51 -12.662 -0.283 -7.276 1.00 2.00 H new ATOM 0 HD13 LEU A 51 -13.440 -0.417 -5.681 1.00 2.00 H new ATOM 0 HD21 LEU A 51 -16.122 -1.588 -6.792 1.00 24.34 H new ATOM 0 HD22 LEU A 51 -16.098 -0.277 -5.589 1.00 24.34 H new ATOM 0 HD23 LEU A 51 -16.966 -0.057 -7.126 1.00 24.34 H new ATOM 776 N GLU A 52 -14.216 2.942 -10.020 1.00 15.14 N ATOM 777 CA GLU A 52 -14.310 2.885 -11.493 1.00 70.11 C ATOM 778 C GLU A 52 -12.936 3.126 -12.127 1.00 11.50 C ATOM 779 O GLU A 52 -12.504 2.377 -13.013 1.00 54.31 O ATOM 780 CB GLU A 52 -15.310 3.949 -12.019 1.00 52.34 C ATOM 781 CG GLU A 52 -15.578 3.861 -13.535 1.00 3.23 C ATOM 782 CD GLU A 52 -16.579 4.912 -14.033 1.00 70.34 C ATOM 783 OE1 GLU A 52 -16.152 5.924 -14.628 1.00 53.22 O ATOM 784 OE2 GLU A 52 -17.796 4.729 -13.827 1.00 65.32 O ATOM 0 H GLU A 52 -14.778 3.685 -9.604 1.00 15.14 H new ATOM 0 HA GLU A 52 -14.666 1.892 -11.768 1.00 70.11 H new ATOM 0 HB2 GLU A 52 -16.255 3.840 -11.486 1.00 52.34 H new ATOM 0 HB3 GLU A 52 -14.925 4.942 -11.785 1.00 52.34 H new ATOM 0 HG2 GLU A 52 -14.637 3.982 -14.072 1.00 3.23 H new ATOM 0 HG3 GLU A 52 -15.956 2.867 -13.774 1.00 3.23 H new ATOM 791 N LYS A 53 -12.263 4.178 -11.626 1.00 71.31 N ATOM 792 CA LYS A 53 -10.928 4.576 -12.085 1.00 52.53 C ATOM 793 C LYS A 53 -9.902 3.450 -11.857 1.00 22.23 C ATOM 794 O LYS A 53 -9.209 3.047 -12.785 1.00 14.24 O ATOM 795 CB LYS A 53 -10.455 5.881 -11.374 1.00 41.10 C ATOM 796 CG LYS A 53 -11.215 7.160 -11.789 1.00 24.44 C ATOM 797 CD LYS A 53 -10.625 8.443 -11.150 1.00 72.05 C ATOM 798 CE LYS A 53 -9.195 8.751 -11.635 1.00 62.43 C ATOM 799 NZ LYS A 53 -9.133 8.987 -13.105 1.00 10.34 N ATOM 0 H LYS A 53 -12.635 4.776 -10.888 1.00 71.31 H new ATOM 0 HA LYS A 53 -10.997 4.769 -13.155 1.00 52.53 H new ATOM 0 HB2 LYS A 53 -10.558 5.748 -10.297 1.00 41.10 H new ATOM 0 HB3 LYS A 53 -9.394 6.024 -11.578 1.00 41.10 H new ATOM 0 HG2 LYS A 53 -11.190 7.256 -12.875 1.00 24.44 H new ATOM 0 HG3 LYS A 53 -12.262 7.065 -11.501 1.00 24.44 H new ATOM 0 HD2 LYS A 53 -11.272 9.289 -11.382 1.00 72.05 H new ATOM 0 HD3 LYS A 53 -10.620 8.333 -10.066 1.00 72.05 H new ATOM 0 HE2 LYS A 53 -8.818 9.630 -11.112 1.00 62.43 H new ATOM 0 HE3 LYS A 53 -8.539 7.920 -11.375 1.00 62.43 H new ATOM 0 HZ1 LYS A 53 -8.646 9.887 -13.292 1.00 10.34 H new ATOM 0 HZ2 LYS A 53 -8.612 8.210 -13.560 1.00 10.34 H new ATOM 0 HZ3 LYS A 53 -10.098 9.029 -13.491 1.00 10.34 H new ATOM 813 N VAL A 54 -9.850 2.932 -10.618 1.00 15.30 N ATOM 814 CA VAL A 54 -8.853 1.926 -10.205 1.00 31.54 C ATOM 815 C VAL A 54 -9.068 0.583 -10.952 1.00 24.44 C ATOM 816 O VAL A 54 -8.096 -0.082 -11.329 1.00 52.25 O ATOM 817 CB VAL A 54 -8.872 1.738 -8.632 1.00 14.42 C ATOM 818 CG1 VAL A 54 -7.927 0.613 -8.161 1.00 44.34 C ATOM 819 CG2 VAL A 54 -8.509 3.068 -7.917 1.00 75.35 C ATOM 0 H VAL A 54 -10.496 3.197 -9.875 1.00 15.30 H new ATOM 0 HA VAL A 54 -7.863 2.288 -10.482 1.00 31.54 H new ATOM 0 HB VAL A 54 -9.887 1.447 -8.363 1.00 14.42 H new ATOM 0 HG11 VAL A 54 -7.978 0.526 -7.076 1.00 44.34 H new ATOM 0 HG12 VAL A 54 -8.230 -0.330 -8.615 1.00 44.34 H new ATOM 0 HG13 VAL A 54 -6.905 0.848 -8.459 1.00 44.34 H new ATOM 0 HG21 VAL A 54 -8.528 2.918 -6.838 1.00 75.35 H new ATOM 0 HG22 VAL A 54 -7.512 3.385 -8.222 1.00 75.35 H new ATOM 0 HG23 VAL A 54 -9.233 3.836 -8.189 1.00 75.35 H new ATOM 829 N LEU A 55 -10.345 0.224 -11.213 1.00 53.51 N ATOM 830 CA LEU A 55 -10.704 -1.002 -11.968 1.00 25.12 C ATOM 831 C LEU A 55 -10.333 -0.866 -13.462 1.00 73.21 C ATOM 832 O LEU A 55 -9.841 -1.822 -14.074 1.00 64.34 O ATOM 833 CB LEU A 55 -12.220 -1.335 -11.823 1.00 1.30 C ATOM 834 CG LEU A 55 -12.689 -1.869 -10.427 1.00 72.45 C ATOM 835 CD1 LEU A 55 -14.206 -2.175 -10.431 1.00 64.34 C ATOM 836 CD2 LEU A 55 -11.867 -3.107 -9.981 1.00 74.12 C ATOM 0 H LEU A 55 -11.152 0.770 -10.910 1.00 53.51 H new ATOM 0 HA LEU A 55 -10.129 -1.823 -11.540 1.00 25.12 H new ATOM 0 HB2 LEU A 55 -12.790 -0.435 -12.053 1.00 1.30 H new ATOM 0 HB3 LEU A 55 -12.480 -2.078 -12.577 1.00 1.30 H new ATOM 0 HG LEU A 55 -12.507 -1.080 -9.697 1.00 72.45 H new ATOM 0 HD11 LEU A 55 -14.505 -2.544 -9.450 1.00 64.34 H new ATOM 0 HD12 LEU A 55 -14.760 -1.265 -10.661 1.00 64.34 H new ATOM 0 HD13 LEU A 55 -14.423 -2.932 -11.185 1.00 64.34 H new ATOM 0 HD21 LEU A 55 -12.222 -3.448 -9.008 1.00 74.12 H new ATOM 0 HD22 LEU A 55 -11.988 -3.906 -10.712 1.00 74.12 H new ATOM 0 HD23 LEU A 55 -10.813 -2.837 -9.909 1.00 74.12 H new ATOM 848 N ASP A 56 -10.565 0.332 -14.032 1.00 33.23 N ATOM 849 CA ASP A 56 -10.283 0.608 -15.460 1.00 64.24 C ATOM 850 C ASP A 56 -8.761 0.725 -15.692 1.00 22.13 C ATOM 851 O ASP A 56 -8.254 0.345 -16.755 1.00 74.53 O ATOM 852 CB ASP A 56 -11.022 1.886 -15.934 1.00 23.42 C ATOM 853 CG ASP A 56 -11.024 2.050 -17.472 1.00 71.25 C ATOM 854 OD1 ASP A 56 -10.205 2.821 -18.011 1.00 54.22 O ATOM 855 OD2 ASP A 56 -11.847 1.387 -18.149 1.00 41.33 O ATOM 0 H ASP A 56 -10.949 1.130 -13.525 1.00 33.23 H new ATOM 0 HA ASP A 56 -10.656 -0.227 -16.054 1.00 64.24 H new ATOM 0 HB2 ASP A 56 -12.051 1.857 -15.576 1.00 23.42 H new ATOM 0 HB3 ASP A 56 -10.552 2.759 -15.482 1.00 23.42 H new ATOM 860 N TYR A 57 -8.038 1.231 -14.673 1.00 64.32 N ATOM 861 CA TYR A 57 -6.563 1.234 -14.657 1.00 24.42 C ATOM 862 C TYR A 57 -6.057 -0.208 -14.716 1.00 72.11 C ATOM 863 O TYR A 57 -5.203 -0.543 -15.539 1.00 63.25 O ATOM 864 CB TYR A 57 -6.005 1.928 -13.379 1.00 53.15 C ATOM 865 CG TYR A 57 -4.479 1.768 -13.189 1.00 13.21 C ATOM 866 CD1 TYR A 57 -3.941 0.671 -12.489 1.00 3.10 C ATOM 867 CD2 TYR A 57 -3.579 2.679 -13.743 1.00 0.41 C ATOM 868 CE1 TYR A 57 -2.582 0.495 -12.359 1.00 42.31 C ATOM 869 CE2 TYR A 57 -2.213 2.505 -13.598 1.00 23.52 C ATOM 870 CZ TYR A 57 -1.724 1.410 -12.914 1.00 11.23 C ATOM 871 OH TYR A 57 -0.372 1.218 -12.801 1.00 14.41 O ATOM 0 H TYR A 57 -8.458 1.647 -13.842 1.00 64.32 H new ATOM 0 HA TYR A 57 -6.214 1.795 -15.524 1.00 24.42 H new ATOM 0 HB2 TYR A 57 -6.246 2.990 -13.421 1.00 53.15 H new ATOM 0 HB3 TYR A 57 -6.514 1.520 -12.506 1.00 53.15 H new ATOM 0 HD1 TYR A 57 -4.611 -0.050 -12.043 1.00 3.10 H new ATOM 0 HD2 TYR A 57 -3.953 3.531 -14.292 1.00 0.41 H new ATOM 0 HE1 TYR A 57 -2.194 -0.358 -11.823 1.00 42.31 H new ATOM 0 HE2 TYR A 57 -1.529 3.227 -14.020 1.00 23.52 H new ATOM 0 HH TYR A 57 0.046 1.306 -13.683 1.00 14.41 H new ATOM 881 N CYS A 58 -6.598 -1.038 -13.798 1.00 1.43 N ATOM 882 CA CYS A 58 -6.257 -2.457 -13.693 1.00 33.42 C ATOM 883 C CYS A 58 -6.571 -3.197 -15.000 1.00 13.24 C ATOM 884 O CYS A 58 -5.879 -4.150 -15.346 1.00 43.15 O ATOM 885 CB CYS A 58 -6.990 -3.103 -12.497 1.00 41.10 C ATOM 886 SG CYS A 58 -6.445 -2.465 -10.904 1.00 13.21 S ATOM 0 H CYS A 58 -7.286 -0.732 -13.110 1.00 1.43 H new ATOM 0 HA CYS A 58 -5.184 -2.538 -13.518 1.00 33.42 H new ATOM 0 HB2 CYS A 58 -8.062 -2.934 -12.602 1.00 41.10 H new ATOM 0 HB3 CYS A 58 -6.833 -4.181 -12.522 1.00 41.10 H new ATOM 0 HG CYS A 58 -7.078 -1.361 -10.639 1.00 13.21 H new ATOM 892 N ARG A 59 -7.609 -2.745 -15.725 1.00 34.51 N ATOM 893 CA ARG A 59 -7.937 -3.284 -17.057 1.00 65.21 C ATOM 894 C ARG A 59 -6.779 -3.050 -18.035 1.00 70.32 C ATOM 895 O ARG A 59 -6.323 -3.996 -18.677 1.00 72.41 O ATOM 896 CB ARG A 59 -9.280 -2.706 -17.586 1.00 14.13 C ATOM 897 CG ARG A 59 -9.608 -3.040 -19.073 1.00 52.30 C ATOM 898 CD ARG A 59 -11.122 -3.100 -19.365 1.00 62.10 C ATOM 899 NE ARG A 59 -11.869 -1.944 -18.821 1.00 44.10 N ATOM 900 CZ ARG A 59 -12.966 -2.032 -18.041 1.00 51.53 C ATOM 901 NH1 ARG A 59 -13.465 -3.217 -17.689 1.00 32.10 N ATOM 902 NH2 ARG A 59 -13.565 -0.927 -17.632 1.00 51.51 N ATOM 0 H ARG A 59 -8.237 -2.006 -15.410 1.00 34.51 H new ATOM 0 HA ARG A 59 -8.075 -4.362 -16.967 1.00 65.21 H new ATOM 0 HB2 ARG A 59 -10.090 -3.080 -16.959 1.00 14.13 H new ATOM 0 HB3 ARG A 59 -9.261 -1.622 -17.470 1.00 14.13 H new ATOM 0 HG2 ARG A 59 -9.150 -2.289 -19.716 1.00 52.30 H new ATOM 0 HG3 ARG A 59 -9.157 -3.998 -19.331 1.00 52.30 H new ATOM 0 HD2 ARG A 59 -11.275 -3.148 -20.443 1.00 62.10 H new ATOM 0 HD3 ARG A 59 -11.530 -4.019 -18.943 1.00 62.10 H new ATOM 0 HE ARG A 59 -11.529 -1.011 -19.053 1.00 44.10 H new ATOM 0 HH11 ARG A 59 -13.016 -4.075 -18.010 1.00 32.10 H new ATOM 0 HH12 ARG A 59 -14.295 -3.266 -17.099 1.00 32.10 H new ATOM 0 HH21 ARG A 59 -13.197 -0.016 -17.906 1.00 51.51 H new ATOM 0 HH22 ARG A 59 -14.395 -0.985 -17.042 1.00 51.51 H new ATOM 916 N HIS A 60 -6.261 -1.809 -18.079 1.00 14.11 N ATOM 917 CA HIS A 60 -5.099 -1.456 -18.924 1.00 24.24 C ATOM 918 C HIS A 60 -3.835 -2.239 -18.489 1.00 41.15 C ATOM 919 O HIS A 60 -3.069 -2.720 -19.334 1.00 51.23 O ATOM 920 CB HIS A 60 -4.826 0.071 -18.881 1.00 25.50 C ATOM 921 CG HIS A 60 -3.656 0.487 -19.743 1.00 44.21 C ATOM 922 ND1 HIS A 60 -2.552 1.164 -19.264 1.00 42.34 N ATOM 923 CD2 HIS A 60 -3.400 0.248 -21.052 1.00 45.10 C ATOM 924 CE1 HIS A 60 -1.676 1.307 -20.238 1.00 0.32 C ATOM 925 NE2 HIS A 60 -2.168 0.763 -21.326 1.00 14.45 N ATOM 0 H HIS A 60 -6.630 -1.028 -17.537 1.00 14.11 H new ATOM 0 HA HIS A 60 -5.340 -1.736 -19.950 1.00 24.24 H new ATOM 0 HB2 HIS A 60 -5.719 0.603 -19.209 1.00 25.50 H new ATOM 0 HB3 HIS A 60 -4.636 0.372 -17.851 1.00 25.50 H new ATOM 0 HD1 HIS A 60 -2.433 1.500 -18.308 1.00 42.34 H new ATOM 0 HD2 HIS A 60 -4.052 -0.257 -21.749 1.00 45.10 H new ATOM 0 HE1 HIS A 60 -0.714 1.791 -20.155 1.00 0.32 H new ATOM 934 N HIS A 61 -3.659 -2.373 -17.165 1.00 32.04 N ATOM 935 CA HIS A 61 -2.506 -3.059 -16.556 1.00 40.25 C ATOM 936 C HIS A 61 -2.570 -4.584 -16.785 1.00 60.13 C ATOM 937 O HIS A 61 -1.549 -5.273 -16.734 1.00 45.33 O ATOM 938 CB HIS A 61 -2.462 -2.751 -15.038 1.00 22.23 C ATOM 939 CG HIS A 61 -1.211 -3.243 -14.360 1.00 15.41 C ATOM 940 ND1 HIS A 61 -1.059 -4.536 -13.902 1.00 32.21 N ATOM 941 CD2 HIS A 61 -0.035 -2.622 -14.116 1.00 64.32 C ATOM 942 CE1 HIS A 61 0.152 -4.686 -13.421 1.00 60.34 C ATOM 943 NE2 HIS A 61 0.798 -3.546 -13.534 1.00 63.42 N ATOM 0 H HIS A 61 -4.319 -2.005 -16.480 1.00 32.04 H new ATOM 0 HA HIS A 61 -1.598 -2.690 -17.033 1.00 40.25 H new ATOM 0 HB2 HIS A 61 -2.545 -1.674 -14.892 1.00 22.23 H new ATOM 0 HB3 HIS A 61 -3.328 -3.206 -14.558 1.00 22.23 H new ATOM 0 HD2 HIS A 61 0.204 -1.592 -14.337 1.00 64.32 H new ATOM 0 HE1 HIS A 61 0.553 -5.597 -13.001 1.00 60.34 H new ATOM 0 HE2 HIS A 61 1.759 -3.376 -13.238 1.00 63.42 H new ATOM 952 N HIS A 62 -3.788 -5.102 -16.992 1.00 64.23 N ATOM 953 CA HIS A 62 -4.013 -6.529 -17.269 1.00 33.51 C ATOM 954 C HIS A 62 -3.730 -6.829 -18.750 1.00 15.54 C ATOM 955 O HIS A 62 -3.185 -7.891 -19.083 1.00 73.25 O ATOM 956 CB HIS A 62 -5.463 -6.917 -16.898 1.00 11.12 C ATOM 957 CG HIS A 62 -5.774 -8.379 -17.062 1.00 21.24 C ATOM 958 ND1 HIS A 62 -5.486 -9.318 -16.095 1.00 52.02 N ATOM 959 CD2 HIS A 62 -6.351 -9.063 -18.081 1.00 52.34 C ATOM 960 CE1 HIS A 62 -5.871 -10.503 -16.513 1.00 45.34 C ATOM 961 NE2 HIS A 62 -6.396 -10.374 -17.709 1.00 21.24 N ATOM 0 H HIS A 62 -4.643 -4.547 -16.973 1.00 64.23 H new ATOM 0 HA HIS A 62 -3.331 -7.124 -16.662 1.00 33.51 H new ATOM 0 HB2 HIS A 62 -5.649 -6.632 -15.863 1.00 11.12 H new ATOM 0 HB3 HIS A 62 -6.151 -6.340 -17.516 1.00 11.12 H new ATOM 0 HD1 HIS A 62 -5.044 -9.124 -15.197 1.00 52.02 H new ATOM 0 HD2 HIS A 62 -6.708 -8.648 -19.012 1.00 52.34 H new ATOM 0 HE1 HIS A 62 -5.772 -11.428 -15.964 1.00 45.34 H new ATOM 0 HE2 HIS A 62 -6.778 -11.135 -18.271 1.00 21.24 H new ATOM 970 N GLN A 63 -4.126 -5.885 -19.624 1.00 34.21 N ATOM 971 CA GLN A 63 -3.915 -5.992 -21.082 1.00 0.44 C ATOM 972 C GLN A 63 -2.431 -5.820 -21.434 1.00 0.41 C ATOM 973 O GLN A 63 -1.950 -6.370 -22.430 1.00 14.31 O ATOM 974 CB GLN A 63 -4.770 -4.943 -21.848 1.00 51.20 C ATOM 975 CG GLN A 63 -6.295 -5.045 -21.621 1.00 1.15 C ATOM 976 CD GLN A 63 -6.859 -6.436 -21.893 1.00 33.43 C ATOM 977 OE1 GLN A 63 -6.961 -7.269 -20.988 1.00 35.30 O ATOM 978 NE2 GLN A 63 -7.203 -6.707 -23.145 1.00 60.31 N ATOM 0 H GLN A 63 -4.601 -5.028 -19.341 1.00 34.21 H new ATOM 0 HA GLN A 63 -4.233 -6.988 -21.389 1.00 0.44 H new ATOM 0 HB2 GLN A 63 -4.441 -3.946 -21.555 1.00 51.20 H new ATOM 0 HB3 GLN A 63 -4.570 -5.044 -22.915 1.00 51.20 H new ATOM 0 HG2 GLN A 63 -6.521 -4.765 -20.592 1.00 1.15 H new ATOM 0 HG3 GLN A 63 -6.799 -4.325 -22.265 1.00 1.15 H new ATOM 0 HE21 GLN A 63 -7.105 -5.993 -23.867 1.00 60.31 H new ATOM 0 HE22 GLN A 63 -7.566 -7.629 -23.386 1.00 60.31 H new ATOM 987 N HIS A 64 -1.718 -5.029 -20.619 1.00 1.24 N ATOM 988 CA HIS A 64 -0.265 -4.837 -20.730 1.00 22.11 C ATOM 989 C HIS A 64 0.367 -5.121 -19.349 1.00 33.43 C ATOM 990 O HIS A 64 0.535 -4.191 -18.543 1.00 2.55 O ATOM 991 CB HIS A 64 0.068 -3.401 -21.230 1.00 21.14 C ATOM 992 CG HIS A 64 -0.445 -3.100 -22.618 1.00 3.12 C ATOM 993 ND1 HIS A 64 0.331 -3.227 -23.749 1.00 73.41 N ATOM 994 CD2 HIS A 64 -1.661 -2.679 -23.055 1.00 52.21 C ATOM 995 CE1 HIS A 64 -0.378 -2.906 -24.811 1.00 14.41 C ATOM 996 NE2 HIS A 64 -1.587 -2.569 -24.422 1.00 2.24 N ATOM 0 H HIS A 64 -2.139 -4.499 -19.856 1.00 1.24 H new ATOM 0 HA HIS A 64 0.150 -5.527 -21.465 1.00 22.11 H new ATOM 0 HB2 HIS A 64 -0.354 -2.677 -20.533 1.00 21.14 H new ATOM 0 HB3 HIS A 64 1.149 -3.264 -21.216 1.00 21.14 H new ATOM 0 HD2 HIS A 64 -2.525 -2.470 -22.441 1.00 52.21 H new ATOM 0 HE1 HIS A 64 -0.025 -2.918 -25.832 1.00 14.41 H new ATOM 0 HE2 HIS A 64 -2.347 -2.274 -25.035 1.00 2.24 H new ATOM 1005 N PRO A 65 0.658 -6.431 -19.022 1.00 22.10 N ATOM 1006 CA PRO A 65 1.248 -6.829 -17.719 1.00 32.50 C ATOM 1007 C PRO A 65 2.686 -6.287 -17.552 1.00 73.01 C ATOM 1008 O PRO A 65 3.649 -6.868 -18.073 1.00 52.31 O ATOM 1009 CB PRO A 65 1.213 -8.389 -17.749 1.00 11.05 C ATOM 1010 CG PRO A 65 0.277 -8.740 -18.873 1.00 61.31 C ATOM 1011 CD PRO A 65 0.429 -7.626 -19.881 1.00 25.54 C ATOM 0 HA PRO A 65 0.699 -6.420 -16.871 1.00 32.50 H new ATOM 0 HB2 PRO A 65 2.207 -8.802 -17.921 1.00 11.05 H new ATOM 0 HB3 PRO A 65 0.859 -8.793 -16.801 1.00 11.05 H new ATOM 0 HG2 PRO A 65 0.533 -9.705 -19.311 1.00 61.31 H new ATOM 0 HG3 PRO A 65 -0.752 -8.813 -18.520 1.00 61.31 H new ATOM 0 HD2 PRO A 65 1.265 -7.804 -20.557 1.00 25.54 H new ATOM 0 HD3 PRO A 65 -0.462 -7.515 -20.499 1.00 25.54 H new ATOM 1019 N GLY A 66 2.796 -5.135 -16.884 1.00 25.15 N ATOM 1020 CA GLY A 66 4.081 -4.487 -16.633 1.00 30.44 C ATOM 1021 C GLY A 66 3.956 -3.371 -15.609 1.00 52.34 C ATOM 1022 O GLY A 66 2.860 -2.843 -15.396 1.00 2.11 O ATOM 0 H GLY A 66 1.997 -4.628 -16.504 1.00 25.15 H new ATOM 0 HA2 GLY A 66 4.799 -5.227 -16.279 1.00 30.44 H new ATOM 0 HA3 GLY A 66 4.473 -4.083 -17.566 1.00 30.44 H new ATOM 1026 N GLY A 67 5.077 -3.024 -14.971 1.00 34.53 N ATOM 1027 CA GLY A 67 5.112 -1.974 -13.954 1.00 72.21 C ATOM 1028 C GLY A 67 6.542 -1.587 -13.634 1.00 41.52 C ATOM 1029 O GLY A 67 7.208 -0.980 -14.477 1.00 43.30 O ATOM 0 H GLY A 67 5.982 -3.462 -15.145 1.00 34.53 H new ATOM 0 HA2 GLY A 67 4.564 -1.100 -14.307 1.00 72.21 H new ATOM 0 HA3 GLY A 67 4.612 -2.320 -13.049 1.00 72.21 H new ATOM 1033 N SER A 68 6.999 -1.930 -12.407 1.00 42.41 N ATOM 1034 CA SER A 68 8.390 -1.698 -11.928 1.00 64.43 C ATOM 1035 C SER A 68 8.786 -0.204 -11.878 1.00 31.34 C ATOM 1036 O SER A 68 9.960 0.115 -11.626 1.00 64.21 O ATOM 1037 CB SER A 68 9.398 -2.505 -12.788 1.00 71.33 C ATOM 1038 OG SER A 68 9.110 -3.890 -12.737 1.00 52.23 O ATOM 0 H SER A 68 6.407 -2.382 -11.710 1.00 42.41 H new ATOM 0 HA SER A 68 8.424 -2.052 -10.898 1.00 64.43 H new ATOM 0 HB2 SER A 68 9.359 -2.159 -13.821 1.00 71.33 H new ATOM 0 HB3 SER A 68 10.412 -2.327 -12.430 1.00 71.33 H new ATOM 0 HG SER A 68 9.757 -4.379 -13.287 1.00 52.23 H new ATOM 1044 N GLY A 69 7.801 0.695 -12.082 1.00 44.34 N ATOM 1045 CA GLY A 69 8.058 2.130 -12.215 1.00 52.04 C ATOM 1046 C GLY A 69 9.053 2.457 -13.327 1.00 43.41 C ATOM 1047 O GLY A 69 9.946 3.293 -13.136 1.00 53.43 O ATOM 0 H GLY A 69 6.816 0.442 -12.158 1.00 44.34 H new ATOM 0 HA2 GLY A 69 7.118 2.645 -12.413 1.00 52.04 H new ATOM 0 HA3 GLY A 69 8.439 2.515 -11.269 1.00 52.04 H new ATOM 1051 N LEU A 70 8.913 1.761 -14.481 1.00 43.34 N ATOM 1052 CA LEU A 70 9.768 1.984 -15.664 1.00 14.25 C ATOM 1053 C LEU A 70 9.543 3.392 -16.217 1.00 0.04 C ATOM 1054 O LEU A 70 8.413 3.898 -16.183 1.00 34.20 O ATOM 1055 CB LEU A 70 9.489 0.929 -16.775 1.00 22.45 C ATOM 1056 CG LEU A 70 9.779 -0.552 -16.399 1.00 63.21 C ATOM 1057 CD1 LEU A 70 9.444 -1.516 -17.565 1.00 73.40 C ATOM 1058 CD2 LEU A 70 11.234 -0.739 -15.908 1.00 54.44 C ATOM 0 H LEU A 70 8.209 1.035 -14.614 1.00 43.34 H new ATOM 0 HA LEU A 70 10.806 1.878 -15.350 1.00 14.25 H new ATOM 0 HB2 LEU A 70 8.443 1.010 -17.070 1.00 22.45 H new ATOM 0 HB3 LEU A 70 10.087 1.185 -17.649 1.00 22.45 H new ATOM 0 HG LEU A 70 9.120 -0.808 -15.570 1.00 63.21 H new ATOM 0 HD11 LEU A 70 9.660 -2.541 -17.263 1.00 73.40 H new ATOM 0 HD12 LEU A 70 8.388 -1.427 -17.818 1.00 73.40 H new ATOM 0 HD13 LEU A 70 10.048 -1.259 -18.435 1.00 73.40 H new ATOM 0 HD21 LEU A 70 11.401 -1.786 -15.654 1.00 54.44 H new ATOM 0 HD22 LEU A 70 11.925 -0.442 -16.697 1.00 54.44 H new ATOM 0 HD23 LEU A 70 11.403 -0.121 -15.026 1.00 54.44 H new ATOM 1070 N ASP A 71 10.626 4.003 -16.721 1.00 73.23 N ATOM 1071 CA ASP A 71 10.605 5.359 -17.279 1.00 55.12 C ATOM 1072 C ASP A 71 9.902 5.356 -18.655 1.00 71.04 C ATOM 1073 O ASP A 71 10.536 5.292 -19.714 1.00 45.05 O ATOM 1074 CB ASP A 71 12.057 5.914 -17.360 1.00 50.15 C ATOM 1075 CG ASP A 71 12.126 7.382 -17.820 1.00 35.51 C ATOM 1076 OD1 ASP A 71 11.744 8.274 -17.034 1.00 24.51 O ATOM 1077 OD2 ASP A 71 12.563 7.652 -18.962 1.00 32.43 O ATOM 0 H ASP A 71 11.546 3.565 -16.752 1.00 73.23 H new ATOM 0 HA ASP A 71 10.034 6.020 -16.627 1.00 55.12 H new ATOM 0 HB2 ASP A 71 12.527 5.825 -16.381 1.00 50.15 H new ATOM 0 HB3 ASP A 71 12.636 5.298 -18.048 1.00 50.15 H new ATOM 1082 N ASP A 72 8.570 5.317 -18.592 1.00 75.13 N ATOM 1083 CA ASP A 72 7.676 5.374 -19.751 1.00 25.24 C ATOM 1084 C ASP A 72 6.403 6.122 -19.343 1.00 44.41 C ATOM 1085 O ASP A 72 6.128 7.210 -19.859 1.00 25.12 O ATOM 1086 CB ASP A 72 7.342 3.942 -20.247 1.00 20.31 C ATOM 1087 CG ASP A 72 6.345 3.922 -21.416 1.00 12.32 C ATOM 1088 OD1 ASP A 72 5.175 3.538 -21.219 1.00 43.32 O ATOM 1089 OD2 ASP A 72 6.737 4.292 -22.543 1.00 10.20 O ATOM 0 H ASP A 72 8.068 5.243 -17.707 1.00 75.13 H new ATOM 0 HA ASP A 72 8.161 5.901 -20.572 1.00 25.24 H new ATOM 0 HB2 ASP A 72 8.263 3.448 -20.555 1.00 20.31 H new ATOM 0 HB3 ASP A 72 6.932 3.364 -19.419 1.00 20.31 H new ATOM 1094 N ILE A 73 5.678 5.529 -18.359 1.00 54.15 N ATOM 1095 CA ILE A 73 4.389 6.033 -17.827 1.00 32.12 C ATOM 1096 C ILE A 73 3.428 6.396 -19.003 1.00 40.55 C ATOM 1097 O ILE A 73 3.448 7.541 -19.478 1.00 44.01 O ATOM 1098 CB ILE A 73 4.551 7.255 -16.808 1.00 1.03 C ATOM 1099 CG1 ILE A 73 5.422 6.883 -15.543 1.00 73.02 C ATOM 1100 CG2 ILE A 73 3.160 7.774 -16.344 1.00 60.35 C ATOM 1101 CD1 ILE A 73 6.922 6.763 -15.775 1.00 72.54 C ATOM 0 H ILE A 73 5.982 4.668 -17.905 1.00 54.15 H new ATOM 0 HA ILE A 73 3.951 5.224 -17.242 1.00 32.12 H new ATOM 0 HB ILE A 73 5.075 8.040 -17.353 1.00 1.03 H new ATOM 0 HG12 ILE A 73 5.253 7.638 -14.776 1.00 73.02 H new ATOM 0 HG13 ILE A 73 5.060 5.936 -15.143 1.00 73.02 H new ATOM 0 HG21 ILE A 73 3.294 8.605 -15.652 1.00 60.35 H new ATOM 0 HG22 ILE A 73 2.590 8.111 -17.210 1.00 60.35 H new ATOM 0 HG23 ILE A 73 2.619 6.970 -15.845 1.00 60.35 H new ATOM 0 HD11 ILE A 73 7.416 6.505 -14.838 1.00 72.54 H new ATOM 0 HD12 ILE A 73 7.115 5.985 -16.513 1.00 72.54 H new ATOM 0 HD13 ILE A 73 7.311 7.714 -16.140 1.00 72.54 H new ATOM 1113 N PRO A 74 2.617 5.416 -19.521 1.00 33.54 N ATOM 1114 CA PRO A 74 1.776 5.622 -20.735 1.00 25.41 C ATOM 1115 C PRO A 74 0.789 6.805 -20.571 1.00 71.45 C ATOM 1116 O PRO A 74 0.321 7.038 -19.459 1.00 1.14 O ATOM 1117 CB PRO A 74 1.032 4.263 -20.906 1.00 3.01 C ATOM 1118 CG PRO A 74 1.858 3.273 -20.137 1.00 41.54 C ATOM 1119 CD PRO A 74 2.427 4.048 -18.965 1.00 25.22 C ATOM 0 HA PRO A 74 2.370 5.888 -21.609 1.00 25.41 H new ATOM 0 HB2 PRO A 74 0.015 4.317 -20.516 1.00 3.01 H new ATOM 0 HB3 PRO A 74 0.956 3.983 -21.957 1.00 3.01 H new ATOM 0 HG2 PRO A 74 1.250 2.435 -19.796 1.00 41.54 H new ATOM 0 HG3 PRO A 74 2.653 2.859 -20.757 1.00 41.54 H new ATOM 0 HD2 PRO A 74 1.745 4.050 -18.115 1.00 25.22 H new ATOM 0 HD3 PRO A 74 3.368 3.620 -18.618 1.00 25.22 H new ATOM 1127 N PRO A 75 0.480 7.566 -21.682 1.00 11.21 N ATOM 1128 CA PRO A 75 -0.398 8.777 -21.654 1.00 53.45 C ATOM 1129 C PRO A 75 -1.714 8.608 -20.855 1.00 33.32 C ATOM 1130 O PRO A 75 -2.137 9.544 -20.168 1.00 4.14 O ATOM 1131 CB PRO A 75 -0.682 9.028 -23.153 1.00 0.34 C ATOM 1132 CG PRO A 75 0.550 8.531 -23.848 1.00 71.15 C ATOM 1133 CD PRO A 75 1.000 7.318 -23.061 1.00 70.13 C ATOM 0 HA PRO A 75 0.090 9.604 -21.138 1.00 53.45 H new ATOM 0 HB2 PRO A 75 -1.571 8.492 -23.485 1.00 0.34 H new ATOM 0 HB3 PRO A 75 -0.854 10.085 -23.354 1.00 0.34 H new ATOM 0 HG2 PRO A 75 0.337 8.269 -24.884 1.00 71.15 H new ATOM 0 HG3 PRO A 75 1.326 9.297 -23.866 1.00 71.15 H new ATOM 0 HD2 PRO A 75 0.594 6.397 -23.481 1.00 70.13 H new ATOM 0 HD3 PRO A 75 2.086 7.219 -23.066 1.00 70.13 H new ATOM 1141 N TYR A 76 -2.329 7.405 -20.941 1.00 11.35 N ATOM 1142 CA TYR A 76 -3.534 7.064 -20.157 1.00 1.04 C ATOM 1143 C TYR A 76 -3.259 7.212 -18.652 1.00 2.15 C ATOM 1144 O TYR A 76 -3.924 7.985 -17.974 1.00 70.11 O ATOM 1145 CB TYR A 76 -4.037 5.615 -20.469 1.00 54.43 C ATOM 1146 CG TYR A 76 -5.064 5.073 -19.446 1.00 10.13 C ATOM 1147 CD1 TYR A 76 -6.350 5.615 -19.350 1.00 74.02 C ATOM 1148 CD2 TYR A 76 -4.725 4.056 -18.539 1.00 64.13 C ATOM 1149 CE1 TYR A 76 -7.245 5.170 -18.391 1.00 72.03 C ATOM 1150 CE2 TYR A 76 -5.624 3.605 -17.591 1.00 34.55 C ATOM 1151 CZ TYR A 76 -6.877 4.166 -17.518 1.00 60.11 C ATOM 1152 OH TYR A 76 -7.756 3.745 -16.547 1.00 12.23 O ATOM 0 H TYR A 76 -2.006 6.653 -21.550 1.00 11.35 H new ATOM 0 HA TYR A 76 -4.319 7.762 -20.448 1.00 1.04 H new ATOM 0 HB2 TYR A 76 -4.487 5.603 -21.462 1.00 54.43 H new ATOM 0 HB3 TYR A 76 -3.180 4.942 -20.500 1.00 54.43 H new ATOM 0 HD1 TYR A 76 -6.650 6.394 -20.035 1.00 74.02 H new ATOM 0 HD2 TYR A 76 -3.740 3.616 -18.583 1.00 64.13 H new ATOM 0 HE1 TYR A 76 -8.230 5.608 -18.326 1.00 72.03 H new ATOM 0 HE2 TYR A 76 -5.343 2.815 -16.910 1.00 34.55 H new ATOM 0 HH TYR A 76 -8.583 3.430 -16.969 1.00 12.23 H new ATOM 1162 N ASP A 77 -2.231 6.493 -18.188 1.00 11.35 N ATOM 1163 CA ASP A 77 -1.893 6.344 -16.758 1.00 22.13 C ATOM 1164 C ASP A 77 -1.306 7.651 -16.204 1.00 73.34 C ATOM 1165 O ASP A 77 -1.419 7.938 -15.008 1.00 63.34 O ATOM 1166 CB ASP A 77 -0.901 5.167 -16.575 1.00 13.53 C ATOM 1167 CG ASP A 77 -1.365 3.898 -17.315 1.00 50.22 C ATOM 1168 OD1 ASP A 77 -1.972 2.996 -16.707 1.00 12.13 O ATOM 1169 OD2 ASP A 77 -1.169 3.831 -18.538 1.00 60.11 O ATOM 0 H ASP A 77 -1.595 5.986 -18.804 1.00 11.35 H new ATOM 0 HA ASP A 77 -2.801 6.124 -16.197 1.00 22.13 H new ATOM 0 HB2 ASP A 77 0.082 5.461 -16.942 1.00 13.53 H new ATOM 0 HB3 ASP A 77 -0.792 4.947 -15.513 1.00 13.53 H new ATOM 1174 N ARG A 78 -0.690 8.430 -17.109 1.00 71.32 N ATOM 1175 CA ARG A 78 -0.065 9.714 -16.785 1.00 11.14 C ATOM 1176 C ARG A 78 -1.147 10.748 -16.413 1.00 44.01 C ATOM 1177 O ARG A 78 -1.085 11.367 -15.347 1.00 33.43 O ATOM 1178 CB ARG A 78 0.797 10.196 -17.989 1.00 2.05 C ATOM 1179 CG ARG A 78 1.823 11.294 -17.644 1.00 72.02 C ATOM 1180 CD ARG A 78 2.694 11.687 -18.852 1.00 3.22 C ATOM 1181 NE ARG A 78 3.439 10.547 -19.429 1.00 12.14 N ATOM 1182 CZ ARG A 78 4.048 10.550 -20.634 1.00 24.33 C ATOM 1183 NH1 ARG A 78 4.014 11.627 -21.423 1.00 5.24 N ATOM 1184 NH2 ARG A 78 4.690 9.466 -21.043 1.00 10.34 N ATOM 0 H ARG A 78 -0.614 8.179 -18.095 1.00 71.32 H new ATOM 0 HA ARG A 78 0.592 9.596 -15.924 1.00 11.14 H new ATOM 0 HB2 ARG A 78 1.327 9.340 -18.406 1.00 2.05 H new ATOM 0 HB3 ARG A 78 0.133 10.570 -18.768 1.00 2.05 H new ATOM 0 HG2 ARG A 78 1.297 12.176 -17.277 1.00 72.02 H new ATOM 0 HG3 ARG A 78 2.465 10.946 -16.835 1.00 72.02 H new ATOM 0 HD2 ARG A 78 2.059 12.125 -19.622 1.00 3.22 H new ATOM 0 HD3 ARG A 78 3.402 12.458 -18.546 1.00 3.22 H new ATOM 0 HE ARG A 78 3.497 9.693 -18.874 1.00 12.14 H new ATOM 0 HH11 ARG A 78 3.522 12.467 -21.119 1.00 5.24 H new ATOM 0 HH12 ARG A 78 4.480 11.610 -22.330 1.00 5.24 H new ATOM 0 HH21 ARG A 78 4.722 8.637 -20.449 1.00 10.34 H new ATOM 0 HH22 ARG A 78 5.153 9.460 -21.952 1.00 10.34 H new ATOM 1198 N ASP A 79 -2.162 10.880 -17.295 1.00 70.34 N ATOM 1199 CA ASP A 79 -3.320 11.782 -17.080 1.00 13.51 C ATOM 1200 C ASP A 79 -4.317 11.195 -16.066 1.00 14.52 C ATOM 1201 O ASP A 79 -5.108 11.933 -15.477 1.00 21.11 O ATOM 1202 CB ASP A 79 -4.039 12.115 -18.412 1.00 42.03 C ATOM 1203 CG ASP A 79 -3.177 12.969 -19.358 1.00 23.33 C ATOM 1204 OD1 ASP A 79 -3.162 14.211 -19.215 1.00 64.10 O ATOM 1205 OD2 ASP A 79 -2.498 12.407 -20.239 1.00 20.35 O ATOM 0 H ASP A 79 -2.204 10.366 -18.175 1.00 70.34 H new ATOM 0 HA ASP A 79 -2.923 12.709 -16.667 1.00 13.51 H new ATOM 0 HB2 ASP A 79 -4.311 11.187 -18.915 1.00 42.03 H new ATOM 0 HB3 ASP A 79 -4.967 12.645 -18.196 1.00 42.03 H new ATOM 1210 N PHE A 80 -4.289 9.862 -15.903 1.00 71.53 N ATOM 1211 CA PHE A 80 -5.110 9.136 -14.912 1.00 13.21 C ATOM 1212 C PHE A 80 -4.777 9.607 -13.485 1.00 0.25 C ATOM 1213 O PHE A 80 -5.674 9.895 -12.682 1.00 30.34 O ATOM 1214 CB PHE A 80 -4.860 7.602 -15.053 1.00 1.51 C ATOM 1215 CG PHE A 80 -5.473 6.741 -13.959 1.00 24.13 C ATOM 1216 CD1 PHE A 80 -6.775 6.283 -14.063 1.00 54.43 C ATOM 1217 CD2 PHE A 80 -4.742 6.416 -12.811 1.00 44.24 C ATOM 1218 CE1 PHE A 80 -7.328 5.529 -13.061 1.00 23.43 C ATOM 1219 CE2 PHE A 80 -5.301 5.661 -11.812 1.00 11.22 C ATOM 1220 CZ PHE A 80 -6.594 5.219 -11.931 1.00 51.30 C ATOM 0 H PHE A 80 -3.692 9.250 -16.459 1.00 71.53 H new ATOM 0 HA PHE A 80 -6.163 9.346 -15.100 1.00 13.21 H new ATOM 0 HB2 PHE A 80 -5.254 7.273 -16.015 1.00 1.51 H new ATOM 0 HB3 PHE A 80 -3.784 7.426 -15.072 1.00 1.51 H new ATOM 0 HD1 PHE A 80 -7.359 6.521 -14.940 1.00 54.43 H new ATOM 0 HD2 PHE A 80 -3.725 6.764 -12.710 1.00 44.24 H new ATOM 0 HE1 PHE A 80 -8.344 5.175 -13.155 1.00 23.43 H new ATOM 0 HE2 PHE A 80 -4.724 5.415 -10.933 1.00 11.22 H new ATOM 0 HZ PHE A 80 -7.038 4.629 -11.143 1.00 51.30 H new ATOM 1230 N CYS A 81 -3.466 9.652 -13.197 1.00 63.20 N ATOM 1231 CA CYS A 81 -2.938 10.043 -11.885 1.00 3.44 C ATOM 1232 C CYS A 81 -3.024 11.569 -11.668 1.00 50.40 C ATOM 1233 O CYS A 81 -2.816 12.045 -10.548 1.00 3.24 O ATOM 1234 CB CYS A 81 -1.489 9.535 -11.748 1.00 31.31 C ATOM 1235 SG CYS A 81 -1.317 7.737 -11.882 1.00 54.11 S ATOM 0 H CYS A 81 -2.740 9.416 -13.874 1.00 63.20 H new ATOM 0 HA CYS A 81 -3.551 9.585 -11.109 1.00 3.44 H new ATOM 0 HB2 CYS A 81 -0.877 10.006 -12.517 1.00 31.31 H new ATOM 0 HB3 CYS A 81 -1.093 9.856 -10.785 1.00 31.31 H new ATOM 0 HG CYS A 81 -1.318 7.393 -13.136 1.00 54.11 H new ATOM 1241 N LYS A 82 -3.331 12.334 -12.745 1.00 15.00 N ATOM 1242 CA LYS A 82 -3.601 13.779 -12.649 1.00 63.13 C ATOM 1243 C LYS A 82 -5.026 13.993 -12.111 1.00 35.35 C ATOM 1244 O LYS A 82 -5.991 14.123 -12.882 1.00 61.42 O ATOM 1245 CB LYS A 82 -3.427 14.482 -14.023 1.00 62.22 C ATOM 1246 CG LYS A 82 -2.005 14.401 -14.606 1.00 52.20 C ATOM 1247 CD LYS A 82 -1.912 15.058 -16.005 1.00 73.42 C ATOM 1248 CE LYS A 82 -0.580 14.773 -16.710 1.00 10.32 C ATOM 1249 NZ LYS A 82 -0.569 15.336 -18.090 1.00 1.14 N ATOM 0 H LYS A 82 -3.396 11.965 -13.694 1.00 15.00 H new ATOM 0 HA LYS A 82 -2.880 14.224 -11.963 1.00 63.13 H new ATOM 0 HB2 LYS A 82 -4.124 14.039 -14.735 1.00 62.22 H new ATOM 0 HB3 LYS A 82 -3.704 15.531 -13.918 1.00 62.22 H new ATOM 0 HG2 LYS A 82 -1.307 14.892 -13.928 1.00 52.20 H new ATOM 0 HG3 LYS A 82 -1.701 13.357 -14.675 1.00 52.20 H new ATOM 0 HD2 LYS A 82 -2.731 14.696 -16.626 1.00 73.42 H new ATOM 0 HD3 LYS A 82 -2.041 16.136 -15.904 1.00 73.42 H new ATOM 0 HE2 LYS A 82 0.239 15.202 -16.133 1.00 10.32 H new ATOM 0 HE3 LYS A 82 -0.411 13.697 -16.752 1.00 10.32 H new ATOM 0 HZ1 LYS A 82 0.276 15.000 -18.595 1.00 1.14 H new ATOM 0 HZ2 LYS A 82 -1.422 15.026 -18.598 1.00 1.14 H new ATOM 0 HZ3 LYS A 82 -0.553 16.375 -18.041 1.00 1.14 H new ATOM 1263 N VAL A 83 -5.152 13.937 -10.784 1.00 42.33 N ATOM 1264 CA VAL A 83 -6.412 14.168 -10.056 1.00 70.21 C ATOM 1265 C VAL A 83 -6.154 15.148 -8.905 1.00 23.31 C ATOM 1266 O VAL A 83 -4.998 15.513 -8.643 1.00 14.30 O ATOM 1267 CB VAL A 83 -7.031 12.821 -9.509 1.00 42.14 C ATOM 1268 CG1 VAL A 83 -7.542 11.919 -10.654 1.00 72.21 C ATOM 1269 CG2 VAL A 83 -6.020 12.060 -8.613 1.00 3.12 C ATOM 0 H VAL A 83 -4.367 13.726 -10.168 1.00 42.33 H new ATOM 0 HA VAL A 83 -7.138 14.594 -10.749 1.00 70.21 H new ATOM 0 HB VAL A 83 -7.891 13.089 -8.895 1.00 42.14 H new ATOM 0 HG11 VAL A 83 -7.960 11.003 -10.237 1.00 72.21 H new ATOM 0 HG12 VAL A 83 -8.313 12.446 -11.216 1.00 72.21 H new ATOM 0 HG13 VAL A 83 -6.714 11.670 -11.318 1.00 72.21 H new ATOM 0 HG21 VAL A 83 -6.476 11.138 -8.252 1.00 3.12 H new ATOM 0 HG22 VAL A 83 -5.128 11.821 -9.192 1.00 3.12 H new ATOM 0 HG23 VAL A 83 -5.744 12.685 -7.764 1.00 3.12 H new ATOM 1279 N ASP A 84 -7.235 15.566 -8.225 1.00 4.33 N ATOM 1280 CA ASP A 84 -7.169 16.536 -7.115 1.00 34.51 C ATOM 1281 C ASP A 84 -6.360 15.929 -5.938 1.00 24.00 C ATOM 1282 O ASP A 84 -6.224 14.702 -5.854 1.00 45.50 O ATOM 1283 CB ASP A 84 -8.617 16.938 -6.672 1.00 72.24 C ATOM 1284 CG ASP A 84 -8.718 18.381 -6.126 1.00 61.40 C ATOM 1285 OD1 ASP A 84 -9.395 19.230 -6.750 1.00 13.00 O ATOM 1286 OD2 ASP A 84 -8.105 18.681 -5.086 1.00 43.23 O ATOM 0 H ASP A 84 -8.180 15.242 -8.428 1.00 4.33 H new ATOM 0 HA ASP A 84 -6.658 17.440 -7.445 1.00 34.51 H new ATOM 0 HB2 ASP A 84 -9.291 16.832 -7.522 1.00 72.24 H new ATOM 0 HB3 ASP A 84 -8.960 16.243 -5.905 1.00 72.24 H new ATOM 1291 N GLN A 85 -5.852 16.787 -5.038 1.00 15.42 N ATOM 1292 CA GLN A 85 -4.928 16.375 -3.961 1.00 42.32 C ATOM 1293 C GLN A 85 -5.561 15.314 -2.997 1.00 32.12 C ATOM 1294 O GLN A 85 -4.924 14.279 -2.759 1.00 75.40 O ATOM 1295 CB GLN A 85 -4.370 17.615 -3.188 1.00 71.44 C ATOM 1296 CG GLN A 85 -3.303 17.270 -2.126 1.00 24.24 C ATOM 1297 CD GLN A 85 -2.062 16.572 -2.701 1.00 30.34 C ATOM 1298 OE1 GLN A 85 -1.650 16.822 -3.835 1.00 32.11 O ATOM 1299 NE2 GLN A 85 -1.483 15.669 -1.934 1.00 35.44 N ATOM 0 H GLN A 85 -6.068 17.784 -5.034 1.00 15.42 H new ATOM 0 HA GLN A 85 -4.083 15.879 -4.439 1.00 42.32 H new ATOM 0 HB2 GLN A 85 -3.940 18.313 -3.906 1.00 71.44 H new ATOM 0 HB3 GLN A 85 -5.199 18.129 -2.701 1.00 71.44 H new ATOM 0 HG2 GLN A 85 -2.993 18.187 -1.624 1.00 24.24 H new ATOM 0 HG3 GLN A 85 -3.752 16.628 -1.368 1.00 24.24 H new ATOM 0 HE21 GLN A 85 -1.847 15.484 -0.999 1.00 35.44 H new ATOM 0 HE22 GLN A 85 -0.671 15.155 -2.275 1.00 35.44 H new ATOM 1308 N PRO A 86 -6.814 15.518 -2.440 1.00 44.42 N ATOM 1309 CA PRO A 86 -7.513 14.453 -1.664 1.00 23.12 C ATOM 1310 C PRO A 86 -7.789 13.179 -2.494 1.00 2.45 C ATOM 1311 O PRO A 86 -7.736 12.064 -1.967 1.00 53.52 O ATOM 1312 CB PRO A 86 -8.844 15.123 -1.231 1.00 13.24 C ATOM 1313 CG PRO A 86 -8.558 16.591 -1.280 1.00 34.03 C ATOM 1314 CD PRO A 86 -7.619 16.773 -2.447 1.00 4.31 C ATOM 0 HA PRO A 86 -6.904 14.108 -0.829 1.00 23.12 H new ATOM 0 HB2 PRO A 86 -9.660 14.855 -1.902 1.00 13.24 H new ATOM 0 HB3 PRO A 86 -9.139 14.809 -0.230 1.00 13.24 H new ATOM 0 HG2 PRO A 86 -9.474 17.166 -1.418 1.00 34.03 H new ATOM 0 HG3 PRO A 86 -8.103 16.935 -0.351 1.00 34.03 H new ATOM 0 HD2 PRO A 86 -8.162 16.897 -3.384 1.00 4.31 H new ATOM 0 HD3 PRO A 86 -6.990 17.655 -2.323 1.00 4.31 H new ATOM 1322 N THR A 87 -8.051 13.375 -3.805 1.00 63.31 N ATOM 1323 CA THR A 87 -8.411 12.292 -4.741 1.00 34.23 C ATOM 1324 C THR A 87 -7.217 11.332 -4.983 1.00 53.24 C ATOM 1325 O THR A 87 -7.414 10.138 -5.231 1.00 65.51 O ATOM 1326 CB THR A 87 -8.927 12.893 -6.090 1.00 64.25 C ATOM 1327 OG1 THR A 87 -9.843 13.958 -5.806 1.00 0.14 O ATOM 1328 CG2 THR A 87 -9.633 11.851 -6.981 1.00 21.53 C ATOM 0 H THR A 87 -8.018 14.295 -4.244 1.00 63.31 H new ATOM 0 HA THR A 87 -9.213 11.707 -4.291 1.00 34.23 H new ATOM 0 HB THR A 87 -8.056 13.253 -6.638 1.00 64.25 H new ATOM 0 HG1 THR A 87 -10.170 14.341 -6.647 1.00 0.14 H new ATOM 0 HG21 THR A 87 -9.969 12.328 -7.902 1.00 21.53 H new ATOM 0 HG22 THR A 87 -8.938 11.047 -7.221 1.00 21.53 H new ATOM 0 HG23 THR A 87 -10.493 11.441 -6.451 1.00 21.53 H new ATOM 1336 N LEU A 88 -5.985 11.881 -4.898 1.00 13.13 N ATOM 1337 CA LEU A 88 -4.730 11.089 -4.901 1.00 2.41 C ATOM 1338 C LEU A 88 -4.733 10.075 -3.742 1.00 13.44 C ATOM 1339 O LEU A 88 -4.461 8.888 -3.941 1.00 3.24 O ATOM 1340 CB LEU A 88 -3.504 12.040 -4.779 1.00 0.33 C ATOM 1341 CG LEU A 88 -3.191 12.907 -6.039 1.00 41.13 C ATOM 1342 CD1 LEU A 88 -2.211 14.048 -5.701 1.00 13.14 C ATOM 1343 CD2 LEU A 88 -2.643 12.025 -7.186 1.00 1.54 C ATOM 0 H LEU A 88 -5.830 12.887 -4.825 1.00 13.13 H new ATOM 0 HA LEU A 88 -4.662 10.541 -5.841 1.00 2.41 H new ATOM 0 HB2 LEU A 88 -3.668 12.708 -3.933 1.00 0.33 H new ATOM 0 HB3 LEU A 88 -2.624 11.440 -4.546 1.00 0.33 H new ATOM 0 HG LEU A 88 -4.123 13.362 -6.375 1.00 41.13 H new ATOM 0 HD11 LEU A 88 -2.012 14.634 -6.598 1.00 13.14 H new ATOM 0 HD12 LEU A 88 -2.650 14.690 -4.937 1.00 13.14 H new ATOM 0 HD13 LEU A 88 -1.277 13.627 -5.328 1.00 13.14 H new ATOM 0 HD21 LEU A 88 -2.431 12.648 -8.055 1.00 1.54 H new ATOM 0 HD22 LEU A 88 -1.727 11.533 -6.860 1.00 1.54 H new ATOM 0 HD23 LEU A 88 -3.385 11.272 -7.452 1.00 1.54 H new ATOM 1355 N PHE A 89 -5.092 10.572 -2.544 1.00 71.35 N ATOM 1356 CA PHE A 89 -5.172 9.758 -1.318 1.00 42.41 C ATOM 1357 C PHE A 89 -6.319 8.740 -1.400 1.00 60.33 C ATOM 1358 O PHE A 89 -6.228 7.674 -0.808 1.00 1.35 O ATOM 1359 CB PHE A 89 -5.324 10.659 -0.068 1.00 22.12 C ATOM 1360 CG PHE A 89 -4.122 11.576 0.176 1.00 74.44 C ATOM 1361 CD1 PHE A 89 -2.892 11.044 0.558 1.00 43.32 C ATOM 1362 CD2 PHE A 89 -4.222 12.960 0.030 1.00 0.25 C ATOM 1363 CE1 PHE A 89 -1.806 11.866 0.789 1.00 41.33 C ATOM 1364 CE2 PHE A 89 -3.135 13.781 0.260 1.00 13.12 C ATOM 1365 CZ PHE A 89 -1.929 13.235 0.640 1.00 22.25 C ATOM 0 H PHE A 89 -5.335 11.552 -2.399 1.00 71.35 H new ATOM 0 HA PHE A 89 -4.239 9.202 -1.226 1.00 42.41 H new ATOM 0 HB2 PHE A 89 -6.220 11.270 -0.177 1.00 22.12 H new ATOM 0 HB3 PHE A 89 -5.473 10.028 0.808 1.00 22.12 H new ATOM 0 HD1 PHE A 89 -2.786 9.976 0.675 1.00 43.32 H new ATOM 0 HD2 PHE A 89 -5.164 13.396 -0.268 1.00 0.25 H new ATOM 0 HE1 PHE A 89 -0.860 11.439 1.086 1.00 41.33 H new ATOM 0 HE2 PHE A 89 -3.231 14.850 0.142 1.00 13.12 H new ATOM 0 HZ PHE A 89 -1.079 13.876 0.822 1.00 22.25 H new ATOM 1375 N GLU A 90 -7.389 9.088 -2.136 1.00 44.51 N ATOM 1376 CA GLU A 90 -8.520 8.171 -2.403 1.00 21.23 C ATOM 1377 C GLU A 90 -8.066 6.954 -3.232 1.00 24.12 C ATOM 1378 O GLU A 90 -8.501 5.826 -2.980 1.00 5.04 O ATOM 1379 CB GLU A 90 -9.658 8.907 -3.146 1.00 73.42 C ATOM 1380 CG GLU A 90 -10.310 10.061 -2.369 1.00 30.12 C ATOM 1381 CD GLU A 90 -11.018 9.616 -1.079 1.00 53.30 C ATOM 1382 OE1 GLU A 90 -12.175 9.145 -1.153 1.00 53.44 O ATOM 1383 OE2 GLU A 90 -10.427 9.754 0.019 1.00 2.24 O ATOM 0 H GLU A 90 -7.498 10.008 -2.563 1.00 44.51 H new ATOM 0 HA GLU A 90 -8.890 7.820 -1.440 1.00 21.23 H new ATOM 0 HB2 GLU A 90 -9.264 9.299 -4.083 1.00 73.42 H new ATOM 0 HB3 GLU A 90 -10.430 8.182 -3.403 1.00 73.42 H new ATOM 0 HG2 GLU A 90 -9.545 10.796 -2.118 1.00 30.12 H new ATOM 0 HG3 GLU A 90 -11.032 10.560 -3.015 1.00 30.12 H new ATOM 1390 N LEU A 91 -7.196 7.210 -4.231 1.00 4.15 N ATOM 1391 CA LEU A 91 -6.592 6.154 -5.072 1.00 43.51 C ATOM 1392 C LEU A 91 -5.659 5.257 -4.227 1.00 14.15 C ATOM 1393 O LEU A 91 -5.591 4.045 -4.442 1.00 44.14 O ATOM 1394 CB LEU A 91 -5.816 6.782 -6.271 1.00 0.44 C ATOM 1395 CG LEU A 91 -6.657 7.647 -7.278 1.00 75.53 C ATOM 1396 CD1 LEU A 91 -5.760 8.262 -8.388 1.00 70.41 C ATOM 1397 CD2 LEU A 91 -7.818 6.831 -7.893 1.00 14.35 C ATOM 0 H LEU A 91 -6.893 8.152 -4.477 1.00 4.15 H new ATOM 0 HA LEU A 91 -7.393 5.534 -5.473 1.00 43.51 H new ATOM 0 HB2 LEU A 91 -5.017 7.406 -5.870 1.00 0.44 H new ATOM 0 HB3 LEU A 91 -5.341 5.975 -6.829 1.00 0.44 H new ATOM 0 HG LEU A 91 -7.093 8.469 -6.710 1.00 75.53 H new ATOM 0 HD11 LEU A 91 -6.375 8.854 -9.066 1.00 70.41 H new ATOM 0 HD12 LEU A 91 -5.004 8.901 -7.932 1.00 70.41 H new ATOM 0 HD13 LEU A 91 -5.271 7.463 -8.945 1.00 70.41 H new ATOM 0 HD21 LEU A 91 -8.379 7.460 -8.584 1.00 14.35 H new ATOM 0 HD22 LEU A 91 -7.415 5.972 -8.429 1.00 14.35 H new ATOM 0 HD23 LEU A 91 -8.480 6.485 -7.099 1.00 14.35 H new ATOM 1409 N ILE A 92 -4.961 5.881 -3.251 1.00 51.15 N ATOM 1410 CA ILE A 92 -4.097 5.176 -2.275 1.00 74.20 C ATOM 1411 C ILE A 92 -4.957 4.290 -1.332 1.00 72.32 C ATOM 1412 O ILE A 92 -4.589 3.143 -1.044 1.00 52.40 O ATOM 1413 CB ILE A 92 -3.224 6.207 -1.441 1.00 73.42 C ATOM 1414 CG1 ILE A 92 -2.264 7.007 -2.389 1.00 73.10 C ATOM 1415 CG2 ILE A 92 -2.428 5.513 -0.304 1.00 41.15 C ATOM 1416 CD1 ILE A 92 -1.439 8.092 -1.705 1.00 23.22 C ATOM 0 H ILE A 92 -4.981 6.892 -3.117 1.00 51.15 H new ATOM 0 HA ILE A 92 -3.414 4.530 -2.826 1.00 74.20 H new ATOM 0 HB ILE A 92 -3.911 6.908 -0.967 1.00 73.42 H new ATOM 0 HG12 ILE A 92 -1.584 6.304 -2.870 1.00 73.10 H new ATOM 0 HG13 ILE A 92 -2.858 7.467 -3.179 1.00 73.10 H new ATOM 0 HG21 ILE A 92 -1.846 6.257 0.239 1.00 41.15 H new ATOM 0 HG22 ILE A 92 -3.122 5.025 0.380 1.00 41.15 H new ATOM 0 HG23 ILE A 92 -1.757 4.769 -0.732 1.00 41.15 H new ATOM 0 HD11 ILE A 92 -0.808 8.588 -2.442 1.00 23.22 H new ATOM 0 HD12 ILE A 92 -2.106 8.823 -1.248 1.00 23.22 H new ATOM 0 HD13 ILE A 92 -0.813 7.642 -0.935 1.00 23.22 H new ATOM 1428 N LEU A 93 -6.124 4.825 -0.897 1.00 73.25 N ATOM 1429 CA LEU A 93 -7.068 4.117 0.002 1.00 34.33 C ATOM 1430 C LEU A 93 -7.647 2.867 -0.694 1.00 22.31 C ATOM 1431 O LEU A 93 -7.680 1.787 -0.106 1.00 35.14 O ATOM 1432 CB LEU A 93 -8.225 5.067 0.473 1.00 53.04 C ATOM 1433 CG LEU A 93 -7.840 6.195 1.496 1.00 52.54 C ATOM 1434 CD1 LEU A 93 -9.052 7.096 1.841 1.00 62.04 C ATOM 1435 CD2 LEU A 93 -7.218 5.601 2.779 1.00 32.51 C ATOM 0 H LEU A 93 -6.437 5.760 -1.160 1.00 73.25 H new ATOM 0 HA LEU A 93 -6.513 3.799 0.885 1.00 34.33 H new ATOM 0 HB2 LEU A 93 -8.657 5.540 -0.409 1.00 53.04 H new ATOM 0 HB3 LEU A 93 -9.007 4.454 0.921 1.00 53.04 H new ATOM 0 HG LEU A 93 -7.090 6.821 1.013 1.00 52.54 H new ATOM 0 HD11 LEU A 93 -8.744 7.863 2.551 1.00 62.04 H new ATOM 0 HD12 LEU A 93 -9.423 7.570 0.932 1.00 62.04 H new ATOM 0 HD13 LEU A 93 -9.843 6.489 2.282 1.00 62.04 H new ATOM 0 HD21 LEU A 93 -6.963 6.407 3.467 1.00 32.51 H new ATOM 0 HD22 LEU A 93 -7.935 4.932 3.255 1.00 32.51 H new ATOM 0 HD23 LEU A 93 -6.317 5.044 2.522 1.00 32.51 H new ATOM 1447 N ALA A 94 -8.067 3.037 -1.965 1.00 14.43 N ATOM 1448 CA ALA A 94 -8.658 1.959 -2.787 1.00 33.14 C ATOM 1449 C ALA A 94 -7.618 0.884 -3.152 1.00 62.25 C ATOM 1450 O ALA A 94 -7.943 -0.304 -3.226 1.00 42.41 O ATOM 1451 CB ALA A 94 -9.280 2.553 -4.060 1.00 13.42 C ATOM 0 H ALA A 94 -8.006 3.931 -2.453 1.00 14.43 H new ATOM 0 HA ALA A 94 -9.435 1.475 -2.196 1.00 33.14 H new ATOM 0 HB1 ALA A 94 -9.713 1.753 -4.661 1.00 13.42 H new ATOM 0 HB2 ALA A 94 -10.059 3.264 -3.786 1.00 13.42 H new ATOM 0 HB3 ALA A 94 -8.509 3.063 -4.637 1.00 13.42 H new ATOM 1457 N ALA A 95 -6.369 1.326 -3.377 1.00 70.42 N ATOM 1458 CA ALA A 95 -5.243 0.432 -3.708 1.00 70.34 C ATOM 1459 C ALA A 95 -4.831 -0.424 -2.502 1.00 21.01 C ATOM 1460 O ALA A 95 -4.470 -1.580 -2.665 1.00 13.43 O ATOM 1461 CB ALA A 95 -4.054 1.246 -4.207 1.00 73.22 C ATOM 0 H ALA A 95 -6.110 2.312 -3.335 1.00 70.42 H new ATOM 0 HA ALA A 95 -5.573 -0.242 -4.498 1.00 70.34 H new ATOM 0 HB1 ALA A 95 -3.229 0.575 -4.448 1.00 73.22 H new ATOM 0 HB2 ALA A 95 -4.342 1.802 -5.099 1.00 73.22 H new ATOM 0 HB3 ALA A 95 -3.739 1.944 -3.431 1.00 73.22 H new ATOM 1467 N ASN A 96 -4.877 0.177 -1.298 1.00 44.42 N ATOM 1468 CA ASN A 96 -4.592 -0.526 -0.023 1.00 43.22 C ATOM 1469 C ASN A 96 -5.754 -1.483 0.330 1.00 31.51 C ATOM 1470 O ASN A 96 -5.542 -2.585 0.847 1.00 11.00 O ATOM 1471 CB ASN A 96 -4.365 0.525 1.114 1.00 2.42 C ATOM 1472 CG ASN A 96 -4.059 -0.068 2.504 1.00 62.02 C ATOM 1473 OD1 ASN A 96 -3.482 -1.150 2.633 1.00 72.43 O ATOM 1474 ND2 ASN A 96 -4.418 0.657 3.559 1.00 51.14 N ATOM 0 H ASN A 96 -5.112 1.162 -1.177 1.00 44.42 H new ATOM 0 HA ASN A 96 -3.686 -1.123 -0.131 1.00 43.22 H new ATOM 0 HB2 ASN A 96 -3.540 1.177 0.825 1.00 2.42 H new ATOM 0 HB3 ASN A 96 -5.254 1.151 1.191 1.00 2.42 H new ATOM 0 HD21 ASN A 96 -4.217 0.321 4.501 1.00 51.14 H new ATOM 0 HD22 ASN A 96 -4.894 1.549 3.426 1.00 51.14 H new ATOM 1481 N TYR A 97 -6.982 -1.043 -0.005 1.00 25.41 N ATOM 1482 CA TYR A 97 -8.230 -1.776 0.289 1.00 42.23 C ATOM 1483 C TYR A 97 -8.357 -3.047 -0.573 1.00 35.12 C ATOM 1484 O TYR A 97 -8.824 -4.086 -0.093 1.00 61.35 O ATOM 1485 CB TYR A 97 -9.450 -0.839 0.065 1.00 30.24 C ATOM 1486 CG TYR A 97 -10.820 -1.462 0.379 1.00 12.44 C ATOM 1487 CD1 TYR A 97 -11.792 -1.636 -0.614 1.00 44.23 C ATOM 1488 CD2 TYR A 97 -11.136 -1.880 1.675 1.00 43.00 C ATOM 1489 CE1 TYR A 97 -13.023 -2.197 -0.325 1.00 24.21 C ATOM 1490 CE2 TYR A 97 -12.364 -2.444 1.964 1.00 42.32 C ATOM 1491 CZ TYR A 97 -13.304 -2.600 0.964 1.00 61.52 C ATOM 1492 OH TYR A 97 -14.535 -3.155 1.258 1.00 14.30 O ATOM 0 H TYR A 97 -7.138 -0.160 -0.492 1.00 25.41 H new ATOM 0 HA TYR A 97 -8.204 -2.093 1.332 1.00 42.23 H new ATOM 0 HB2 TYR A 97 -9.323 0.050 0.682 1.00 30.24 H new ATOM 0 HB3 TYR A 97 -9.448 -0.509 -0.974 1.00 30.24 H new ATOM 0 HD1 TYR A 97 -11.576 -1.326 -1.626 1.00 44.23 H new ATOM 0 HD2 TYR A 97 -10.408 -1.760 2.464 1.00 43.00 H new ATOM 0 HE1 TYR A 97 -13.760 -2.319 -1.105 1.00 24.21 H new ATOM 0 HE2 TYR A 97 -12.589 -2.763 2.971 1.00 42.32 H new ATOM 0 HH TYR A 97 -14.571 -3.386 2.210 1.00 14.30 H new ATOM 1502 N LEU A 98 -7.961 -2.948 -1.855 1.00 44.53 N ATOM 1503 CA LEU A 98 -8.030 -4.071 -2.820 1.00 20.15 C ATOM 1504 C LEU A 98 -6.659 -4.773 -2.978 1.00 25.32 C ATOM 1505 O LEU A 98 -6.554 -5.775 -3.702 1.00 65.45 O ATOM 1506 CB LEU A 98 -8.558 -3.564 -4.188 1.00 43.12 C ATOM 1507 CG LEU A 98 -9.992 -2.946 -4.181 1.00 61.32 C ATOM 1508 CD1 LEU A 98 -10.390 -2.434 -5.587 1.00 3.35 C ATOM 1509 CD2 LEU A 98 -11.035 -3.950 -3.630 1.00 24.31 C ATOM 0 H LEU A 98 -7.584 -2.089 -2.255 1.00 44.53 H new ATOM 0 HA LEU A 98 -8.726 -4.813 -2.429 1.00 20.15 H new ATOM 0 HB2 LEU A 98 -7.863 -2.816 -4.569 1.00 43.12 H new ATOM 0 HB3 LEU A 98 -8.546 -4.397 -4.891 1.00 43.12 H new ATOM 0 HG LEU A 98 -9.978 -2.087 -3.510 1.00 61.32 H new ATOM 0 HD11 LEU A 98 -11.393 -2.010 -5.549 1.00 3.35 H new ATOM 0 HD12 LEU A 98 -9.684 -1.668 -5.909 1.00 3.35 H new ATOM 0 HD13 LEU A 98 -10.373 -3.263 -6.294 1.00 3.35 H new ATOM 0 HD21 LEU A 98 -12.023 -3.490 -3.638 1.00 24.31 H new ATOM 0 HD22 LEU A 98 -11.046 -4.843 -4.255 1.00 24.31 H new ATOM 0 HD23 LEU A 98 -10.771 -4.225 -2.609 1.00 24.31 H new ATOM 1521 N ASP A 99 -5.643 -4.233 -2.274 1.00 13.13 N ATOM 1522 CA ASP A 99 -4.235 -4.705 -2.295 1.00 33.31 C ATOM 1523 C ASP A 99 -3.665 -4.753 -3.740 1.00 12.01 C ATOM 1524 O ASP A 99 -2.936 -5.682 -4.131 1.00 70.44 O ATOM 1525 CB ASP A 99 -4.067 -6.060 -1.534 1.00 73.32 C ATOM 1526 CG ASP A 99 -2.588 -6.411 -1.223 1.00 22.54 C ATOM 1527 OD1 ASP A 99 -1.836 -5.516 -0.769 1.00 64.43 O ATOM 1528 OD2 ASP A 99 -2.168 -7.580 -1.388 1.00 1.52 O ATOM 0 H ASP A 99 -5.779 -3.433 -1.656 1.00 13.13 H new ATOM 0 HA ASP A 99 -3.637 -3.972 -1.753 1.00 33.31 H new ATOM 0 HB2 ASP A 99 -4.627 -6.016 -0.600 1.00 73.32 H new ATOM 0 HB3 ASP A 99 -4.505 -6.860 -2.130 1.00 73.32 H new ATOM 1533 N ILE A 100 -4.015 -3.718 -4.526 1.00 12.23 N ATOM 1534 CA ILE A 100 -3.469 -3.515 -5.872 1.00 31.04 C ATOM 1535 C ILE A 100 -2.162 -2.723 -5.743 1.00 33.24 C ATOM 1536 O ILE A 100 -2.157 -1.484 -5.781 1.00 34.50 O ATOM 1537 CB ILE A 100 -4.480 -2.769 -6.825 1.00 61.10 C ATOM 1538 CG1 ILE A 100 -5.877 -3.455 -6.772 1.00 33.54 C ATOM 1539 CG2 ILE A 100 -3.937 -2.719 -8.284 1.00 30.05 C ATOM 1540 CD1 ILE A 100 -6.962 -2.752 -7.563 1.00 20.51 C ATOM 0 H ILE A 100 -4.684 -3.002 -4.242 1.00 12.23 H new ATOM 0 HA ILE A 100 -3.285 -4.488 -6.327 1.00 31.04 H new ATOM 0 HB ILE A 100 -4.588 -1.742 -6.477 1.00 61.10 H new ATOM 0 HG12 ILE A 100 -5.779 -4.475 -7.144 1.00 33.54 H new ATOM 0 HG13 ILE A 100 -6.193 -3.524 -5.731 1.00 33.54 H new ATOM 0 HG21 ILE A 100 -4.653 -2.199 -8.921 1.00 30.05 H new ATOM 0 HG22 ILE A 100 -2.985 -2.188 -8.300 1.00 30.05 H new ATOM 0 HG23 ILE A 100 -3.793 -3.734 -8.653 1.00 30.05 H new ATOM 0 HD11 ILE A 100 -7.898 -3.303 -7.466 1.00 20.51 H new ATOM 0 HD12 ILE A 100 -7.095 -1.741 -7.179 1.00 20.51 H new ATOM 0 HD13 ILE A 100 -6.675 -2.707 -8.614 1.00 20.51 H new ATOM 1552 N LYS A 101 -1.072 -3.474 -5.526 1.00 53.34 N ATOM 1553 CA LYS A 101 0.293 -2.931 -5.401 1.00 61.52 C ATOM 1554 C LYS A 101 0.752 -2.181 -6.688 1.00 61.32 C ATOM 1555 O LYS A 101 1.442 -1.177 -6.558 1.00 74.44 O ATOM 1556 CB LYS A 101 1.311 -4.051 -5.037 1.00 64.34 C ATOM 1557 CG LYS A 101 0.860 -4.977 -3.882 1.00 73.21 C ATOM 1558 CD LYS A 101 1.959 -5.992 -3.475 1.00 72.40 C ATOM 1559 CE LYS A 101 1.436 -7.136 -2.593 1.00 42.44 C ATOM 1560 NZ LYS A 101 0.744 -6.649 -1.385 1.00 52.31 N ATOM 0 H LYS A 101 -1.112 -4.489 -5.431 1.00 53.34 H new ATOM 0 HA LYS A 101 0.266 -2.204 -4.590 1.00 61.52 H new ATOM 0 HB2 LYS A 101 1.495 -4.659 -5.923 1.00 64.34 H new ATOM 0 HB3 LYS A 101 2.260 -3.588 -4.765 1.00 64.34 H new ATOM 0 HG2 LYS A 101 0.591 -4.370 -3.017 1.00 73.21 H new ATOM 0 HG3 LYS A 101 -0.037 -5.518 -4.183 1.00 73.21 H new ATOM 0 HD2 LYS A 101 2.406 -6.413 -4.376 1.00 72.40 H new ATOM 0 HD3 LYS A 101 2.751 -5.465 -2.942 1.00 72.40 H new ATOM 0 HE2 LYS A 101 0.752 -7.755 -3.174 1.00 42.44 H new ATOM 0 HE3 LYS A 101 2.270 -7.773 -2.298 1.00 42.44 H new ATOM 0 HZ1 LYS A 101 0.456 -7.459 -0.800 1.00 52.31 H new ATOM 0 HZ2 LYS A 101 1.386 -6.039 -0.840 1.00 52.31 H new ATOM 0 HZ3 LYS A 101 -0.098 -6.105 -1.663 1.00 52.31 H new ATOM 1574 N PRO A 102 0.418 -2.670 -7.957 1.00 54.32 N ATOM 1575 CA PRO A 102 0.645 -1.882 -9.209 1.00 72.13 C ATOM 1576 C PRO A 102 0.153 -0.415 -9.133 1.00 31.42 C ATOM 1577 O PRO A 102 0.942 0.519 -9.324 1.00 51.11 O ATOM 1578 CB PRO A 102 -0.171 -2.667 -10.263 1.00 61.13 C ATOM 1579 CG PRO A 102 -0.076 -4.089 -9.812 1.00 62.01 C ATOM 1580 CD PRO A 102 -0.095 -4.043 -8.298 1.00 50.43 C ATOM 0 HA PRO A 102 1.709 -1.789 -9.427 1.00 72.13 H new ATOM 0 HB2 PRO A 102 -1.206 -2.328 -10.299 1.00 61.13 H new ATOM 0 HB3 PRO A 102 0.241 -2.538 -11.264 1.00 61.13 H new ATOM 0 HG2 PRO A 102 -0.909 -4.678 -10.196 1.00 62.01 H new ATOM 0 HG3 PRO A 102 0.839 -4.555 -10.178 1.00 62.01 H new ATOM 0 HD2 PRO A 102 -1.101 -4.199 -7.909 1.00 50.43 H new ATOM 0 HD3 PRO A 102 0.537 -4.821 -7.869 1.00 50.43 H new ATOM 1588 N LEU A 103 -1.148 -0.239 -8.812 1.00 21.51 N ATOM 1589 CA LEU A 103 -1.792 1.089 -8.775 1.00 53.02 C ATOM 1590 C LEU A 103 -1.218 1.913 -7.622 1.00 30.15 C ATOM 1591 O LEU A 103 -0.929 3.098 -7.791 1.00 55.32 O ATOM 1592 CB LEU A 103 -3.350 0.949 -8.669 1.00 41.43 C ATOM 1593 CG LEU A 103 -4.229 2.266 -8.783 1.00 64.51 C ATOM 1594 CD1 LEU A 103 -4.440 2.979 -7.427 1.00 61.13 C ATOM 1595 CD2 LEU A 103 -3.647 3.250 -9.824 1.00 33.33 C ATOM 0 H LEU A 103 -1.775 -1.007 -8.574 1.00 21.51 H new ATOM 0 HA LEU A 103 -1.579 1.615 -9.706 1.00 53.02 H new ATOM 0 HB2 LEU A 103 -3.677 0.262 -9.449 1.00 41.43 H new ATOM 0 HB3 LEU A 103 -3.578 0.478 -7.713 1.00 41.43 H new ATOM 0 HG LEU A 103 -5.210 1.935 -9.123 1.00 64.51 H new ATOM 0 HD11 LEU A 103 -5.049 3.871 -7.576 1.00 61.13 H new ATOM 0 HD12 LEU A 103 -4.947 2.305 -6.736 1.00 61.13 H new ATOM 0 HD13 LEU A 103 -3.473 3.264 -7.012 1.00 61.13 H new ATOM 0 HD21 LEU A 103 -4.275 4.140 -9.875 1.00 33.33 H new ATOM 0 HD22 LEU A 103 -2.637 3.535 -9.530 1.00 33.33 H new ATOM 0 HD23 LEU A 103 -3.618 2.770 -10.802 1.00 33.33 H new ATOM 1607 N LEU A 104 -1.024 1.248 -6.472 1.00 12.34 N ATOM 1608 CA LEU A 104 -0.477 1.871 -5.261 1.00 24.44 C ATOM 1609 C LEU A 104 0.918 2.453 -5.532 1.00 32.00 C ATOM 1610 O LEU A 104 1.193 3.595 -5.181 1.00 40.12 O ATOM 1611 CB LEU A 104 -0.415 0.830 -4.113 1.00 70.22 C ATOM 1612 CG LEU A 104 0.040 1.361 -2.718 1.00 11.12 C ATOM 1613 CD1 LEU A 104 -0.902 2.476 -2.201 1.00 65.10 C ATOM 1614 CD2 LEU A 104 0.147 0.198 -1.707 1.00 0.21 C ATOM 0 H LEU A 104 -1.244 0.259 -6.358 1.00 12.34 H new ATOM 0 HA LEU A 104 -1.134 2.688 -4.963 1.00 24.44 H new ATOM 0 HB2 LEU A 104 -1.403 0.384 -4.003 1.00 70.22 H new ATOM 0 HB3 LEU A 104 0.264 0.031 -4.412 1.00 70.22 H new ATOM 0 HG LEU A 104 1.029 1.805 -2.830 1.00 11.12 H new ATOM 0 HD11 LEU A 104 -0.555 2.823 -1.227 1.00 65.10 H new ATOM 0 HD12 LEU A 104 -0.900 3.309 -2.904 1.00 65.10 H new ATOM 0 HD13 LEU A 104 -1.914 2.083 -2.107 1.00 65.10 H new ATOM 0 HD21 LEU A 104 0.465 0.585 -0.739 1.00 0.21 H new ATOM 0 HD22 LEU A 104 -0.825 -0.284 -1.603 1.00 0.21 H new ATOM 0 HD23 LEU A 104 0.876 -0.529 -2.065 1.00 0.21 H new ATOM 1626 N ASP A 105 1.747 1.663 -6.234 1.00 2.22 N ATOM 1627 CA ASP A 105 3.151 2.002 -6.522 1.00 2.23 C ATOM 1628 C ASP A 105 3.242 3.182 -7.502 1.00 74.10 C ATOM 1629 O ASP A 105 4.029 4.096 -7.293 1.00 62.42 O ATOM 1630 CB ASP A 105 3.896 0.765 -7.091 1.00 52.14 C ATOM 1631 CG ASP A 105 5.408 1.002 -7.255 1.00 63.24 C ATOM 1632 OD1 ASP A 105 6.133 0.980 -6.232 1.00 72.42 O ATOM 1633 OD2 ASP A 105 5.882 1.234 -8.394 1.00 54.55 O ATOM 0 H ASP A 105 1.460 0.764 -6.621 1.00 2.22 H new ATOM 0 HA ASP A 105 3.629 2.301 -5.589 1.00 2.23 H new ATOM 0 HB2 ASP A 105 3.736 -0.086 -6.429 1.00 52.14 H new ATOM 0 HB3 ASP A 105 3.467 0.501 -8.058 1.00 52.14 H new ATOM 1638 N VAL A 106 2.404 3.153 -8.552 1.00 15.55 N ATOM 1639 CA VAL A 106 2.375 4.206 -9.593 1.00 1.34 C ATOM 1640 C VAL A 106 1.801 5.533 -9.035 1.00 52.13 C ATOM 1641 O VAL A 106 2.275 6.615 -9.398 1.00 2.14 O ATOM 1642 CB VAL A 106 1.569 3.723 -10.857 1.00 42.22 C ATOM 1643 CG1 VAL A 106 1.352 4.852 -11.904 1.00 14.12 C ATOM 1644 CG2 VAL A 106 2.276 2.507 -11.505 1.00 0.33 C ATOM 0 H VAL A 106 1.729 2.404 -8.707 1.00 15.55 H new ATOM 0 HA VAL A 106 3.402 4.398 -9.903 1.00 1.34 H new ATOM 0 HB VAL A 106 0.579 3.427 -10.511 1.00 42.22 H new ATOM 0 HG11 VAL A 106 0.791 4.459 -12.752 1.00 14.12 H new ATOM 0 HG12 VAL A 106 0.794 5.669 -11.447 1.00 14.12 H new ATOM 0 HG13 VAL A 106 2.319 5.220 -12.248 1.00 14.12 H new ATOM 0 HG21 VAL A 106 1.711 2.180 -12.378 1.00 0.33 H new ATOM 0 HG22 VAL A 106 3.283 2.792 -11.810 1.00 0.33 H new ATOM 0 HG23 VAL A 106 2.332 1.692 -10.784 1.00 0.33 H new ATOM 1654 N THR A 107 0.801 5.441 -8.138 1.00 50.42 N ATOM 1655 CA THR A 107 0.227 6.626 -7.460 1.00 13.42 C ATOM 1656 C THR A 107 1.250 7.208 -6.458 1.00 52.33 C ATOM 1657 O THR A 107 1.398 8.432 -6.346 1.00 21.43 O ATOM 1658 CB THR A 107 -1.129 6.280 -6.742 1.00 22.14 C ATOM 1659 OG1 THR A 107 -2.050 5.726 -7.698 1.00 43.45 O ATOM 1660 CG2 THR A 107 -1.784 7.514 -6.089 1.00 61.25 C ATOM 0 H THR A 107 0.371 4.558 -7.863 1.00 50.42 H new ATOM 0 HA THR A 107 0.008 7.379 -8.217 1.00 13.42 H new ATOM 0 HB THR A 107 -0.900 5.563 -5.954 1.00 22.14 H new ATOM 0 HG1 THR A 107 -1.819 4.789 -7.870 1.00 43.45 H new ATOM 0 HG21 THR A 107 -2.716 7.219 -5.608 1.00 61.25 H new ATOM 0 HG22 THR A 107 -1.108 7.933 -5.344 1.00 61.25 H new ATOM 0 HG23 THR A 107 -1.991 8.263 -6.853 1.00 61.25 H new ATOM 1668 N CYS A 108 1.990 6.303 -5.783 1.00 71.43 N ATOM 1669 CA CYS A 108 3.074 6.671 -4.852 1.00 3.01 C ATOM 1670 C CYS A 108 4.269 7.280 -5.615 1.00 51.12 C ATOM 1671 O CYS A 108 4.973 8.132 -5.075 1.00 51.43 O ATOM 1672 CB CYS A 108 3.522 5.448 -4.019 1.00 63.13 C ATOM 1673 SG CYS A 108 2.264 4.827 -2.880 1.00 75.02 S ATOM 0 H CYS A 108 1.851 5.296 -5.869 1.00 71.43 H new ATOM 0 HA CYS A 108 2.689 7.426 -4.166 1.00 3.01 H new ATOM 0 HB2 CYS A 108 3.809 4.645 -4.698 1.00 63.13 H new ATOM 0 HB3 CYS A 108 4.411 5.717 -3.449 1.00 63.13 H new ATOM 0 HG CYS A 108 1.432 4.065 -3.526 1.00 75.02 H new ATOM 1679 N LYS A 109 4.470 6.847 -6.880 1.00 12.34 N ATOM 1680 CA LYS A 109 5.492 7.428 -7.773 1.00 24.00 C ATOM 1681 C LYS A 109 5.081 8.857 -8.161 1.00 11.23 C ATOM 1682 O LYS A 109 5.881 9.769 -8.044 1.00 74.24 O ATOM 1683 CB LYS A 109 5.723 6.548 -9.060 1.00 53.34 C ATOM 1684 CG LYS A 109 7.041 5.729 -9.085 1.00 2.24 C ATOM 1685 CD LYS A 109 7.080 4.586 -8.049 1.00 72.03 C ATOM 1686 CE LYS A 109 8.395 3.791 -8.100 1.00 14.44 C ATOM 1687 NZ LYS A 109 8.364 2.619 -7.184 1.00 62.40 N ATOM 0 H LYS A 109 3.933 6.092 -7.306 1.00 12.34 H new ATOM 0 HA LYS A 109 6.438 7.454 -7.233 1.00 24.00 H new ATOM 0 HB2 LYS A 109 4.885 5.858 -9.161 1.00 53.34 H new ATOM 0 HB3 LYS A 109 5.705 7.201 -9.933 1.00 53.34 H new ATOM 0 HG2 LYS A 109 7.179 5.309 -10.081 1.00 2.24 H new ATOM 0 HG3 LYS A 109 7.880 6.401 -8.903 1.00 2.24 H new ATOM 0 HD2 LYS A 109 6.948 5.001 -7.050 1.00 72.03 H new ATOM 0 HD3 LYS A 109 6.243 3.910 -8.226 1.00 72.03 H new ATOM 0 HE2 LYS A 109 8.576 3.451 -9.120 1.00 14.44 H new ATOM 0 HE3 LYS A 109 9.225 4.443 -7.829 1.00 14.44 H new ATOM 0 HZ1 LYS A 109 9.071 2.747 -6.432 1.00 62.40 H new ATOM 0 HZ2 LYS A 109 7.418 2.535 -6.760 1.00 62.40 H new ATOM 0 HZ3 LYS A 109 8.581 1.754 -7.719 1.00 62.40 H new ATOM 1701 N THR A 110 3.808 9.024 -8.587 1.00 3.51 N ATOM 1702 CA THR A 110 3.264 10.317 -9.056 1.00 3.01 C ATOM 1703 C THR A 110 3.376 11.406 -7.971 1.00 14.43 C ATOM 1704 O THR A 110 3.921 12.487 -8.226 1.00 10.44 O ATOM 1705 CB THR A 110 1.771 10.174 -9.501 1.00 73.32 C ATOM 1706 OG1 THR A 110 1.679 9.192 -10.544 1.00 31.32 O ATOM 1707 CG2 THR A 110 1.160 11.510 -9.997 1.00 41.43 C ATOM 0 H THR A 110 3.129 8.264 -8.615 1.00 3.51 H new ATOM 0 HA THR A 110 3.863 10.619 -9.915 1.00 3.01 H new ATOM 0 HB THR A 110 1.201 9.865 -8.625 1.00 73.32 H new ATOM 0 HG1 THR A 110 1.880 8.306 -10.177 1.00 31.32 H new ATOM 0 HG21 THR A 110 0.123 11.349 -10.292 1.00 41.43 H new ATOM 0 HG22 THR A 110 1.199 12.248 -9.195 1.00 41.43 H new ATOM 0 HG23 THR A 110 1.728 11.874 -10.853 1.00 41.43 H new ATOM 1715 N VAL A 111 2.878 11.092 -6.756 1.00 22.11 N ATOM 1716 CA VAL A 111 2.889 12.033 -5.623 1.00 31.21 C ATOM 1717 C VAL A 111 4.334 12.358 -5.194 1.00 3.13 C ATOM 1718 O VAL A 111 4.627 13.497 -4.809 1.00 64.21 O ATOM 1719 CB VAL A 111 2.035 11.512 -4.403 1.00 31.21 C ATOM 1720 CG1 VAL A 111 0.543 11.351 -4.791 1.00 42.12 C ATOM 1721 CG2 VAL A 111 2.602 10.196 -3.828 1.00 74.22 C ATOM 0 H VAL A 111 2.461 10.187 -6.537 1.00 22.11 H new ATOM 0 HA VAL A 111 2.417 12.954 -5.966 1.00 31.21 H new ATOM 0 HB VAL A 111 2.100 12.266 -3.619 1.00 31.21 H new ATOM 0 HG11 VAL A 111 -0.020 10.991 -3.930 1.00 42.12 H new ATOM 0 HG12 VAL A 111 0.144 12.314 -5.108 1.00 42.12 H new ATOM 0 HG13 VAL A 111 0.455 10.635 -5.608 1.00 42.12 H new ATOM 0 HG21 VAL A 111 1.986 9.870 -2.990 1.00 74.22 H new ATOM 0 HG22 VAL A 111 2.597 9.429 -4.602 1.00 74.22 H new ATOM 0 HG23 VAL A 111 3.624 10.359 -3.486 1.00 74.22 H new ATOM 1731 N ALA A 112 5.236 11.355 -5.320 1.00 4.31 N ATOM 1732 CA ALA A 112 6.675 11.533 -5.063 1.00 35.44 C ATOM 1733 C ALA A 112 7.306 12.452 -6.123 1.00 4.22 C ATOM 1734 O ALA A 112 8.113 13.305 -5.794 1.00 75.25 O ATOM 1735 CB ALA A 112 7.393 10.176 -5.021 1.00 51.12 C ATOM 0 H ALA A 112 4.983 10.408 -5.601 1.00 4.31 H new ATOM 0 HA ALA A 112 6.791 12.007 -4.088 1.00 35.44 H new ATOM 0 HB1 ALA A 112 8.455 10.332 -4.830 1.00 51.12 H new ATOM 0 HB2 ALA A 112 6.967 9.564 -4.226 1.00 51.12 H new ATOM 0 HB3 ALA A 112 7.267 9.668 -5.977 1.00 51.12 H new ATOM 1741 N ASN A 113 6.877 12.303 -7.393 1.00 33.03 N ATOM 1742 CA ASN A 113 7.441 13.069 -8.530 1.00 74.03 C ATOM 1743 C ASN A 113 7.046 14.552 -8.462 1.00 43.33 C ATOM 1744 O ASN A 113 7.762 15.403 -8.995 1.00 1.02 O ATOM 1745 CB ASN A 113 7.000 12.471 -9.903 1.00 43.33 C ATOM 1746 CG ASN A 113 7.562 11.070 -10.182 1.00 4.43 C ATOM 1747 OD1 ASN A 113 8.642 10.705 -9.712 1.00 32.21 O ATOM 1748 ND2 ASN A 113 6.833 10.271 -10.953 1.00 1.51 N ATOM 0 H ASN A 113 6.136 11.655 -7.661 1.00 33.03 H new ATOM 0 HA ASN A 113 8.525 12.992 -8.450 1.00 74.03 H new ATOM 0 HB2 ASN A 113 5.911 12.428 -9.936 1.00 43.33 H new ATOM 0 HB3 ASN A 113 7.317 13.144 -10.700 1.00 43.33 H new ATOM 0 HD21 ASN A 113 7.163 9.330 -11.169 1.00 1.51 H new ATOM 0 HD22 ASN A 113 5.943 10.598 -11.329 1.00 1.51 H new ATOM 1755 N MET A 114 5.905 14.854 -7.814 1.00 71.30 N ATOM 1756 CA MET A 114 5.426 16.245 -7.660 1.00 72.44 C ATOM 1757 C MET A 114 6.270 16.979 -6.603 1.00 24.31 C ATOM 1758 O MET A 114 6.791 18.069 -6.855 1.00 33.15 O ATOM 1759 CB MET A 114 3.921 16.283 -7.262 1.00 73.41 C ATOM 1760 CG MET A 114 2.967 15.586 -8.246 1.00 53.40 C ATOM 1761 SD MET A 114 1.219 15.862 -7.851 1.00 54.11 S ATOM 1762 CE MET A 114 1.130 15.423 -6.112 1.00 21.43 C ATOM 0 H MET A 114 5.296 14.155 -7.388 1.00 71.30 H new ATOM 0 HA MET A 114 5.534 16.748 -8.621 1.00 72.44 H new ATOM 0 HB2 MET A 114 3.809 15.820 -6.282 1.00 73.41 H new ATOM 0 HB3 MET A 114 3.615 17.324 -7.159 1.00 73.41 H new ATOM 0 HG2 MET A 114 3.167 15.946 -9.255 1.00 53.40 H new ATOM 0 HG3 MET A 114 3.170 14.515 -8.244 1.00 53.40 H new ATOM 0 HE1 MET A 114 0.632 14.459 -6.005 1.00 21.43 H new ATOM 0 HE2 MET A 114 2.137 15.358 -5.701 1.00 21.43 H new ATOM 0 HE3 MET A 114 0.566 16.184 -5.573 1.00 21.43 H new ATOM 1772 N ILE A 115 6.440 16.334 -5.433 1.00 52.10 N ATOM 1773 CA ILE A 115 7.122 16.940 -4.264 1.00 30.43 C ATOM 1774 C ILE A 115 8.663 16.923 -4.421 1.00 61.31 C ATOM 1775 O ILE A 115 9.351 17.807 -3.904 1.00 42.14 O ATOM 1776 CB ILE A 115 6.692 16.225 -2.926 1.00 22.32 C ATOM 1777 CG1 ILE A 115 7.052 14.708 -2.975 1.00 12.21 C ATOM 1778 CG2 ILE A 115 5.176 16.428 -2.655 1.00 1.43 C ATOM 1779 CD1 ILE A 115 6.578 13.895 -1.794 1.00 63.44 C ATOM 0 H ILE A 115 6.112 15.383 -5.268 1.00 52.10 H new ATOM 0 HA ILE A 115 6.809 17.983 -4.215 1.00 30.43 H new ATOM 0 HB ILE A 115 7.244 16.678 -2.102 1.00 22.32 H new ATOM 0 HG12 ILE A 115 6.629 14.280 -3.884 1.00 12.21 H new ATOM 0 HG13 ILE A 115 8.135 14.610 -3.051 1.00 12.21 H new ATOM 0 HG21 ILE A 115 4.902 15.926 -1.727 1.00 1.43 H new ATOM 0 HG22 ILE A 115 4.961 17.493 -2.569 1.00 1.43 H new ATOM 0 HG23 ILE A 115 4.600 16.007 -3.479 1.00 1.43 H new ATOM 0 HD11 ILE A 115 6.878 12.855 -1.924 1.00 63.44 H new ATOM 0 HD12 ILE A 115 7.022 14.289 -0.880 1.00 63.44 H new ATOM 0 HD13 ILE A 115 5.492 13.953 -1.725 1.00 63.44 H new ATOM 1791 N ARG A 116 9.187 15.910 -5.135 1.00 32.55 N ATOM 1792 CA ARG A 116 10.633 15.789 -5.446 1.00 73.14 C ATOM 1793 C ARG A 116 10.971 16.520 -6.758 1.00 11.41 C ATOM 1794 O ARG A 116 12.147 16.721 -7.067 1.00 51.33 O ATOM 1795 CB ARG A 116 11.052 14.298 -5.572 1.00 55.54 C ATOM 1796 CG ARG A 116 10.909 13.457 -4.283 1.00 2.42 C ATOM 1797 CD ARG A 116 11.326 11.984 -4.497 1.00 12.42 C ATOM 1798 NE ARG A 116 11.348 11.192 -3.247 1.00 1.53 N ATOM 1799 CZ ARG A 116 12.387 10.437 -2.827 1.00 73.34 C ATOM 1800 NH1 ARG A 116 13.508 10.356 -3.530 1.00 44.22 N ATOM 1801 NH2 ARG A 116 12.284 9.743 -1.712 1.00 73.03 N ATOM 0 H ARG A 116 8.624 15.149 -5.515 1.00 32.55 H new ATOM 0 HA ARG A 116 11.184 16.247 -4.624 1.00 73.14 H new ATOM 0 HB2 ARG A 116 10.453 13.835 -6.356 1.00 55.54 H new ATOM 0 HB3 ARG A 116 12.091 14.257 -5.899 1.00 55.54 H new ATOM 0 HG2 ARG A 116 11.522 13.895 -3.495 1.00 2.42 H new ATOM 0 HG3 ARG A 116 9.875 13.494 -3.940 1.00 2.42 H new ATOM 0 HD2 ARG A 116 10.637 11.518 -5.202 1.00 12.42 H new ATOM 0 HD3 ARG A 116 12.316 11.957 -4.953 1.00 12.42 H new ATOM 0 HE ARG A 116 10.516 11.218 -2.658 1.00 1.53 H new ATOM 0 HH11 ARG A 116 13.599 10.870 -4.407 1.00 44.22 H new ATOM 0 HH12 ARG A 116 14.280 9.780 -3.194 1.00 44.22 H new ATOM 0 HH21 ARG A 116 11.422 9.776 -1.168 1.00 73.03 H new ATOM 0 HH22 ARG A 116 13.067 9.172 -1.392 1.00 73.03 H new ATOM 1815 N GLY A 117 9.930 16.873 -7.540 1.00 72.40 N ATOM 1816 CA GLY A 117 10.108 17.585 -8.810 1.00 42.43 C ATOM 1817 C GLY A 117 10.433 19.070 -8.628 1.00 64.33 C ATOM 1818 O GLY A 117 11.113 19.656 -9.495 1.00 12.32 O ATOM 1819 OXT GLY A 117 10.004 19.666 -7.614 1.00 37.62 O ATOM 0 H GLY A 117 8.957 16.673 -7.308 1.00 72.40 H new ATOM 0 HA2 GLY A 117 10.910 17.111 -9.376 1.00 42.43 H new ATOM 0 HA3 GLY A 117 9.199 17.489 -9.404 1.00 42.43 H new TER 1823 GLY A 117 ATOM 1824 N SER B 2 17.528 -13.542 18.122 1.00 11.15 N ATOM 1825 CA SER B 2 18.600 -12.967 17.282 1.00 11.32 C ATOM 1826 C SER B 2 18.075 -11.782 16.452 1.00 74.13 C ATOM 1827 O SER B 2 16.902 -11.764 16.043 1.00 24.04 O ATOM 1828 CB SER B 2 19.191 -14.053 16.365 1.00 0.40 C ATOM 1829 OG SER B 2 19.569 -15.193 17.119 1.00 64.21 O ATOM 0 HA SER B 2 19.387 -12.593 17.936 1.00 11.32 H new ATOM 0 HB2 SER B 2 18.458 -14.337 15.610 1.00 0.40 H new ATOM 0 HB3 SER B 2 20.058 -13.657 15.835 1.00 0.40 H new ATOM 0 HG SER B 2 18.975 -15.285 17.893 1.00 64.21 H new ATOM 1837 N LEU B 3 18.961 -10.807 16.211 1.00 32.13 N ATOM 1838 CA LEU B 3 18.657 -9.595 15.440 1.00 53.33 C ATOM 1839 C LEU B 3 19.064 -9.778 13.966 1.00 63.52 C ATOM 1840 O LEU B 3 20.220 -10.108 13.681 1.00 75.30 O ATOM 1841 CB LEU B 3 19.417 -8.385 16.039 1.00 11.23 C ATOM 1842 CG LEU B 3 19.147 -8.066 17.541 1.00 31.53 C ATOM 1843 CD1 LEU B 3 19.981 -6.857 18.008 1.00 50.23 C ATOM 1844 CD2 LEU B 3 17.645 -7.844 17.810 1.00 33.24 C ATOM 0 H LEU B 3 19.922 -10.839 16.551 1.00 32.13 H new ATOM 0 HA LEU B 3 17.584 -9.413 15.491 1.00 53.33 H new ATOM 0 HB2 LEU B 3 20.486 -8.558 15.914 1.00 11.23 H new ATOM 0 HB3 LEU B 3 19.167 -7.501 15.452 1.00 11.23 H new ATOM 0 HG LEU B 3 19.458 -8.933 18.123 1.00 31.53 H new ATOM 0 HD11 LEU B 3 19.774 -6.656 19.059 1.00 50.23 H new ATOM 0 HD12 LEU B 3 21.041 -7.076 17.883 1.00 50.23 H new ATOM 0 HD13 LEU B 3 19.719 -5.982 17.413 1.00 50.23 H new ATOM 0 HD21 LEU B 3 17.493 -7.624 18.867 1.00 33.24 H new ATOM 0 HD22 LEU B 3 17.288 -7.007 17.210 1.00 33.24 H new ATOM 0 HD23 LEU B 3 17.091 -8.744 17.544 1.00 33.24 H new ATOM 1856 N VAL B 4 18.109 -9.582 13.041 1.00 62.01 N ATOM 1857 CA VAL B 4 18.400 -9.537 11.596 1.00 31.11 C ATOM 1858 C VAL B 4 18.962 -8.150 11.223 1.00 22.25 C ATOM 1859 O VAL B 4 18.361 -7.112 11.539 1.00 11.21 O ATOM 1860 CB VAL B 4 17.145 -9.892 10.705 1.00 10.32 C ATOM 1861 CG1 VAL B 4 16.791 -11.391 10.835 1.00 52.51 C ATOM 1862 CG2 VAL B 4 15.925 -9.001 11.049 1.00 64.21 C ATOM 0 H VAL B 4 17.123 -9.451 13.269 1.00 62.01 H new ATOM 0 HA VAL B 4 19.147 -10.304 11.389 1.00 31.11 H new ATOM 0 HB VAL B 4 17.410 -9.689 9.667 1.00 10.32 H new ATOM 0 HG11 VAL B 4 15.924 -11.615 10.214 1.00 52.51 H new ATOM 0 HG12 VAL B 4 17.638 -11.995 10.508 1.00 52.51 H new ATOM 0 HG13 VAL B 4 16.561 -11.622 11.875 1.00 52.51 H new ATOM 0 HG21 VAL B 4 15.083 -9.277 10.414 1.00 64.21 H new ATOM 0 HG22 VAL B 4 15.653 -9.144 12.095 1.00 64.21 H new ATOM 0 HG23 VAL B 4 16.179 -7.955 10.880 1.00 64.21 H new ATOM 1872 N LYS B 5 20.133 -8.157 10.587 1.00 64.24 N ATOM 1873 CA LYS B 5 20.868 -6.946 10.218 1.00 41.33 C ATOM 1874 C LYS B 5 20.361 -6.445 8.858 1.00 11.44 C ATOM 1875 O LYS B 5 20.685 -7.022 7.816 1.00 30.41 O ATOM 1876 CB LYS B 5 22.385 -7.258 10.192 1.00 30.44 C ATOM 1877 CG LYS B 5 22.916 -7.871 11.508 1.00 14.52 C ATOM 1878 CD LYS B 5 24.439 -8.125 11.496 1.00 43.23 C ATOM 1879 CE LYS B 5 24.931 -8.697 12.838 1.00 40.13 C ATOM 1880 NZ LYS B 5 26.406 -8.873 12.856 1.00 70.42 N ATOM 0 H LYS B 5 20.606 -9.017 10.309 1.00 64.24 H new ATOM 0 HA LYS B 5 20.702 -6.156 10.950 1.00 41.33 H new ATOM 0 HB2 LYS B 5 22.591 -7.946 9.372 1.00 30.44 H new ATOM 0 HB3 LYS B 5 22.932 -6.339 9.983 1.00 30.44 H new ATOM 0 HG2 LYS B 5 22.673 -7.204 12.335 1.00 14.52 H new ATOM 0 HG3 LYS B 5 22.400 -8.812 11.696 1.00 14.52 H new ATOM 0 HD2 LYS B 5 24.686 -8.819 10.692 1.00 43.23 H new ATOM 0 HD3 LYS B 5 24.962 -7.192 11.284 1.00 43.23 H new ATOM 0 HE2 LYS B 5 24.635 -8.030 13.648 1.00 40.13 H new ATOM 0 HE3 LYS B 5 24.448 -9.657 13.023 1.00 40.13 H new ATOM 0 HZ1 LYS B 5 26.698 -9.260 13.776 1.00 70.42 H new ATOM 0 HZ2 LYS B 5 26.687 -9.529 12.099 1.00 70.42 H new ATOM 0 HZ3 LYS B 5 26.867 -7.953 12.705 1.00 70.42 H new ATOM 1894 N LEU B 6 19.503 -5.419 8.896 1.00 22.35 N ATOM 1895 CA LEU B 6 18.844 -4.862 7.707 1.00 73.32 C ATOM 1896 C LEU B 6 19.411 -3.467 7.414 1.00 55.22 C ATOM 1897 O LEU B 6 19.014 -2.490 8.058 1.00 60.23 O ATOM 1898 CB LEU B 6 17.306 -4.799 7.942 1.00 34.24 C ATOM 1899 CG LEU B 6 16.620 -6.155 8.308 1.00 52.43 C ATOM 1900 CD1 LEU B 6 15.131 -5.953 8.658 1.00 12.02 C ATOM 1901 CD2 LEU B 6 16.804 -7.199 7.178 1.00 4.42 C ATOM 0 H LEU B 6 19.243 -4.946 9.762 1.00 22.35 H new ATOM 0 HA LEU B 6 19.034 -5.501 6.845 1.00 73.32 H new ATOM 0 HB2 LEU B 6 17.108 -4.085 8.742 1.00 34.24 H new ATOM 0 HB3 LEU B 6 16.835 -4.406 7.041 1.00 34.24 H new ATOM 0 HG LEU B 6 17.112 -6.547 9.198 1.00 52.43 H new ATOM 0 HD11 LEU B 6 14.682 -6.914 8.908 1.00 12.02 H new ATOM 0 HD12 LEU B 6 15.046 -5.280 9.511 1.00 12.02 H new ATOM 0 HD13 LEU B 6 14.611 -5.522 7.802 1.00 12.02 H new ATOM 0 HD21 LEU B 6 16.316 -8.132 7.461 1.00 4.42 H new ATOM 0 HD22 LEU B 6 16.358 -6.821 6.258 1.00 4.42 H new ATOM 0 HD23 LEU B 6 17.867 -7.379 7.019 1.00 4.42 H new ATOM 1913 N GLU B 7 20.361 -3.375 6.471 1.00 62.13 N ATOM 1914 CA GLU B 7 20.964 -2.083 6.092 1.00 61.41 C ATOM 1915 C GLU B 7 19.988 -1.285 5.227 1.00 75.03 C ATOM 1916 O GLU B 7 19.168 -1.855 4.504 1.00 43.50 O ATOM 1917 CB GLU B 7 22.314 -2.241 5.341 1.00 61.21 C ATOM 1918 CG GLU B 7 23.441 -2.914 6.146 1.00 60.14 C ATOM 1919 CD GLU B 7 23.169 -4.392 6.476 1.00 14.54 C ATOM 1920 OE1 GLU B 7 23.045 -5.198 5.528 1.00 33.42 O ATOM 1921 OE2 GLU B 7 23.084 -4.749 7.674 1.00 31.12 O ATOM 0 H GLU B 7 20.729 -4.176 5.957 1.00 62.13 H new ATOM 0 HA GLU B 7 21.172 -1.550 7.020 1.00 61.41 H new ATOM 0 HB2 GLU B 7 22.141 -2.822 4.435 1.00 61.21 H new ATOM 0 HB3 GLU B 7 22.654 -1.254 5.027 1.00 61.21 H new ATOM 0 HG2 GLU B 7 24.371 -2.842 5.582 1.00 60.14 H new ATOM 0 HG3 GLU B 7 23.589 -2.365 7.076 1.00 60.14 H new ATOM 1928 N SER B 8 20.082 0.034 5.331 1.00 45.40 N ATOM 1929 CA SER B 8 19.301 0.959 4.516 1.00 72.34 C ATOM 1930 C SER B 8 20.080 1.363 3.252 1.00 12.11 C ATOM 1931 O SER B 8 21.205 0.899 3.014 1.00 14.53 O ATOM 1932 CB SER B 8 18.976 2.188 5.379 1.00 42.52 C ATOM 1933 OG SER B 8 20.157 2.732 5.959 1.00 74.55 O ATOM 0 H SER B 8 20.708 0.498 5.989 1.00 45.40 H new ATOM 0 HA SER B 8 18.379 0.483 4.184 1.00 72.34 H new ATOM 0 HB2 SER B 8 18.484 2.945 4.769 1.00 42.52 H new ATOM 0 HB3 SER B 8 18.275 1.909 6.166 1.00 42.52 H new ATOM 0 HG SER B 8 20.353 2.267 6.799 1.00 74.55 H new ATOM 1939 N SER B 9 19.447 2.233 2.446 1.00 51.03 N ATOM 1940 CA SER B 9 20.098 2.931 1.324 1.00 73.03 C ATOM 1941 C SER B 9 21.244 3.820 1.846 1.00 14.54 C ATOM 1942 O SER B 9 22.240 4.051 1.153 1.00 21.32 O ATOM 1943 CB SER B 9 19.051 3.784 0.563 1.00 42.14 C ATOM 1944 OG SER B 9 19.603 4.392 -0.598 1.00 0.10 O ATOM 0 H SER B 9 18.462 2.473 2.556 1.00 51.03 H new ATOM 0 HA SER B 9 20.519 2.196 0.638 1.00 73.03 H new ATOM 0 HB2 SER B 9 18.209 3.154 0.277 1.00 42.14 H new ATOM 0 HB3 SER B 9 18.661 4.556 1.226 1.00 42.14 H new ATOM 0 HG SER B 9 19.398 3.843 -1.384 1.00 0.10 H new ATOM 1950 N ASP B 10 21.090 4.279 3.104 1.00 21.34 N ATOM 1951 CA ASP B 10 22.062 5.138 3.803 1.00 44.41 C ATOM 1952 C ASP B 10 23.080 4.278 4.605 1.00 1.51 C ATOM 1953 O ASP B 10 23.848 4.795 5.428 1.00 4.51 O ATOM 1954 CB ASP B 10 21.265 6.114 4.708 1.00 23.41 C ATOM 1955 CG ASP B 10 22.123 7.189 5.399 1.00 41.25 C ATOM 1956 OD1 ASP B 10 22.664 8.063 4.696 1.00 32.53 O ATOM 1957 OD2 ASP B 10 22.250 7.174 6.645 1.00 75.53 O ATOM 0 H ASP B 10 20.272 4.058 3.671 1.00 21.34 H new ATOM 0 HA ASP B 10 22.653 5.715 3.092 1.00 44.41 H new ATOM 0 HB2 ASP B 10 20.503 6.608 4.105 1.00 23.41 H new ATOM 0 HB3 ASP B 10 20.743 5.537 5.472 1.00 23.41 H new ATOM 1962 N GLU B 11 23.046 2.944 4.359 1.00 42.24 N ATOM 1963 CA GLU B 11 24.091 1.975 4.780 1.00 65.32 C ATOM 1964 C GLU B 11 24.038 1.641 6.301 1.00 43.30 C ATOM 1965 O GLU B 11 24.806 0.798 6.782 1.00 51.32 O ATOM 1966 CB GLU B 11 25.503 2.490 4.320 1.00 13.45 C ATOM 1967 CG GLU B 11 26.677 1.499 4.470 1.00 11.14 C ATOM 1968 CD GLU B 11 28.023 2.095 4.013 1.00 2.35 C ATOM 1969 OE1 GLU B 11 28.526 1.732 2.921 1.00 64.41 O ATOM 1970 OE2 GLU B 11 28.571 2.957 4.737 1.00 51.43 O ATOM 0 H GLU B 11 22.278 2.503 3.853 1.00 42.24 H new ATOM 0 HA GLU B 11 23.891 1.025 4.284 1.00 65.32 H new ATOM 0 HB2 GLU B 11 25.435 2.783 3.272 1.00 13.45 H new ATOM 0 HB3 GLU B 11 25.740 3.389 4.888 1.00 13.45 H new ATOM 0 HG2 GLU B 11 26.756 1.192 5.513 1.00 11.14 H new ATOM 0 HG3 GLU B 11 26.466 0.602 3.888 1.00 11.14 H new ATOM 1977 N LYS B 12 23.100 2.265 7.053 1.00 32.33 N ATOM 1978 CA LYS B 12 22.956 2.015 8.507 1.00 73.00 C ATOM 1979 C LYS B 12 22.392 0.607 8.760 1.00 63.30 C ATOM 1980 O LYS B 12 21.324 0.271 8.244 1.00 73.22 O ATOM 1981 CB LYS B 12 22.034 3.059 9.188 1.00 2.14 C ATOM 1982 CG LYS B 12 22.577 4.502 9.212 1.00 34.25 C ATOM 1983 CD LYS B 12 21.742 5.414 10.146 1.00 62.45 C ATOM 1984 CE LYS B 12 22.207 6.876 10.136 1.00 24.24 C ATOM 1985 NZ LYS B 12 21.358 7.725 11.016 1.00 31.01 N ATOM 0 H LYS B 12 22.435 2.942 6.679 1.00 32.33 H new ATOM 0 HA LYS B 12 23.952 2.100 8.942 1.00 73.00 H new ATOM 0 HB2 LYS B 12 21.072 3.059 8.675 1.00 2.14 H new ATOM 0 HB3 LYS B 12 21.849 2.741 10.214 1.00 2.14 H new ATOM 0 HG2 LYS B 12 23.615 4.495 9.544 1.00 34.25 H new ATOM 0 HG3 LYS B 12 22.568 4.911 8.202 1.00 34.25 H new ATOM 0 HD2 LYS B 12 20.695 5.370 9.845 1.00 62.45 H new ATOM 0 HD3 LYS B 12 21.797 5.029 11.164 1.00 62.45 H new ATOM 0 HE2 LYS B 12 23.244 6.931 10.466 1.00 24.24 H new ATOM 0 HE3 LYS B 12 22.176 7.262 9.117 1.00 24.24 H new ATOM 0 HZ1 LYS B 12 21.700 8.707 10.986 1.00 31.01 H new ATOM 0 HZ2 LYS B 12 20.373 7.691 10.685 1.00 31.01 H new ATOM 0 HZ3 LYS B 12 21.408 7.371 11.993 1.00 31.01 H new ATOM 1999 N VAL B 13 23.125 -0.186 9.553 1.00 4.13 N ATOM 2000 CA VAL B 13 22.735 -1.551 9.941 1.00 63.44 C ATOM 2001 C VAL B 13 21.613 -1.497 11.006 1.00 5.53 C ATOM 2002 O VAL B 13 21.855 -1.078 12.143 1.00 34.44 O ATOM 2003 CB VAL B 13 23.985 -2.333 10.513 1.00 34.21 C ATOM 2004 CG1 VAL B 13 23.634 -3.790 10.889 1.00 44.32 C ATOM 2005 CG2 VAL B 13 25.176 -2.274 9.520 1.00 44.43 C ATOM 0 H VAL B 13 24.018 0.105 9.949 1.00 4.13 H new ATOM 0 HA VAL B 13 22.365 -2.075 9.060 1.00 63.44 H new ATOM 0 HB VAL B 13 24.289 -1.835 11.434 1.00 34.21 H new ATOM 0 HG11 VAL B 13 24.522 -4.289 11.277 1.00 44.32 H new ATOM 0 HG12 VAL B 13 22.854 -3.791 11.651 1.00 44.32 H new ATOM 0 HG13 VAL B 13 23.278 -4.318 10.005 1.00 44.32 H new ATOM 0 HG21 VAL B 13 26.024 -2.819 9.936 1.00 44.43 H new ATOM 0 HG22 VAL B 13 24.883 -2.727 8.573 1.00 44.43 H new ATOM 0 HG23 VAL B 13 25.459 -1.235 9.353 1.00 44.43 H new ATOM 2015 N PHE B 14 20.384 -1.880 10.628 1.00 52.23 N ATOM 2016 CA PHE B 14 19.230 -1.901 11.552 1.00 4.13 C ATOM 2017 C PHE B 14 18.972 -3.328 12.034 1.00 41.31 C ATOM 2018 O PHE B 14 18.276 -4.118 11.385 1.00 24.34 O ATOM 2019 CB PHE B 14 17.978 -1.283 10.883 1.00 64.10 C ATOM 2020 CG PHE B 14 18.150 0.203 10.593 1.00 12.13 C ATOM 2021 CD1 PHE B 14 18.279 1.108 11.647 1.00 35.43 C ATOM 2022 CD2 PHE B 14 18.214 0.692 9.291 1.00 44.52 C ATOM 2023 CE1 PHE B 14 18.461 2.450 11.405 1.00 14.22 C ATOM 2024 CE2 PHE B 14 18.389 2.039 9.055 1.00 44.32 C ATOM 2025 CZ PHE B 14 18.515 2.915 10.112 1.00 1.33 C ATOM 0 H PHE B 14 20.158 -2.183 9.680 1.00 52.23 H new ATOM 0 HA PHE B 14 19.462 -1.289 12.424 1.00 4.13 H new ATOM 0 HB2 PHE B 14 17.769 -1.810 9.952 1.00 64.10 H new ATOM 0 HB3 PHE B 14 17.114 -1.426 11.532 1.00 64.10 H new ATOM 0 HD1 PHE B 14 18.235 0.751 12.665 1.00 35.43 H new ATOM 0 HD2 PHE B 14 18.126 0.010 8.458 1.00 44.52 H new ATOM 0 HE1 PHE B 14 18.562 3.139 12.231 1.00 14.22 H new ATOM 0 HE2 PHE B 14 18.427 2.408 8.041 1.00 44.32 H new ATOM 0 HZ PHE B 14 18.656 3.969 9.924 1.00 1.33 H new ATOM 2035 N GLU B 15 19.590 -3.646 13.174 1.00 1.14 N ATOM 2036 CA GLU B 15 19.480 -4.947 13.828 1.00 12.52 C ATOM 2037 C GLU B 15 18.194 -4.995 14.667 1.00 60.24 C ATOM 2038 O GLU B 15 18.170 -4.530 15.813 1.00 72.41 O ATOM 2039 CB GLU B 15 20.732 -5.192 14.702 1.00 74.53 C ATOM 2040 CG GLU B 15 22.059 -5.058 13.943 1.00 1.12 C ATOM 2041 CD GLU B 15 23.295 -5.339 14.810 1.00 63.15 C ATOM 2042 OE1 GLU B 15 23.511 -6.505 15.194 1.00 1.54 O ATOM 2043 OE2 GLU B 15 24.059 -4.394 15.115 1.00 32.11 O ATOM 0 H GLU B 15 20.191 -2.993 13.676 1.00 1.14 H new ATOM 0 HA GLU B 15 19.426 -5.738 13.080 1.00 12.52 H new ATOM 0 HB2 GLU B 15 20.727 -4.485 15.532 1.00 74.53 H new ATOM 0 HB3 GLU B 15 20.671 -6.191 15.134 1.00 74.53 H new ATOM 0 HG2 GLU B 15 22.055 -5.746 13.097 1.00 1.12 H new ATOM 0 HG3 GLU B 15 22.134 -4.050 13.534 1.00 1.12 H new ATOM 2050 N ILE B 16 17.117 -5.503 14.061 1.00 22.01 N ATOM 2051 CA ILE B 16 15.796 -5.620 14.706 1.00 4.01 C ATOM 2052 C ILE B 16 15.472 -7.110 14.947 1.00 4.32 C ATOM 2053 O ILE B 16 16.023 -7.979 14.265 1.00 64.13 O ATOM 2054 CB ILE B 16 14.677 -4.929 13.823 1.00 42.01 C ATOM 2055 CG1 ILE B 16 13.293 -4.939 14.552 1.00 23.41 C ATOM 2056 CG2 ILE B 16 14.583 -5.578 12.415 1.00 31.14 C ATOM 2057 CD1 ILE B 16 12.160 -4.280 13.798 1.00 43.30 C ATOM 0 H ILE B 16 17.132 -5.849 13.101 1.00 22.01 H new ATOM 0 HA ILE B 16 15.819 -5.105 15.666 1.00 4.01 H new ATOM 0 HB ILE B 16 14.966 -3.888 13.681 1.00 42.01 H new ATOM 0 HG12 ILE B 16 13.017 -5.973 14.758 1.00 23.41 H new ATOM 0 HG13 ILE B 16 13.405 -4.441 15.515 1.00 23.41 H new ATOM 0 HG21 ILE B 16 13.806 -5.080 11.836 1.00 31.14 H new ATOM 0 HG22 ILE B 16 15.539 -5.475 11.902 1.00 31.14 H new ATOM 0 HG23 ILE B 16 14.338 -6.635 12.517 1.00 31.14 H new ATOM 0 HD11 ILE B 16 11.246 -4.341 14.389 1.00 43.30 H new ATOM 0 HD12 ILE B 16 12.405 -3.234 13.615 1.00 43.30 H new ATOM 0 HD13 ILE B 16 12.011 -4.790 12.846 1.00 43.30 H new ATOM 2069 N GLU B 17 14.597 -7.383 15.939 1.00 62.35 N ATOM 2070 CA GLU B 17 14.131 -8.740 16.267 1.00 21.43 C ATOM 2071 C GLU B 17 13.481 -9.373 15.018 1.00 43.10 C ATOM 2072 O GLU B 17 12.613 -8.748 14.385 1.00 13.14 O ATOM 2073 CB GLU B 17 13.114 -8.718 17.450 1.00 2.13 C ATOM 2074 CG GLU B 17 13.651 -8.205 18.816 1.00 33.35 C ATOM 2075 CD GLU B 17 14.034 -6.705 18.865 1.00 73.51 C ATOM 2076 OE1 GLU B 17 15.100 -6.367 19.417 1.00 10.15 O ATOM 2077 OE2 GLU B 17 13.279 -5.857 18.348 1.00 42.52 O ATOM 0 H GLU B 17 14.194 -6.661 16.536 1.00 62.35 H new ATOM 0 HA GLU B 17 14.989 -9.337 16.577 1.00 21.43 H new ATOM 0 HB2 GLU B 17 12.267 -8.096 17.161 1.00 2.13 H new ATOM 0 HB3 GLU B 17 12.733 -9.729 17.591 1.00 2.13 H new ATOM 0 HG2 GLU B 17 12.894 -8.393 19.577 1.00 33.35 H new ATOM 0 HG3 GLU B 17 14.527 -8.794 19.086 1.00 33.35 H new ATOM 2084 N LYS B 18 13.926 -10.595 14.685 1.00 24.12 N ATOM 2085 CA LYS B 18 13.509 -11.315 13.469 1.00 13.42 C ATOM 2086 C LYS B 18 11.984 -11.530 13.424 1.00 41.42 C ATOM 2087 O LYS B 18 11.367 -11.401 12.368 1.00 73.51 O ATOM 2088 CB LYS B 18 14.253 -12.672 13.387 1.00 65.05 C ATOM 2089 CG LYS B 18 13.953 -13.496 12.109 1.00 50.50 C ATOM 2090 CD LYS B 18 14.736 -14.833 12.051 1.00 5.22 C ATOM 2091 CE LYS B 18 14.364 -15.794 13.194 1.00 23.53 C ATOM 2092 NZ LYS B 18 15.134 -17.065 13.143 1.00 31.11 N ATOM 0 H LYS B 18 14.591 -11.116 15.256 1.00 24.12 H new ATOM 0 HA LYS B 18 13.772 -10.704 12.606 1.00 13.42 H new ATOM 0 HB2 LYS B 18 15.326 -12.487 13.441 1.00 65.05 H new ATOM 0 HB3 LYS B 18 13.989 -13.270 14.259 1.00 65.05 H new ATOM 0 HG2 LYS B 18 12.884 -13.705 12.061 1.00 50.50 H new ATOM 0 HG3 LYS B 18 14.201 -12.898 11.232 1.00 50.50 H new ATOM 0 HD2 LYS B 18 14.543 -15.321 11.096 1.00 5.22 H new ATOM 0 HD3 LYS B 18 15.805 -14.624 12.092 1.00 5.22 H new ATOM 0 HE2 LYS B 18 14.543 -15.303 14.150 1.00 23.53 H new ATOM 0 HE3 LYS B 18 13.298 -16.017 13.145 1.00 23.53 H new ATOM 0 HZ1 LYS B 18 14.847 -17.677 13.933 1.00 31.11 H new ATOM 0 HZ2 LYS B 18 14.944 -17.550 12.243 1.00 31.11 H new ATOM 0 HZ3 LYS B 18 16.151 -16.858 13.217 1.00 31.11 H new ATOM 2106 N GLU B 19 11.400 -11.807 14.603 1.00 20.54 N ATOM 2107 CA GLU B 19 9.948 -12.033 14.781 1.00 63.35 C ATOM 2108 C GLU B 19 9.108 -10.813 14.323 1.00 61.23 C ATOM 2109 O GLU B 19 7.978 -10.965 13.838 1.00 44.52 O ATOM 2110 CB GLU B 19 9.662 -12.363 16.270 1.00 74.22 C ATOM 2111 CG GLU B 19 10.086 -11.254 17.260 1.00 24.41 C ATOM 2112 CD GLU B 19 9.982 -11.674 18.733 1.00 44.31 C ATOM 2113 OE1 GLU B 19 10.988 -12.152 19.302 1.00 21.22 O ATOM 2114 OE2 GLU B 19 8.890 -11.529 19.328 1.00 64.02 O ATOM 0 H GLU B 19 11.927 -11.882 15.473 1.00 20.54 H new ATOM 0 HA GLU B 19 9.653 -12.873 14.152 1.00 63.35 H new ATOM 0 HB2 GLU B 19 8.595 -12.552 16.390 1.00 74.22 H new ATOM 0 HB3 GLU B 19 10.181 -13.285 16.532 1.00 74.22 H new ATOM 0 HG2 GLU B 19 11.114 -10.961 17.046 1.00 24.41 H new ATOM 0 HG3 GLU B 19 9.463 -10.375 17.096 1.00 24.41 H new ATOM 2121 N ILE B 20 9.684 -9.614 14.488 1.00 24.21 N ATOM 2122 CA ILE B 20 9.058 -8.342 14.092 1.00 1.41 C ATOM 2123 C ILE B 20 9.248 -8.100 12.583 1.00 65.44 C ATOM 2124 O ILE B 20 8.333 -7.631 11.896 1.00 60.31 O ATOM 2125 CB ILE B 20 9.672 -7.155 14.917 1.00 71.45 C ATOM 2126 CG1 ILE B 20 9.579 -7.449 16.450 1.00 23.14 C ATOM 2127 CG2 ILE B 20 8.980 -5.824 14.559 1.00 12.14 C ATOM 2128 CD1 ILE B 20 10.169 -6.383 17.351 1.00 43.54 C ATOM 0 H ILE B 20 10.608 -9.497 14.905 1.00 24.21 H new ATOM 0 HA ILE B 20 7.990 -8.397 14.303 1.00 1.41 H new ATOM 0 HB ILE B 20 10.726 -7.060 14.656 1.00 71.45 H new ATOM 0 HG12 ILE B 20 8.530 -7.585 16.714 1.00 23.14 H new ATOM 0 HG13 ILE B 20 10.084 -8.393 16.653 1.00 23.14 H new ATOM 0 HG21 ILE B 20 9.421 -5.016 15.142 1.00 12.14 H new ATOM 0 HG22 ILE B 20 9.113 -5.619 13.497 1.00 12.14 H new ATOM 0 HG23 ILE B 20 7.916 -5.895 14.785 1.00 12.14 H new ATOM 0 HD11 ILE B 20 10.054 -6.683 18.393 1.00 43.54 H new ATOM 0 HD12 ILE B 20 11.228 -6.260 17.124 1.00 43.54 H new ATOM 0 HD13 ILE B 20 9.650 -5.439 17.186 1.00 43.54 H new ATOM 2140 N ALA B 21 10.449 -8.441 12.084 1.00 61.14 N ATOM 2141 CA ALA B 21 10.787 -8.347 10.650 1.00 63.52 C ATOM 2142 C ALA B 21 9.956 -9.331 9.796 1.00 75.05 C ATOM 2143 O ALA B 21 9.807 -9.144 8.584 1.00 70.12 O ATOM 2144 CB ALA B 21 12.290 -8.588 10.456 1.00 32.21 C ATOM 0 H ALA B 21 11.214 -8.790 12.662 1.00 61.14 H new ATOM 0 HA ALA B 21 10.538 -7.343 10.308 1.00 63.52 H new ATOM 0 HB1 ALA B 21 12.536 -8.518 9.396 1.00 32.21 H new ATOM 0 HB2 ALA B 21 12.853 -7.837 11.010 1.00 32.21 H new ATOM 0 HB3 ALA B 21 12.550 -9.581 10.824 1.00 32.21 H new ATOM 2150 N CYS B 22 9.420 -10.381 10.453 1.00 64.33 N ATOM 2151 CA CYS B 22 8.518 -11.357 9.824 1.00 42.24 C ATOM 2152 C CYS B 22 7.140 -10.739 9.491 1.00 45.03 C ATOM 2153 O CYS B 22 6.452 -11.224 8.592 1.00 33.41 O ATOM 2154 CB CYS B 22 8.353 -12.586 10.738 1.00 54.32 C ATOM 2155 SG CYS B 22 9.894 -13.479 11.048 1.00 2.12 S ATOM 0 H CYS B 22 9.604 -10.572 11.438 1.00 64.33 H new ATOM 0 HA CYS B 22 8.968 -11.668 8.881 1.00 42.24 H new ATOM 0 HB2 CYS B 22 7.933 -12.264 11.691 1.00 54.32 H new ATOM 0 HB3 CYS B 22 7.633 -13.269 10.286 1.00 54.32 H new ATOM 0 HG CYS B 22 10.726 -12.703 11.676 1.00 2.12 H new ATOM 2161 N MET B 23 6.747 -9.666 10.216 1.00 34.44 N ATOM 2162 CA MET B 23 5.459 -8.969 9.975 1.00 1.13 C ATOM 2163 C MET B 23 5.485 -8.240 8.618 1.00 4.35 C ATOM 2164 O MET B 23 4.446 -8.090 7.960 1.00 63.04 O ATOM 2165 CB MET B 23 5.126 -7.966 11.102 1.00 13.33 C ATOM 2166 CG MET B 23 5.161 -8.536 12.528 1.00 52.21 C ATOM 2167 SD MET B 23 4.259 -7.506 13.716 1.00 11.22 S ATOM 2168 CE MET B 23 4.729 -5.854 13.224 1.00 44.31 C ATOM 0 H MET B 23 7.301 -9.264 10.972 1.00 34.44 H new ATOM 0 HA MET B 23 4.679 -9.730 9.962 1.00 1.13 H new ATOM 0 HB2 MET B 23 5.829 -7.135 11.044 1.00 13.33 H new ATOM 0 HB3 MET B 23 4.133 -7.556 10.918 1.00 13.33 H new ATOM 0 HG2 MET B 23 4.733 -9.539 12.525 1.00 52.21 H new ATOM 0 HG3 MET B 23 6.198 -8.633 12.851 1.00 52.21 H new ATOM 0 HE1 MET B 23 4.359 -5.137 13.957 1.00 44.31 H new ATOM 0 HE2 MET B 23 5.815 -5.787 13.166 1.00 44.31 H new ATOM 0 HE3 MET B 23 4.299 -5.629 12.248 1.00 44.31 H new ATOM 2178 N SER B 24 6.682 -7.772 8.231 1.00 14.44 N ATOM 2179 CA SER B 24 6.953 -7.348 6.859 1.00 3.13 C ATOM 2180 C SER B 24 6.898 -8.585 5.959 1.00 2.23 C ATOM 2181 O SER B 24 7.754 -9.469 6.081 1.00 65.43 O ATOM 2182 CB SER B 24 8.345 -6.703 6.747 1.00 65.23 C ATOM 2183 OG SER B 24 8.455 -5.539 7.514 1.00 53.01 O ATOM 0 H SER B 24 7.480 -7.679 8.859 1.00 14.44 H new ATOM 0 HA SER B 24 6.210 -6.610 6.557 1.00 3.13 H new ATOM 0 HB2 SER B 24 9.101 -7.419 7.068 1.00 65.23 H new ATOM 0 HB3 SER B 24 8.551 -6.468 5.703 1.00 65.23 H new ATOM 0 HG SER B 24 9.204 -5.000 7.184 1.00 53.01 H new ATOM 2189 N VAL B 25 5.885 -8.644 5.083 1.00 52.00 N ATOM 2190 CA VAL B 25 5.702 -9.764 4.151 1.00 64.03 C ATOM 2191 C VAL B 25 6.923 -9.894 3.214 1.00 45.43 C ATOM 2192 O VAL B 25 7.332 -11.002 2.892 1.00 64.44 O ATOM 2193 CB VAL B 25 4.366 -9.608 3.326 1.00 50.41 C ATOM 2194 CG1 VAL B 25 4.158 -10.777 2.325 1.00 15.33 C ATOM 2195 CG2 VAL B 25 3.147 -9.463 4.280 1.00 13.14 C ATOM 0 H VAL B 25 5.172 -7.919 5.001 1.00 52.00 H new ATOM 0 HA VAL B 25 5.621 -10.681 4.735 1.00 64.03 H new ATOM 0 HB VAL B 25 4.452 -8.696 2.735 1.00 50.41 H new ATOM 0 HG11 VAL B 25 3.226 -10.627 1.779 1.00 15.33 H new ATOM 0 HG12 VAL B 25 4.990 -10.806 1.621 1.00 15.33 H new ATOM 0 HG13 VAL B 25 4.112 -11.719 2.871 1.00 15.33 H new ATOM 0 HG21 VAL B 25 2.235 -9.357 3.692 1.00 13.14 H new ATOM 0 HG22 VAL B 25 3.071 -10.349 4.910 1.00 13.14 H new ATOM 0 HG23 VAL B 25 3.279 -8.582 4.908 1.00 13.14 H new ATOM 2205 N THR B 26 7.540 -8.751 2.861 1.00 74.42 N ATOM 2206 CA THR B 26 8.712 -8.713 1.964 1.00 52.12 C ATOM 2207 C THR B 26 9.959 -9.353 2.624 1.00 2.55 C ATOM 2208 O THR B 26 10.572 -10.253 2.038 1.00 2.53 O ATOM 2209 CB THR B 26 9.009 -7.243 1.531 1.00 4.35 C ATOM 2210 OG1 THR B 26 7.882 -6.734 0.804 1.00 0.13 O ATOM 2211 CG2 THR B 26 10.276 -7.098 0.669 1.00 61.24 C ATOM 0 H THR B 26 7.243 -7.832 3.187 1.00 74.42 H new ATOM 0 HA THR B 26 8.476 -9.302 1.078 1.00 52.12 H new ATOM 0 HB THR B 26 9.186 -6.674 2.443 1.00 4.35 H new ATOM 0 HG1 THR B 26 8.196 -6.209 0.039 1.00 0.13 H new ATOM 0 HG21 THR B 26 10.419 -6.050 0.406 1.00 61.24 H new ATOM 0 HG22 THR B 26 11.141 -7.452 1.230 1.00 61.24 H new ATOM 0 HG23 THR B 26 10.167 -7.689 -0.240 1.00 61.24 H new ATOM 2219 N ILE B 27 10.294 -8.909 3.856 1.00 12.23 N ATOM 2220 CA ILE B 27 11.482 -9.398 4.592 1.00 70.45 C ATOM 2221 C ILE B 27 11.317 -10.893 4.932 1.00 44.35 C ATOM 2222 O ILE B 27 12.255 -11.681 4.770 1.00 72.34 O ATOM 2223 CB ILE B 27 11.731 -8.570 5.911 1.00 31.03 C ATOM 2224 CG1 ILE B 27 11.894 -7.047 5.594 1.00 71.35 C ATOM 2225 CG2 ILE B 27 12.965 -9.106 6.694 1.00 62.14 C ATOM 2226 CD1 ILE B 27 11.965 -6.149 6.822 1.00 45.15 C ATOM 0 H ILE B 27 9.755 -8.208 4.364 1.00 12.23 H new ATOM 0 HA ILE B 27 12.350 -9.266 3.946 1.00 70.45 H new ATOM 0 HB ILE B 27 10.854 -8.694 6.547 1.00 31.03 H new ATOM 0 HG12 ILE B 27 12.800 -6.907 5.004 1.00 71.35 H new ATOM 0 HG13 ILE B 27 11.057 -6.727 4.973 1.00 71.35 H new ATOM 0 HG21 ILE B 27 13.108 -8.513 7.597 1.00 62.14 H new ATOM 0 HG22 ILE B 27 12.798 -10.148 6.967 1.00 62.14 H new ATOM 0 HG23 ILE B 27 13.854 -9.033 6.067 1.00 62.14 H new ATOM 0 HD11 ILE B 27 12.078 -5.111 6.508 1.00 45.15 H new ATOM 0 HD12 ILE B 27 11.049 -6.255 7.403 1.00 45.15 H new ATOM 0 HD13 ILE B 27 12.819 -6.437 7.435 1.00 45.15 H new ATOM 2238 N LYS B 28 10.094 -11.258 5.375 1.00 52.21 N ATOM 2239 CA LYS B 28 9.718 -12.645 5.705 1.00 73.14 C ATOM 2240 C LYS B 28 9.914 -13.567 4.487 1.00 22.51 C ATOM 2241 O LYS B 28 10.583 -14.600 4.584 1.00 45.12 O ATOM 2242 CB LYS B 28 8.237 -12.695 6.168 1.00 3.14 C ATOM 2243 CG LYS B 28 7.737 -14.092 6.608 1.00 4.14 C ATOM 2244 CD LYS B 28 6.222 -14.119 6.919 1.00 0.03 C ATOM 2245 CE LYS B 28 5.346 -13.783 5.693 1.00 51.42 C ATOM 2246 NZ LYS B 28 5.528 -14.758 4.584 1.00 51.34 N ATOM 0 H LYS B 28 9.335 -10.590 5.514 1.00 52.21 H new ATOM 0 HA LYS B 28 10.362 -12.994 6.512 1.00 73.14 H new ATOM 0 HB2 LYS B 28 8.108 -12.001 6.999 1.00 3.14 H new ATOM 0 HB3 LYS B 28 7.605 -12.339 5.354 1.00 3.14 H new ATOM 0 HG2 LYS B 28 7.954 -14.814 5.821 1.00 4.14 H new ATOM 0 HG3 LYS B 28 8.290 -14.408 7.492 1.00 4.14 H new ATOM 0 HD2 LYS B 28 5.951 -15.107 7.292 1.00 0.03 H new ATOM 0 HD3 LYS B 28 6.008 -13.408 7.717 1.00 0.03 H new ATOM 0 HE2 LYS B 28 4.298 -13.767 5.992 1.00 51.42 H new ATOM 0 HE3 LYS B 28 5.591 -12.782 5.338 1.00 51.42 H new ATOM 0 HZ1 LYS B 28 5.790 -14.250 3.715 1.00 51.34 H new ATOM 0 HZ2 LYS B 28 6.282 -15.430 4.833 1.00 51.34 H new ATOM 0 HZ3 LYS B 28 4.640 -15.276 4.428 1.00 51.34 H new ATOM 2260 N ASN B 29 9.355 -13.138 3.337 1.00 74.22 N ATOM 2261 CA ASN B 29 9.428 -13.885 2.061 1.00 5.55 C ATOM 2262 C ASN B 29 10.873 -14.010 1.560 1.00 45.23 C ATOM 2263 O ASN B 29 11.188 -14.962 0.866 1.00 52.43 O ATOM 2264 CB ASN B 29 8.534 -13.222 0.968 1.00 3.04 C ATOM 2265 CG ASN B 29 7.026 -13.495 1.132 1.00 62.20 C ATOM 2266 OD1 ASN B 29 6.528 -13.733 2.235 1.00 51.51 O ATOM 2267 ND2 ASN B 29 6.286 -13.434 0.034 1.00 34.24 N ATOM 0 H ASN B 29 8.838 -12.261 3.265 1.00 74.22 H new ATOM 0 HA ASN B 29 9.050 -14.889 2.256 1.00 5.55 H new ATOM 0 HB2 ASN B 29 8.700 -12.145 0.983 1.00 3.04 H new ATOM 0 HB3 ASN B 29 8.852 -13.580 -0.011 1.00 3.04 H new ATOM 0 HD21 ASN B 29 5.279 -13.586 0.089 1.00 34.24 H new ATOM 0 HD22 ASN B 29 6.724 -13.235 -0.866 1.00 34.24 H new ATOM 2274 N MET B 30 11.738 -13.038 1.905 1.00 11.31 N ATOM 2275 CA MET B 30 13.182 -13.108 1.585 1.00 72.10 C ATOM 2276 C MET B 30 13.868 -14.215 2.409 1.00 11.11 C ATOM 2277 O MET B 30 14.623 -15.021 1.864 1.00 45.35 O ATOM 2278 CB MET B 30 13.884 -11.737 1.818 1.00 21.40 C ATOM 2279 CG MET B 30 13.532 -10.662 0.780 1.00 13.30 C ATOM 2280 SD MET B 30 14.384 -9.096 1.085 1.00 61.21 S ATOM 2281 CE MET B 30 13.839 -8.110 -0.312 1.00 21.22 C ATOM 0 H MET B 30 11.465 -12.193 2.406 1.00 11.31 H new ATOM 0 HA MET B 30 13.275 -13.354 0.527 1.00 72.10 H new ATOM 0 HB2 MET B 30 13.618 -11.369 2.809 1.00 21.40 H new ATOM 0 HB3 MET B 30 14.963 -11.889 1.814 1.00 21.40 H new ATOM 0 HG2 MET B 30 13.791 -11.024 -0.215 1.00 13.30 H new ATOM 0 HG3 MET B 30 12.455 -10.493 0.788 1.00 13.30 H new ATOM 0 HE1 MET B 30 14.200 -7.088 -0.199 1.00 21.22 H new ATOM 0 HE2 MET B 30 14.236 -8.535 -1.234 1.00 21.22 H new ATOM 0 HE3 MET B 30 12.750 -8.108 -0.353 1.00 21.22 H new ATOM 2291 N ILE B 31 13.568 -14.264 3.722 1.00 52.30 N ATOM 2292 CA ILE B 31 14.138 -15.278 4.642 1.00 50.33 C ATOM 2293 C ILE B 31 13.666 -16.699 4.241 1.00 73.15 C ATOM 2294 O ILE B 31 14.419 -17.667 4.346 1.00 45.05 O ATOM 2295 CB ILE B 31 13.753 -14.975 6.148 1.00 44.25 C ATOM 2296 CG1 ILE B 31 14.207 -13.535 6.559 1.00 40.35 C ATOM 2297 CG2 ILE B 31 14.359 -16.038 7.110 1.00 52.14 C ATOM 2298 CD1 ILE B 31 13.775 -13.096 7.954 1.00 71.42 C ATOM 0 H ILE B 31 12.930 -13.610 4.175 1.00 52.30 H new ATOM 0 HA ILE B 31 15.224 -15.229 4.558 1.00 50.33 H new ATOM 0 HB ILE B 31 12.667 -15.029 6.231 1.00 44.25 H new ATOM 0 HG12 ILE B 31 15.294 -13.482 6.498 1.00 40.35 H new ATOM 0 HG13 ILE B 31 13.812 -12.825 5.833 1.00 40.35 H new ATOM 0 HG21 ILE B 31 14.077 -15.803 8.136 1.00 52.14 H new ATOM 0 HG22 ILE B 31 13.980 -17.025 6.847 1.00 52.14 H new ATOM 0 HG23 ILE B 31 15.445 -16.031 7.022 1.00 52.14 H new ATOM 0 HD11 ILE B 31 14.137 -12.086 8.146 1.00 71.42 H new ATOM 0 HD12 ILE B 31 12.687 -13.110 8.019 1.00 71.42 H new ATOM 0 HD13 ILE B 31 14.192 -13.778 8.695 1.00 71.42 H new ATOM 2310 N GLU B 32 12.415 -16.801 3.768 1.00 61.24 N ATOM 2311 CA GLU B 32 11.806 -18.083 3.356 1.00 5.33 C ATOM 2312 C GLU B 32 12.315 -18.546 1.970 1.00 34.54 C ATOM 2313 O GLU B 32 12.706 -19.709 1.809 1.00 22.25 O ATOM 2314 CB GLU B 32 10.262 -17.957 3.368 1.00 63.35 C ATOM 2315 CG GLU B 32 9.680 -17.649 4.765 1.00 62.24 C ATOM 2316 CD GLU B 32 8.162 -17.414 4.756 1.00 33.13 C ATOM 2317 OE1 GLU B 32 7.414 -18.153 5.444 1.00 70.25 O ATOM 2318 OE2 GLU B 32 7.707 -16.482 4.057 1.00 73.34 O ATOM 0 H GLU B 32 11.794 -15.999 3.659 1.00 61.24 H new ATOM 0 HA GLU B 32 12.107 -18.847 4.073 1.00 5.33 H new ATOM 0 HB2 GLU B 32 9.964 -17.168 2.677 1.00 63.35 H new ATOM 0 HB3 GLU B 32 9.827 -18.885 2.998 1.00 63.35 H new ATOM 0 HG2 GLU B 32 9.908 -18.477 5.436 1.00 62.24 H new ATOM 0 HG3 GLU B 32 10.174 -16.766 5.170 1.00 62.24 H new ATOM 2325 N ASP B 33 12.341 -17.614 0.989 1.00 71.11 N ATOM 2326 CA ASP B 33 12.616 -17.942 -0.436 1.00 62.31 C ATOM 2327 C ASP B 33 14.118 -18.154 -0.692 1.00 30.31 C ATOM 2328 O ASP B 33 14.508 -19.112 -1.362 1.00 4.21 O ATOM 2329 CB ASP B 33 12.074 -16.811 -1.359 1.00 5.53 C ATOM 2330 CG ASP B 33 12.243 -17.100 -2.865 1.00 3.03 C ATOM 2331 OD1 ASP B 33 13.305 -16.773 -3.445 1.00 54.52 O ATOM 2332 OD2 ASP B 33 11.307 -17.653 -3.485 1.00 54.04 O ATOM 0 H ASP B 33 12.174 -16.622 1.157 1.00 71.11 H new ATOM 0 HA ASP B 33 12.104 -18.876 -0.665 1.00 62.31 H new ATOM 0 HB2 ASP B 33 11.017 -16.656 -1.145 1.00 5.53 H new ATOM 0 HB3 ASP B 33 12.588 -15.881 -1.117 1.00 5.53 H new ATOM 2337 N ILE B 34 14.945 -17.239 -0.167 1.00 24.23 N ATOM 2338 CA ILE B 34 16.419 -17.308 -0.291 1.00 11.24 C ATOM 2339 C ILE B 34 16.968 -18.397 0.646 1.00 53.12 C ATOM 2340 O ILE B 34 17.928 -19.110 0.316 1.00 43.00 O ATOM 2341 CB ILE B 34 17.080 -15.910 0.039 1.00 63.12 C ATOM 2342 CG1 ILE B 34 16.496 -14.794 -0.899 1.00 43.30 C ATOM 2343 CG2 ILE B 34 18.629 -15.962 -0.063 1.00 64.42 C ATOM 2344 CD1 ILE B 34 16.957 -13.379 -0.575 1.00 55.10 C ATOM 0 H ILE B 34 14.617 -16.428 0.357 1.00 24.23 H new ATOM 0 HA ILE B 34 16.671 -17.562 -1.321 1.00 11.24 H new ATOM 0 HB ILE B 34 16.834 -15.665 1.072 1.00 63.12 H new ATOM 0 HG12 ILE B 34 16.772 -15.024 -1.928 1.00 43.30 H new ATOM 0 HG13 ILE B 34 15.408 -14.827 -0.845 1.00 43.30 H new ATOM 0 HG21 ILE B 34 19.042 -14.981 0.171 1.00 64.42 H new ATOM 0 HG22 ILE B 34 19.016 -16.697 0.643 1.00 64.42 H new ATOM 0 HG23 ILE B 34 18.918 -16.245 -1.075 1.00 64.42 H new ATOM 0 HD11 ILE B 34 16.502 -12.679 -1.275 1.00 55.10 H new ATOM 0 HD12 ILE B 34 16.657 -13.122 0.441 1.00 55.10 H new ATOM 0 HD13 ILE B 34 18.042 -13.322 -0.659 1.00 55.10 H new ATOM 2356 N GLY B 35 16.312 -18.541 1.806 1.00 43.50 N ATOM 2357 CA GLY B 35 16.731 -19.483 2.839 1.00 2.35 C ATOM 2358 C GLY B 35 17.281 -18.756 4.048 1.00 43.33 C ATOM 2359 O GLY B 35 17.347 -17.514 4.056 1.00 14.32 O ATOM 0 H GLY B 35 15.478 -18.006 2.049 1.00 43.50 H new ATOM 0 HA2 GLY B 35 15.884 -20.102 3.137 1.00 2.35 H new ATOM 0 HA3 GLY B 35 17.490 -20.154 2.437 1.00 2.35 H new ATOM 2363 N GLU B 36 17.654 -19.527 5.079 1.00 23.31 N ATOM 2364 CA GLU B 36 18.234 -18.995 6.317 1.00 23.24 C ATOM 2365 C GLU B 36 19.620 -18.396 6.019 1.00 24.11 C ATOM 2366 O GLU B 36 20.633 -19.102 6.021 1.00 50.44 O ATOM 2367 CB GLU B 36 18.306 -20.103 7.403 1.00 63.13 C ATOM 2368 CG GLU B 36 16.933 -20.684 7.799 1.00 22.14 C ATOM 2369 CD GLU B 36 17.036 -21.766 8.884 1.00 73.42 C ATOM 2370 OE1 GLU B 36 16.894 -21.438 10.085 1.00 70.12 O ATOM 2371 OE2 GLU B 36 17.272 -22.945 8.542 1.00 74.01 O ATOM 0 H GLU B 36 17.561 -20.543 5.076 1.00 23.31 H new ATOM 0 HA GLU B 36 17.597 -18.202 6.708 1.00 23.24 H new ATOM 0 HB2 GLU B 36 18.940 -20.912 7.041 1.00 63.13 H new ATOM 0 HB3 GLU B 36 18.787 -19.695 8.292 1.00 63.13 H new ATOM 0 HG2 GLU B 36 16.292 -19.878 8.156 1.00 22.14 H new ATOM 0 HG3 GLU B 36 16.454 -21.106 6.916 1.00 22.14 H new ATOM 2378 N SER B 37 19.621 -17.099 5.683 1.00 43.14 N ATOM 2379 CA SER B 37 20.829 -16.347 5.332 1.00 41.21 C ATOM 2380 C SER B 37 21.384 -15.646 6.584 1.00 2.13 C ATOM 2381 O SER B 37 20.725 -14.766 7.154 1.00 22.01 O ATOM 2382 CB SER B 37 20.486 -15.327 4.217 1.00 31.14 C ATOM 2383 OG SER B 37 19.908 -15.987 3.097 1.00 1.41 O ATOM 0 H SER B 37 18.771 -16.537 5.647 1.00 43.14 H new ATOM 0 HA SER B 37 21.598 -17.022 4.957 1.00 41.21 H new ATOM 0 HB2 SER B 37 19.794 -14.578 4.602 1.00 31.14 H new ATOM 0 HB3 SER B 37 21.388 -14.799 3.909 1.00 31.14 H new ATOM 0 HG SER B 37 19.033 -16.351 3.347 1.00 1.41 H new ATOM 2389 N ASP B 38 22.583 -16.069 7.024 1.00 42.31 N ATOM 2390 CA ASP B 38 23.302 -15.442 8.156 1.00 41.52 C ATOM 2391 C ASP B 38 23.951 -14.115 7.718 1.00 61.13 C ATOM 2392 O ASP B 38 24.307 -13.287 8.561 1.00 30.32 O ATOM 2393 CB ASP B 38 24.368 -16.415 8.727 1.00 51.24 C ATOM 2394 CG ASP B 38 25.405 -16.870 7.677 1.00 2.40 C ATOM 2395 OD1 ASP B 38 25.095 -17.797 6.897 1.00 72.23 O ATOM 2396 OD2 ASP B 38 26.523 -16.313 7.628 1.00 64.30 O ATOM 0 H ASP B 38 23.083 -16.854 6.607 1.00 42.31 H new ATOM 0 HA ASP B 38 22.582 -15.223 8.944 1.00 41.52 H new ATOM 0 HB2 ASP B 38 24.887 -15.930 9.553 1.00 51.24 H new ATOM 0 HB3 ASP B 38 23.867 -17.292 9.136 1.00 51.24 H new ATOM 2401 N SER B 39 24.107 -13.944 6.391 1.00 53.32 N ATOM 2402 CA SER B 39 24.575 -12.689 5.780 1.00 14.41 C ATOM 2403 C SER B 39 23.518 -11.574 5.985 1.00 13.44 C ATOM 2404 O SER B 39 22.312 -11.858 5.942 1.00 33.21 O ATOM 2405 CB SER B 39 24.842 -12.905 4.269 1.00 24.12 C ATOM 2406 OG SER B 39 25.803 -13.934 4.057 1.00 72.31 O ATOM 0 H SER B 39 23.910 -14.678 5.711 1.00 53.32 H new ATOM 0 HA SER B 39 25.504 -12.383 6.260 1.00 14.41 H new ATOM 0 HB2 SER B 39 23.910 -13.165 3.766 1.00 24.12 H new ATOM 0 HB3 SER B 39 25.196 -11.976 3.823 1.00 24.12 H new ATOM 0 HG SER B 39 25.951 -14.050 3.095 1.00 72.31 H new ATOM 2412 N PRO B 40 23.946 -10.287 6.198 1.00 12.12 N ATOM 2413 CA PRO B 40 23.008 -9.155 6.400 1.00 33.00 C ATOM 2414 C PRO B 40 22.327 -8.733 5.073 1.00 5.05 C ATOM 2415 O PRO B 40 22.905 -8.912 3.992 1.00 70.34 O ATOM 2416 CB PRO B 40 23.933 -8.054 6.968 1.00 42.22 C ATOM 2417 CG PRO B 40 25.278 -8.323 6.368 1.00 1.10 C ATOM 2418 CD PRO B 40 25.373 -9.831 6.240 1.00 51.33 C ATOM 0 HA PRO B 40 22.173 -9.389 7.060 1.00 33.00 H new ATOM 0 HB2 PRO B 40 23.574 -7.061 6.699 1.00 42.22 H new ATOM 0 HB3 PRO B 40 23.972 -8.095 8.057 1.00 42.22 H new ATOM 0 HG2 PRO B 40 25.377 -7.840 5.396 1.00 1.10 H new ATOM 0 HG3 PRO B 40 26.075 -7.932 7.001 1.00 1.10 H new ATOM 0 HD2 PRO B 40 25.910 -10.121 5.337 1.00 51.33 H new ATOM 0 HD3 PRO B 40 25.907 -10.269 7.083 1.00 51.33 H new ATOM 2426 N ILE B 41 21.084 -8.213 5.156 1.00 45.30 N ATOM 2427 CA ILE B 41 20.276 -7.855 3.973 1.00 44.44 C ATOM 2428 C ILE B 41 20.273 -6.311 3.807 1.00 13.20 C ATOM 2429 O ILE B 41 19.587 -5.612 4.562 1.00 5.13 O ATOM 2430 CB ILE B 41 18.778 -8.396 4.059 1.00 42.31 C ATOM 2431 CG1 ILE B 41 18.706 -9.967 4.236 1.00 43.04 C ATOM 2432 CG2 ILE B 41 17.955 -7.954 2.811 1.00 44.32 C ATOM 2433 CD1 ILE B 41 19.033 -10.500 5.633 1.00 14.01 C ATOM 0 H ILE B 41 20.614 -8.030 6.043 1.00 45.30 H new ATOM 0 HA ILE B 41 20.732 -8.333 3.106 1.00 44.44 H new ATOM 0 HB ILE B 41 18.338 -7.951 4.952 1.00 42.31 H new ATOM 0 HG12 ILE B 41 17.702 -10.297 3.968 1.00 43.04 H new ATOM 0 HG13 ILE B 41 19.393 -10.425 3.524 1.00 43.04 H new ATOM 0 HG21 ILE B 41 16.937 -8.335 2.893 1.00 44.32 H new ATOM 0 HG22 ILE B 41 17.932 -6.866 2.757 1.00 44.32 H new ATOM 0 HG23 ILE B 41 18.420 -8.352 1.909 1.00 44.32 H new ATOM 0 HD11 ILE B 41 18.952 -11.587 5.636 1.00 14.01 H new ATOM 0 HD12 ILE B 41 20.049 -10.211 5.904 1.00 14.01 H new ATOM 0 HD13 ILE B 41 18.332 -10.082 6.355 1.00 14.01 H new ATOM 2445 N PRO B 42 21.078 -5.747 2.843 1.00 73.44 N ATOM 2446 CA PRO B 42 21.055 -4.306 2.537 1.00 24.21 C ATOM 2447 C PRO B 42 19.948 -3.932 1.523 1.00 53.21 C ATOM 2448 O PRO B 42 20.015 -4.304 0.344 1.00 22.32 O ATOM 2449 CB PRO B 42 22.478 -4.060 1.978 1.00 44.24 C ATOM 2450 CG PRO B 42 22.872 -5.352 1.314 1.00 23.31 C ATOM 2451 CD PRO B 42 22.097 -6.463 2.017 1.00 41.20 C ATOM 0 HA PRO B 42 20.820 -3.687 3.403 1.00 24.21 H new ATOM 0 HB2 PRO B 42 22.484 -3.234 1.267 1.00 44.24 H new ATOM 0 HB3 PRO B 42 23.174 -3.799 2.775 1.00 44.24 H new ATOM 0 HG2 PRO B 42 22.635 -5.328 0.250 1.00 23.31 H new ATOM 0 HG3 PRO B 42 23.946 -5.518 1.397 1.00 23.31 H new ATOM 0 HD2 PRO B 42 21.625 -7.133 1.298 1.00 41.20 H new ATOM 0 HD3 PRO B 42 22.753 -7.073 2.638 1.00 41.20 H new ATOM 2459 N LEU B 43 18.908 -3.242 2.011 1.00 53.24 N ATOM 2460 CA LEU B 43 17.834 -2.675 1.168 1.00 45.45 C ATOM 2461 C LEU B 43 18.286 -1.286 0.638 1.00 73.03 C ATOM 2462 O LEU B 43 18.223 -0.301 1.380 1.00 31.34 O ATOM 2463 CB LEU B 43 16.491 -2.528 1.960 1.00 43.44 C ATOM 2464 CG LEU B 43 15.810 -3.839 2.499 1.00 53.02 C ATOM 2465 CD1 LEU B 43 15.638 -4.897 1.382 1.00 20.05 C ATOM 2466 CD2 LEU B 43 16.554 -4.419 3.730 1.00 3.23 C ATOM 0 H LEU B 43 18.783 -3.058 3.006 1.00 53.24 H new ATOM 0 HA LEU B 43 17.653 -3.358 0.338 1.00 45.45 H new ATOM 0 HB2 LEU B 43 16.674 -1.872 2.811 1.00 43.44 H new ATOM 0 HB3 LEU B 43 15.775 -2.020 1.314 1.00 43.44 H new ATOM 0 HG LEU B 43 14.812 -3.560 2.836 1.00 53.02 H new ATOM 0 HD11 LEU B 43 15.164 -5.788 1.794 1.00 20.05 H new ATOM 0 HD12 LEU B 43 15.014 -4.489 0.587 1.00 20.05 H new ATOM 0 HD13 LEU B 43 16.615 -5.160 0.977 1.00 20.05 H new ATOM 0 HD21 LEU B 43 16.048 -5.324 4.068 1.00 3.23 H new ATOM 0 HD22 LEU B 43 17.581 -4.659 3.455 1.00 3.23 H new ATOM 0 HD23 LEU B 43 16.556 -3.683 4.534 1.00 3.23 H new ATOM 2478 N PRO B 44 18.726 -1.170 -0.663 1.00 0.32 N ATOM 2479 CA PRO B 44 19.296 0.085 -1.213 1.00 60.44 C ATOM 2480 C PRO B 44 18.222 1.076 -1.731 1.00 41.03 C ATOM 2481 O PRO B 44 18.551 2.074 -2.388 1.00 34.14 O ATOM 2482 CB PRO B 44 20.191 -0.451 -2.354 1.00 14.21 C ATOM 2483 CG PRO B 44 19.453 -1.653 -2.882 1.00 30.31 C ATOM 2484 CD PRO B 44 18.686 -2.241 -1.704 1.00 62.33 C ATOM 0 HA PRO B 44 19.827 0.675 -0.465 1.00 60.44 H new ATOM 0 HB2 PRO B 44 20.334 0.299 -3.131 1.00 14.21 H new ATOM 0 HB3 PRO B 44 21.181 -0.723 -1.987 1.00 14.21 H new ATOM 0 HG2 PRO B 44 18.773 -1.369 -3.685 1.00 30.31 H new ATOM 0 HG3 PRO B 44 20.148 -2.384 -3.296 1.00 30.31 H new ATOM 0 HD2 PRO B 44 17.661 -2.488 -1.981 1.00 62.33 H new ATOM 0 HD3 PRO B 44 19.150 -3.160 -1.347 1.00 62.33 H new ATOM 2492 N ASN B 45 16.945 0.797 -1.406 1.00 12.00 N ATOM 2493 CA ASN B 45 15.798 1.631 -1.809 1.00 33.21 C ATOM 2494 C ASN B 45 15.375 2.569 -0.658 1.00 73.51 C ATOM 2495 O ASN B 45 15.417 3.796 -0.797 1.00 61.43 O ATOM 2496 CB ASN B 45 14.619 0.719 -2.246 1.00 24.02 C ATOM 2497 CG ASN B 45 13.348 1.490 -2.630 1.00 51.24 C ATOM 2498 OD1 ASN B 45 12.456 1.703 -1.806 1.00 61.32 O ATOM 2499 ND2 ASN B 45 13.264 1.929 -3.878 1.00 23.13 N ATOM 0 H ASN B 45 16.680 -0.018 -0.853 1.00 12.00 H new ATOM 0 HA ASN B 45 16.090 2.255 -2.653 1.00 33.21 H new ATOM 0 HB2 ASN B 45 14.936 0.113 -3.095 1.00 24.02 H new ATOM 0 HB3 ASN B 45 14.384 0.031 -1.434 1.00 24.02 H new ATOM 0 HD21 ASN B 45 12.446 2.458 -4.178 1.00 23.13 H new ATOM 0 HD22 ASN B 45 14.018 1.737 -4.538 1.00 23.13 H new ATOM 2506 N VAL B 46 14.991 1.974 0.483 1.00 35.41 N ATOM 2507 CA VAL B 46 14.454 2.726 1.638 1.00 24.30 C ATOM 2508 C VAL B 46 15.603 3.360 2.464 1.00 24.41 C ATOM 2509 O VAL B 46 16.582 2.689 2.797 1.00 62.23 O ATOM 2510 CB VAL B 46 13.537 1.803 2.536 1.00 20.20 C ATOM 2511 CG1 VAL B 46 14.288 0.546 3.036 1.00 41.34 C ATOM 2512 CG2 VAL B 46 12.910 2.600 3.711 1.00 12.41 C ATOM 0 H VAL B 46 15.042 0.967 0.634 1.00 35.41 H new ATOM 0 HA VAL B 46 13.832 3.537 1.258 1.00 24.30 H new ATOM 0 HB VAL B 46 12.721 1.452 1.904 1.00 20.20 H new ATOM 0 HG11 VAL B 46 13.619 -0.058 3.649 1.00 41.34 H new ATOM 0 HG12 VAL B 46 14.626 -0.040 2.181 1.00 41.34 H new ATOM 0 HG13 VAL B 46 15.150 0.849 3.631 1.00 41.34 H new ATOM 0 HG21 VAL B 46 12.285 1.936 4.309 1.00 12.41 H new ATOM 0 HG22 VAL B 46 13.703 3.012 4.335 1.00 12.41 H new ATOM 0 HG23 VAL B 46 12.301 3.413 3.315 1.00 12.41 H new ATOM 2522 N THR B 47 15.466 4.666 2.772 1.00 12.44 N ATOM 2523 CA THR B 47 16.476 5.451 3.514 1.00 54.25 C ATOM 2524 C THR B 47 16.516 5.069 5.009 1.00 51.43 C ATOM 2525 O THR B 47 15.611 4.386 5.496 1.00 44.32 O ATOM 2526 CB THR B 47 16.174 6.972 3.361 1.00 11.40 C ATOM 2527 OG1 THR B 47 14.813 7.230 3.738 1.00 43.52 O ATOM 2528 CG2 THR B 47 16.409 7.470 1.925 1.00 72.22 C ATOM 0 H THR B 47 14.644 5.211 2.511 1.00 12.44 H new ATOM 0 HA THR B 47 17.454 5.224 3.090 1.00 54.25 H new ATOM 0 HB THR B 47 16.860 7.511 4.014 1.00 11.40 H new ATOM 0 HG1 THR B 47 14.623 8.187 3.644 1.00 43.52 H new ATOM 0 HG21 THR B 47 16.185 8.535 1.868 1.00 72.22 H new ATOM 0 HG22 THR B 47 17.450 7.302 1.648 1.00 72.22 H new ATOM 0 HG23 THR B 47 15.759 6.926 1.240 1.00 72.22 H new ATOM 2536 N SER B 48 17.558 5.539 5.729 1.00 60.03 N ATOM 2537 CA SER B 48 17.818 5.134 7.126 1.00 61.25 C ATOM 2538 C SER B 48 16.774 5.682 8.094 1.00 30.13 C ATOM 2539 O SER B 48 16.256 4.940 8.926 1.00 73.31 O ATOM 2540 CB SER B 48 19.218 5.581 7.567 1.00 41.32 C ATOM 2541 OG SER B 48 19.377 6.986 7.465 1.00 71.25 O ATOM 0 H SER B 48 18.237 6.205 5.361 1.00 60.03 H new ATOM 0 HA SER B 48 17.757 4.046 7.154 1.00 61.25 H new ATOM 0 HB2 SER B 48 19.392 5.269 8.597 1.00 41.32 H new ATOM 0 HB3 SER B 48 19.969 5.084 6.952 1.00 41.32 H new ATOM 0 HG SER B 48 20.309 7.195 7.245 1.00 71.25 H new ATOM 2547 N THR B 49 16.480 6.983 7.961 1.00 20.35 N ATOM 2548 CA THR B 49 15.530 7.694 8.829 1.00 34.12 C ATOM 2549 C THR B 49 14.150 7.015 8.796 1.00 4.33 C ATOM 2550 O THR B 49 13.556 6.729 9.835 1.00 74.01 O ATOM 2551 CB THR B 49 15.395 9.180 8.369 1.00 54.54 C ATOM 2552 OG1 THR B 49 15.006 9.208 6.988 1.00 51.05 O ATOM 2553 CG2 THR B 49 16.710 9.966 8.527 1.00 54.22 C ATOM 0 H THR B 49 16.897 7.576 7.243 1.00 20.35 H new ATOM 0 HA THR B 49 15.910 7.664 9.850 1.00 34.12 H new ATOM 0 HB THR B 49 14.645 9.653 9.003 1.00 54.54 H new ATOM 0 HG1 THR B 49 14.917 10.138 6.692 1.00 51.05 H new ATOM 0 HG21 THR B 49 16.562 10.993 8.193 1.00 54.22 H new ATOM 0 HG22 THR B 49 17.011 9.965 9.575 1.00 54.22 H new ATOM 0 HG23 THR B 49 17.489 9.497 7.925 1.00 54.22 H new ATOM 2561 N ILE B 50 13.698 6.705 7.573 1.00 50.25 N ATOM 2562 CA ILE B 50 12.362 6.163 7.319 1.00 13.41 C ATOM 2563 C ILE B 50 12.291 4.684 7.717 1.00 75.34 C ATOM 2564 O ILE B 50 11.334 4.271 8.369 1.00 34.42 O ATOM 2565 CB ILE B 50 11.966 6.362 5.811 1.00 50.30 C ATOM 2566 CG1 ILE B 50 12.071 7.877 5.429 1.00 72.43 C ATOM 2567 CG2 ILE B 50 10.555 5.806 5.508 1.00 23.41 C ATOM 2568 CD1 ILE B 50 11.239 8.822 6.296 1.00 75.21 C ATOM 0 H ILE B 50 14.256 6.825 6.728 1.00 50.25 H new ATOM 0 HA ILE B 50 11.645 6.709 7.933 1.00 13.41 H new ATOM 0 HB ILE B 50 12.666 5.794 5.198 1.00 50.30 H new ATOM 0 HG12 ILE B 50 13.116 8.179 5.489 1.00 72.43 H new ATOM 0 HG13 ILE B 50 11.764 7.996 4.390 1.00 72.43 H new ATOM 0 HG21 ILE B 50 10.320 5.964 4.455 1.00 23.41 H new ATOM 0 HG22 ILE B 50 10.529 4.739 5.730 1.00 23.41 H new ATOM 0 HG23 ILE B 50 9.820 6.323 6.125 1.00 23.41 H new ATOM 0 HD11 ILE B 50 11.378 9.847 5.954 1.00 75.21 H new ATOM 0 HD12 ILE B 50 10.185 8.554 6.219 1.00 75.21 H new ATOM 0 HD13 ILE B 50 11.559 8.740 7.335 1.00 75.21 H new ATOM 2580 N LEU B 51 13.333 3.909 7.349 1.00 20.31 N ATOM 2581 CA LEU B 51 13.408 2.468 7.670 1.00 45.23 C ATOM 2582 C LEU B 51 13.428 2.250 9.195 1.00 34.40 C ATOM 2583 O LEU B 51 12.734 1.368 9.700 1.00 42.33 O ATOM 2584 CB LEU B 51 14.652 1.802 7.008 1.00 3.12 C ATOM 2585 CG LEU B 51 14.777 0.247 7.179 1.00 31.24 C ATOM 2586 CD1 LEU B 51 13.522 -0.487 6.644 1.00 44.12 C ATOM 2587 CD2 LEU B 51 16.064 -0.293 6.508 1.00 42.44 C ATOM 0 H LEU B 51 14.137 4.259 6.827 1.00 20.31 H new ATOM 0 HA LEU B 51 12.516 1.992 7.262 1.00 45.23 H new ATOM 0 HB2 LEU B 51 14.636 2.030 5.942 1.00 3.12 H new ATOM 0 HB3 LEU B 51 15.549 2.265 7.420 1.00 3.12 H new ATOM 0 HG LEU B 51 14.848 0.044 8.248 1.00 31.24 H new ATOM 0 HD11 LEU B 51 13.644 -1.562 6.779 1.00 44.12 H new ATOM 0 HD12 LEU B 51 12.642 -0.150 7.192 1.00 44.12 H new ATOM 0 HD13 LEU B 51 13.396 -0.266 5.584 1.00 44.12 H new ATOM 0 HD21 LEU B 51 16.120 -1.373 6.645 1.00 42.44 H new ATOM 0 HD22 LEU B 51 16.043 -0.063 5.443 1.00 42.44 H new ATOM 0 HD23 LEU B 51 16.936 0.176 6.963 1.00 42.44 H new ATOM 2599 N GLU B 52 14.188 3.103 9.910 1.00 73.23 N ATOM 2600 CA GLU B 52 14.318 3.046 11.381 1.00 34.54 C ATOM 2601 C GLU B 52 12.954 3.269 12.046 1.00 31.35 C ATOM 2602 O GLU B 52 12.552 2.515 12.944 1.00 12.25 O ATOM 2603 CB GLU B 52 15.314 4.127 11.876 1.00 72.43 C ATOM 2604 CG GLU B 52 15.644 4.047 13.376 1.00 5.43 C ATOM 2605 CD GLU B 52 16.645 5.120 13.827 1.00 55.15 C ATOM 2606 OE1 GLU B 52 16.230 6.131 14.432 1.00 44.31 O ATOM 2607 OE2 GLU B 52 17.858 4.954 13.573 1.00 23.02 O ATOM 0 H GLU B 52 14.731 3.853 9.483 1.00 73.23 H new ATOM 0 HA GLU B 52 14.693 2.059 11.653 1.00 34.54 H new ATOM 0 HB2 GLU B 52 16.240 4.038 11.307 1.00 72.43 H new ATOM 0 HB3 GLU B 52 14.900 5.112 11.659 1.00 72.43 H new ATOM 0 HG2 GLU B 52 14.724 4.151 13.951 1.00 5.43 H new ATOM 0 HG3 GLU B 52 16.050 3.061 13.601 1.00 5.43 H new ATOM 2614 N LYS B 53 12.254 4.309 11.556 1.00 52.41 N ATOM 2615 CA LYS B 53 10.924 4.682 12.047 1.00 72.24 C ATOM 2616 C LYS B 53 9.909 3.540 11.840 1.00 14.55 C ATOM 2617 O LYS B 53 9.241 3.129 12.786 1.00 61.22 O ATOM 2618 CB LYS B 53 10.416 5.979 11.355 1.00 13.51 C ATOM 2619 CG LYS B 53 11.157 7.271 11.773 1.00 1.34 C ATOM 2620 CD LYS B 53 10.532 8.543 11.146 1.00 55.22 C ATOM 2621 CE LYS B 53 9.097 8.813 11.641 1.00 5.43 C ATOM 2622 NZ LYS B 53 9.038 8.997 13.117 1.00 12.11 N ATOM 0 H LYS B 53 12.599 4.911 10.809 1.00 52.41 H new ATOM 0 HA LYS B 53 11.015 4.871 13.117 1.00 72.24 H new ATOM 0 HB2 LYS B 53 10.507 5.858 10.276 1.00 13.51 H new ATOM 0 HB3 LYS B 53 9.355 6.099 11.574 1.00 13.51 H new ATOM 0 HG2 LYS B 53 11.141 7.360 12.859 1.00 1.34 H new ATOM 0 HG3 LYS B 53 12.203 7.199 11.474 1.00 1.34 H new ATOM 0 HD2 LYS B 53 11.159 9.403 11.380 1.00 55.22 H new ATOM 0 HD3 LYS B 53 10.523 8.440 10.061 1.00 55.22 H new ATOM 0 HE2 LYS B 53 8.706 9.704 11.149 1.00 5.43 H new ATOM 0 HE3 LYS B 53 8.453 7.982 11.354 1.00 5.43 H new ATOM 0 HZ1 LYS B 53 8.495 9.856 13.338 1.00 12.11 H new ATOM 0 HZ2 LYS B 53 8.575 8.173 13.551 1.00 12.11 H new ATOM 0 HZ3 LYS B 53 10.003 9.090 13.494 1.00 12.11 H new ATOM 2636 N VAL B 54 9.840 3.022 10.605 1.00 3.43 N ATOM 2637 CA VAL B 54 8.849 2.003 10.211 1.00 63.14 C ATOM 2638 C VAL B 54 9.103 0.660 10.951 1.00 44.25 C ATOM 2639 O VAL B 54 8.149 -0.020 11.348 1.00 71.30 O ATOM 2640 CB VAL B 54 8.840 1.819 8.639 1.00 22.30 C ATOM 2641 CG1 VAL B 54 7.905 0.679 8.184 1.00 2.31 C ATOM 2642 CG2 VAL B 54 8.441 3.143 7.935 1.00 5.20 C ATOM 0 H VAL B 54 10.468 3.296 9.850 1.00 3.43 H new ATOM 0 HA VAL B 54 7.859 2.348 10.509 1.00 63.14 H new ATOM 0 HB VAL B 54 9.855 1.546 8.349 1.00 22.30 H new ATOM 0 HG11 VAL B 54 7.936 0.595 7.098 1.00 2.31 H new ATOM 0 HG12 VAL B 54 8.232 -0.260 8.630 1.00 2.31 H new ATOM 0 HG13 VAL B 54 6.885 0.896 8.502 1.00 2.31 H new ATOM 0 HG21 VAL B 54 8.441 2.995 6.855 1.00 5.20 H new ATOM 0 HG22 VAL B 54 7.445 3.442 8.260 1.00 5.20 H new ATOM 0 HG23 VAL B 54 9.157 3.923 8.194 1.00 5.20 H new ATOM 2652 N LEU B 55 10.390 0.323 11.183 1.00 51.10 N ATOM 2653 CA LEU B 55 10.784 -0.896 11.931 1.00 62.34 C ATOM 2654 C LEU B 55 10.439 -0.772 13.434 1.00 21.43 C ATOM 2655 O LEU B 55 9.980 -1.739 14.052 1.00 65.42 O ATOM 2656 CB LEU B 55 12.303 -1.204 11.751 1.00 74.44 C ATOM 2657 CG LEU B 55 12.753 -1.726 10.345 1.00 62.35 C ATOM 2658 CD1 LEU B 55 14.276 -2.001 10.322 1.00 4.14 C ATOM 2659 CD2 LEU B 55 11.949 -2.978 9.913 1.00 72.25 C ATOM 0 H LEU B 55 11.181 0.881 10.861 1.00 51.10 H new ATOM 0 HA LEU B 55 10.212 -1.726 11.516 1.00 62.34 H new ATOM 0 HB2 LEU B 55 12.863 -0.295 11.972 1.00 74.44 H new ATOM 0 HB3 LEU B 55 12.591 -1.945 12.497 1.00 74.44 H new ATOM 0 HG LEU B 55 12.539 -0.942 9.619 1.00 62.35 H new ATOM 0 HD11 LEU B 55 14.566 -2.363 9.335 1.00 4.14 H new ATOM 0 HD12 LEU B 55 14.815 -1.080 10.544 1.00 4.14 H new ATOM 0 HD13 LEU B 55 14.521 -2.754 11.071 1.00 4.14 H new ATOM 0 HD21 LEU B 55 12.291 -3.309 8.933 1.00 72.25 H new ATOM 0 HD22 LEU B 55 12.101 -3.776 10.639 1.00 72.25 H new ATOM 0 HD23 LEU B 55 10.889 -2.730 9.863 1.00 72.25 H new ATOM 2671 N ASP B 56 10.662 0.430 14.006 1.00 4.12 N ATOM 2672 CA ASP B 56 10.412 0.697 15.444 1.00 71.33 C ATOM 2673 C ASP B 56 8.895 0.795 15.720 1.00 2.32 C ATOM 2674 O ASP B 56 8.423 0.440 16.814 1.00 53.45 O ATOM 2675 CB ASP B 56 11.145 1.985 15.900 1.00 11.24 C ATOM 2676 CG ASP B 56 11.171 2.160 17.434 1.00 40.24 C ATOM 2677 OD1 ASP B 56 10.349 2.926 17.986 1.00 22.35 O ATOM 2678 OD2 ASP B 56 12.012 1.508 18.098 1.00 51.52 O ATOM 0 H ASP B 56 11.017 1.237 13.493 1.00 4.12 H new ATOM 0 HA ASP B 56 10.810 -0.136 16.023 1.00 71.33 H new ATOM 0 HB2 ASP B 56 12.169 1.964 15.526 1.00 11.24 H new ATOM 0 HB3 ASP B 56 10.659 2.851 15.450 1.00 11.24 H new ATOM 2683 N TYR B 57 8.142 1.281 14.707 1.00 34.23 N ATOM 2684 CA TYR B 57 6.667 1.260 14.713 1.00 11.40 C ATOM 2685 C TYR B 57 6.188 -0.186 14.777 1.00 52.00 C ATOM 2686 O TYR B 57 5.359 -0.540 15.617 1.00 40.22 O ATOM 2687 CB TYR B 57 6.076 1.949 13.444 1.00 41.31 C ATOM 2688 CG TYR B 57 4.547 1.762 13.279 1.00 23.43 C ATOM 2689 CD1 TYR B 57 4.015 0.658 12.584 1.00 41.23 C ATOM 2690 CD2 TYR B 57 3.639 2.655 13.851 1.00 13.34 C ATOM 2691 CE1 TYR B 57 2.657 0.457 12.480 1.00 60.43 C ATOM 2692 CE2 TYR B 57 2.273 2.457 13.731 1.00 51.51 C ATOM 2693 CZ TYR B 57 1.794 1.355 13.052 1.00 42.34 C ATOM 2694 OH TYR B 57 0.442 1.137 12.963 1.00 43.24 O ATOM 0 H TYR B 57 8.542 1.697 13.866 1.00 34.23 H new ATOM 0 HA TYR B 57 6.322 1.814 15.586 1.00 11.40 H new ATOM 0 HB2 TYR B 57 6.299 3.015 13.485 1.00 41.31 H new ATOM 0 HB3 TYR B 57 6.577 1.552 12.561 1.00 41.31 H new ATOM 0 HD1 TYR B 57 4.689 -0.048 12.122 1.00 41.23 H new ATOM 0 HD2 TYR B 57 4.007 3.513 14.395 1.00 13.34 H new ATOM 0 HE1 TYR B 57 2.274 -0.403 11.951 1.00 60.43 H new ATOM 0 HE2 TYR B 57 1.584 3.164 14.168 1.00 51.51 H new ATOM 0 HH TYR B 57 0.039 1.216 13.853 1.00 43.24 H new ATOM 2704 N CYS B 58 6.721 -1.003 13.842 1.00 52.33 N ATOM 2705 CA CYS B 58 6.403 -2.427 13.737 1.00 31.30 C ATOM 2706 C CYS B 58 6.749 -3.167 15.034 1.00 4.24 C ATOM 2707 O CYS B 58 6.082 -4.133 15.389 1.00 14.15 O ATOM 2708 CB CYS B 58 7.126 -3.057 12.527 1.00 41.24 C ATOM 2709 SG CYS B 58 6.532 -2.437 10.946 1.00 2.41 S ATOM 0 H CYS B 58 7.387 -0.682 13.139 1.00 52.33 H new ATOM 0 HA CYS B 58 5.329 -2.524 13.579 1.00 31.30 H new ATOM 0 HB2 CYS B 58 8.195 -2.861 12.608 1.00 41.24 H new ATOM 0 HB3 CYS B 58 6.997 -4.139 12.558 1.00 41.24 H new ATOM 0 HG CYS B 58 7.103 -1.299 10.684 1.00 2.41 H new ATOM 2715 N ARG B 59 7.792 -2.697 15.744 1.00 55.22 N ATOM 2716 CA ARG B 59 8.151 -3.231 17.065 1.00 42.41 C ATOM 2717 C ARG B 59 7.008 -3.019 18.068 1.00 74.23 C ATOM 2718 O ARG B 59 6.579 -3.975 18.713 1.00 22.44 O ATOM 2719 CB ARG B 59 9.490 -2.629 17.566 1.00 64.03 C ATOM 2720 CG ARG B 59 9.857 -2.974 19.039 1.00 74.40 C ATOM 2721 CD ARG B 59 11.376 -3.012 19.290 1.00 62.43 C ATOM 2722 NE ARG B 59 12.090 -1.837 18.742 1.00 31.40 N ATOM 2723 CZ ARG B 59 13.178 -1.899 17.950 1.00 1.31 C ATOM 2724 NH1 ARG B 59 13.692 -3.078 17.595 1.00 12.01 N ATOM 2725 NH2 ARG B 59 13.747 -0.779 17.524 1.00 63.24 N ATOM 0 H ARG B 59 8.401 -1.945 15.420 1.00 55.22 H new ATOM 0 HA ARG B 59 8.303 -4.306 16.972 1.00 42.41 H new ATOM 0 HB2 ARG B 59 10.293 -2.977 16.916 1.00 64.03 H new ATOM 0 HB3 ARG B 59 9.444 -1.545 17.463 1.00 64.03 H new ATOM 0 HG2 ARG B 59 9.403 -2.237 19.702 1.00 74.40 H new ATOM 0 HG3 ARG B 59 9.428 -3.942 19.297 1.00 74.40 H new ATOM 0 HD2 ARG B 59 11.558 -3.071 20.363 1.00 62.43 H new ATOM 0 HD3 ARG B 59 11.788 -3.918 18.846 1.00 62.43 H new ATOM 0 HE ARG B 59 11.732 -0.912 18.982 1.00 31.40 H new ATOM 0 HH11 ARG B 59 13.261 -3.942 17.924 1.00 12.01 H new ATOM 0 HH12 ARG B 59 14.516 -3.115 16.995 1.00 12.01 H new ATOM 0 HH21 ARG B 59 13.361 0.125 17.796 1.00 63.24 H new ATOM 0 HH22 ARG B 59 14.571 -0.822 16.924 1.00 63.24 H new ATOM 2739 N HIS B 60 6.469 -1.787 18.126 1.00 24.02 N ATOM 2740 CA HIS B 60 5.317 -1.459 18.995 1.00 12.14 C ATOM 2741 C HIS B 60 4.062 -2.262 18.579 1.00 4.31 C ATOM 2742 O HIS B 60 3.319 -2.762 19.435 1.00 35.53 O ATOM 2743 CB HIS B 60 5.012 0.061 18.959 1.00 12.34 C ATOM 2744 CG HIS B 60 3.860 0.463 19.851 1.00 44.01 C ATOM 2745 ND1 HIS B 60 2.725 1.109 19.400 1.00 1.40 N ATOM 2746 CD2 HIS B 60 3.654 0.238 21.171 1.00 25.41 C ATOM 2747 CE1 HIS B 60 1.882 1.254 20.405 1.00 14.44 C ATOM 2748 NE2 HIS B 60 2.420 0.740 21.487 1.00 21.11 N ATOM 0 H HIS B 60 6.813 -0.997 17.580 1.00 24.02 H new ATOM 0 HA HIS B 60 5.583 -1.737 20.015 1.00 12.14 H new ATOM 0 HB2 HIS B 60 5.904 0.610 19.260 1.00 12.34 H new ATOM 0 HB3 HIS B 60 4.788 0.355 17.934 1.00 12.34 H new ATOM 0 HD1 HIS B 60 2.564 1.424 18.443 1.00 1.40 H new ATOM 0 HD2 HIS B 60 4.338 -0.249 21.850 1.00 25.41 H new ATOM 0 HE1 HIS B 60 0.909 1.719 20.347 1.00 14.44 H new ATOM 2757 N HIS B 61 3.865 -2.393 17.258 1.00 22.53 N ATOM 2758 CA HIS B 61 2.714 -3.095 16.667 1.00 11.24 C ATOM 2759 C HIS B 61 2.816 -4.623 16.879 1.00 22.53 C ATOM 2760 O HIS B 61 1.809 -5.331 16.844 1.00 5.13 O ATOM 2761 CB HIS B 61 2.625 -2.775 15.153 1.00 22.43 C ATOM 2762 CG HIS B 61 1.374 -3.294 14.492 1.00 13.32 C ATOM 2763 ND1 HIS B 61 1.240 -4.594 14.042 1.00 51.50 N ATOM 2764 CD2 HIS B 61 0.183 -2.699 14.268 1.00 32.24 C ATOM 2765 CE1 HIS B 61 0.026 -4.770 13.572 1.00 21.42 C ATOM 2766 NE2 HIS B 61 -0.639 -3.640 13.695 1.00 4.21 N ATOM 0 H HIS B 61 4.506 -2.011 16.563 1.00 22.53 H new ATOM 0 HA HIS B 61 1.811 -2.746 17.168 1.00 11.24 H new ATOM 0 HB2 HIS B 61 2.675 -1.695 15.016 1.00 22.43 H new ATOM 0 HB3 HIS B 61 3.493 -3.200 14.650 1.00 22.43 H new ATOM 0 HD2 HIS B 61 -0.075 -1.676 14.496 1.00 32.24 H new ATOM 0 HE1 HIS B 61 -0.362 -5.688 13.155 1.00 21.42 H new ATOM 0 HE2 HIS B 61 -1.607 -3.488 13.411 1.00 4.21 H new ATOM 2775 N HIS B 62 4.050 -5.121 17.051 1.00 45.00 N ATOM 2776 CA HIS B 62 4.303 -6.545 17.318 1.00 3.35 C ATOM 2777 C HIS B 62 4.047 -6.852 18.798 1.00 12.42 C ATOM 2778 O HIS B 62 3.505 -7.907 19.130 1.00 34.41 O ATOM 2779 CB HIS B 62 5.752 -6.919 16.928 1.00 11.40 C ATOM 2780 CG HIS B 62 6.084 -8.381 17.092 1.00 63.14 C ATOM 2781 ND1 HIS B 62 5.790 -9.327 16.133 1.00 15.42 N ATOM 2782 CD2 HIS B 62 6.688 -9.055 18.104 1.00 22.15 C ATOM 2783 CE1 HIS B 62 6.193 -10.509 16.548 1.00 30.50 C ATOM 2784 NE2 HIS B 62 6.742 -10.369 17.735 1.00 73.41 N ATOM 0 H HIS B 62 4.896 -4.552 17.009 1.00 45.00 H new ATOM 0 HA HIS B 62 3.622 -7.144 16.713 1.00 3.35 H new ATOM 0 HB2 HIS B 62 5.920 -6.635 15.889 1.00 11.40 H new ATOM 0 HB3 HIS B 62 6.442 -6.332 17.535 1.00 11.40 H new ATOM 0 HD1 HIS B 62 5.332 -9.140 15.241 1.00 15.42 H new ATOM 0 HD2 HIS B 62 7.056 -8.632 19.027 1.00 22.15 H new ATOM 0 HE1 HIS B 62 6.090 -11.437 16.006 1.00 30.50 H new ATOM 0 HE2 HIS B 62 7.145 -11.123 18.292 1.00 73.41 H new ATOM 2793 N GLN B 63 4.452 -5.908 19.667 1.00 30.34 N ATOM 2794 CA GLN B 63 4.282 -6.035 21.124 1.00 32.14 C ATOM 2795 C GLN B 63 2.799 -5.911 21.506 1.00 65.14 C ATOM 2796 O GLN B 63 2.343 -6.541 22.458 1.00 13.01 O ATOM 2797 CB GLN B 63 5.134 -4.973 21.879 1.00 54.42 C ATOM 2798 CG GLN B 63 6.658 -5.059 21.632 1.00 41.03 C ATOM 2799 CD GLN B 63 7.254 -6.443 21.894 1.00 3.10 C ATOM 2800 OE1 GLN B 63 7.360 -7.272 20.989 1.00 24.52 O ATOM 2801 NE2 GLN B 63 7.620 -6.708 23.137 1.00 21.32 N ATOM 0 H GLN B 63 4.904 -5.040 19.380 1.00 30.34 H new ATOM 0 HA GLN B 63 4.634 -7.023 21.422 1.00 32.14 H new ATOM 0 HB2 GLN B 63 4.790 -3.980 21.588 1.00 54.42 H new ATOM 0 HB3 GLN B 63 4.949 -5.074 22.948 1.00 54.42 H new ATOM 0 HG2 GLN B 63 6.865 -4.775 20.600 1.00 41.03 H new ATOM 0 HG3 GLN B 63 7.161 -4.332 22.270 1.00 41.03 H new ATOM 0 HE21 GLN B 63 7.518 -5.997 23.861 1.00 21.32 H new ATOM 0 HE22 GLN B 63 8.004 -7.623 23.371 1.00 21.32 H new ATOM 2810 N HIS B 64 2.059 -5.092 20.745 1.00 53.33 N ATOM 2811 CA HIS B 64 0.601 -4.932 20.889 1.00 2.11 C ATOM 2812 C HIS B 64 -0.056 -5.228 19.525 1.00 41.43 C ATOM 2813 O HIS B 64 -0.248 -4.302 18.721 1.00 51.32 O ATOM 2814 CB HIS B 64 0.250 -3.502 21.391 1.00 12.31 C ATOM 2815 CG HIS B 64 0.771 -3.181 22.771 1.00 61.10 C ATOM 2816 ND1 HIS B 64 0.007 -3.312 23.911 1.00 35.12 N ATOM 2817 CD2 HIS B 64 1.984 -2.731 23.192 1.00 15.14 C ATOM 2818 CE1 HIS B 64 0.717 -2.960 24.961 1.00 0.21 C ATOM 2819 NE2 HIS B 64 1.918 -2.605 24.555 1.00 13.41 N ATOM 0 H HIS B 64 2.458 -4.515 20.004 1.00 53.33 H new ATOM 0 HA HIS B 64 0.220 -5.631 21.633 1.00 2.11 H new ATOM 0 HB2 HIS B 64 0.651 -2.774 20.686 1.00 12.31 H new ATOM 0 HB3 HIS B 64 -0.834 -3.385 21.389 1.00 12.31 H new ATOM 0 HD2 HIS B 64 2.839 -2.514 22.569 1.00 15.14 H new ATOM 0 HE1 HIS B 64 0.372 -2.962 25.985 1.00 0.21 H new ATOM 0 HE2 HIS B 64 2.677 -2.287 25.158 1.00 13.41 H new ATOM 2828 N PRO B 65 -0.339 -6.540 19.204 1.00 31.33 N ATOM 2829 CA PRO B 65 -0.943 -6.941 17.910 1.00 61.53 C ATOM 2830 C PRO B 65 -2.392 -6.424 17.768 1.00 62.31 C ATOM 2831 O PRO B 65 -3.336 -7.021 18.304 1.00 63.31 O ATOM 2832 CB PRO B 65 -0.876 -8.500 17.928 1.00 45.24 C ATOM 2833 CG PRO B 65 0.074 -8.841 19.045 1.00 35.54 C ATOM 2834 CD PRO B 65 -0.090 -7.733 20.061 1.00 41.22 C ATOM 0 HA PRO B 65 -0.417 -6.516 17.055 1.00 61.53 H new ATOM 0 HB2 PRO B 65 -1.860 -8.935 18.102 1.00 45.24 H new ATOM 0 HB3 PRO B 65 -0.519 -8.890 16.975 1.00 45.24 H new ATOM 0 HG2 PRO B 65 -0.163 -9.812 19.480 1.00 35.54 H new ATOM 0 HG3 PRO B 65 1.101 -8.895 18.685 1.00 35.54 H new ATOM 0 HD2 PRO B 65 -0.921 -7.925 20.740 1.00 41.22 H new ATOM 0 HD3 PRO B 65 0.802 -7.611 20.676 1.00 41.22 H new ATOM 2842 N GLY B 66 -2.534 -5.275 17.104 1.00 65.50 N ATOM 2843 CA GLY B 66 -3.833 -4.645 16.878 1.00 25.43 C ATOM 2844 C GLY B 66 -3.748 -3.533 15.842 1.00 12.20 C ATOM 2845 O GLY B 66 -2.662 -3.010 15.576 1.00 71.24 O ATOM 0 H GLY B 66 -1.750 -4.756 16.708 1.00 65.50 H new ATOM 0 HA2 GLY B 66 -4.549 -5.397 16.547 1.00 25.43 H new ATOM 0 HA3 GLY B 66 -4.209 -4.239 17.817 1.00 25.43 H new ATOM 2849 N GLY B 67 -4.896 -3.183 15.257 1.00 14.12 N ATOM 2850 CA GLY B 67 -4.981 -2.135 14.243 1.00 51.53 C ATOM 2851 C GLY B 67 -6.424 -1.781 13.953 1.00 70.22 C ATOM 2852 O GLY B 67 -7.078 -1.164 14.794 1.00 20.51 O ATOM 0 H GLY B 67 -5.792 -3.620 15.475 1.00 14.12 H new ATOM 0 HA2 GLY B 67 -4.446 -1.249 14.584 1.00 51.53 H new ATOM 0 HA3 GLY B 67 -4.493 -2.469 13.327 1.00 51.53 H new ATOM 2856 N SER B 68 -6.906 -2.167 12.749 1.00 32.13 N ATOM 2857 CA SER B 68 -8.308 -1.958 12.280 1.00 24.14 C ATOM 2858 C SER B 68 -8.719 -0.465 12.220 1.00 21.11 C ATOM 2859 O SER B 68 -9.895 -0.154 11.970 1.00 0.24 O ATOM 2860 CB SER B 68 -9.305 -2.769 13.156 1.00 65.01 C ATOM 2861 OG SER B 68 -9.031 -4.162 13.103 1.00 52.42 O ATOM 0 H SER B 68 -6.325 -2.642 12.058 1.00 32.13 H new ATOM 0 HA SER B 68 -8.348 -2.327 11.255 1.00 24.14 H new ATOM 0 HB2 SER B 68 -9.247 -2.425 14.189 1.00 65.01 H new ATOM 0 HB3 SER B 68 -10.324 -2.584 12.815 1.00 65.01 H new ATOM 0 HG SER B 68 -9.674 -4.643 13.665 1.00 52.42 H new ATOM 2867 N GLY B 69 -7.735 0.446 12.403 1.00 54.35 N ATOM 2868 CA GLY B 69 -7.999 1.877 12.548 1.00 34.50 C ATOM 2869 C GLY B 69 -8.965 2.191 13.689 1.00 35.12 C ATOM 2870 O GLY B 69 -9.851 3.034 13.532 1.00 22.42 O ATOM 0 H GLY B 69 -6.746 0.201 12.453 1.00 54.35 H new ATOM 0 HA2 GLY B 69 -7.058 2.399 12.721 1.00 34.50 H new ATOM 0 HA3 GLY B 69 -8.410 2.262 11.615 1.00 34.50 H new ATOM 2874 N LEU B 70 -8.799 1.492 14.835 1.00 55.53 N ATOM 2875 CA LEU B 70 -9.636 1.703 16.033 1.00 12.52 C ATOM 2876 C LEU B 70 -9.437 3.117 16.578 1.00 32.40 C ATOM 2877 O LEU B 70 -8.319 3.649 16.524 1.00 13.40 O ATOM 2878 CB LEU B 70 -9.314 0.659 17.140 1.00 34.24 C ATOM 2879 CG LEU B 70 -9.592 -0.828 16.773 1.00 44.20 C ATOM 2880 CD1 LEU B 70 -9.226 -1.784 17.931 1.00 32.12 C ATOM 2881 CD2 LEU B 70 -11.049 -1.034 16.309 1.00 74.24 C ATOM 0 H LEU B 70 -8.086 0.772 14.953 1.00 55.53 H new ATOM 0 HA LEU B 70 -10.677 1.575 15.737 1.00 12.52 H new ATOM 0 HB2 LEU B 70 -8.262 0.756 17.409 1.00 34.24 H new ATOM 0 HB3 LEU B 70 -9.895 0.909 18.028 1.00 34.24 H new ATOM 0 HG LEU B 70 -8.943 -1.077 15.933 1.00 44.20 H new ATOM 0 HD11 LEU B 70 -9.435 -2.812 17.634 1.00 32.12 H new ATOM 0 HD12 LEU B 70 -8.166 -1.682 18.166 1.00 32.12 H new ATOM 0 HD13 LEU B 70 -9.818 -1.533 18.811 1.00 32.12 H new ATOM 0 HD21 LEU B 70 -11.207 -2.084 16.061 1.00 74.24 H new ATOM 0 HD22 LEU B 70 -11.730 -0.744 17.109 1.00 74.24 H new ATOM 0 HD23 LEU B 70 -11.241 -0.420 15.429 1.00 74.24 H new ATOM 2893 N ASP B 71 -10.529 3.714 17.086 1.00 32.12 N ATOM 2894 CA ASP B 71 -10.517 5.058 17.671 1.00 2.42 C ATOM 2895 C ASP B 71 -9.794 5.031 19.038 1.00 65.34 C ATOM 2896 O ASP B 71 -10.411 4.907 20.101 1.00 72.33 O ATOM 2897 CB ASP B 71 -11.969 5.601 17.787 1.00 73.04 C ATOM 2898 CG ASP B 71 -12.027 7.054 18.302 1.00 33.24 C ATOM 2899 OD1 ASP B 71 -11.637 7.972 17.547 1.00 21.01 O ATOM 2900 OD2 ASP B 71 -12.446 7.288 19.461 1.00 2.42 O ATOM 0 H ASP B 71 -11.448 3.272 17.100 1.00 32.12 H new ATOM 0 HA ASP B 71 -9.966 5.738 17.021 1.00 2.42 H new ATOM 0 HB2 ASP B 71 -12.451 5.547 16.811 1.00 73.04 H new ATOM 0 HB3 ASP B 71 -12.539 4.960 18.459 1.00 73.04 H new ATOM 2905 N ASP B 72 -8.462 5.028 18.956 1.00 15.32 N ATOM 2906 CA ASP B 72 -7.552 5.095 20.102 1.00 53.15 C ATOM 2907 C ASP B 72 -6.312 5.888 19.671 1.00 74.55 C ATOM 2908 O ASP B 72 -6.071 6.994 20.171 1.00 71.22 O ATOM 2909 CB ASP B 72 -7.172 3.663 20.573 1.00 24.21 C ATOM 2910 CG ASP B 72 -6.181 3.649 21.752 1.00 42.02 C ATOM 2911 OD1 ASP B 72 -4.998 3.290 21.557 1.00 23.43 O ATOM 2912 OD2 ASP B 72 -6.586 4.011 22.880 1.00 71.04 O ATOM 0 H ASP B 72 -7.972 4.977 18.063 1.00 15.32 H new ATOM 0 HA ASP B 72 -8.031 5.594 20.945 1.00 53.15 H new ATOM 0 HB2 ASP B 72 -8.078 3.132 20.864 1.00 24.21 H new ATOM 0 HB3 ASP B 72 -6.737 3.117 19.736 1.00 24.21 H new ATOM 2917 N ILE B 73 -5.584 5.312 18.676 1.00 4.33 N ATOM 2918 CA ILE B 73 -4.321 5.855 18.118 1.00 32.31 C ATOM 2919 C ILE B 73 -3.341 6.230 19.269 1.00 3.32 C ATOM 2920 O ILE B 73 -3.379 7.367 19.759 1.00 35.15 O ATOM 2921 CB ILE B 73 -4.531 7.078 17.112 1.00 60.32 C ATOM 2922 CG1 ILE B 73 -5.424 6.697 15.867 1.00 10.44 C ATOM 2923 CG2 ILE B 73 -3.159 7.621 16.622 1.00 15.13 C ATOM 2924 CD1 ILE B 73 -6.917 6.552 16.134 1.00 2.25 C ATOM 0 H ILE B 73 -5.868 4.439 18.232 1.00 4.33 H new ATOM 0 HA ILE B 73 -3.882 5.060 17.515 1.00 32.31 H new ATOM 0 HB ILE B 73 -5.058 7.852 17.670 1.00 60.32 H new ATOM 0 HG12 ILE B 73 -5.285 7.458 15.099 1.00 10.44 H new ATOM 0 HG13 ILE B 73 -5.056 5.757 15.455 1.00 10.44 H new ATOM 0 HG21 ILE B 73 -3.321 8.454 15.938 1.00 15.13 H new ATOM 0 HG22 ILE B 73 -2.576 7.962 17.478 1.00 15.13 H new ATOM 0 HG23 ILE B 73 -2.617 6.828 16.107 1.00 15.13 H new ATOM 0 HD11 ILE B 73 -7.428 6.289 15.208 1.00 2.25 H new ATOM 0 HD12 ILE B 73 -7.080 5.768 16.874 1.00 2.25 H new ATOM 0 HD13 ILE B 73 -7.312 7.495 16.512 1.00 2.25 H new ATOM 2936 N PRO B 74 -2.495 5.266 19.758 1.00 11.22 N ATOM 2937 CA PRO B 74 -1.625 5.486 20.949 1.00 13.45 C ATOM 2938 C PRO B 74 -0.663 6.685 20.763 1.00 72.32 C ATOM 2939 O PRO B 74 -0.223 6.926 19.642 1.00 44.10 O ATOM 2940 CB PRO B 74 -0.862 4.136 21.106 1.00 41.54 C ATOM 2941 CG PRO B 74 -1.690 3.137 20.351 1.00 70.51 C ATOM 2942 CD PRO B 74 -2.296 3.904 19.194 1.00 12.23 C ATOM 0 HA PRO B 74 -2.199 5.746 21.839 1.00 13.45 H new ATOM 0 HB2 PRO B 74 0.147 4.202 20.698 1.00 41.54 H new ATOM 0 HB3 PRO B 74 -0.764 3.857 22.155 1.00 41.54 H new ATOM 0 HG2 PRO B 74 -1.077 2.309 19.995 1.00 70.51 H new ATOM 0 HG3 PRO B 74 -2.465 2.709 20.987 1.00 70.51 H new ATOM 0 HD2 PRO B 74 -1.633 3.919 18.329 1.00 12.23 H new ATOM 0 HD3 PRO B 74 -3.237 3.462 18.866 1.00 12.23 H new ATOM 2950 N PRO B 75 -0.343 7.450 21.870 1.00 4.44 N ATOM 2951 CA PRO B 75 0.505 8.680 21.824 1.00 53.12 C ATOM 2952 C PRO B 75 1.817 8.530 21.017 1.00 24.51 C ATOM 2953 O PRO B 75 2.238 9.482 20.347 1.00 5.01 O ATOM 2954 CB PRO B 75 0.799 8.957 23.316 1.00 15.21 C ATOM 2955 CG PRO B 75 -0.403 8.420 24.033 1.00 63.01 C ATOM 2956 CD PRO B 75 -0.819 7.184 23.260 1.00 31.31 C ATOM 0 HA PRO B 75 -0.009 9.489 21.305 1.00 53.12 H new ATOM 0 HB2 PRO B 75 1.712 8.459 23.641 1.00 15.21 H new ATOM 0 HB3 PRO B 75 0.932 10.022 23.505 1.00 15.21 H new ATOM 0 HG2 PRO B 75 -0.165 8.174 25.068 1.00 63.01 H new ATOM 0 HG3 PRO B 75 -1.206 9.156 24.057 1.00 63.01 H new ATOM 0 HD2 PRO B 75 -0.364 6.283 23.672 1.00 31.31 H new ATOM 0 HD3 PRO B 75 -1.899 7.038 23.291 1.00 31.31 H new ATOM 2964 N TYR B 76 2.438 7.328 21.077 1.00 61.52 N ATOM 2965 CA TYR B 76 3.630 7.009 20.270 1.00 32.21 C ATOM 2966 C TYR B 76 3.322 7.161 18.770 1.00 14.54 C ATOM 2967 O TYR B 76 3.948 7.963 18.087 1.00 33.55 O ATOM 2968 CB TYR B 76 4.163 5.571 20.561 1.00 72.11 C ATOM 2969 CG TYR B 76 5.178 5.058 19.515 1.00 23.24 C ATOM 2970 CD1 TYR B 76 6.450 5.630 19.392 1.00 40.13 C ATOM 2971 CD2 TYR B 76 4.839 4.039 18.615 1.00 74.13 C ATOM 2972 CE1 TYR B 76 7.332 5.207 18.412 1.00 0.31 C ATOM 2973 CE2 TYR B 76 5.721 3.610 17.646 1.00 3.23 C ATOM 2974 CZ TYR B 76 6.963 4.199 17.544 1.00 70.44 C ATOM 2975 OH TYR B 76 7.836 3.782 16.563 1.00 31.32 O ATOM 0 H TYR B 76 2.129 6.565 21.679 1.00 61.52 H new ATOM 0 HA TYR B 76 4.409 7.717 20.552 1.00 32.21 H new ATOM 0 HB2 TYR B 76 4.632 5.560 21.545 1.00 72.11 H new ATOM 0 HB3 TYR B 76 3.319 4.882 20.603 1.00 72.11 H new ATOM 0 HD1 TYR B 76 6.748 6.414 20.073 1.00 40.13 H new ATOM 0 HD2 TYR B 76 3.864 3.579 18.682 1.00 74.13 H new ATOM 0 HE1 TYR B 76 8.307 5.665 18.327 1.00 0.31 H new ATOM 0 HE2 TYR B 76 5.440 2.816 16.970 1.00 3.23 H new ATOM 0 HH TYR B 76 8.671 3.476 16.976 1.00 31.32 H new ATOM 2985 N ASP B 77 2.303 6.420 18.322 1.00 2.22 N ATOM 2986 CA ASP B 77 1.943 6.260 16.898 1.00 72.34 C ATOM 2987 C ASP B 77 1.321 7.555 16.351 1.00 10.21 C ATOM 2988 O ASP B 77 1.387 7.835 15.148 1.00 65.41 O ATOM 2989 CB ASP B 77 0.968 5.062 16.735 1.00 32.24 C ATOM 2990 CG ASP B 77 1.458 3.798 17.477 1.00 31.24 C ATOM 2991 OD1 ASP B 77 2.018 2.870 16.856 1.00 70.21 O ATOM 2992 OD2 ASP B 77 1.316 3.758 18.709 1.00 33.43 O ATOM 0 H ASP B 77 1.688 5.901 18.949 1.00 2.22 H new ATOM 0 HA ASP B 77 2.846 6.055 16.322 1.00 72.34 H new ATOM 0 HB2 ASP B 77 -0.015 5.343 17.112 1.00 32.24 H new ATOM 0 HB3 ASP B 77 0.850 4.835 15.675 1.00 32.24 H new ATOM 2997 N ARG B 78 0.715 8.332 17.269 1.00 51.35 N ATOM 2998 CA ARG B 78 0.061 9.609 16.958 1.00 62.24 C ATOM 2999 C ARG B 78 1.124 10.657 16.568 1.00 25.13 C ATOM 3000 O ARG B 78 1.040 11.269 15.498 1.00 14.12 O ATOM 3001 CB ARG B 78 -0.786 10.075 18.180 1.00 53.11 C ATOM 3002 CG ARG B 78 -1.827 11.170 17.862 1.00 52.41 C ATOM 3003 CD ARG B 78 -2.690 11.549 19.085 1.00 14.33 C ATOM 3004 NE ARG B 78 -3.402 10.398 19.676 1.00 4.34 N ATOM 3005 CZ ARG B 78 -3.972 10.384 20.894 1.00 34.13 C ATOM 3006 NH1 ARG B 78 -3.926 11.451 21.689 1.00 24.42 N ATOM 3007 NH2 ARG B 78 -4.606 9.301 21.303 1.00 34.42 N ATOM 0 H ARG B 78 0.668 8.084 18.257 1.00 51.35 H new ATOM 0 HA ARG B 78 -0.613 9.485 16.110 1.00 62.24 H new ATOM 0 HB2 ARG B 78 -1.303 9.211 18.597 1.00 53.11 H new ATOM 0 HB3 ARG B 78 -0.112 10.446 18.952 1.00 53.11 H new ATOM 0 HG2 ARG B 78 -1.312 12.059 17.497 1.00 52.41 H new ATOM 0 HG3 ARG B 78 -2.477 10.825 17.058 1.00 52.41 H new ATOM 0 HD2 ARG B 78 -2.053 12.002 19.844 1.00 14.33 H new ATOM 0 HD3 ARG B 78 -3.418 12.304 18.788 1.00 14.33 H new ATOM 0 HE ARG B 78 -3.466 9.547 19.117 1.00 4.34 H new ATOM 0 HH11 ARG B 78 -3.452 12.299 21.378 1.00 24.42 H new ATOM 0 HH12 ARG B 78 -4.365 11.420 22.609 1.00 24.42 H new ATOM 0 HH21 ARG B 78 -4.661 8.483 20.697 1.00 34.42 H new ATOM 0 HH22 ARG B 78 -5.041 9.282 22.225 1.00 34.42 H new ATOM 3021 N ASP B 79 2.148 10.814 17.437 1.00 74.43 N ATOM 3022 CA ASP B 79 3.283 11.740 17.200 1.00 43.43 C ATOM 3023 C ASP B 79 4.262 11.180 16.157 1.00 73.34 C ATOM 3024 O ASP B 79 5.021 11.940 15.544 1.00 63.33 O ATOM 3025 CB ASP B 79 4.029 12.073 18.512 1.00 14.12 C ATOM 3026 CG ASP B 79 3.190 12.928 19.473 1.00 71.42 C ATOM 3027 OD1 ASP B 79 3.144 14.166 19.296 1.00 12.12 O ATOM 3028 OD2 ASP B 79 2.558 12.377 20.391 1.00 42.21 O ATOM 0 H ASP B 79 2.213 10.306 18.319 1.00 74.43 H new ATOM 0 HA ASP B 79 2.859 12.664 16.806 1.00 43.43 H new ATOM 0 HB2 ASP B 79 4.311 11.145 19.010 1.00 14.12 H new ATOM 0 HB3 ASP B 79 4.953 12.601 18.275 1.00 14.12 H new ATOM 3033 N PHE B 80 4.253 9.848 15.995 1.00 51.32 N ATOM 3034 CA PHE B 80 5.061 9.136 14.986 1.00 41.31 C ATOM 3035 C PHE B 80 4.694 9.601 13.571 1.00 63.24 C ATOM 3036 O PHE B 80 5.572 9.903 12.751 1.00 25.40 O ATOM 3037 CB PHE B 80 4.844 7.598 15.136 1.00 43.25 C ATOM 3038 CG PHE B 80 5.452 6.748 14.032 1.00 43.14 C ATOM 3039 CD1 PHE B 80 6.764 6.314 14.112 1.00 74.00 C ATOM 3040 CD2 PHE B 80 4.708 6.408 12.898 1.00 74.21 C ATOM 3041 CE1 PHE B 80 7.314 5.575 13.097 1.00 32.24 C ATOM 3042 CE2 PHE B 80 5.262 5.666 11.887 1.00 4.45 C ATOM 3043 CZ PHE B 80 6.567 5.249 11.982 1.00 32.30 C ATOM 0 H PHE B 80 3.680 9.226 16.565 1.00 51.32 H new ATOM 0 HA PHE B 80 6.115 9.364 15.148 1.00 41.31 H new ATOM 0 HB2 PHE B 80 5.263 7.279 16.090 1.00 43.25 H new ATOM 0 HB3 PHE B 80 3.773 7.401 15.176 1.00 43.25 H new ATOM 0 HD1 PHE B 80 7.358 6.559 14.980 1.00 74.00 H new ATOM 0 HD2 PHE B 80 3.682 6.735 12.817 1.00 74.21 H new ATOM 0 HE1 PHE B 80 8.340 5.245 13.170 1.00 32.24 H new ATOM 0 HE2 PHE B 80 4.674 5.410 11.018 1.00 4.45 H new ATOM 0 HZ PHE B 80 7.008 4.667 11.186 1.00 32.30 H new ATOM 3053 N CYS B 81 3.377 9.632 13.311 1.00 53.43 N ATOM 3054 CA CYS B 81 2.816 10.018 12.012 1.00 41.10 C ATOM 3055 C CYS B 81 2.870 11.548 11.795 1.00 55.51 C ATOM 3056 O CYS B 81 2.637 12.024 10.678 1.00 61.42 O ATOM 3057 CB CYS B 81 1.375 9.487 11.908 1.00 21.33 C ATOM 3058 SG CYS B 81 1.232 7.688 12.053 1.00 21.32 S ATOM 0 H CYS B 81 2.669 9.388 14.003 1.00 53.43 H new ATOM 0 HA CYS B 81 3.421 9.573 11.222 1.00 41.10 H new ATOM 0 HB2 CYS B 81 0.772 9.952 12.688 1.00 21.33 H new ATOM 0 HB3 CYS B 81 0.954 9.797 10.952 1.00 21.33 H new ATOM 0 HG CYS B 81 1.264 7.350 13.308 1.00 21.32 H new ATOM 3064 N LYS B 82 3.180 12.314 12.871 1.00 30.21 N ATOM 3065 CA LYS B 82 3.420 13.765 12.775 1.00 45.14 C ATOM 3066 C LYS B 82 4.834 14.000 12.220 1.00 50.03 C ATOM 3067 O LYS B 82 5.808 14.129 12.980 1.00 51.12 O ATOM 3068 CB LYS B 82 3.253 14.467 14.151 1.00 15.03 C ATOM 3069 CG LYS B 82 1.849 14.344 14.770 1.00 62.11 C ATOM 3070 CD LYS B 82 1.777 14.986 16.178 1.00 1.53 C ATOM 3071 CE LYS B 82 0.478 14.652 16.922 1.00 73.05 C ATOM 3072 NZ LYS B 82 0.486 15.202 18.308 1.00 31.45 N ATOM 0 H LYS B 82 3.268 11.943 13.817 1.00 30.21 H new ATOM 0 HA LYS B 82 2.679 14.198 12.103 1.00 45.14 H new ATOM 0 HB2 LYS B 82 3.980 14.049 14.847 1.00 15.03 H new ATOM 0 HB3 LYS B 82 3.493 15.524 14.036 1.00 15.03 H new ATOM 0 HG2 LYS B 82 1.121 14.823 14.115 1.00 62.11 H new ATOM 0 HG3 LYS B 82 1.573 13.292 14.837 1.00 62.11 H new ATOM 0 HD2 LYS B 82 2.626 14.646 16.770 1.00 1.53 H new ATOM 0 HD3 LYS B 82 1.867 16.068 16.083 1.00 1.53 H new ATOM 0 HE2 LYS B 82 -0.372 15.058 16.373 1.00 73.05 H new ATOM 0 HE3 LYS B 82 0.346 13.571 16.959 1.00 73.05 H new ATOM 0 HZ1 LYS B 82 -0.332 14.833 18.833 1.00 31.45 H new ATOM 0 HZ2 LYS B 82 1.363 14.917 18.789 1.00 31.45 H new ATOM 0 HZ3 LYS B 82 0.433 16.240 18.270 1.00 31.45 H new ATOM 3086 N VAL B 83 4.940 13.951 10.894 1.00 72.54 N ATOM 3087 CA VAL B 83 6.181 14.213 10.148 1.00 61.20 C ATOM 3088 C VAL B 83 5.884 15.196 9.006 1.00 10.20 C ATOM 3089 O VAL B 83 4.722 15.563 8.776 1.00 43.33 O ATOM 3090 CB VAL B 83 6.815 12.881 9.582 1.00 24.00 C ATOM 3091 CG1 VAL B 83 7.366 11.980 10.712 1.00 2.13 C ATOM 3092 CG2 VAL B 83 5.805 12.107 8.695 1.00 2.33 C ATOM 0 H VAL B 83 4.151 13.723 10.289 1.00 72.54 H new ATOM 0 HA VAL B 83 6.910 14.650 10.830 1.00 61.20 H new ATOM 0 HB VAL B 83 7.659 13.170 8.955 1.00 24.00 H new ATOM 0 HG11 VAL B 83 7.793 11.075 10.280 1.00 2.13 H new ATOM 0 HG12 VAL B 83 8.137 12.518 11.263 1.00 2.13 H new ATOM 0 HG13 VAL B 83 6.556 11.711 11.390 1.00 2.13 H new ATOM 0 HG21 VAL B 83 6.272 11.196 8.321 1.00 2.33 H new ATOM 0 HG22 VAL B 83 4.926 11.848 9.285 1.00 2.33 H new ATOM 0 HG23 VAL B 83 5.506 12.732 7.854 1.00 2.33 H new ATOM 3102 N ASP B 84 6.944 15.618 8.298 1.00 62.25 N ATOM 3103 CA ASP B 84 6.846 16.591 7.192 1.00 10.03 C ATOM 3104 C ASP B 84 6.029 15.973 6.026 1.00 1.41 C ATOM 3105 O ASP B 84 5.911 14.743 5.937 1.00 50.34 O ATOM 3106 CB ASP B 84 8.283 17.011 6.737 1.00 4.43 C ATOM 3107 CG ASP B 84 8.365 18.447 6.179 1.00 53.23 C ATOM 3108 OD1 ASP B 84 9.018 19.310 6.804 1.00 42.41 O ATOM 3109 OD2 ASP B 84 7.781 18.723 5.120 1.00 51.12 O ATOM 0 H ASP B 84 7.895 15.295 8.475 1.00 62.25 H new ATOM 0 HA ASP B 84 6.325 17.488 7.525 1.00 10.03 H new ATOM 0 HB2 ASP B 84 8.963 16.921 7.584 1.00 4.43 H new ATOM 0 HB3 ASP B 84 8.630 16.314 5.974 1.00 4.43 H new ATOM 3114 N GLN B 85 5.482 16.829 5.144 1.00 21.34 N ATOM 3115 CA GLN B 85 4.544 16.401 4.081 1.00 13.42 C ATOM 3116 C GLN B 85 5.180 15.359 3.100 1.00 71.42 C ATOM 3117 O GLN B 85 4.561 14.315 2.864 1.00 61.12 O ATOM 3118 CB GLN B 85 3.938 17.631 3.328 1.00 13.34 C ATOM 3119 CG GLN B 85 2.843 17.269 2.296 1.00 2.44 C ATOM 3120 CD GLN B 85 1.627 16.552 2.910 1.00 72.01 C ATOM 3121 OE1 GLN B 85 1.238 16.805 4.054 1.00 52.03 O ATOM 3122 NE2 GLN B 85 1.039 15.630 2.165 1.00 3.24 N ATOM 0 H GLN B 85 5.674 17.831 5.144 1.00 21.34 H new ATOM 0 HA GLN B 85 3.721 15.883 4.573 1.00 13.42 H new ATOM 0 HB2 GLN B 85 3.517 18.320 4.061 1.00 13.34 H new ATOM 0 HB3 GLN B 85 4.741 18.161 2.817 1.00 13.34 H new ATOM 0 HG2 GLN B 85 2.505 18.181 1.803 1.00 2.44 H new ATOM 0 HG3 GLN B 85 3.278 16.632 1.526 1.00 2.44 H new ATOM 0 HE21 GLN B 85 1.381 15.441 1.223 1.00 3.24 H new ATOM 0 HE22 GLN B 85 0.244 15.108 2.533 1.00 3.24 H new ATOM 3131 N PRO B 86 6.423 15.589 2.527 1.00 61.41 N ATOM 3132 CA PRO B 86 7.137 14.541 1.749 1.00 1.12 C ATOM 3133 C PRO B 86 7.451 13.270 2.564 1.00 31.30 C ATOM 3134 O PRO B 86 7.421 12.157 2.028 1.00 34.21 O ATOM 3135 CB PRO B 86 8.449 15.240 1.293 1.00 73.12 C ATOM 3136 CG PRO B 86 8.119 16.700 1.326 1.00 71.03 C ATOM 3137 CD PRO B 86 7.191 16.866 2.508 1.00 4.03 C ATOM 0 HA PRO B 86 6.520 14.183 0.925 1.00 1.12 H new ATOM 0 HB2 PRO B 86 9.278 15.004 1.960 1.00 73.12 H new ATOM 0 HB3 PRO B 86 8.743 14.921 0.293 1.00 73.12 H new ATOM 0 HG2 PRO B 86 9.018 17.305 1.442 1.00 71.03 H new ATOM 0 HG3 PRO B 86 7.639 17.017 0.400 1.00 71.03 H new ATOM 0 HD2 PRO B 86 7.744 17.016 3.435 1.00 4.03 H new ATOM 0 HD3 PRO B 86 6.535 17.728 2.386 1.00 4.03 H new ATOM 3145 N THR B 87 7.723 13.462 3.873 1.00 12.24 N ATOM 3146 CA THR B 87 8.116 12.378 4.797 1.00 24.54 C ATOM 3147 C THR B 87 6.943 11.393 5.047 1.00 62.24 C ATOM 3148 O THR B 87 7.169 10.203 5.287 1.00 34.41 O ATOM 3149 CB THR B 87 8.633 12.975 6.147 1.00 74.32 C ATOM 3150 OG1 THR B 87 9.513 14.071 5.875 1.00 1.42 O ATOM 3151 CG2 THR B 87 9.383 11.942 7.010 1.00 40.30 C ATOM 0 H THR B 87 7.676 14.378 4.320 1.00 12.24 H new ATOM 0 HA THR B 87 8.925 11.816 4.330 1.00 24.54 H new ATOM 0 HB THR B 87 7.757 13.301 6.708 1.00 74.32 H new ATOM 0 HG1 THR B 87 9.837 14.448 6.720 1.00 1.42 H new ATOM 0 HG21 THR B 87 9.718 12.414 7.934 1.00 40.30 H new ATOM 0 HG22 THR B 87 8.716 11.113 7.247 1.00 40.30 H new ATOM 0 HG23 THR B 87 10.246 11.567 6.460 1.00 40.30 H new ATOM 3159 N LEU B 88 5.699 11.917 4.983 1.00 22.32 N ATOM 3160 CA LEU B 88 4.461 11.097 5.012 1.00 21.53 C ATOM 3161 C LEU B 88 4.466 10.083 3.854 1.00 52.24 C ATOM 3162 O LEU B 88 4.225 8.892 4.055 1.00 5.10 O ATOM 3163 CB LEU B 88 3.213 12.019 4.911 1.00 33.54 C ATOM 3164 CG LEU B 88 2.905 12.880 6.174 1.00 75.12 C ATOM 3165 CD1 LEU B 88 1.888 13.987 5.847 1.00 14.34 C ATOM 3166 CD2 LEU B 88 2.401 11.993 7.339 1.00 3.10 C ATOM 0 H LEU B 88 5.522 12.919 4.910 1.00 22.32 H new ATOM 0 HA LEU B 88 4.423 10.550 5.954 1.00 21.53 H new ATOM 0 HB2 LEU B 88 3.346 12.688 4.061 1.00 33.54 H new ATOM 0 HB3 LEU B 88 2.343 11.399 4.695 1.00 33.54 H new ATOM 0 HG LEU B 88 3.832 13.357 6.492 1.00 75.12 H new ATOM 0 HD11 LEU B 88 1.689 14.574 6.743 1.00 14.34 H new ATOM 0 HD12 LEU B 88 2.293 14.636 5.071 1.00 14.34 H new ATOM 0 HD13 LEU B 88 0.960 13.536 5.495 1.00 14.34 H new ATOM 0 HD21 LEU B 88 2.193 12.617 8.208 1.00 3.10 H new ATOM 0 HD22 LEU B 88 1.489 11.478 7.036 1.00 3.10 H new ATOM 0 HD23 LEU B 88 3.165 11.259 7.594 1.00 3.10 H new ATOM 3178 N PHE B 89 4.788 10.591 2.649 1.00 71.43 N ATOM 3179 CA PHE B 89 4.868 9.778 1.423 1.00 22.52 C ATOM 3180 C PHE B 89 6.033 8.781 1.483 1.00 63.10 C ATOM 3181 O PHE B 89 5.950 7.717 0.890 1.00 22.12 O ATOM 3182 CB PHE B 89 4.973 10.679 0.170 1.00 24.14 C ATOM 3183 CG PHE B 89 3.746 11.568 -0.041 1.00 24.54 C ATOM 3184 CD1 PHE B 89 2.515 11.014 -0.395 1.00 31.35 C ATOM 3185 CD2 PHE B 89 3.821 12.952 0.109 1.00 3.32 C ATOM 3186 CE1 PHE B 89 1.408 11.816 -0.597 1.00 61.24 C ATOM 3187 CE2 PHE B 89 2.717 13.749 -0.093 1.00 2.20 C ATOM 3188 CZ PHE B 89 1.509 13.181 -0.444 1.00 41.25 C ATOM 0 H PHE B 89 5.000 11.577 2.499 1.00 71.43 H new ATOM 0 HA PHE B 89 3.947 9.200 1.350 1.00 22.52 H new ATOM 0 HB2 PHE B 89 5.859 11.309 0.257 1.00 24.14 H new ATOM 0 HB3 PHE B 89 5.114 10.051 -0.710 1.00 24.14 H new ATOM 0 HD1 PHE B 89 2.426 9.944 -0.513 1.00 31.35 H new ATOM 0 HD2 PHE B 89 4.760 13.406 0.388 1.00 3.32 H new ATOM 0 HE1 PHE B 89 0.463 11.372 -0.875 1.00 61.24 H new ATOM 0 HE2 PHE B 89 2.796 14.820 0.023 1.00 2.20 H new ATOM 0 HZ PHE B 89 0.643 13.807 -0.599 1.00 41.25 H new ATOM 3198 N GLU B 90 7.104 9.143 2.205 1.00 51.51 N ATOM 3199 CA GLU B 90 8.249 8.242 2.456 1.00 61.31 C ATOM 3200 C GLU B 90 7.822 7.016 3.283 1.00 14.52 C ATOM 3201 O GLU B 90 8.262 5.892 3.016 1.00 21.35 O ATOM 3202 CB GLU B 90 9.375 8.997 3.198 1.00 44.50 C ATOM 3203 CG GLU B 90 10.000 10.158 2.419 1.00 64.42 C ATOM 3204 CD GLU B 90 10.670 9.713 1.115 1.00 73.10 C ATOM 3205 OE1 GLU B 90 11.866 9.353 1.139 1.00 35.34 O ATOM 3206 OE2 GLU B 90 10.008 9.745 0.057 1.00 20.15 O ATOM 0 H GLU B 90 7.205 10.064 2.632 1.00 51.51 H new ATOM 0 HA GLU B 90 8.618 7.898 1.490 1.00 61.31 H new ATOM 0 HB2 GLU B 90 8.976 9.382 4.136 1.00 44.50 H new ATOM 0 HB3 GLU B 90 10.161 8.286 3.454 1.00 44.50 H new ATOM 0 HG2 GLU B 90 9.228 10.893 2.192 1.00 64.42 H new ATOM 0 HG3 GLU B 90 10.738 10.655 3.049 1.00 64.42 H new ATOM 3213 N LEU B 91 6.968 7.260 4.297 1.00 64.33 N ATOM 3214 CA LEU B 91 6.401 6.195 5.145 1.00 2.40 C ATOM 3215 C LEU B 91 5.470 5.286 4.310 1.00 64.40 C ATOM 3216 O LEU B 91 5.437 4.070 4.515 1.00 31.42 O ATOM 3217 CB LEU B 91 5.641 6.807 6.358 1.00 1.12 C ATOM 3218 CG LEU B 91 6.491 7.687 7.343 1.00 13.44 C ATOM 3219 CD1 LEU B 91 5.607 8.283 8.467 1.00 63.12 C ATOM 3220 CD2 LEU B 91 7.682 6.893 7.933 1.00 42.13 C ATOM 0 H LEU B 91 6.654 8.197 4.550 1.00 64.33 H new ATOM 0 HA LEU B 91 7.217 5.585 5.533 1.00 2.40 H new ATOM 0 HB2 LEU B 91 4.822 7.416 5.976 1.00 1.12 H new ATOM 0 HB3 LEU B 91 5.194 5.992 6.927 1.00 1.12 H new ATOM 0 HG LEU B 91 6.903 8.515 6.766 1.00 13.44 H new ATOM 0 HD11 LEU B 91 6.223 8.887 9.133 1.00 63.12 H new ATOM 0 HD12 LEU B 91 4.830 8.907 8.026 1.00 63.12 H new ATOM 0 HD13 LEU B 91 5.145 7.475 9.034 1.00 63.12 H new ATOM 0 HD21 LEU B 91 8.247 7.534 8.610 1.00 42.13 H new ATOM 0 HD22 LEU B 91 7.307 6.028 8.481 1.00 42.13 H new ATOM 0 HD23 LEU B 91 8.331 6.557 7.125 1.00 42.13 H new ATOM 3232 N ILE B 92 4.747 5.901 3.348 1.00 63.01 N ATOM 3233 CA ILE B 92 3.879 5.183 2.386 1.00 14.42 C ATOM 3234 C ILE B 92 4.735 4.313 1.424 1.00 22.41 C ATOM 3235 O ILE B 92 4.378 3.163 1.139 1.00 35.32 O ATOM 3236 CB ILE B 92 2.974 6.200 1.572 1.00 2.51 C ATOM 3237 CG1 ILE B 92 2.019 6.983 2.540 1.00 40.23 C ATOM 3238 CG2 ILE B 92 2.165 5.494 0.449 1.00 3.53 C ATOM 3239 CD1 ILE B 92 1.160 8.052 1.873 1.00 62.41 C ATOM 0 H ILE B 92 4.749 6.912 3.216 1.00 63.01 H new ATOM 0 HA ILE B 92 3.219 4.523 2.949 1.00 14.42 H new ATOM 0 HB ILE B 92 3.641 6.912 1.086 1.00 2.51 H new ATOM 0 HG12 ILE B 92 1.362 6.268 3.035 1.00 40.23 H new ATOM 0 HG13 ILE B 92 2.621 7.454 3.317 1.00 40.23 H new ATOM 0 HG21 ILE B 92 1.560 6.230 -0.081 1.00 3.53 H new ATOM 0 HG22 ILE B 92 2.852 5.018 -0.250 1.00 3.53 H new ATOM 0 HG23 ILE B 92 1.514 4.739 0.889 1.00 3.53 H new ATOM 0 HD11 ILE B 92 0.535 8.537 2.623 1.00 62.41 H new ATOM 0 HD12 ILE B 92 1.804 8.795 1.402 1.00 62.41 H new ATOM 0 HD13 ILE B 92 0.526 7.590 1.116 1.00 62.41 H new ATOM 3251 N LEU B 93 5.884 4.868 0.967 1.00 63.25 N ATOM 3252 CA LEU B 93 6.822 4.176 0.050 1.00 41.54 C ATOM 3253 C LEU B 93 7.434 2.934 0.732 1.00 42.31 C ATOM 3254 O LEU B 93 7.464 1.853 0.144 1.00 24.24 O ATOM 3255 CB LEU B 93 7.957 5.145 -0.434 1.00 42.12 C ATOM 3256 CG LEU B 93 7.538 6.265 -1.449 1.00 41.23 C ATOM 3257 CD1 LEU B 93 8.727 7.200 -1.786 1.00 13.12 C ATOM 3258 CD2 LEU B 93 6.934 5.657 -2.735 1.00 53.42 C ATOM 0 H LEU B 93 6.186 5.808 1.224 1.00 63.25 H new ATOM 0 HA LEU B 93 6.256 3.851 -0.823 1.00 41.54 H new ATOM 0 HB2 LEU B 93 8.392 5.625 0.443 1.00 42.12 H new ATOM 0 HB3 LEU B 93 8.744 4.546 -0.893 1.00 42.12 H new ATOM 0 HG LEU B 93 6.768 6.868 -0.968 1.00 41.23 H new ATOM 0 HD11 LEU B 93 8.401 7.964 -2.492 1.00 13.12 H new ATOM 0 HD12 LEU B 93 9.084 7.678 -0.874 1.00 13.12 H new ATOM 0 HD13 LEU B 93 9.534 6.617 -2.230 1.00 13.12 H new ATOM 0 HD21 LEU B 93 6.653 6.458 -3.419 1.00 53.42 H new ATOM 0 HD22 LEU B 93 7.671 5.013 -3.214 1.00 53.42 H new ATOM 0 HD23 LEU B 93 6.051 5.071 -2.480 1.00 53.42 H new ATOM 3270 N ALA B 94 7.884 3.114 1.990 1.00 24.13 N ATOM 3271 CA ALA B 94 8.510 2.045 2.799 1.00 52.04 C ATOM 3272 C ALA B 94 7.497 0.952 3.180 1.00 73.44 C ATOM 3273 O ALA B 94 7.844 -0.231 3.246 1.00 41.41 O ATOM 3274 CB ALA B 94 9.144 2.651 4.061 1.00 51.03 C ATOM 0 H ALA B 94 7.824 4.008 2.477 1.00 24.13 H new ATOM 0 HA ALA B 94 9.285 1.574 2.194 1.00 52.04 H new ATOM 0 HB1 ALA B 94 9.604 1.860 4.653 1.00 51.03 H new ATOM 0 HB2 ALA B 94 9.904 3.377 3.773 1.00 51.03 H new ATOM 0 HB3 ALA B 94 8.374 3.147 4.653 1.00 51.03 H new ATOM 3280 N ALA B 95 6.244 1.371 3.429 1.00 44.20 N ATOM 3281 CA ALA B 95 5.142 0.458 3.780 1.00 5.41 C ATOM 3282 C ALA B 95 4.718 -0.404 2.581 1.00 62.41 C ATOM 3283 O ALA B 95 4.376 -1.565 2.750 1.00 23.40 O ATOM 3284 CB ALA B 95 3.947 1.248 4.306 1.00 23.20 C ATOM 0 H ALA B 95 5.967 2.352 3.393 1.00 44.20 H new ATOM 0 HA ALA B 95 5.503 -0.210 4.562 1.00 5.41 H new ATOM 0 HB1 ALA B 95 3.140 0.561 4.561 1.00 23.20 H new ATOM 0 HB2 ALA B 95 4.243 1.807 5.194 1.00 23.20 H new ATOM 0 HB3 ALA B 95 3.603 1.942 3.539 1.00 23.20 H new ATOM 3290 N ASN B 96 4.734 0.196 1.377 1.00 33.15 N ATOM 3291 CA ASN B 96 4.436 -0.510 0.106 1.00 2.41 C ATOM 3292 C ASN B 96 5.609 -1.446 -0.272 1.00 40.24 C ATOM 3293 O ASN B 96 5.408 -2.555 -0.787 1.00 12.21 O ATOM 3294 CB ASN B 96 4.169 0.538 -1.022 1.00 61.53 C ATOM 3295 CG ASN B 96 3.846 -0.064 -2.406 1.00 14.02 C ATOM 3296 OD1 ASN B 96 3.285 -1.157 -2.522 1.00 42.55 O ATOM 3297 ND2 ASN B 96 4.180 0.661 -3.466 1.00 4.45 N ATOM 0 H ASN B 96 4.953 1.184 1.252 1.00 33.15 H new ATOM 0 HA ASN B 96 3.544 -1.123 0.230 1.00 2.41 H new ATOM 0 HB2 ASN B 96 3.339 1.175 -0.717 1.00 61.53 H new ATOM 0 HB3 ASN B 96 5.045 1.179 -1.117 1.00 61.53 H new ATOM 0 HD21 ASN B 96 3.974 0.318 -4.404 1.00 4.45 H new ATOM 0 HD22 ASN B 96 4.643 1.561 -3.343 1.00 4.45 H new ATOM 3304 N TYR B 97 6.834 -0.980 0.032 1.00 32.30 N ATOM 3305 CA TYR B 97 8.090 -1.687 -0.289 1.00 71.10 C ATOM 3306 C TYR B 97 8.261 -2.956 0.570 1.00 53.33 C ATOM 3307 O TYR B 97 8.727 -3.987 0.079 1.00 54.35 O ATOM 3308 CB TYR B 97 9.295 -0.724 -0.092 1.00 42.35 C ATOM 3309 CG TYR B 97 10.673 -1.321 -0.430 1.00 1.53 C ATOM 3310 CD1 TYR B 97 11.662 -1.482 0.550 1.00 51.10 C ATOM 3311 CD2 TYR B 97 10.981 -1.728 -1.733 1.00 4.45 C ATOM 3312 CE1 TYR B 97 12.898 -2.021 0.240 1.00 32.21 C ATOM 3313 CE2 TYR B 97 12.217 -2.268 -2.043 1.00 12.15 C ATOM 3314 CZ TYR B 97 13.171 -2.412 -1.054 1.00 1.33 C ATOM 3315 OH TYR B 97 14.407 -2.945 -1.364 1.00 73.21 O ATOM 0 H TYR B 97 6.983 -0.093 0.513 1.00 32.30 H new ATOM 0 HA TYR B 97 8.049 -2.005 -1.331 1.00 71.10 H new ATOM 0 HB2 TYR B 97 9.138 0.160 -0.710 1.00 42.35 H new ATOM 0 HB3 TYR B 97 9.306 -0.389 0.945 1.00 42.35 H new ATOM 0 HD1 TYR B 97 11.455 -1.180 1.566 1.00 51.10 H new ATOM 0 HD2 TYR B 97 10.240 -1.619 -2.511 1.00 4.45 H new ATOM 0 HE1 TYR B 97 13.647 -2.135 1.009 1.00 32.21 H new ATOM 0 HE2 TYR B 97 12.435 -2.576 -3.055 1.00 12.15 H new ATOM 0 HH TYR B 97 14.436 -3.170 -2.317 1.00 73.21 H new ATOM 3325 N LEU B 98 7.892 -2.863 1.862 1.00 54.50 N ATOM 3326 CA LEU B 98 8.002 -3.985 2.825 1.00 64.01 C ATOM 3327 C LEU B 98 6.649 -4.709 3.009 1.00 74.23 C ATOM 3328 O LEU B 98 6.575 -5.718 3.728 1.00 11.32 O ATOM 3329 CB LEU B 98 8.544 -3.472 4.183 1.00 5.33 C ATOM 3330 CG LEU B 98 9.967 -2.827 4.153 1.00 40.41 C ATOM 3331 CD1 LEU B 98 10.377 -2.312 5.553 1.00 51.12 C ATOM 3332 CD2 LEU B 98 11.016 -3.815 3.582 1.00 73.24 C ATOM 0 H LEU B 98 7.509 -2.011 2.271 1.00 54.50 H new ATOM 0 HA LEU B 98 8.706 -4.712 2.419 1.00 64.01 H new ATOM 0 HB2 LEU B 98 7.842 -2.737 4.578 1.00 5.33 H new ATOM 0 HB3 LEU B 98 8.560 -4.307 4.884 1.00 5.33 H new ATOM 0 HG LEU B 98 9.930 -1.966 3.486 1.00 40.41 H new ATOM 0 HD11 LEU B 98 11.371 -1.869 5.501 1.00 51.12 H new ATOM 0 HD12 LEU B 98 9.662 -1.561 5.888 1.00 51.12 H new ATOM 0 HD13 LEU B 98 10.387 -3.143 6.258 1.00 51.12 H new ATOM 0 HD21 LEU B 98 11.997 -3.339 3.573 1.00 73.24 H new ATOM 0 HD22 LEU B 98 11.052 -4.708 4.206 1.00 73.24 H new ATOM 0 HD23 LEU B 98 10.738 -4.093 2.565 1.00 73.24 H new ATOM 3344 N ASP B 99 5.609 -4.180 2.334 1.00 32.00 N ATOM 3345 CA ASP B 99 4.213 -4.677 2.378 1.00 75.53 C ATOM 3346 C ASP B 99 3.673 -4.747 3.832 1.00 55.22 C ATOM 3347 O ASP B 99 2.972 -5.692 4.233 1.00 20.13 O ATOM 3348 CB ASP B 99 4.067 -6.029 1.614 1.00 4.21 C ATOM 3349 CG ASP B 99 2.594 -6.415 1.330 1.00 1.53 C ATOM 3350 OD1 ASP B 99 1.797 -5.530 0.941 1.00 23.10 O ATOM 3351 OD2 ASP B 99 2.229 -7.601 1.444 1.00 5.22 O ATOM 0 H ASP B 99 5.717 -3.370 1.723 1.00 32.00 H new ATOM 0 HA ASP B 99 3.586 -3.954 1.855 1.00 75.53 H new ATOM 0 HB2 ASP B 99 4.607 -5.965 0.670 1.00 4.21 H new ATOM 0 HB3 ASP B 99 4.537 -6.821 2.197 1.00 4.21 H new ATOM 3356 N ILE B 100 4.013 -3.709 4.614 1.00 43.44 N ATOM 3357 CA ILE B 100 3.485 -3.521 5.970 1.00 64.20 C ATOM 3358 C ILE B 100 2.162 -2.752 5.864 1.00 34.10 C ATOM 3359 O ILE B 100 2.137 -1.515 5.901 1.00 60.11 O ATOM 3360 CB ILE B 100 4.499 -2.762 6.907 1.00 64.25 C ATOM 3361 CG1 ILE B 100 5.907 -3.423 6.824 1.00 73.22 C ATOM 3362 CG2 ILE B 100 3.982 -2.726 8.376 1.00 21.20 C ATOM 3363 CD1 ILE B 100 6.992 -2.698 7.593 1.00 44.10 C ATOM 0 H ILE B 100 4.662 -2.978 4.321 1.00 43.44 H new ATOM 0 HA ILE B 100 3.324 -4.498 6.425 1.00 64.20 H new ATOM 0 HB ILE B 100 4.583 -1.731 6.563 1.00 64.25 H new ATOM 0 HG12 ILE B 100 5.837 -4.445 7.197 1.00 73.22 H new ATOM 0 HG13 ILE B 100 6.203 -3.486 5.777 1.00 73.22 H new ATOM 0 HG21 ILE B 100 4.700 -2.197 9.002 1.00 21.20 H new ATOM 0 HG22 ILE B 100 3.022 -2.212 8.411 1.00 21.20 H new ATOM 0 HG23 ILE B 100 3.862 -3.745 8.744 1.00 21.20 H new ATOM 0 HD11 ILE B 100 7.937 -3.230 7.478 1.00 44.10 H new ATOM 0 HD12 ILE B 100 7.097 -1.684 7.206 1.00 44.10 H new ATOM 0 HD13 ILE B 100 6.725 -2.658 8.649 1.00 44.10 H new ATOM 3375 N LYS B 101 1.083 -3.523 5.668 1.00 30.01 N ATOM 3376 CA LYS B 101 -0.293 -3.005 5.573 1.00 33.31 C ATOM 3377 C LYS B 101 -0.741 -2.263 6.870 1.00 22.34 C ATOM 3378 O LYS B 101 -1.453 -1.273 6.753 1.00 11.04 O ATOM 3379 CB LYS B 101 -1.298 -4.144 5.231 1.00 5.34 C ATOM 3380 CG LYS B 101 -0.854 -5.059 4.066 1.00 33.43 C ATOM 3381 CD LYS B 101 -1.940 -6.096 3.688 1.00 33.01 C ATOM 3382 CE LYS B 101 -1.412 -7.223 2.787 1.00 23.03 C ATOM 3383 NZ LYS B 101 -0.783 -6.711 1.554 1.00 32.03 N ATOM 0 H LYS B 101 1.140 -4.537 5.570 1.00 30.01 H new ATOM 0 HA LYS B 101 -0.295 -2.277 4.762 1.00 33.31 H new ATOM 0 HB2 LYS B 101 -1.451 -4.756 6.120 1.00 5.34 H new ATOM 0 HB3 LYS B 101 -2.261 -3.699 4.981 1.00 5.34 H new ATOM 0 HG2 LYS B 101 -0.620 -4.447 3.195 1.00 33.43 H new ATOM 0 HG3 LYS B 101 0.062 -5.580 4.345 1.00 33.43 H new ATOM 0 HD2 LYS B 101 -2.351 -6.530 4.599 1.00 33.01 H new ATOM 0 HD3 LYS B 101 -2.759 -5.587 3.180 1.00 33.01 H new ATOM 0 HE2 LYS B 101 -0.686 -7.818 3.342 1.00 23.03 H new ATOM 0 HE3 LYS B 101 -2.234 -7.888 2.523 1.00 23.03 H new ATOM 0 HZ1 LYS B 101 -0.535 -7.508 0.934 1.00 32.03 H new ATOM 0 HZ2 LYS B 101 -1.448 -6.082 1.060 1.00 32.03 H new ATOM 0 HZ3 LYS B 101 0.078 -6.181 1.798 1.00 32.03 H new ATOM 3397 N PRO B 102 -0.372 -2.745 8.133 1.00 61.10 N ATOM 3398 CA PRO B 102 -0.587 -1.962 9.391 1.00 14.43 C ATOM 3399 C PRO B 102 -0.128 -0.488 9.305 1.00 61.31 C ATOM 3400 O PRO B 102 -0.929 0.434 9.507 1.00 41.14 O ATOM 3401 CB PRO B 102 0.267 -2.731 10.426 1.00 11.40 C ATOM 3402 CG PRO B 102 0.195 -4.156 9.976 1.00 22.21 C ATOM 3403 CD PRO B 102 0.174 -4.107 8.462 1.00 32.23 C ATOM 0 HA PRO B 102 -1.647 -1.891 9.633 1.00 14.43 H new ATOM 0 HB2 PRO B 102 1.295 -2.370 10.441 1.00 11.40 H new ATOM 0 HB3 PRO B 102 -0.127 -2.612 11.435 1.00 11.40 H new ATOM 0 HG2 PRO B 102 1.052 -4.725 10.338 1.00 22.21 H new ATOM 0 HG3 PRO B 102 -0.699 -4.645 10.364 1.00 22.21 H new ATOM 0 HD2 PRO B 102 1.173 -4.244 8.047 1.00 32.23 H new ATOM 0 HD3 PRO B 102 -0.454 -4.896 8.049 1.00 32.23 H new ATOM 3411 N LEU B 103 1.163 -0.288 8.960 1.00 4.32 N ATOM 3412 CA LEU B 103 1.783 1.049 8.914 1.00 11.52 C ATOM 3413 C LEU B 103 1.171 1.865 7.772 1.00 73.22 C ATOM 3414 O LEU B 103 0.861 3.044 7.950 1.00 70.15 O ATOM 3415 CB LEU B 103 3.341 0.937 8.779 1.00 62.44 C ATOM 3416 CG LEU B 103 4.196 2.268 8.879 1.00 2.02 C ATOM 3417 CD1 LEU B 103 4.368 2.986 7.519 1.00 4.55 C ATOM 3418 CD2 LEU B 103 3.618 3.240 9.932 1.00 15.34 C ATOM 0 H LEU B 103 1.798 -1.045 8.708 1.00 4.32 H new ATOM 0 HA LEU B 103 1.580 1.569 9.850 1.00 11.52 H new ATOM 0 HB2 LEU B 103 3.695 0.255 9.552 1.00 62.44 H new ATOM 0 HB3 LEU B 103 3.560 0.471 7.818 1.00 62.44 H new ATOM 0 HG LEU B 103 5.189 1.954 9.201 1.00 2.02 H new ATOM 0 HD11 LEU B 103 4.962 3.889 7.657 1.00 4.55 H new ATOM 0 HD12 LEU B 103 4.874 2.322 6.818 1.00 4.55 H new ATOM 0 HD13 LEU B 103 3.389 3.253 7.122 1.00 4.55 H new ATOM 0 HD21 LEU B 103 4.231 4.140 9.971 1.00 15.34 H new ATOM 0 HD22 LEU B 103 2.597 3.508 9.659 1.00 15.34 H new ATOM 0 HD23 LEU B 103 3.617 2.759 10.910 1.00 15.34 H new ATOM 3430 N LEU B 104 0.967 1.199 6.626 1.00 5.35 N ATOM 3431 CA LEU B 104 0.384 1.812 5.426 1.00 2.24 C ATOM 3432 C LEU B 104 -1.016 2.369 5.725 1.00 73.12 C ATOM 3433 O LEU B 104 -1.322 3.504 5.374 1.00 54.10 O ATOM 3434 CB LEU B 104 0.317 0.770 4.280 1.00 72.43 C ATOM 3435 CG LEU B 104 -0.177 1.294 2.894 1.00 71.34 C ATOM 3436 CD1 LEU B 104 0.737 2.425 2.357 1.00 40.22 C ATOM 3437 CD2 LEU B 104 -0.287 0.127 1.888 1.00 45.12 C ATOM 0 H LEU B 104 1.204 0.214 6.506 1.00 5.35 H new ATOM 0 HA LEU B 104 1.020 2.641 5.115 1.00 2.24 H new ATOM 0 HB2 LEU B 104 1.311 0.342 4.149 1.00 72.43 H new ATOM 0 HB3 LEU B 104 -0.341 -0.041 4.593 1.00 72.43 H new ATOM 0 HG LEU B 104 -1.170 1.724 3.025 1.00 71.34 H new ATOM 0 HD11 LEU B 104 0.364 2.766 1.391 1.00 40.22 H new ATOM 0 HD12 LEU B 104 0.737 3.258 3.061 1.00 40.22 H new ATOM 0 HD13 LEU B 104 1.753 2.048 2.241 1.00 40.22 H new ATOM 0 HD21 LEU B 104 -0.632 0.507 0.926 1.00 45.12 H new ATOM 0 HD22 LEU B 104 0.690 -0.340 1.764 1.00 45.12 H new ATOM 0 HD23 LEU B 104 -0.997 -0.611 2.263 1.00 45.12 H new ATOM 3449 N ASP B 105 -1.815 1.565 6.448 1.00 13.45 N ATOM 3450 CA ASP B 105 -3.219 1.876 6.763 1.00 23.20 C ATOM 3451 C ASP B 105 -3.310 3.054 7.746 1.00 45.54 C ATOM 3452 O ASP B 105 -4.112 3.956 7.552 1.00 70.20 O ATOM 3453 CB ASP B 105 -3.922 0.623 7.349 1.00 23.12 C ATOM 3454 CG ASP B 105 -5.435 0.821 7.551 1.00 4.12 C ATOM 3455 OD1 ASP B 105 -6.192 0.728 6.554 1.00 22.33 O ATOM 3456 OD2 ASP B 105 -5.882 1.078 8.698 1.00 63.44 O ATOM 0 H ASP B 105 -1.501 0.674 6.833 1.00 13.45 H new ATOM 0 HA ASP B 105 -3.725 2.165 5.842 1.00 23.20 H new ATOM 0 HB2 ASP B 105 -3.758 -0.224 6.683 1.00 23.12 H new ATOM 0 HB3 ASP B 105 -3.464 0.370 8.305 1.00 23.12 H new ATOM 3461 N VAL B 106 -2.452 3.035 8.782 1.00 11.45 N ATOM 3462 CA VAL B 106 -2.421 4.085 9.823 1.00 64.55 C ATOM 3463 C VAL B 106 -1.885 5.422 9.261 1.00 51.30 C ATOM 3464 O VAL B 106 -2.368 6.495 9.642 1.00 75.32 O ATOM 3465 CB VAL B 106 -1.584 3.612 11.072 1.00 33.31 C ATOM 3466 CG1 VAL B 106 -1.371 4.743 12.119 1.00 54.32 C ATOM 3467 CG2 VAL B 106 -2.257 2.381 11.728 1.00 14.11 C ATOM 0 H VAL B 106 -1.763 2.296 8.923 1.00 11.45 H new ATOM 0 HA VAL B 106 -3.446 4.259 10.152 1.00 64.55 H new ATOM 0 HB VAL B 106 -0.594 3.335 10.709 1.00 33.31 H new ATOM 0 HG11 VAL B 106 -0.788 4.359 12.956 1.00 54.32 H new ATOM 0 HG12 VAL B 106 -0.837 5.572 11.655 1.00 54.32 H new ATOM 0 HG13 VAL B 106 -2.339 5.092 12.480 1.00 54.32 H new ATOM 0 HG21 VAL B 106 -1.671 2.062 12.590 1.00 14.11 H new ATOM 0 HG22 VAL B 106 -3.264 2.646 12.052 1.00 14.11 H new ATOM 0 HG23 VAL B 106 -2.311 1.567 11.005 1.00 14.11 H new ATOM 3477 N THR B 107 -0.906 5.352 8.339 1.00 31.43 N ATOM 3478 CA THR B 107 -0.369 6.549 7.650 1.00 61.30 C ATOM 3479 C THR B 107 -1.423 7.111 6.667 1.00 30.04 C ATOM 3480 O THR B 107 -1.597 8.332 6.562 1.00 25.55 O ATOM 3481 CB THR B 107 0.979 6.227 6.907 1.00 64.10 C ATOM 3482 OG1 THR B 107 1.925 5.690 7.846 1.00 5.22 O ATOM 3483 CG2 THR B 107 1.601 7.472 6.245 1.00 43.41 C ATOM 0 H THR B 107 -0.467 4.477 8.051 1.00 31.43 H new ATOM 0 HA THR B 107 -0.151 7.308 8.402 1.00 61.30 H new ATOM 0 HB THR B 107 0.748 5.507 6.122 1.00 64.10 H new ATOM 0 HG1 THR B 107 1.706 4.753 8.031 1.00 5.22 H new ATOM 0 HG21 THR B 107 2.529 7.193 5.746 1.00 43.41 H new ATOM 0 HG22 THR B 107 0.905 7.881 5.513 1.00 43.41 H new ATOM 0 HG23 THR B 107 1.810 8.223 7.007 1.00 43.41 H new ATOM 3491 N CYS B 108 -2.160 6.193 6.004 1.00 21.23 N ATOM 3492 CA CYS B 108 -3.271 6.543 5.096 1.00 52.34 C ATOM 3493 C CYS B 108 -4.460 7.130 5.884 1.00 51.15 C ATOM 3494 O CYS B 108 -5.191 7.970 5.361 1.00 64.43 O ATOM 3495 CB CYS B 108 -3.717 5.317 4.265 1.00 42.13 C ATOM 3496 SG CYS B 108 -2.473 4.730 3.091 1.00 12.14 S ATOM 0 H CYS B 108 -2.000 5.189 6.084 1.00 21.23 H new ATOM 0 HA CYS B 108 -2.911 7.305 4.405 1.00 52.34 H new ATOM 0 HB2 CYS B 108 -3.972 4.504 4.945 1.00 42.13 H new ATOM 0 HB3 CYS B 108 -4.625 5.572 3.719 1.00 42.13 H new ATOM 0 HG CYS B 108 -1.597 4.000 3.715 1.00 12.14 H new ATOM 3502 N LYS B 109 -4.625 6.691 7.151 1.00 25.11 N ATOM 3503 CA LYS B 109 -5.639 7.255 8.062 1.00 22.25 C ATOM 3504 C LYS B 109 -5.242 8.687 8.452 1.00 54.34 C ATOM 3505 O LYS B 109 -6.057 9.584 8.356 1.00 44.31 O ATOM 3506 CB LYS B 109 -5.844 6.363 9.343 1.00 42.45 C ATOM 3507 CG LYS B 109 -7.152 5.531 9.365 1.00 11.00 C ATOM 3508 CD LYS B 109 -7.163 4.370 8.350 1.00 52.14 C ATOM 3509 CE LYS B 109 -8.455 3.539 8.429 1.00 74.14 C ATOM 3510 NZ LYS B 109 -8.423 2.369 7.517 1.00 41.21 N ATOM 0 H LYS B 109 -4.066 5.945 7.565 1.00 25.11 H new ATOM 0 HA LYS B 109 -6.593 7.275 7.536 1.00 22.25 H new ATOM 0 HB2 LYS B 109 -4.997 5.682 9.431 1.00 42.45 H new ATOM 0 HB3 LYS B 109 -5.827 7.008 10.222 1.00 42.45 H new ATOM 0 HG2 LYS B 109 -7.299 5.128 10.367 1.00 11.00 H new ATOM 0 HG3 LYS B 109 -7.995 6.190 9.159 1.00 11.00 H new ATOM 0 HD2 LYS B 109 -7.052 4.770 7.342 1.00 52.14 H new ATOM 0 HD3 LYS B 109 -6.305 3.723 8.532 1.00 52.14 H new ATOM 0 HE2 LYS B 109 -8.603 3.196 9.453 1.00 74.14 H new ATOM 0 HE3 LYS B 109 -9.307 4.170 8.178 1.00 74.14 H new ATOM 0 HZ1 LYS B 109 -9.163 2.472 6.794 1.00 41.21 H new ATOM 0 HZ2 LYS B 109 -7.493 2.314 7.055 1.00 41.21 H new ATOM 0 HZ3 LYS B 109 -8.591 1.499 8.062 1.00 41.21 H new ATOM 3524 N THR B 110 -3.963 8.871 8.852 1.00 34.23 N ATOM 3525 CA THR B 110 -3.435 10.173 9.314 1.00 11.04 C ATOM 3526 C THR B 110 -3.587 11.264 8.238 1.00 32.14 C ATOM 3527 O THR B 110 -4.142 12.337 8.510 1.00 31.13 O ATOM 3528 CB THR B 110 -1.929 10.057 9.728 1.00 14.15 C ATOM 3529 OG1 THR B 110 -1.791 9.067 10.758 1.00 11.21 O ATOM 3530 CG2 THR B 110 -1.341 11.403 10.222 1.00 2.31 C ATOM 0 H THR B 110 -3.270 8.122 8.863 1.00 34.23 H new ATOM 0 HA THR B 110 -4.025 10.460 10.185 1.00 11.04 H new ATOM 0 HB THR B 110 -1.369 9.766 8.839 1.00 14.15 H new ATOM 0 HG1 THR B 110 -1.972 8.179 10.385 1.00 11.21 H new ATOM 0 HG21 THR B 110 -0.295 11.265 10.496 1.00 2.31 H new ATOM 0 HG22 THR B 110 -1.413 12.145 9.427 1.00 2.31 H new ATOM 0 HG23 THR B 110 -1.901 11.747 11.091 1.00 2.31 H new ATOM 3538 N VAL B 111 -3.110 10.961 7.011 1.00 65.12 N ATOM 3539 CA VAL B 111 -3.162 11.907 5.882 1.00 74.13 C ATOM 3540 C VAL B 111 -4.618 12.208 5.483 1.00 65.15 C ATOM 3541 O VAL B 111 -4.936 13.342 5.103 1.00 15.32 O ATOM 3542 CB VAL B 111 -2.323 11.406 4.642 1.00 33.04 C ATOM 3543 CG1 VAL B 111 -0.821 11.264 5.002 1.00 70.31 C ATOM 3544 CG2 VAL B 111 -2.882 10.084 4.066 1.00 64.43 C ATOM 0 H VAL B 111 -2.683 10.064 6.780 1.00 65.12 H new ATOM 0 HA VAL B 111 -2.701 12.835 6.221 1.00 74.13 H new ATOM 0 HB VAL B 111 -2.414 12.164 3.864 1.00 33.04 H new ATOM 0 HG11 VAL B 111 -0.269 10.917 4.129 1.00 70.31 H new ATOM 0 HG12 VAL B 111 -0.430 12.231 5.319 1.00 70.31 H new ATOM 0 HG13 VAL B 111 -0.708 10.544 5.812 1.00 70.31 H new ATOM 0 HG21 VAL B 111 -2.277 9.773 3.214 1.00 64.43 H new ATOM 0 HG22 VAL B 111 -2.852 9.311 4.834 1.00 64.43 H new ATOM 0 HG23 VAL B 111 -3.912 10.235 3.743 1.00 64.43 H new ATOM 3554 N ALA B 112 -5.501 11.189 5.628 1.00 1.03 N ATOM 3555 CA ALA B 112 -6.949 11.346 5.402 1.00 73.40 C ATOM 3556 C ALA B 112 -7.567 12.266 6.469 1.00 62.34 C ATOM 3557 O ALA B 112 -8.371 13.123 6.146 1.00 11.04 O ATOM 3558 CB ALA B 112 -7.649 9.979 5.392 1.00 74.43 C ATOM 0 H ALA B 112 -5.227 10.246 5.903 1.00 1.03 H new ATOM 0 HA ALA B 112 -7.094 11.809 4.426 1.00 73.40 H new ATOM 0 HB1 ALA B 112 -8.717 10.118 5.224 1.00 74.43 H new ATOM 0 HB2 ALA B 112 -7.233 9.363 4.594 1.00 74.43 H new ATOM 0 HB3 ALA B 112 -7.494 9.484 6.351 1.00 74.43 H new ATOM 3564 N ASN B 113 -7.123 12.111 7.731 1.00 71.04 N ATOM 3565 CA ASN B 113 -7.666 12.871 8.884 1.00 35.33 C ATOM 3566 C ASN B 113 -7.287 14.359 8.818 1.00 33.14 C ATOM 3567 O ASN B 113 -7.980 15.196 9.399 1.00 50.34 O ATOM 3568 CB ASN B 113 -7.182 12.273 10.238 1.00 53.23 C ATOM 3569 CG ASN B 113 -7.709 10.863 10.519 1.00 50.20 C ATOM 3570 OD1 ASN B 113 -8.782 10.473 10.059 1.00 12.23 O ATOM 3571 ND2 ASN B 113 -6.953 10.085 11.277 1.00 10.31 N ATOM 0 H ASN B 113 -6.381 11.459 7.984 1.00 71.04 H new ATOM 0 HA ASN B 113 -8.751 12.786 8.826 1.00 35.33 H new ATOM 0 HB2 ASN B 113 -6.092 12.251 10.245 1.00 53.23 H new ATOM 0 HB3 ASN B 113 -7.492 12.934 11.047 1.00 53.23 H new ATOM 0 HD21 ASN B 113 -7.255 9.135 11.494 1.00 10.31 H new ATOM 0 HD22 ASN B 113 -6.068 10.435 11.644 1.00 10.31 H new ATOM 3578 N MET B 114 -6.171 14.678 8.139 1.00 60.25 N ATOM 3579 CA MET B 114 -5.715 16.074 7.970 1.00 22.03 C ATOM 3580 C MET B 114 -6.583 16.796 6.927 1.00 35.44 C ATOM 3581 O MET B 114 -7.079 17.895 7.176 1.00 23.43 O ATOM 3582 CB MET B 114 -4.223 16.135 7.544 1.00 4.22 C ATOM 3583 CG MET B 114 -3.246 15.451 8.511 1.00 3.22 C ATOM 3584 SD MET B 114 -1.510 15.757 8.089 1.00 2.14 S ATOM 3585 CE MET B 114 -1.441 15.327 6.346 1.00 44.22 C ATOM 0 H MET B 114 -5.565 13.987 7.696 1.00 60.25 H new ATOM 0 HA MET B 114 -5.816 16.574 8.933 1.00 22.03 H new ATOM 0 HB2 MET B 114 -4.122 15.674 6.562 1.00 4.22 H new ATOM 0 HB3 MET B 114 -3.933 17.180 7.437 1.00 4.22 H new ATOM 0 HG2 MET B 114 -3.437 15.805 9.524 1.00 3.22 H new ATOM 0 HG3 MET B 114 -3.432 14.377 8.509 1.00 3.22 H new ATOM 0 HE1 MET B 114 -0.993 14.340 6.232 1.00 44.22 H new ATOM 0 HE2 MET B 114 -2.450 15.317 5.933 1.00 44.22 H new ATOM 0 HE3 MET B 114 -0.838 16.063 5.813 1.00 44.22 H new ATOM 3595 N ILE B 115 -6.776 16.142 5.763 1.00 35.35 N ATOM 3596 CA ILE B 115 -7.492 16.740 4.614 1.00 71.12 C ATOM 3597 C ILE B 115 -9.024 16.712 4.817 1.00 62.34 C ATOM 3598 O ILE B 115 -9.735 17.611 4.355 1.00 23.23 O ATOM 3599 CB ILE B 115 -7.087 16.032 3.257 1.00 22.01 C ATOM 3600 CG1 ILE B 115 -7.432 14.510 3.289 1.00 4.34 C ATOM 3601 CG2 ILE B 115 -5.580 16.252 2.960 1.00 25.03 C ATOM 3602 CD1 ILE B 115 -6.997 13.720 2.069 1.00 4.33 C ATOM 0 H ILE B 115 -6.444 15.193 5.592 1.00 35.35 H new ATOM 0 HA ILE B 115 -7.189 17.785 4.553 1.00 71.12 H new ATOM 0 HB ILE B 115 -7.667 16.485 2.453 1.00 22.01 H new ATOM 0 HG12 ILE B 115 -6.969 14.068 4.171 1.00 4.34 H new ATOM 0 HG13 ILE B 115 -8.510 14.401 3.406 1.00 4.34 H new ATOM 0 HG21 ILE B 115 -5.318 15.759 2.024 1.00 25.03 H new ATOM 0 HG22 ILE B 115 -5.378 17.320 2.877 1.00 25.03 H new ATOM 0 HG23 ILE B 115 -4.984 15.832 3.770 1.00 25.03 H new ATOM 0 HD11 ILE B 115 -7.283 12.675 2.191 1.00 4.33 H new ATOM 0 HD12 ILE B 115 -7.480 14.127 1.181 1.00 4.33 H new ATOM 0 HD13 ILE B 115 -5.915 13.789 1.958 1.00 4.33 H new ATOM 3614 N ARG B 116 -9.515 15.683 5.522 1.00 65.32 N ATOM 3615 CA ARG B 116 -10.949 15.534 5.855 1.00 11.51 C ATOM 3616 C ARG B 116 -11.286 16.255 7.177 1.00 3.30 C ATOM 3617 O ARG B 116 -12.464 16.477 7.472 1.00 63.25 O ATOM 3618 CB ARG B 116 -11.339 14.034 5.963 1.00 23.13 C ATOM 3619 CG ARG B 116 -11.214 13.217 4.649 1.00 22.51 C ATOM 3620 CD ARG B 116 -11.585 11.735 4.858 1.00 24.41 C ATOM 3621 NE ARG B 116 -11.602 10.952 3.605 1.00 73.54 N ATOM 3622 CZ ARG B 116 -12.601 10.145 3.217 1.00 40.33 C ATOM 3623 NH1 ARG B 116 -13.688 9.999 3.976 1.00 13.44 N ATOM 3624 NH2 ARG B 116 -12.500 9.464 2.085 1.00 4.12 N ATOM 0 H ARG B 116 -8.932 14.926 5.881 1.00 65.32 H new ATOM 0 HA ARG B 116 -11.523 15.991 5.049 1.00 11.51 H new ATOM 0 HB2 ARG B 116 -10.712 13.567 6.722 1.00 23.13 H new ATOM 0 HB3 ARG B 116 -12.368 13.968 6.315 1.00 23.13 H new ATOM 0 HG2 ARG B 116 -11.864 13.650 3.888 1.00 22.51 H new ATOM 0 HG3 ARG B 116 -10.193 13.287 4.274 1.00 22.51 H new ATOM 0 HD2 ARG B 116 -10.874 11.284 5.550 1.00 24.41 H new ATOM 0 HD3 ARG B 116 -12.567 11.677 5.328 1.00 24.41 H new ATOM 0 HE ARG B 116 -10.793 11.031 2.989 1.00 73.54 H new ATOM 0 HH11 ARG B 116 -13.765 10.503 4.859 1.00 13.44 H new ATOM 0 HH12 ARG B 116 -14.443 9.383 3.673 1.00 13.44 H new ATOM 0 HH21 ARG B 116 -11.663 9.553 1.509 1.00 4.12 H new ATOM 0 HH22 ARG B 116 -13.259 8.850 1.790 1.00 4.12 H new ATOM 3638 N GLY B 117 -10.246 16.600 7.961 1.00 71.44 N ATOM 3639 CA GLY B 117 -10.417 17.248 9.268 1.00 34.42 C ATOM 3640 C GLY B 117 -10.741 18.738 9.164 1.00 22.45 C ATOM 3641 O GLY B 117 -11.476 19.260 10.027 1.00 44.45 O ATOM 3642 OXT GLY B 117 -10.262 19.399 8.221 1.00 37.62 O ATOM 0 H GLY B 117 -9.272 16.437 7.705 1.00 71.44 H new ATOM 0 HA2 GLY B 117 -11.216 16.746 9.813 1.00 34.42 H new ATOM 0 HA3 GLY B 117 -9.505 17.121 9.851 1.00 34.42 H new TER 3646 GLY B 117