USER MOD reduce.3.24.130724 H: found=0, std=0, add=1822, rem=0, adj=64 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= -0.843 K(o=-3.8,f=-8.5!) USER MOD Set 1.2: B 114 MET CE :methyl 160:sc= -2.94 (180deg=-2.23!) USER MOD Set 2.1: B 57 TYR OH : rot -52:sc= -0.475 USER MOD Set 2.2: B 68 SER OG : rot 90:sc= 0 USER MOD Set 3.1: B 47 THR OG1 : rot 180:sc= -0.0697 USER MOD Set 3.2: B 49 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: B 30 MET CE :methyl -132:sc= 0 (180deg=-1.52!) USER MOD Set 4.2: B 97 TYR OH : rot 180:sc= -0.319 USER MOD Set 5.1: B 28 LYS NZ :NH3+ -121:sc= 1.64 (180deg=0.112) USER MOD Set 5.2: B 29 ASN : amide:sc= 0.524 K(o=2.2,f=-4.1) USER MOD Set 6.1: B 23 MET CE :methyl 136:sc= -0.762 (180deg=-1.72!) USER MOD Set 6.2: B 61 HIS : no HD1:sc= -0.124 K(o=-0.89,f=-1.8) USER MOD Set 7.1: A 85 GLN : amide:sc= -0.859 K(o=-3.6,f=-8.5!) USER MOD Set 7.2: A 114 MET CE :methyl 162:sc= -2.74 (180deg=-1.92!) USER MOD Set 8.1: A 47 THR OG1 : rot 180:sc= -0.0284 USER MOD Set 8.2: A 49 THR OG1 : rot 180:sc= 0 USER MOD Set 9.1: A 30 MET CE :methyl -129:sc= 0 (180deg=-1.67!) USER MOD Set 9.2: A 97 TYR OH : rot 180:sc= -0.301 USER MOD Set10.1: A 28 LYS NZ :NH3+ -122:sc= 1.59 (180deg=0.123) USER MOD Set10.2: A 29 ASN : amide:sc= 0.448 K(o=2,f=-3.8) USER MOD Set11.1: A 23 MET CE :methyl 138:sc= -0.962 (180deg=-1.78!) USER MOD Set11.2: A 61 HIS : no HD1:sc= -0.087 K(o=-1,f=-2) USER MOD Single : A 2 SER OG : rot 39:sc= 0.0634 USER MOD Single : A 5 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00273) USER MOD Single : A 8 SER OG : rot -80:sc= 0.498 USER MOD Single : A 9 SER OG : rot 180:sc= 0 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 73:sc= 1.28 USER MOD Single : A 24 SER OG : rot 18:sc= -0.723 USER MOD Single : A 26 THR OG1 : rot 174:sc= 0.314 USER MOD Single : A 37 SER OG : rot 44:sc= -0.78 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 48 SER OG : rot -140:sc= 0.305 USER MOD Single : A 53 LYS NZ :NH3+ -153:sc= 1.07 (180deg=0.22) USER MOD Single : A 57 TYR OH : rot 163:sc= -0.432 USER MOD Single : A 58 CYS SG : rot 81:sc= 0.119 USER MOD Single : A 60 HIS : no HE2:sc= 0.0141 X(o=0.014,f=-0.16) USER MOD Single : A 62 HIS : no HD1:sc= 0.0971 K(o=0.097,f=-0.54) USER MOD Single : A 63 GLN : amide:sc= -0.179 K(o=-0.18,f=-1.4) USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 68 SER OG : rot 120:sc= 0 USER MOD Single : A 76 TYR OH : rot 50:sc= 0.336 USER MOD Single : A 81 CYS SG : rot 49:sc= 0.689 USER MOD Single : A 82 LYS NZ :NH3+ -177:sc= 0.415 (180deg=0.41) USER MOD Single : A 87 THR OG1 : rot -169:sc= -0.805 USER MOD Single : A 96 ASN :FLIP amide:sc= -1.39 F(o=-2.2!,f=-1.4) USER MOD Single : A 101 LYS NZ :NH3+ 177:sc= 0.474 (180deg=0.462) USER MOD Single : A 107 THR OG1 : rot 80:sc= 0.482 USER MOD Single : A 108 CYS SG : rot 88:sc= -0.76 USER MOD Single : A 109 LYS NZ :NH3+ 151:sc= 0.899 (180deg=0.395) USER MOD Single : A 110 THR OG1 : rot 62:sc= 0.68 USER MOD Single : A 113 ASN : amide:sc= -0.162 X(o=-0.16,f=-0.47) USER MOD Single : B 2 SER OG : rot 36:sc= 0.0555 USER MOD Single : B 5 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00966) USER MOD Single : B 8 SER OG : rot -80:sc= 0.471 USER MOD Single : B 9 SER OG : rot 180:sc= 0 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 58:sc= 1.18 USER MOD Single : B 24 SER OG : rot 17:sc= -0.716 USER MOD Single : B 26 THR OG1 : rot 173:sc= 0.306 USER MOD Single : B 37 SER OG : rot 46:sc= -0.753 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 48 SER OG : rot -139:sc= 0.426 USER MOD Single : B 53 LYS NZ :NH3+ -150:sc= 1.03 (180deg=0.197) USER MOD Single : B 58 CYS SG : rot 80:sc= 0.125 USER MOD Single : B 60 HIS : no HE2:sc= 0.0341 X(o=0.034,f=-0.23) USER MOD Single : B 62 HIS : no HD1:sc= 0.124 K(o=0.12,f=-0.71) USER MOD Single : B 63 GLN : amide:sc= -0.371 K(o=-0.37,f=-2) USER MOD Single : B 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 76 TYR OH : rot 59:sc= 0.294 USER MOD Single : B 81 CYS SG : rot 41:sc= 0.746 USER MOD Single : B 82 LYS NZ :NH3+ -175:sc= 0.497 (180deg=0.489) USER MOD Single : B 87 THR OG1 : rot -170:sc= -0.456 USER MOD Single : B 96 ASN :FLIP amide:sc= -1.96 F(o=-3.1!,f=-2) USER MOD Single : B 101 LYS NZ :NH3+ -134:sc= 0.599 (180deg=0.36) USER MOD Single : B 107 THR OG1 : rot 81:sc= 0.485 USER MOD Single : B 108 CYS SG : rot 82:sc= -0.757 USER MOD Single : B 109 LYS NZ :NH3+ 151:sc= 0.893 (180deg=0.375) USER MOD Single : B 110 THR OG1 : rot 63:sc= 0.702 USER MOD Single : B 113 ASN : amide:sc= -0.142 X(o=-0.14,f=-0.45) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 -16.688 -14.836 -16.823 1.00 54.25 N ATOM 2 CA SER A 2 -17.893 -14.258 -16.204 1.00 52.20 C ATOM 3 C SER A 2 -17.553 -12.943 -15.493 1.00 1.02 C ATOM 4 O SER A 2 -16.465 -12.802 -14.910 1.00 63.31 O ATOM 5 CB SER A 2 -18.505 -15.269 -15.216 1.00 43.44 C ATOM 6 OG SER A 2 -18.847 -16.480 -15.874 1.00 51.31 O ATOM 0 HA SER A 2 -18.624 -14.041 -16.983 1.00 52.20 H new ATOM 0 HB2 SER A 2 -17.796 -15.474 -14.414 1.00 43.44 H new ATOM 0 HB3 SER A 2 -19.393 -14.839 -14.753 1.00 43.44 H new ATOM 0 HG SER A 2 -18.159 -16.698 -16.537 1.00 51.31 H new ATOM 14 N LEU A 3 -18.487 -11.982 -15.557 1.00 35.44 N ATOM 15 CA LEU A 3 -18.342 -10.680 -14.898 1.00 61.22 C ATOM 16 C LEU A 3 -18.798 -10.799 -13.434 1.00 55.41 C ATOM 17 O LEU A 3 -19.917 -11.246 -13.170 1.00 0.22 O ATOM 18 CB LEU A 3 -19.180 -9.595 -15.638 1.00 0.01 C ATOM 19 CG LEU A 3 -18.859 -9.386 -17.152 1.00 63.33 C ATOM 20 CD1 LEU A 3 -19.809 -8.349 -17.788 1.00 4.23 C ATOM 21 CD2 LEU A 3 -17.387 -8.988 -17.362 1.00 75.15 C ATOM 0 H LEU A 3 -19.363 -12.088 -16.068 1.00 35.44 H new ATOM 0 HA LEU A 3 -17.295 -10.378 -14.929 1.00 61.22 H new ATOM 0 HB2 LEU A 3 -20.235 -9.855 -15.545 1.00 0.01 H new ATOM 0 HB3 LEU A 3 -19.039 -8.644 -15.124 1.00 0.01 H new ATOM 0 HG LEU A 3 -19.021 -10.339 -17.656 1.00 63.33 H new ATOM 0 HD11 LEU A 3 -19.560 -8.226 -18.842 1.00 4.23 H new ATOM 0 HD12 LEU A 3 -20.839 -8.695 -17.696 1.00 4.23 H new ATOM 0 HD13 LEU A 3 -19.700 -7.393 -17.275 1.00 4.23 H new ATOM 0 HD21 LEU A 3 -17.196 -8.850 -18.426 1.00 75.15 H new ATOM 0 HD22 LEU A 3 -17.183 -8.057 -16.833 1.00 75.15 H new ATOM 0 HD23 LEU A 3 -16.739 -9.775 -16.976 1.00 75.15 H new ATOM 33 N VAL A 4 -17.917 -10.457 -12.490 1.00 52.35 N ATOM 34 CA VAL A 4 -18.295 -10.288 -11.076 1.00 52.11 C ATOM 35 C VAL A 4 -18.726 -8.830 -10.842 1.00 72.03 C ATOM 36 O VAL A 4 -18.097 -7.886 -11.346 1.00 63.20 O ATOM 37 CB VAL A 4 -17.144 -10.697 -10.078 1.00 74.31 C ATOM 38 CG1 VAL A 4 -16.940 -12.231 -10.064 1.00 43.43 C ATOM 39 CG2 VAL A 4 -15.824 -9.968 -10.408 1.00 63.21 C ATOM 0 H VAL A 4 -16.928 -10.290 -12.677 1.00 52.35 H new ATOM 0 HA VAL A 4 -19.126 -10.963 -10.870 1.00 52.11 H new ATOM 0 HB VAL A 4 -17.451 -10.387 -9.079 1.00 74.31 H new ATOM 0 HG11 VAL A 4 -16.141 -12.485 -9.368 1.00 43.43 H new ATOM 0 HG12 VAL A 4 -17.863 -12.718 -9.750 1.00 43.43 H new ATOM 0 HG13 VAL A 4 -16.672 -12.572 -11.064 1.00 43.43 H new ATOM 0 HG21 VAL A 4 -15.053 -10.273 -9.701 1.00 63.21 H new ATOM 0 HG22 VAL A 4 -15.510 -10.224 -11.420 1.00 63.21 H new ATOM 0 HG23 VAL A 4 -15.976 -8.891 -10.337 1.00 63.21 H new ATOM 49 N LYS A 5 -19.825 -8.666 -10.109 1.00 70.25 N ATOM 50 CA LYS A 5 -20.402 -7.358 -9.804 1.00 31.00 C ATOM 51 C LYS A 5 -19.686 -6.747 -8.586 1.00 74.10 C ATOM 52 O LYS A 5 -19.660 -7.348 -7.515 1.00 24.44 O ATOM 53 CB LYS A 5 -21.919 -7.515 -9.538 1.00 74.14 C ATOM 54 CG LYS A 5 -22.766 -7.898 -10.773 1.00 33.12 C ATOM 55 CD LYS A 5 -24.278 -7.915 -10.451 1.00 40.24 C ATOM 56 CE LYS A 5 -25.166 -8.171 -11.672 1.00 13.44 C ATOM 57 NZ LYS A 5 -24.894 -9.486 -12.291 1.00 12.44 N ATOM 0 H LYS A 5 -20.346 -9.445 -9.706 1.00 70.25 H new ATOM 0 HA LYS A 5 -20.267 -6.685 -10.651 1.00 31.00 H new ATOM 0 HB2 LYS A 5 -22.060 -8.275 -8.770 1.00 74.14 H new ATOM 0 HB3 LYS A 5 -22.300 -6.578 -9.132 1.00 74.14 H new ATOM 0 HG2 LYS A 5 -22.574 -7.190 -11.579 1.00 33.12 H new ATOM 0 HG3 LYS A 5 -22.460 -8.880 -11.133 1.00 33.12 H new ATOM 0 HD2 LYS A 5 -24.472 -8.685 -9.704 1.00 40.24 H new ATOM 0 HD3 LYS A 5 -24.556 -6.960 -10.005 1.00 40.24 H new ATOM 0 HE2 LYS A 5 -26.214 -8.120 -11.375 1.00 13.44 H new ATOM 0 HE3 LYS A 5 -25.005 -7.384 -12.408 1.00 13.44 H new ATOM 0 HZ1 LYS A 5 -25.528 -9.625 -13.103 1.00 12.44 H new ATOM 0 HZ2 LYS A 5 -23.906 -9.520 -12.614 1.00 12.44 H new ATOM 0 HZ3 LYS A 5 -25.056 -10.239 -11.592 1.00 12.44 H new ATOM 71 N LEU A 6 -19.068 -5.574 -8.776 1.00 34.14 N ATOM 72 CA LEU A 6 -18.376 -4.831 -7.701 1.00 13.22 C ATOM 73 C LEU A 6 -19.181 -3.575 -7.356 1.00 12.24 C ATOM 74 O LEU A 6 -19.072 -2.550 -8.036 1.00 3.31 O ATOM 75 CB LEU A 6 -16.915 -4.474 -8.128 1.00 35.51 C ATOM 76 CG LEU A 6 -15.814 -5.527 -7.773 1.00 0.42 C ATOM 77 CD1 LEU A 6 -16.117 -6.933 -8.333 1.00 51.34 C ATOM 78 CD2 LEU A 6 -14.438 -5.032 -8.238 1.00 54.22 C ATOM 0 H LEU A 6 -19.031 -5.107 -9.682 1.00 34.14 H new ATOM 0 HA LEU A 6 -18.308 -5.458 -6.812 1.00 13.22 H new ATOM 0 HB2 LEU A 6 -16.902 -4.316 -9.206 1.00 35.51 H new ATOM 0 HB3 LEU A 6 -16.644 -3.526 -7.663 1.00 35.51 H new ATOM 0 HG LEU A 6 -15.810 -5.630 -6.688 1.00 0.42 H new ATOM 0 HD11 LEU A 6 -15.316 -7.617 -8.052 1.00 51.34 H new ATOM 0 HD12 LEU A 6 -17.061 -7.292 -7.923 1.00 51.34 H new ATOM 0 HD13 LEU A 6 -16.188 -6.884 -9.420 1.00 51.34 H new ATOM 0 HD21 LEU A 6 -13.680 -5.773 -7.985 1.00 54.22 H new ATOM 0 HD22 LEU A 6 -14.452 -4.880 -9.317 1.00 54.22 H new ATOM 0 HD23 LEU A 6 -14.204 -4.090 -7.742 1.00 54.22 H new ATOM 90 N GLU A 7 -20.017 -3.686 -6.318 1.00 45.44 N ATOM 91 CA GLU A 7 -20.817 -2.566 -5.822 1.00 14.13 C ATOM 92 C GLU A 7 -19.935 -1.683 -4.923 1.00 40.14 C ATOM 93 O GLU A 7 -19.366 -2.168 -3.947 1.00 53.14 O ATOM 94 CB GLU A 7 -22.057 -3.089 -5.054 1.00 3.14 C ATOM 95 CG GLU A 7 -22.984 -1.975 -4.521 1.00 31.32 C ATOM 96 CD GLU A 7 -24.268 -2.520 -3.891 1.00 60.31 C ATOM 97 OE1 GLU A 7 -24.267 -2.838 -2.682 1.00 64.44 O ATOM 98 OE2 GLU A 7 -25.289 -2.634 -4.606 1.00 15.23 O ATOM 0 H GLU A 7 -20.156 -4.554 -5.800 1.00 45.44 H new ATOM 0 HA GLU A 7 -21.178 -1.969 -6.659 1.00 14.13 H new ATOM 0 HB2 GLU A 7 -22.631 -3.740 -5.713 1.00 3.14 H new ATOM 0 HB3 GLU A 7 -21.721 -3.700 -4.216 1.00 3.14 H new ATOM 0 HG2 GLU A 7 -22.445 -1.384 -3.781 1.00 31.32 H new ATOM 0 HG3 GLU A 7 -23.243 -1.303 -5.339 1.00 31.32 H new ATOM 105 N SER A 8 -19.811 -0.402 -5.284 1.00 33.00 N ATOM 106 CA SER A 8 -19.016 0.576 -4.530 1.00 65.20 C ATOM 107 C SER A 8 -19.821 1.136 -3.341 1.00 63.01 C ATOM 108 O SER A 8 -21.009 0.830 -3.175 1.00 4.12 O ATOM 109 CB SER A 8 -18.593 1.714 -5.485 1.00 73.44 C ATOM 110 OG SER A 8 -19.720 2.353 -6.065 1.00 64.51 O ATOM 0 H SER A 8 -20.261 -0.011 -6.112 1.00 33.00 H new ATOM 0 HA SER A 8 -18.129 0.088 -4.125 1.00 65.20 H new ATOM 0 HB2 SER A 8 -17.999 2.447 -4.939 1.00 73.44 H new ATOM 0 HB3 SER A 8 -17.956 1.311 -6.273 1.00 73.44 H new ATOM 0 HG SER A 8 -20.056 1.811 -6.809 1.00 64.51 H new ATOM 116 N SER A 9 -19.144 1.961 -2.527 1.00 2.02 N ATOM 117 CA SER A 9 -19.763 2.721 -1.425 1.00 40.23 C ATOM 118 C SER A 9 -20.762 3.775 -1.964 1.00 33.15 C ATOM 119 O SER A 9 -21.667 4.217 -1.245 1.00 23.13 O ATOM 120 CB SER A 9 -18.661 3.402 -0.581 1.00 61.31 C ATOM 121 OG SER A 9 -19.215 4.057 0.551 1.00 31.42 O ATOM 0 H SER A 9 -18.141 2.122 -2.615 1.00 2.02 H new ATOM 0 HA SER A 9 -20.321 2.028 -0.796 1.00 40.23 H new ATOM 0 HB2 SER A 9 -17.936 2.657 -0.255 1.00 61.31 H new ATOM 0 HB3 SER A 9 -18.122 4.124 -1.195 1.00 61.31 H new ATOM 0 HG SER A 9 -18.498 4.478 1.069 1.00 31.42 H new ATOM 127 N ASP A 10 -20.582 4.160 -3.246 1.00 30.33 N ATOM 128 CA ASP A 10 -21.464 5.115 -3.954 1.00 0.52 C ATOM 129 C ASP A 10 -22.677 4.385 -4.593 1.00 61.13 C ATOM 130 O ASP A 10 -23.480 4.994 -5.310 1.00 0.20 O ATOM 131 CB ASP A 10 -20.620 5.862 -5.015 1.00 3.35 C ATOM 132 CG ASP A 10 -21.351 7.045 -5.679 1.00 24.33 C ATOM 133 OD1 ASP A 10 -21.412 8.132 -5.067 1.00 34.22 O ATOM 134 OD2 ASP A 10 -21.857 6.897 -6.815 1.00 54.31 O ATOM 0 H ASP A 10 -19.815 3.815 -3.823 1.00 30.33 H new ATOM 0 HA ASP A 10 -21.875 5.837 -3.248 1.00 0.52 H new ATOM 0 HB2 ASP A 10 -19.708 6.230 -4.545 1.00 3.35 H new ATOM 0 HB3 ASP A 10 -20.318 5.155 -5.788 1.00 3.35 H new ATOM 139 N GLU A 11 -22.788 3.058 -4.315 1.00 31.01 N ATOM 140 CA GLU A 11 -23.954 2.206 -4.676 1.00 43.23 C ATOM 141 C GLU A 11 -24.008 1.872 -6.189 1.00 30.43 C ATOM 142 O GLU A 11 -24.963 1.237 -6.653 1.00 24.40 O ATOM 143 CB GLU A 11 -25.288 2.850 -4.173 1.00 51.55 C ATOM 144 CG GLU A 11 -25.300 3.166 -2.652 1.00 21.12 C ATOM 145 CD GLU A 11 -26.485 4.025 -2.177 1.00 23.51 C ATOM 146 OE1 GLU A 11 -26.952 4.898 -2.935 1.00 73.15 O ATOM 147 OE2 GLU A 11 -26.918 3.879 -1.013 1.00 54.30 O ATOM 0 H GLU A 11 -22.057 2.542 -3.825 1.00 31.01 H new ATOM 0 HA GLU A 11 -23.825 1.252 -4.165 1.00 43.23 H new ATOM 0 HB2 GLU A 11 -25.467 3.772 -4.727 1.00 51.55 H new ATOM 0 HB3 GLU A 11 -26.114 2.176 -4.401 1.00 51.55 H new ATOM 0 HG2 GLU A 11 -25.308 2.226 -2.101 1.00 21.12 H new ATOM 0 HG3 GLU A 11 -24.373 3.678 -2.395 1.00 21.12 H new ATOM 154 N LYS A 12 -22.970 2.279 -6.947 1.00 73.35 N ATOM 155 CA LYS A 12 -22.846 1.955 -8.383 1.00 73.43 C ATOM 156 C LYS A 12 -22.068 0.644 -8.557 1.00 23.43 C ATOM 157 O LYS A 12 -20.971 0.485 -8.009 1.00 33.20 O ATOM 158 CB LYS A 12 -22.157 3.106 -9.158 1.00 41.33 C ATOM 159 CG LYS A 12 -23.010 4.389 -9.268 1.00 25.32 C ATOM 160 CD LYS A 12 -22.337 5.488 -10.124 1.00 33.13 C ATOM 161 CE LYS A 12 -23.165 6.781 -10.196 1.00 52.12 C ATOM 162 NZ LYS A 12 -22.452 7.863 -10.930 1.00 61.14 N ATOM 0 H LYS A 12 -22.198 2.838 -6.584 1.00 73.35 H new ATOM 0 HA LYS A 12 -23.847 1.831 -8.796 1.00 73.43 H new ATOM 0 HB2 LYS A 12 -21.216 3.349 -8.665 1.00 41.33 H new ATOM 0 HB3 LYS A 12 -21.911 2.758 -10.161 1.00 41.33 H new ATOM 0 HG2 LYS A 12 -23.978 4.139 -9.702 1.00 25.32 H new ATOM 0 HG3 LYS A 12 -23.200 4.780 -8.268 1.00 25.32 H new ATOM 0 HD2 LYS A 12 -21.355 5.714 -9.709 1.00 33.13 H new ATOM 0 HD3 LYS A 12 -22.177 5.108 -11.133 1.00 33.13 H new ATOM 0 HE2 LYS A 12 -24.116 6.575 -10.688 1.00 52.12 H new ATOM 0 HE3 LYS A 12 -23.396 7.120 -9.186 1.00 52.12 H new ATOM 0 HZ1 LYS A 12 -23.046 8.716 -10.954 1.00 61.14 H new ATOM 0 HZ2 LYS A 12 -21.557 8.079 -10.447 1.00 61.14 H new ATOM 0 HZ3 LYS A 12 -22.254 7.551 -11.902 1.00 61.14 H new ATOM 176 N VAL A 13 -22.662 -0.282 -9.314 1.00 53.31 N ATOM 177 CA VAL A 13 -22.132 -1.632 -9.537 1.00 14.54 C ATOM 178 C VAL A 13 -21.338 -1.688 -10.860 1.00 12.20 C ATOM 179 O VAL A 13 -21.865 -1.340 -11.924 1.00 20.03 O ATOM 180 CB VAL A 13 -23.318 -2.666 -9.564 1.00 74.33 C ATOM 181 CG1 VAL A 13 -22.819 -4.102 -9.807 1.00 32.55 C ATOM 182 CG2 VAL A 13 -24.167 -2.576 -8.269 1.00 75.24 C ATOM 0 H VAL A 13 -23.543 -0.112 -9.799 1.00 53.31 H new ATOM 0 HA VAL A 13 -21.454 -1.888 -8.722 1.00 14.54 H new ATOM 0 HB VAL A 13 -23.960 -2.402 -10.404 1.00 74.33 H new ATOM 0 HG11 VAL A 13 -23.668 -4.785 -9.819 1.00 32.55 H new ATOM 0 HG12 VAL A 13 -22.302 -4.150 -10.765 1.00 32.55 H new ATOM 0 HG13 VAL A 13 -22.133 -4.389 -9.010 1.00 32.55 H new ATOM 0 HG21 VAL A 13 -24.979 -3.302 -8.315 1.00 75.24 H new ATOM 0 HG22 VAL A 13 -23.537 -2.791 -7.406 1.00 75.24 H new ATOM 0 HG23 VAL A 13 -24.582 -1.572 -8.175 1.00 75.24 H new ATOM 192 N PHE A 14 -20.070 -2.115 -10.777 1.00 61.40 N ATOM 193 CA PHE A 14 -19.165 -2.261 -11.928 1.00 30.25 C ATOM 194 C PHE A 14 -18.930 -3.752 -12.196 1.00 70.21 C ATOM 195 O PHE A 14 -18.238 -4.427 -11.420 1.00 30.41 O ATOM 196 CB PHE A 14 -17.823 -1.538 -11.633 1.00 42.13 C ATOM 197 CG PHE A 14 -17.982 -0.032 -11.436 1.00 42.30 C ATOM 198 CD1 PHE A 14 -17.899 0.841 -12.522 1.00 63.13 C ATOM 199 CD2 PHE A 14 -18.248 0.507 -10.175 1.00 41.43 C ATOM 200 CE1 PHE A 14 -18.079 2.201 -12.353 1.00 33.43 C ATOM 201 CE2 PHE A 14 -18.421 1.865 -10.010 1.00 4.51 C ATOM 202 CZ PHE A 14 -18.339 2.711 -11.098 1.00 44.44 C ATOM 0 H PHE A 14 -19.635 -2.374 -9.891 1.00 61.40 H new ATOM 0 HA PHE A 14 -19.612 -1.808 -12.813 1.00 30.25 H new ATOM 0 HB2 PHE A 14 -17.374 -1.970 -10.738 1.00 42.13 H new ATOM 0 HB3 PHE A 14 -17.131 -1.719 -12.456 1.00 42.13 H new ATOM 0 HD1 PHE A 14 -17.692 0.449 -13.507 1.00 63.13 H new ATOM 0 HD2 PHE A 14 -18.319 -0.148 -9.319 1.00 41.43 H new ATOM 0 HE1 PHE A 14 -18.016 2.864 -13.203 1.00 33.43 H new ATOM 0 HE2 PHE A 14 -18.621 2.268 -9.028 1.00 4.51 H new ATOM 0 HZ PHE A 14 -18.479 3.774 -10.966 1.00 44.44 H new ATOM 212 N GLU A 15 -19.543 -4.265 -13.273 1.00 43.42 N ATOM 213 CA GLU A 15 -19.397 -5.664 -13.687 1.00 73.22 C ATOM 214 C GLU A 15 -18.045 -5.850 -14.402 1.00 53.23 C ATOM 215 O GLU A 15 -17.958 -5.766 -15.635 1.00 61.00 O ATOM 216 CB GLU A 15 -20.574 -6.094 -14.602 1.00 61.12 C ATOM 217 CG GLU A 15 -21.974 -5.870 -14.000 1.00 11.22 C ATOM 218 CD GLU A 15 -23.102 -6.413 -14.895 1.00 70.22 C ATOM 219 OE1 GLU A 15 -23.309 -5.872 -15.996 1.00 53.11 O ATOM 220 OE2 GLU A 15 -23.784 -7.379 -14.508 1.00 5.14 O ATOM 0 H GLU A 15 -20.154 -3.719 -13.881 1.00 43.42 H new ATOM 0 HA GLU A 15 -19.419 -6.301 -12.803 1.00 73.22 H new ATOM 0 HB2 GLU A 15 -20.505 -5.545 -15.541 1.00 61.12 H new ATOM 0 HB3 GLU A 15 -20.462 -7.151 -14.842 1.00 61.12 H new ATOM 0 HG2 GLU A 15 -22.026 -6.353 -13.024 1.00 11.22 H new ATOM 0 HG3 GLU A 15 -22.128 -4.803 -13.836 1.00 11.22 H new ATOM 227 N ILE A 16 -16.991 -6.041 -13.603 1.00 23.35 N ATOM 228 CA ILE A 16 -15.627 -6.265 -14.102 1.00 72.14 C ATOM 229 C ILE A 16 -15.409 -7.776 -14.279 1.00 65.44 C ATOM 230 O ILE A 16 -16.058 -8.584 -13.603 1.00 10.42 O ATOM 231 CB ILE A 16 -14.554 -5.646 -13.113 1.00 44.24 C ATOM 232 CG1 ILE A 16 -13.099 -5.690 -13.698 1.00 40.31 C ATOM 233 CG2 ILE A 16 -14.604 -6.324 -11.725 1.00 72.21 C ATOM 234 CD1 ILE A 16 -12.890 -4.877 -14.969 1.00 42.33 C ATOM 0 H ILE A 16 -17.058 -6.045 -12.585 1.00 23.35 H new ATOM 0 HA ILE A 16 -15.503 -5.766 -15.063 1.00 72.14 H new ATOM 0 HB ILE A 16 -14.821 -4.596 -12.992 1.00 44.24 H new ATOM 0 HG12 ILE A 16 -12.407 -5.330 -12.937 1.00 40.31 H new ATOM 0 HG13 ILE A 16 -12.837 -6.728 -13.902 1.00 40.31 H new ATOM 0 HG21 ILE A 16 -13.855 -5.874 -11.073 1.00 72.21 H new ATOM 0 HG22 ILE A 16 -15.594 -6.187 -11.289 1.00 72.21 H new ATOM 0 HG23 ILE A 16 -14.399 -7.389 -11.833 1.00 72.21 H new ATOM 0 HD11 ILE A 16 -11.854 -4.971 -15.295 1.00 42.33 H new ATOM 0 HD12 ILE A 16 -13.552 -5.249 -15.752 1.00 42.33 H new ATOM 0 HD13 ILE A 16 -13.115 -3.829 -14.772 1.00 42.33 H new ATOM 246 N GLU A 17 -14.527 -8.144 -15.215 1.00 63.25 N ATOM 247 CA GLU A 17 -14.133 -9.541 -15.447 1.00 53.30 C ATOM 248 C GLU A 17 -13.481 -10.106 -14.176 1.00 43.44 C ATOM 249 O GLU A 17 -12.622 -9.441 -13.577 1.00 45.44 O ATOM 250 CB GLU A 17 -13.178 -9.617 -16.667 1.00 12.11 C ATOM 251 CG GLU A 17 -13.786 -9.013 -17.954 1.00 51.53 C ATOM 252 CD GLU A 17 -12.852 -9.020 -19.170 1.00 62.40 C ATOM 253 OE1 GLU A 17 -12.260 -7.967 -19.500 1.00 30.32 O ATOM 254 OE2 GLU A 17 -12.715 -10.081 -19.817 1.00 42.20 O ATOM 0 H GLU A 17 -14.064 -7.480 -15.836 1.00 63.25 H new ATOM 0 HA GLU A 17 -15.010 -10.147 -15.673 1.00 53.30 H new ATOM 0 HB2 GLU A 17 -12.253 -9.093 -16.429 1.00 12.11 H new ATOM 0 HB3 GLU A 17 -12.916 -10.659 -16.851 1.00 12.11 H new ATOM 0 HG2 GLU A 17 -14.691 -9.566 -18.205 1.00 51.53 H new ATOM 0 HG3 GLU A 17 -14.086 -7.985 -17.750 1.00 51.53 H new ATOM 261 N LYS A 18 -13.921 -11.317 -13.769 1.00 52.24 N ATOM 262 CA LYS A 18 -13.487 -11.972 -12.517 1.00 1.32 C ATOM 263 C LYS A 18 -11.955 -12.057 -12.432 1.00 41.10 C ATOM 264 O LYS A 18 -11.372 -11.812 -11.372 1.00 21.24 O ATOM 265 CB LYS A 18 -14.103 -13.394 -12.383 1.00 33.45 C ATOM 266 CG LYS A 18 -13.717 -14.130 -11.071 1.00 34.05 C ATOM 267 CD LYS A 18 -14.106 -15.627 -11.076 1.00 14.30 C ATOM 268 CE LYS A 18 -13.588 -16.371 -9.832 1.00 34.32 C ATOM 269 NZ LYS A 18 -13.802 -17.842 -9.936 1.00 72.23 N ATOM 0 H LYS A 18 -14.591 -11.870 -14.304 1.00 52.24 H new ATOM 0 HA LYS A 18 -13.846 -11.357 -11.692 1.00 1.32 H new ATOM 0 HB2 LYS A 18 -15.189 -13.315 -12.437 1.00 33.45 H new ATOM 0 HB3 LYS A 18 -13.785 -13.998 -13.233 1.00 33.45 H new ATOM 0 HG2 LYS A 18 -12.642 -14.041 -10.915 1.00 34.05 H new ATOM 0 HG3 LYS A 18 -14.203 -13.638 -10.229 1.00 34.05 H new ATOM 0 HD2 LYS A 18 -15.191 -15.718 -11.125 1.00 14.30 H new ATOM 0 HD3 LYS A 18 -13.706 -16.101 -11.972 1.00 14.30 H new ATOM 0 HE2 LYS A 18 -12.525 -16.167 -9.703 1.00 34.32 H new ATOM 0 HE3 LYS A 18 -14.095 -15.992 -8.945 1.00 34.32 H new ATOM 0 HZ1 LYS A 18 -13.440 -18.307 -9.079 1.00 72.23 H new ATOM 0 HZ2 LYS A 18 -14.819 -18.039 -10.033 1.00 72.23 H new ATOM 0 HZ3 LYS A 18 -13.297 -18.208 -10.768 1.00 72.23 H new ATOM 283 N GLU A 19 -11.333 -12.370 -13.578 1.00 22.13 N ATOM 284 CA GLU A 19 -9.870 -12.497 -13.713 1.00 24.03 C ATOM 285 C GLU A 19 -9.127 -11.173 -13.385 1.00 11.41 C ATOM 286 O GLU A 19 -8.030 -11.191 -12.816 1.00 23.21 O ATOM 287 CB GLU A 19 -9.530 -13.023 -15.137 1.00 31.44 C ATOM 288 CG GLU A 19 -10.025 -12.147 -16.313 1.00 14.25 C ATOM 289 CD GLU A 19 -9.888 -12.841 -17.683 1.00 5.51 C ATOM 290 OE1 GLU A 19 -8.747 -13.149 -18.085 1.00 20.02 O ATOM 291 OE2 GLU A 19 -10.913 -13.093 -18.360 1.00 50.23 O ATOM 0 H GLU A 19 -11.835 -12.545 -14.448 1.00 22.13 H new ATOM 0 HA GLU A 19 -9.515 -13.218 -12.977 1.00 24.03 H new ATOM 0 HB2 GLU A 19 -8.448 -13.128 -15.217 1.00 31.44 H new ATOM 0 HB3 GLU A 19 -9.956 -14.020 -15.247 1.00 31.44 H new ATOM 0 HG2 GLU A 19 -11.070 -11.885 -16.148 1.00 14.25 H new ATOM 0 HG3 GLU A 19 -9.461 -11.215 -16.327 1.00 14.25 H new ATOM 298 N ILE A 20 -9.753 -10.027 -13.714 1.00 60.23 N ATOM 299 CA ILE A 20 -9.199 -8.683 -13.424 1.00 11.40 C ATOM 300 C ILE A 20 -9.442 -8.315 -11.936 1.00 21.52 C ATOM 301 O ILE A 20 -8.628 -7.628 -11.306 1.00 5.35 O ATOM 302 CB ILE A 20 -9.827 -7.600 -14.389 1.00 55.31 C ATOM 303 CG1 ILE A 20 -9.593 -8.000 -15.888 1.00 44.44 C ATOM 304 CG2 ILE A 20 -9.274 -6.181 -14.098 1.00 51.21 C ATOM 305 CD1 ILE A 20 -10.141 -7.018 -16.917 1.00 64.14 C ATOM 0 H ILE A 20 -10.656 -10.003 -14.188 1.00 60.23 H new ATOM 0 HA ILE A 20 -8.124 -8.701 -13.601 1.00 11.40 H new ATOM 0 HB ILE A 20 -10.900 -7.570 -14.202 1.00 55.31 H new ATOM 0 HG12 ILE A 20 -8.522 -8.114 -16.053 1.00 44.44 H new ATOM 0 HG13 ILE A 20 -10.048 -8.975 -16.062 1.00 44.44 H new ATOM 0 HG21 ILE A 20 -9.730 -5.465 -14.782 1.00 51.21 H new ATOM 0 HG22 ILE A 20 -9.510 -5.902 -13.071 1.00 51.21 H new ATOM 0 HG23 ILE A 20 -8.193 -6.176 -14.236 1.00 51.21 H new ATOM 0 HD11 ILE A 20 -9.928 -7.386 -17.921 1.00 64.14 H new ATOM 0 HD12 ILE A 20 -11.219 -6.919 -16.788 1.00 64.14 H new ATOM 0 HD13 ILE A 20 -9.669 -6.045 -16.779 1.00 64.14 H new ATOM 317 N ALA A 21 -10.560 -8.810 -11.372 1.00 42.34 N ATOM 318 CA ALA A 21 -10.903 -8.613 -9.944 1.00 12.30 C ATOM 319 C ALA A 21 -10.033 -9.493 -9.014 1.00 61.14 C ATOM 320 O ALA A 21 -9.908 -9.202 -7.820 1.00 61.14 O ATOM 321 CB ALA A 21 -12.396 -8.887 -9.724 1.00 14.42 C ATOM 0 H ALA A 21 -11.250 -9.356 -11.888 1.00 42.34 H new ATOM 0 HA ALA A 21 -10.691 -7.576 -9.685 1.00 12.30 H new ATOM 0 HB1 ALA A 21 -12.642 -8.740 -8.672 1.00 14.42 H new ATOM 0 HB2 ALA A 21 -12.985 -8.202 -10.333 1.00 14.42 H new ATOM 0 HB3 ALA A 21 -12.623 -9.914 -10.010 1.00 14.42 H new ATOM 327 N CYS A 22 -9.452 -10.574 -9.580 1.00 24.43 N ATOM 328 CA CYS A 22 -8.516 -11.467 -8.865 1.00 0.22 C ATOM 329 C CYS A 22 -7.134 -10.803 -8.659 1.00 4.23 C ATOM 330 O CYS A 22 -6.378 -11.204 -7.768 1.00 23.23 O ATOM 331 CB CYS A 22 -8.381 -12.806 -9.624 1.00 52.12 C ATOM 332 SG CYS A 22 -9.923 -13.750 -9.715 1.00 25.31 S ATOM 0 H CYS A 22 -9.620 -10.851 -10.547 1.00 24.43 H new ATOM 0 HA CYS A 22 -8.925 -11.663 -7.874 1.00 0.22 H new ATOM 0 HB2 CYS A 22 -8.028 -12.606 -10.636 1.00 52.12 H new ATOM 0 HB3 CYS A 22 -7.621 -13.415 -9.135 1.00 52.12 H new ATOM 0 HG CYS A 22 -10.731 -13.180 -10.559 1.00 25.31 H new ATOM 338 N MET A 23 -6.806 -9.808 -9.515 1.00 12.52 N ATOM 339 CA MET A 23 -5.579 -8.977 -9.369 1.00 34.33 C ATOM 340 C MET A 23 -5.604 -8.220 -8.032 1.00 54.34 C ATOM 341 O MET A 23 -4.570 -8.047 -7.366 1.00 41.02 O ATOM 342 CB MET A 23 -5.472 -7.969 -10.541 1.00 64.23 C ATOM 343 CG MET A 23 -5.411 -8.611 -11.927 1.00 62.41 C ATOM 344 SD MET A 23 -5.478 -7.405 -13.274 1.00 73.25 S ATOM 345 CE MET A 23 -4.053 -6.369 -12.919 1.00 31.03 C ATOM 0 H MET A 23 -7.377 -9.556 -10.322 1.00 12.52 H new ATOM 0 HA MET A 23 -4.711 -9.636 -9.387 1.00 34.33 H new ATOM 0 HB2 MET A 23 -6.329 -7.296 -10.504 1.00 64.23 H new ATOM 0 HB3 MET A 23 -4.580 -7.358 -10.398 1.00 64.23 H new ATOM 0 HG2 MET A 23 -4.492 -9.190 -12.012 1.00 62.41 H new ATOM 0 HG3 MET A 23 -6.240 -9.311 -12.033 1.00 62.41 H new ATOM 0 HE1 MET A 23 -3.528 -6.142 -13.847 1.00 31.03 H new ATOM 0 HE2 MET A 23 -4.385 -5.441 -12.454 1.00 31.03 H new ATOM 0 HE3 MET A 23 -3.381 -6.895 -12.241 1.00 31.03 H new ATOM 355 N SER A 24 -6.811 -7.767 -7.672 1.00 1.10 N ATOM 356 CA SER A 24 -7.098 -7.208 -6.358 1.00 4.41 C ATOM 357 C SER A 24 -7.144 -8.355 -5.343 1.00 42.44 C ATOM 358 O SER A 24 -8.033 -9.205 -5.419 1.00 74.11 O ATOM 359 CB SER A 24 -8.441 -6.454 -6.389 1.00 72.41 C ATOM 360 OG SER A 24 -8.747 -5.914 -5.116 1.00 64.33 O ATOM 0 H SER A 24 -7.619 -7.781 -8.295 1.00 1.10 H new ATOM 0 HA SER A 24 -6.321 -6.499 -6.072 1.00 4.41 H new ATOM 0 HB2 SER A 24 -8.396 -5.653 -7.127 1.00 72.41 H new ATOM 0 HB3 SER A 24 -9.236 -7.131 -6.702 1.00 72.41 H new ATOM 0 HG SER A 24 -7.934 -5.884 -4.569 1.00 64.33 H new ATOM 366 N VAL A 25 -6.168 -8.379 -4.417 1.00 13.22 N ATOM 367 CA VAL A 25 -6.010 -9.470 -3.441 1.00 53.14 C ATOM 368 C VAL A 25 -7.227 -9.554 -2.495 1.00 34.12 C ATOM 369 O VAL A 25 -7.759 -10.641 -2.280 1.00 23.11 O ATOM 370 CB VAL A 25 -4.665 -9.317 -2.626 1.00 2.34 C ATOM 371 CG1 VAL A 25 -4.525 -10.396 -1.522 1.00 54.33 C ATOM 372 CG2 VAL A 25 -3.448 -9.342 -3.587 1.00 24.31 C ATOM 0 H VAL A 25 -5.468 -7.643 -4.325 1.00 13.22 H new ATOM 0 HA VAL A 25 -5.957 -10.406 -3.997 1.00 53.14 H new ATOM 0 HB VAL A 25 -4.693 -8.351 -2.121 1.00 2.34 H new ATOM 0 HG11 VAL A 25 -3.586 -10.251 -0.988 1.00 54.33 H new ATOM 0 HG12 VAL A 25 -5.357 -10.311 -0.822 1.00 54.33 H new ATOM 0 HG13 VAL A 25 -4.534 -11.386 -1.978 1.00 54.33 H new ATOM 0 HG21 VAL A 25 -2.528 -9.236 -3.012 1.00 24.31 H new ATOM 0 HG22 VAL A 25 -3.431 -10.288 -4.128 1.00 24.31 H new ATOM 0 HG23 VAL A 25 -3.529 -8.520 -4.298 1.00 24.31 H new ATOM 382 N THR A 26 -7.679 -8.394 -1.988 1.00 71.05 N ATOM 383 CA THR A 26 -8.794 -8.316 -1.020 1.00 25.02 C ATOM 384 C THR A 26 -10.133 -8.795 -1.641 1.00 65.02 C ATOM 385 O THR A 26 -10.818 -9.628 -1.045 1.00 51.24 O ATOM 386 CB THR A 26 -8.952 -6.864 -0.464 1.00 43.21 C ATOM 387 OG1 THR A 26 -7.697 -6.423 0.084 1.00 13.11 O ATOM 388 CG2 THR A 26 -10.048 -6.753 0.617 1.00 3.03 C ATOM 0 H THR A 26 -7.286 -7.486 -2.235 1.00 71.05 H new ATOM 0 HA THR A 26 -8.547 -8.985 -0.196 1.00 25.02 H new ATOM 0 HB THR A 26 -9.255 -6.231 -1.298 1.00 43.21 H new ATOM 0 HG1 THR A 26 -7.766 -5.480 0.341 1.00 13.11 H new ATOM 0 HG21 THR A 26 -10.112 -5.722 0.966 1.00 3.03 H new ATOM 0 HG22 THR A 26 -11.007 -7.054 0.195 1.00 3.03 H new ATOM 0 HG23 THR A 26 -9.800 -7.405 1.455 1.00 3.03 H new ATOM 396 N ILE A 27 -10.471 -8.278 -2.847 1.00 33.25 N ATOM 397 CA ILE A 27 -11.727 -8.635 -3.564 1.00 70.21 C ATOM 398 C ILE A 27 -11.740 -10.139 -3.910 1.00 53.15 C ATOM 399 O ILE A 27 -12.767 -10.813 -3.761 1.00 72.03 O ATOM 400 CB ILE A 27 -11.896 -7.775 -4.874 1.00 62.52 C ATOM 401 CG1 ILE A 27 -11.983 -6.260 -4.515 1.00 22.01 C ATOM 402 CG2 ILE A 27 -13.129 -8.222 -5.712 1.00 24.44 C ATOM 403 CD1 ILE A 27 -11.979 -5.323 -5.709 1.00 64.45 C ATOM 0 H ILE A 27 -9.889 -7.608 -3.349 1.00 33.25 H new ATOM 0 HA ILE A 27 -12.565 -8.417 -2.902 1.00 70.21 H new ATOM 0 HB ILE A 27 -11.016 -7.940 -5.495 1.00 62.52 H new ATOM 0 HG12 ILE A 27 -12.893 -6.089 -3.939 1.00 22.01 H new ATOM 0 HG13 ILE A 27 -11.144 -6.005 -3.868 1.00 22.01 H new ATOM 0 HG21 ILE A 27 -13.206 -7.602 -6.605 1.00 24.44 H new ATOM 0 HG22 ILE A 27 -13.012 -9.266 -6.004 1.00 24.44 H new ATOM 0 HG23 ILE A 27 -14.034 -8.112 -5.115 1.00 24.44 H new ATOM 0 HD11 ILE A 27 -12.042 -4.292 -5.362 1.00 64.45 H new ATOM 0 HD12 ILE A 27 -11.058 -5.459 -6.275 1.00 64.45 H new ATOM 0 HD13 ILE A 27 -12.834 -5.544 -6.348 1.00 64.45 H new ATOM 415 N LYS A 28 -10.567 -10.635 -4.348 1.00 3.21 N ATOM 416 CA LYS A 28 -10.327 -12.058 -4.627 1.00 61.42 C ATOM 417 C LYS A 28 -10.623 -12.905 -3.373 1.00 41.44 C ATOM 418 O LYS A 28 -11.367 -13.884 -3.441 1.00 3.43 O ATOM 419 CB LYS A 28 -8.856 -12.251 -5.077 1.00 2.42 C ATOM 420 CG LYS A 28 -8.455 -13.694 -5.454 1.00 60.22 C ATOM 421 CD LYS A 28 -6.934 -13.842 -5.709 1.00 71.00 C ATOM 422 CE LYS A 28 -6.079 -13.458 -4.484 1.00 45.22 C ATOM 423 NZ LYS A 28 -6.376 -14.301 -3.297 1.00 64.05 N ATOM 0 H LYS A 28 -9.751 -10.048 -4.519 1.00 3.21 H new ATOM 0 HA LYS A 28 -10.992 -12.388 -5.425 1.00 61.42 H new ATOM 0 HB2 LYS A 28 -8.670 -11.606 -5.936 1.00 2.42 H new ATOM 0 HB3 LYS A 28 -8.202 -11.910 -4.275 1.00 2.42 H new ATOM 0 HG2 LYS A 28 -8.753 -14.371 -4.653 1.00 60.22 H new ATOM 0 HG3 LYS A 28 -9.001 -13.997 -6.348 1.00 60.22 H new ATOM 0 HD2 LYS A 28 -6.716 -14.873 -5.989 1.00 71.00 H new ATOM 0 HD3 LYS A 28 -6.650 -13.216 -6.555 1.00 71.00 H new ATOM 0 HE2 LYS A 28 -5.023 -13.552 -4.738 1.00 45.22 H new ATOM 0 HE3 LYS A 28 -6.255 -12.411 -4.236 1.00 45.22 H new ATOM 0 HZ1 LYS A 28 -6.675 -13.695 -2.507 1.00 64.05 H new ATOM 0 HZ2 LYS A 28 -7.138 -14.970 -3.528 1.00 64.05 H new ATOM 0 HZ3 LYS A 28 -5.523 -14.829 -3.024 1.00 64.05 H new ATOM 437 N ASN A 29 -10.080 -12.454 -2.217 1.00 2.41 N ATOM 438 CA ASN A 29 -10.245 -13.142 -0.914 1.00 75.44 C ATOM 439 C ASN A 29 -11.713 -13.121 -0.453 1.00 75.33 C ATOM 440 O ASN A 29 -12.159 -14.059 0.199 1.00 1.42 O ATOM 441 CB ASN A 29 -9.337 -12.514 0.189 1.00 34.54 C ATOM 442 CG ASN A 29 -7.831 -12.660 -0.077 1.00 71.40 C ATOM 443 OD1 ASN A 29 -7.383 -13.562 -0.784 1.00 31.13 O ATOM 444 ND2 ASN A 29 -7.030 -11.777 0.505 1.00 35.25 N ATOM 0 H ASN A 29 -9.517 -11.605 -2.161 1.00 2.41 H new ATOM 0 HA ASN A 29 -9.938 -14.177 -1.064 1.00 75.44 H new ATOM 0 HB2 ASN A 29 -9.577 -11.455 0.282 1.00 34.54 H new ATOM 0 HB3 ASN A 29 -9.572 -12.979 1.146 1.00 34.54 H new ATOM 0 HD21 ASN A 29 -6.021 -11.838 0.370 1.00 35.25 H new ATOM 0 HD22 ASN A 29 -7.423 -11.037 1.087 1.00 35.25 H new ATOM 451 N MET A 30 -12.446 -12.038 -0.800 1.00 0.43 N ATOM 452 CA MET A 30 -13.884 -11.892 -0.471 1.00 20.20 C ATOM 453 C MET A 30 -14.719 -12.978 -1.180 1.00 74.11 C ATOM 454 O MET A 30 -15.587 -13.609 -0.566 1.00 50.24 O ATOM 455 CB MET A 30 -14.404 -10.467 -0.843 1.00 74.43 C ATOM 456 CG MET A 30 -13.833 -9.331 0.019 1.00 12.12 C ATOM 457 SD MET A 30 -14.485 -7.705 -0.427 1.00 53.04 S ATOM 458 CE MET A 30 -13.822 -6.670 0.881 1.00 32.54 C ATOM 0 H MET A 30 -12.061 -11.245 -1.313 1.00 0.43 H new ATOM 0 HA MET A 30 -13.996 -12.021 0.606 1.00 20.20 H new ATOM 0 HB2 MET A 30 -14.164 -10.268 -1.887 1.00 74.43 H new ATOM 0 HB3 MET A 30 -15.491 -10.458 -0.759 1.00 74.43 H new ATOM 0 HG2 MET A 30 -14.057 -9.531 1.067 1.00 12.12 H new ATOM 0 HG3 MET A 30 -12.747 -9.320 -0.078 1.00 12.12 H new ATOM 0 HE1 MET A 30 -14.627 -6.084 1.325 1.00 32.54 H new ATOM 0 HE2 MET A 30 -13.366 -7.298 1.646 1.00 32.54 H new ATOM 0 HE3 MET A 30 -13.070 -5.998 0.467 1.00 32.54 H new ATOM 468 N ILE A 31 -14.406 -13.202 -2.473 1.00 63.22 N ATOM 469 CA ILE A 31 -15.078 -14.214 -3.310 1.00 21.33 C ATOM 470 C ILE A 31 -14.735 -15.635 -2.805 1.00 32.24 C ATOM 471 O ILE A 31 -15.624 -16.481 -2.671 1.00 74.54 O ATOM 472 CB ILE A 31 -14.685 -14.044 -4.834 1.00 52.05 C ATOM 473 CG1 ILE A 31 -15.060 -12.605 -5.333 1.00 1.11 C ATOM 474 CG2 ILE A 31 -15.345 -15.138 -5.721 1.00 73.02 C ATOM 475 CD1 ILE A 31 -14.623 -12.279 -6.755 1.00 35.21 C ATOM 0 H ILE A 31 -13.678 -12.684 -2.966 1.00 63.22 H new ATOM 0 HA ILE A 31 -16.155 -14.068 -3.230 1.00 21.33 H new ATOM 0 HB ILE A 31 -13.606 -14.170 -4.922 1.00 52.05 H new ATOM 0 HG12 ILE A 31 -16.141 -12.484 -5.265 1.00 1.11 H new ATOM 0 HG13 ILE A 31 -14.615 -11.875 -4.657 1.00 1.11 H new ATOM 0 HG21 ILE A 31 -15.052 -14.989 -6.760 1.00 73.02 H new ATOM 0 HG22 ILE A 31 -15.016 -16.123 -5.389 1.00 73.02 H new ATOM 0 HG23 ILE A 31 -16.430 -15.070 -5.636 1.00 73.02 H new ATOM 0 HD11 ILE A 31 -14.928 -11.263 -7.006 1.00 35.21 H new ATOM 0 HD12 ILE A 31 -13.539 -12.361 -6.830 1.00 35.21 H new ATOM 0 HD13 ILE A 31 -15.089 -12.979 -7.448 1.00 35.21 H new ATOM 487 N GLU A 32 -13.444 -15.853 -2.477 1.00 71.13 N ATOM 488 CA GLU A 32 -12.930 -17.158 -1.991 1.00 65.24 C ATOM 489 C GLU A 32 -13.447 -17.487 -0.574 1.00 3.34 C ATOM 490 O GLU A 32 -13.580 -18.663 -0.216 1.00 52.40 O ATOM 491 CB GLU A 32 -11.381 -17.167 -1.990 1.00 1.22 C ATOM 492 CG GLU A 32 -10.737 -16.986 -3.381 1.00 70.42 C ATOM 493 CD GLU A 32 -9.203 -16.914 -3.315 1.00 4.33 C ATOM 494 OE1 GLU A 32 -8.517 -17.884 -3.718 1.00 34.10 O ATOM 495 OE2 GLU A 32 -8.675 -15.889 -2.829 1.00 3.55 O ATOM 0 H GLU A 32 -12.726 -15.131 -2.540 1.00 71.13 H new ATOM 0 HA GLU A 32 -13.299 -17.922 -2.675 1.00 65.24 H new ATOM 0 HB2 GLU A 32 -11.026 -16.372 -1.334 1.00 1.22 H new ATOM 0 HB3 GLU A 32 -11.036 -18.109 -1.564 1.00 1.22 H new ATOM 0 HG2 GLU A 32 -11.031 -17.815 -4.025 1.00 70.42 H new ATOM 0 HG3 GLU A 32 -11.121 -16.075 -3.840 1.00 70.42 H new ATOM 502 N ASP A 33 -13.740 -16.437 0.216 1.00 33.03 N ATOM 503 CA ASP A 33 -14.256 -16.573 1.602 1.00 12.03 C ATOM 504 C ASP A 33 -15.709 -17.086 1.584 1.00 54.03 C ATOM 505 O ASP A 33 -16.106 -17.913 2.408 1.00 60.22 O ATOM 506 CB ASP A 33 -14.161 -15.213 2.341 1.00 1.21 C ATOM 507 CG ASP A 33 -14.659 -15.286 3.796 1.00 54.22 C ATOM 508 OD1 ASP A 33 -13.886 -15.702 4.688 1.00 14.12 O ATOM 509 OD2 ASP A 33 -15.831 -14.942 4.054 1.00 62.13 O ATOM 0 H ASP A 33 -13.628 -15.468 -0.083 1.00 33.03 H new ATOM 0 HA ASP A 33 -13.645 -17.300 2.138 1.00 12.03 H new ATOM 0 HB2 ASP A 33 -13.126 -14.873 2.333 1.00 1.21 H new ATOM 0 HB3 ASP A 33 -14.745 -14.469 1.799 1.00 1.21 H new ATOM 514 N ILE A 34 -16.483 -16.573 0.618 1.00 4.14 N ATOM 515 CA ILE A 34 -17.851 -17.048 0.323 1.00 22.41 C ATOM 516 C ILE A 34 -17.777 -18.350 -0.529 1.00 62.11 C ATOM 517 O ILE A 34 -18.768 -19.073 -0.704 1.00 51.43 O ATOM 518 CB ILE A 34 -18.662 -15.916 -0.424 1.00 2.40 C ATOM 519 CG1 ILE A 34 -18.615 -14.582 0.401 1.00 65.22 C ATOM 520 CG2 ILE A 34 -20.130 -16.341 -0.701 1.00 51.41 C ATOM 521 CD1 ILE A 34 -19.253 -13.375 -0.277 1.00 53.40 C ATOM 0 H ILE A 34 -16.179 -15.811 0.012 1.00 4.14 H new ATOM 0 HA ILE A 34 -18.372 -17.277 1.252 1.00 22.41 H new ATOM 0 HB ILE A 34 -18.188 -15.751 -1.391 1.00 2.40 H new ATOM 0 HG12 ILE A 34 -19.113 -14.747 1.356 1.00 65.22 H new ATOM 0 HG13 ILE A 34 -17.574 -14.346 0.621 1.00 65.22 H new ATOM 0 HG21 ILE A 34 -20.651 -15.534 -1.216 1.00 51.41 H new ATOM 0 HG22 ILE A 34 -20.138 -17.235 -1.325 1.00 51.41 H new ATOM 0 HG23 ILE A 34 -20.632 -16.553 0.243 1.00 51.41 H new ATOM 0 HD11 ILE A 34 -19.168 -12.505 0.374 1.00 53.40 H new ATOM 0 HD12 ILE A 34 -18.742 -13.174 -1.219 1.00 53.40 H new ATOM 0 HD13 ILE A 34 -20.305 -13.581 -0.472 1.00 53.40 H new ATOM 533 N GLY A 35 -16.561 -18.649 -1.028 1.00 22.41 N ATOM 534 CA GLY A 35 -16.302 -19.827 -1.842 1.00 22.22 C ATOM 535 C GLY A 35 -16.411 -19.494 -3.309 1.00 12.24 C ATOM 536 O GLY A 35 -15.399 -19.389 -4.017 1.00 12.22 O ATOM 0 H GLY A 35 -15.736 -18.071 -0.870 1.00 22.41 H new ATOM 0 HA2 GLY A 35 -15.306 -20.214 -1.625 1.00 22.22 H new ATOM 0 HA3 GLY A 35 -17.012 -20.614 -1.589 1.00 22.22 H new ATOM 540 N GLU A 36 -17.661 -19.301 -3.759 1.00 3.43 N ATOM 541 CA GLU A 36 -17.990 -18.925 -5.142 1.00 33.12 C ATOM 542 C GLU A 36 -19.095 -17.849 -5.104 1.00 42.24 C ATOM 543 O GLU A 36 -20.246 -18.155 -4.768 1.00 75.32 O ATOM 544 CB GLU A 36 -18.453 -20.177 -5.962 1.00 32.03 C ATOM 545 CG GLU A 36 -17.429 -21.339 -6.002 1.00 20.13 C ATOM 546 CD GLU A 36 -17.911 -22.564 -6.799 1.00 51.22 C ATOM 547 OE1 GLU A 36 -17.482 -22.742 -7.964 1.00 62.02 O ATOM 548 OE2 GLU A 36 -18.717 -23.356 -6.261 1.00 13.40 O ATOM 0 H GLU A 36 -18.483 -19.403 -3.163 1.00 3.43 H new ATOM 0 HA GLU A 36 -17.106 -18.524 -5.638 1.00 33.12 H new ATOM 0 HB2 GLU A 36 -19.386 -20.548 -5.538 1.00 32.03 H new ATOM 0 HB3 GLU A 36 -18.669 -19.866 -6.984 1.00 32.03 H new ATOM 0 HG2 GLU A 36 -16.499 -20.976 -6.439 1.00 20.13 H new ATOM 0 HG3 GLU A 36 -17.203 -21.647 -4.981 1.00 20.13 H new ATOM 555 N SER A 37 -18.732 -16.589 -5.415 1.00 35.42 N ATOM 556 CA SER A 37 -19.675 -15.458 -5.414 1.00 60.11 C ATOM 557 C SER A 37 -19.387 -14.496 -6.585 1.00 71.10 C ATOM 558 O SER A 37 -18.381 -13.773 -6.586 1.00 72.23 O ATOM 559 CB SER A 37 -19.633 -14.711 -4.058 1.00 20.22 C ATOM 560 OG SER A 37 -18.319 -14.299 -3.724 1.00 71.44 O ATOM 0 H SER A 37 -17.780 -16.329 -5.673 1.00 35.42 H new ATOM 0 HA SER A 37 -20.681 -15.856 -5.550 1.00 60.11 H new ATOM 0 HB2 SER A 37 -20.287 -13.840 -4.103 1.00 20.22 H new ATOM 0 HB3 SER A 37 -20.021 -15.360 -3.273 1.00 20.22 H new ATOM 0 HG SER A 37 -17.883 -13.921 -4.516 1.00 71.44 H new ATOM 566 N ASP A 38 -20.265 -14.540 -7.602 1.00 23.44 N ATOM 567 CA ASP A 38 -20.305 -13.551 -8.696 1.00 45.13 C ATOM 568 C ASP A 38 -21.238 -12.383 -8.312 1.00 22.03 C ATOM 569 O ASP A 38 -21.189 -11.313 -8.935 1.00 54.11 O ATOM 570 CB ASP A 38 -20.779 -14.229 -10.010 1.00 4.54 C ATOM 571 CG ASP A 38 -22.224 -14.765 -9.931 1.00 23.05 C ATOM 572 OD1 ASP A 38 -22.453 -15.784 -9.244 1.00 33.44 O ATOM 573 OD2 ASP A 38 -23.138 -14.176 -10.553 1.00 4.00 O ATOM 0 H ASP A 38 -20.973 -15.269 -7.690 1.00 23.44 H new ATOM 0 HA ASP A 38 -19.303 -13.154 -8.860 1.00 45.13 H new ATOM 0 HB2 ASP A 38 -20.709 -13.511 -10.827 1.00 4.54 H new ATOM 0 HB3 ASP A 38 -20.106 -15.052 -10.250 1.00 4.54 H new ATOM 578 N SER A 39 -22.093 -12.626 -7.284 1.00 3.24 N ATOM 579 CA SER A 39 -23.055 -11.647 -6.733 1.00 55.13 C ATOM 580 C SER A 39 -22.345 -10.348 -6.253 1.00 14.21 C ATOM 581 O SER A 39 -21.174 -10.417 -5.867 1.00 21.24 O ATOM 582 CB SER A 39 -23.845 -12.311 -5.568 1.00 22.32 C ATOM 583 OG SER A 39 -24.595 -13.426 -6.030 1.00 54.22 O ATOM 0 H SER A 39 -22.130 -13.528 -6.809 1.00 3.24 H new ATOM 0 HA SER A 39 -23.746 -11.354 -7.523 1.00 55.13 H new ATOM 0 HB2 SER A 39 -23.152 -12.632 -4.791 1.00 22.32 H new ATOM 0 HB3 SER A 39 -24.515 -11.580 -5.116 1.00 22.32 H new ATOM 0 HG SER A 39 -25.081 -13.827 -5.279 1.00 54.22 H new ATOM 589 N PRO A 40 -23.044 -9.153 -6.272 1.00 40.42 N ATOM 590 CA PRO A 40 -22.420 -7.837 -5.964 1.00 31.13 C ATOM 591 C PRO A 40 -21.652 -7.804 -4.629 1.00 14.01 C ATOM 592 O PRO A 40 -22.262 -7.840 -3.554 1.00 51.44 O ATOM 593 CB PRO A 40 -23.615 -6.851 -5.957 1.00 5.52 C ATOM 594 CG PRO A 40 -24.663 -7.508 -6.804 1.00 32.44 C ATOM 595 CD PRO A 40 -24.497 -8.996 -6.591 1.00 25.11 C ATOM 0 HA PRO A 40 -21.655 -7.587 -6.699 1.00 31.13 H new ATOM 0 HB2 PRO A 40 -23.978 -6.677 -4.944 1.00 5.52 H new ATOM 0 HB3 PRO A 40 -23.329 -5.881 -6.364 1.00 5.52 H new ATOM 0 HG2 PRO A 40 -25.661 -7.181 -6.513 1.00 32.44 H new ATOM 0 HG3 PRO A 40 -24.536 -7.247 -7.855 1.00 32.44 H new ATOM 0 HD2 PRO A 40 -25.126 -9.356 -5.777 1.00 25.11 H new ATOM 0 HD3 PRO A 40 -24.774 -9.561 -7.481 1.00 25.11 H new ATOM 603 N ILE A 41 -20.306 -7.805 -4.725 1.00 72.11 N ATOM 604 CA ILE A 41 -19.406 -7.605 -3.585 1.00 75.05 C ATOM 605 C ILE A 41 -19.495 -6.112 -3.150 1.00 34.42 C ATOM 606 O ILE A 41 -19.042 -5.236 -3.904 1.00 32.22 O ATOM 607 CB ILE A 41 -17.895 -7.991 -3.934 1.00 5.34 C ATOM 608 CG1 ILE A 41 -17.742 -9.498 -4.393 1.00 74.33 C ATOM 609 CG2 ILE A 41 -16.955 -7.685 -2.739 1.00 12.52 C ATOM 610 CD1 ILE A 41 -18.000 -9.764 -5.877 1.00 32.44 C ATOM 0 H ILE A 41 -19.815 -7.947 -5.608 1.00 72.11 H new ATOM 0 HA ILE A 41 -19.717 -8.263 -2.773 1.00 75.05 H new ATOM 0 HB ILE A 41 -17.601 -7.370 -4.780 1.00 5.34 H new ATOM 0 HG12 ILE A 41 -16.733 -9.832 -4.152 1.00 74.33 H new ATOM 0 HG13 ILE A 41 -18.429 -10.109 -3.807 1.00 74.33 H new ATOM 0 HG21 ILE A 41 -15.933 -7.956 -3.002 1.00 12.52 H new ATOM 0 HG22 ILE A 41 -16.999 -6.621 -2.504 1.00 12.52 H new ATOM 0 HG23 ILE A 41 -17.272 -8.262 -1.870 1.00 12.52 H new ATOM 0 HD11 ILE A 41 -17.869 -10.826 -6.085 1.00 32.44 H new ATOM 0 HD12 ILE A 41 -19.019 -9.469 -6.128 1.00 32.44 H new ATOM 0 HD13 ILE A 41 -17.297 -9.187 -6.478 1.00 32.44 H new ATOM 622 N PRO A 42 -20.128 -5.786 -1.966 1.00 14.53 N ATOM 623 CA PRO A 42 -20.245 -4.393 -1.490 1.00 70.25 C ATOM 624 C PRO A 42 -18.917 -3.907 -0.860 1.00 75.24 C ATOM 625 O PRO A 42 -18.353 -4.566 0.029 1.00 54.43 O ATOM 626 CB PRO A 42 -21.400 -4.465 -0.462 1.00 4.42 C ATOM 627 CG PRO A 42 -21.324 -5.854 0.105 1.00 23.42 C ATOM 628 CD PRO A 42 -20.768 -6.741 -1.004 1.00 40.51 C ATOM 0 HA PRO A 42 -20.448 -3.675 -2.285 1.00 70.25 H new ATOM 0 HB2 PRO A 42 -21.283 -3.713 0.318 1.00 4.42 H new ATOM 0 HB3 PRO A 42 -22.364 -4.284 -0.937 1.00 4.42 H new ATOM 0 HG2 PRO A 42 -20.679 -5.880 0.984 1.00 23.42 H new ATOM 0 HG3 PRO A 42 -22.308 -6.199 0.422 1.00 23.42 H new ATOM 0 HD2 PRO A 42 -20.044 -7.456 -0.614 1.00 40.51 H new ATOM 0 HD3 PRO A 42 -21.558 -7.318 -1.484 1.00 40.51 H new ATOM 636 N LEU A 43 -18.412 -2.769 -1.348 1.00 33.21 N ATOM 637 CA LEU A 43 -17.140 -2.177 -0.911 1.00 50.02 C ATOM 638 C LEU A 43 -17.433 -0.818 -0.230 1.00 34.31 C ATOM 639 O LEU A 43 -17.447 0.223 -0.902 1.00 55.21 O ATOM 640 CB LEU A 43 -16.174 -2.034 -2.134 1.00 33.31 C ATOM 641 CG LEU A 43 -15.787 -3.364 -2.870 1.00 65.24 C ATOM 642 CD1 LEU A 43 -14.943 -3.093 -4.140 1.00 33.53 C ATOM 643 CD2 LEU A 43 -15.068 -4.348 -1.917 1.00 15.14 C ATOM 0 H LEU A 43 -18.882 -2.223 -2.070 1.00 33.21 H new ATOM 0 HA LEU A 43 -16.643 -2.820 -0.185 1.00 50.02 H new ATOM 0 HB2 LEU A 43 -16.636 -1.363 -2.859 1.00 33.31 H new ATOM 0 HB3 LEU A 43 -15.258 -1.552 -1.792 1.00 33.31 H new ATOM 0 HG LEU A 43 -16.716 -3.835 -3.193 1.00 65.24 H new ATOM 0 HD11 LEU A 43 -14.695 -4.039 -4.621 1.00 33.53 H new ATOM 0 HD12 LEU A 43 -15.514 -2.473 -4.831 1.00 33.53 H new ATOM 0 HD13 LEU A 43 -14.025 -2.576 -3.863 1.00 33.53 H new ATOM 0 HD21 LEU A 43 -14.814 -5.259 -2.459 1.00 15.14 H new ATOM 0 HD22 LEU A 43 -14.157 -3.886 -1.537 1.00 15.14 H new ATOM 0 HD23 LEU A 43 -15.726 -4.593 -1.083 1.00 15.14 H new ATOM 655 N PRO A 44 -17.701 -0.803 1.124 1.00 4.11 N ATOM 656 CA PRO A 44 -18.118 0.405 1.859 1.00 4.21 C ATOM 657 C PRO A 44 -16.899 1.234 2.319 1.00 1.13 C ATOM 658 O PRO A 44 -16.672 1.444 3.521 1.00 33.12 O ATOM 659 CB PRO A 44 -18.952 -0.180 3.044 1.00 2.33 C ATOM 660 CG PRO A 44 -18.594 -1.651 3.144 1.00 42.34 C ATOM 661 CD PRO A 44 -17.569 -1.946 2.062 1.00 32.11 C ATOM 0 HA PRO A 44 -18.696 1.110 1.261 1.00 4.21 H new ATOM 0 HB2 PRO A 44 -18.720 0.339 3.974 1.00 2.33 H new ATOM 0 HB3 PRO A 44 -20.020 -0.053 2.866 1.00 2.33 H new ATOM 0 HG2 PRO A 44 -18.188 -1.881 4.129 1.00 42.34 H new ATOM 0 HG3 PRO A 44 -19.481 -2.271 3.012 1.00 42.34 H new ATOM 0 HD2 PRO A 44 -16.562 -2.011 2.473 1.00 32.11 H new ATOM 0 HD3 PRO A 44 -17.773 -2.895 1.566 1.00 32.11 H new ATOM 669 N ASN A 45 -16.136 1.721 1.326 1.00 55.14 N ATOM 670 CA ASN A 45 -14.897 2.485 1.538 1.00 4.32 C ATOM 671 C ASN A 45 -14.556 3.245 0.248 1.00 65.41 C ATOM 672 O ASN A 45 -14.444 4.476 0.240 1.00 75.45 O ATOM 673 CB ASN A 45 -13.731 1.534 1.934 1.00 62.40 C ATOM 674 CG ASN A 45 -12.421 2.259 2.274 1.00 4.35 C ATOM 675 OD1 ASN A 45 -11.598 2.540 1.400 1.00 33.24 O ATOM 676 ND2 ASN A 45 -12.208 2.541 3.551 1.00 52.34 N ATOM 0 H ASN A 45 -16.366 1.593 0.341 1.00 55.14 H new ATOM 0 HA ASN A 45 -15.041 3.195 2.353 1.00 4.32 H new ATOM 0 HB2 ASN A 45 -14.038 0.938 2.794 1.00 62.40 H new ATOM 0 HB3 ASN A 45 -13.548 0.840 1.114 1.00 62.40 H new ATOM 0 HD21 ASN A 45 -11.344 3.003 3.834 1.00 52.34 H new ATOM 0 HD22 ASN A 45 -12.908 2.296 4.251 1.00 52.34 H new ATOM 683 N VAL A 46 -14.399 2.483 -0.847 1.00 42.12 N ATOM 684 CA VAL A 46 -14.061 3.032 -2.171 1.00 14.34 C ATOM 685 C VAL A 46 -15.352 3.475 -2.908 1.00 71.31 C ATOM 686 O VAL A 46 -16.322 2.715 -2.987 1.00 10.14 O ATOM 687 CB VAL A 46 -13.235 1.983 -3.025 1.00 51.44 C ATOM 688 CG1 VAL A 46 -13.996 0.655 -3.237 1.00 41.14 C ATOM 689 CG2 VAL A 46 -12.775 2.581 -4.372 1.00 32.31 C ATOM 0 H VAL A 46 -14.503 1.468 -0.839 1.00 42.12 H new ATOM 0 HA VAL A 46 -13.428 3.909 -2.036 1.00 14.34 H new ATOM 0 HB VAL A 46 -12.346 1.747 -2.440 1.00 51.44 H new ATOM 0 HG11 VAL A 46 -13.383 -0.025 -3.828 1.00 41.14 H new ATOM 0 HG12 VAL A 46 -14.212 0.201 -2.270 1.00 41.14 H new ATOM 0 HG13 VAL A 46 -14.930 0.851 -3.763 1.00 41.14 H new ATOM 0 HG21 VAL A 46 -12.212 1.832 -4.929 1.00 32.31 H new ATOM 0 HG22 VAL A 46 -13.647 2.885 -4.952 1.00 32.31 H new ATOM 0 HG23 VAL A 46 -12.141 3.448 -4.188 1.00 32.31 H new ATOM 699 N THR A 47 -15.367 4.724 -3.409 1.00 13.41 N ATOM 700 CA THR A 47 -16.511 5.282 -4.158 1.00 44.33 C ATOM 701 C THR A 47 -16.493 4.798 -5.619 1.00 21.14 C ATOM 702 O THR A 47 -15.553 4.116 -6.039 1.00 73.42 O ATOM 703 CB THR A 47 -16.497 6.839 -4.106 1.00 34.01 C ATOM 704 OG1 THR A 47 -15.275 7.324 -4.680 1.00 72.12 O ATOM 705 CG2 THR A 47 -16.651 7.369 -2.665 1.00 34.22 C ATOM 0 H THR A 47 -14.588 5.375 -3.307 1.00 13.41 H new ATOM 0 HA THR A 47 -17.428 4.928 -3.687 1.00 44.33 H new ATOM 0 HB THR A 47 -17.349 7.203 -4.680 1.00 34.01 H new ATOM 0 HG1 THR A 47 -15.265 8.303 -4.650 1.00 72.12 H new ATOM 0 HG21 THR A 47 -16.636 8.459 -2.675 1.00 34.22 H new ATOM 0 HG22 THR A 47 -17.597 7.023 -2.249 1.00 34.22 H new ATOM 0 HG23 THR A 47 -15.829 7.000 -2.052 1.00 34.22 H new ATOM 713 N SER A 48 -17.538 5.169 -6.379 1.00 24.41 N ATOM 714 CA SER A 48 -17.758 4.686 -7.753 1.00 41.53 C ATOM 715 C SER A 48 -16.675 5.169 -8.721 1.00 32.15 C ATOM 716 O SER A 48 -16.125 4.374 -9.475 1.00 43.44 O ATOM 717 CB SER A 48 -19.136 5.148 -8.251 1.00 41.20 C ATOM 718 OG SER A 48 -19.253 6.564 -8.185 1.00 55.42 O ATOM 0 H SER A 48 -18.257 5.816 -6.055 1.00 24.41 H new ATOM 0 HA SER A 48 -17.712 3.597 -7.726 1.00 41.53 H new ATOM 0 HB2 SER A 48 -19.286 4.815 -9.278 1.00 41.20 H new ATOM 0 HB3 SER A 48 -19.918 4.686 -7.648 1.00 41.20 H new ATOM 0 HG SER A 48 -20.152 6.804 -7.877 1.00 55.42 H new ATOM 724 N THR A 49 -16.377 6.475 -8.666 1.00 13.10 N ATOM 725 CA THR A 49 -15.417 7.130 -9.567 1.00 40.35 C ATOM 726 C THR A 49 -13.999 6.562 -9.375 1.00 23.22 C ATOM 727 O THR A 49 -13.252 6.355 -10.346 1.00 22.04 O ATOM 728 CB THR A 49 -15.411 8.668 -9.306 1.00 51.41 C ATOM 729 OG1 THR A 49 -15.076 8.916 -7.929 1.00 21.44 O ATOM 730 CG2 THR A 49 -16.775 9.316 -9.624 1.00 24.32 C ATOM 0 H THR A 49 -16.799 7.112 -7.990 1.00 13.10 H new ATOM 0 HA THR A 49 -15.726 6.935 -10.594 1.00 40.35 H new ATOM 0 HB THR A 49 -14.669 9.114 -9.968 1.00 51.41 H new ATOM 0 HG1 THR A 49 -15.070 9.882 -7.763 1.00 21.44 H new ATOM 0 HG21 THR A 49 -16.724 10.387 -9.427 1.00 24.32 H new ATOM 0 HG22 THR A 49 -17.020 9.151 -10.673 1.00 24.32 H new ATOM 0 HG23 THR A 49 -17.546 8.868 -8.996 1.00 24.32 H new ATOM 738 N ILE A 50 -13.654 6.301 -8.103 1.00 2.02 N ATOM 739 CA ILE A 50 -12.338 5.780 -7.718 1.00 55.30 C ATOM 740 C ILE A 50 -12.223 4.304 -8.129 1.00 2.04 C ATOM 741 O ILE A 50 -11.240 3.918 -8.757 1.00 1.43 O ATOM 742 CB ILE A 50 -12.092 5.974 -6.171 1.00 34.53 C ATOM 743 CG1 ILE A 50 -12.189 7.489 -5.795 1.00 71.42 C ATOM 744 CG2 ILE A 50 -10.737 5.379 -5.715 1.00 71.14 C ATOM 745 CD1 ILE A 50 -11.204 8.404 -6.520 1.00 20.22 C ATOM 0 H ILE A 50 -14.283 6.447 -7.314 1.00 2.02 H new ATOM 0 HA ILE A 50 -11.563 6.341 -8.241 1.00 55.30 H new ATOM 0 HB ILE A 50 -12.872 5.426 -5.642 1.00 34.53 H new ATOM 0 HG12 ILE A 50 -13.202 7.834 -6.003 1.00 71.42 H new ATOM 0 HG13 ILE A 50 -12.032 7.591 -4.721 1.00 71.42 H new ATOM 0 HG21 ILE A 50 -10.612 5.537 -4.644 1.00 71.14 H new ATOM 0 HG22 ILE A 50 -10.718 4.310 -5.929 1.00 71.14 H new ATOM 0 HG23 ILE A 50 -9.925 5.871 -6.251 1.00 71.14 H new ATOM 0 HD11 ILE A 50 -11.352 9.432 -6.190 1.00 20.22 H new ATOM 0 HD12 ILE A 50 -10.184 8.093 -6.293 1.00 20.22 H new ATOM 0 HD13 ILE A 50 -11.372 8.340 -7.595 1.00 20.22 H new ATOM 757 N LEU A 51 -13.275 3.511 -7.822 1.00 32.20 N ATOM 758 CA LEU A 51 -13.339 2.069 -8.170 1.00 20.42 C ATOM 759 C LEU A 51 -13.315 1.862 -9.701 1.00 71.22 C ATOM 760 O LEU A 51 -12.720 0.903 -10.192 1.00 54.25 O ATOM 761 CB LEU A 51 -14.612 1.411 -7.549 1.00 60.12 C ATOM 762 CG LEU A 51 -14.751 -0.144 -7.730 1.00 13.42 C ATOM 763 CD1 LEU A 51 -13.569 -0.903 -7.078 1.00 64.25 C ATOM 764 CD2 LEU A 51 -16.111 -0.657 -7.193 1.00 3.44 C ATOM 0 H LEU A 51 -14.101 3.849 -7.328 1.00 32.20 H new ATOM 0 HA LEU A 51 -12.457 1.584 -7.752 1.00 20.42 H new ATOM 0 HB2 LEU A 51 -14.626 1.634 -6.482 1.00 60.12 H new ATOM 0 HB3 LEU A 51 -15.490 1.886 -7.986 1.00 60.12 H new ATOM 0 HG LEU A 51 -14.720 -0.348 -8.800 1.00 13.42 H new ATOM 0 HD11 LEU A 51 -13.700 -1.975 -7.224 1.00 64.25 H new ATOM 0 HD12 LEU A 51 -12.634 -0.586 -7.540 1.00 64.25 H new ATOM 0 HD13 LEU A 51 -13.540 -0.683 -6.011 1.00 64.25 H new ATOM 0 HD21 LEU A 51 -16.174 -1.736 -7.334 1.00 3.44 H new ATOM 0 HD22 LEU A 51 -16.194 -0.424 -6.131 1.00 3.44 H new ATOM 0 HD23 LEU A 51 -16.923 -0.172 -7.736 1.00 3.44 H new ATOM 776 N GLU A 52 -13.941 2.802 -10.431 1.00 12.24 N ATOM 777 CA GLU A 52 -13.966 2.821 -11.905 1.00 0.23 C ATOM 778 C GLU A 52 -12.537 2.926 -12.457 1.00 44.11 C ATOM 779 O GLU A 52 -12.124 2.118 -13.292 1.00 72.12 O ATOM 780 CB GLU A 52 -14.856 4.010 -12.375 1.00 13.22 C ATOM 781 CG GLU A 52 -14.905 4.277 -13.907 1.00 23.04 C ATOM 782 CD GLU A 52 -13.894 5.342 -14.403 1.00 32.21 C ATOM 783 OE1 GLU A 52 -14.171 6.548 -14.232 1.00 22.25 O ATOM 784 OE2 GLU A 52 -12.837 4.977 -14.970 1.00 63.22 O ATOM 0 H GLU A 52 -14.450 3.579 -10.009 1.00 12.24 H new ATOM 0 HA GLU A 52 -14.392 1.894 -12.288 1.00 0.23 H new ATOM 0 HB2 GLU A 52 -15.874 3.833 -12.027 1.00 13.22 H new ATOM 0 HB3 GLU A 52 -14.503 4.916 -11.882 1.00 13.22 H new ATOM 0 HG2 GLU A 52 -14.716 3.341 -14.433 1.00 23.04 H new ATOM 0 HG3 GLU A 52 -15.912 4.596 -14.176 1.00 23.04 H new ATOM 791 N LYS A 53 -11.800 3.929 -11.946 1.00 62.23 N ATOM 792 CA LYS A 53 -10.395 4.192 -12.314 1.00 10.02 C ATOM 793 C LYS A 53 -9.471 3.011 -11.942 1.00 63.13 C ATOM 794 O LYS A 53 -8.587 2.641 -12.722 1.00 71.02 O ATOM 795 CB LYS A 53 -9.903 5.509 -11.630 1.00 2.22 C ATOM 796 CG LYS A 53 -10.188 6.807 -12.424 1.00 13.21 C ATOM 797 CD LYS A 53 -9.615 8.068 -11.719 1.00 0.33 C ATOM 798 CE LYS A 53 -10.372 8.424 -10.428 1.00 51.32 C ATOM 799 NZ LYS A 53 -11.794 8.759 -10.704 1.00 41.23 N ATOM 0 H LYS A 53 -12.166 4.587 -11.258 1.00 62.23 H new ATOM 0 HA LYS A 53 -10.349 4.309 -13.397 1.00 10.02 H new ATOM 0 HB2 LYS A 53 -10.375 5.590 -10.651 1.00 2.22 H new ATOM 0 HB3 LYS A 53 -8.829 5.433 -11.461 1.00 2.22 H new ATOM 0 HG2 LYS A 53 -9.755 6.723 -13.421 1.00 13.21 H new ATOM 0 HG3 LYS A 53 -11.264 6.923 -12.552 1.00 13.21 H new ATOM 0 HD2 LYS A 53 -8.564 7.901 -11.484 1.00 0.33 H new ATOM 0 HD3 LYS A 53 -9.658 8.914 -12.405 1.00 0.33 H new ATOM 0 HE2 LYS A 53 -10.323 7.585 -9.733 1.00 51.32 H new ATOM 0 HE3 LYS A 53 -9.886 9.270 -9.941 1.00 51.32 H new ATOM 0 HZ1 LYS A 53 -12.147 9.405 -9.969 1.00 41.23 H new ATOM 0 HZ2 LYS A 53 -11.868 9.219 -11.634 1.00 41.23 H new ATOM 0 HZ3 LYS A 53 -12.362 7.888 -10.702 1.00 41.23 H new ATOM 813 N VAL A 54 -9.694 2.440 -10.747 1.00 72.12 N ATOM 814 CA VAL A 54 -8.890 1.330 -10.208 1.00 12.11 C ATOM 815 C VAL A 54 -9.023 0.073 -11.099 1.00 23.43 C ATOM 816 O VAL A 54 -8.016 -0.546 -11.470 1.00 73.13 O ATOM 817 CB VAL A 54 -9.299 1.031 -8.706 1.00 61.41 C ATOM 818 CG1 VAL A 54 -8.737 -0.311 -8.199 1.00 3.23 C ATOM 819 CG2 VAL A 54 -8.847 2.185 -7.773 1.00 73.14 C ATOM 0 H VAL A 54 -10.443 2.738 -10.122 1.00 72.12 H new ATOM 0 HA VAL A 54 -7.840 1.622 -10.214 1.00 12.11 H new ATOM 0 HB VAL A 54 -10.386 0.958 -8.686 1.00 61.41 H new ATOM 0 HG11 VAL A 54 -9.046 -0.468 -7.166 1.00 3.23 H new ATOM 0 HG12 VAL A 54 -9.118 -1.123 -8.819 1.00 3.23 H new ATOM 0 HG13 VAL A 54 -7.649 -0.293 -8.253 1.00 3.23 H new ATOM 0 HG21 VAL A 54 -9.138 1.959 -6.747 1.00 73.14 H new ATOM 0 HG22 VAL A 54 -7.764 2.294 -7.827 1.00 73.14 H new ATOM 0 HG23 VAL A 54 -9.321 3.115 -8.088 1.00 73.14 H new ATOM 829 N LEU A 55 -10.273 -0.253 -11.482 1.00 21.14 N ATOM 830 CA LEU A 55 -10.574 -1.428 -12.325 1.00 40.25 C ATOM 831 C LEU A 55 -10.092 -1.214 -13.767 1.00 31.13 C ATOM 832 O LEU A 55 -9.612 -2.156 -14.405 1.00 42.32 O ATOM 833 CB LEU A 55 -12.093 -1.744 -12.302 1.00 74.41 C ATOM 834 CG LEU A 55 -12.665 -2.206 -10.925 1.00 53.44 C ATOM 835 CD1 LEU A 55 -14.197 -2.402 -10.992 1.00 52.41 C ATOM 836 CD2 LEU A 55 -11.943 -3.476 -10.417 1.00 41.33 C ATOM 0 H LEU A 55 -11.098 0.286 -11.218 1.00 21.14 H new ATOM 0 HA LEU A 55 -10.036 -2.281 -11.912 1.00 40.25 H new ATOM 0 HB2 LEU A 55 -12.636 -0.854 -12.621 1.00 74.41 H new ATOM 0 HB3 LEU A 55 -12.295 -2.522 -13.039 1.00 74.41 H new ATOM 0 HG LEU A 55 -12.474 -1.415 -10.200 1.00 53.44 H new ATOM 0 HD11 LEU A 55 -14.566 -2.724 -10.018 1.00 52.41 H new ATOM 0 HD12 LEU A 55 -14.673 -1.461 -11.267 1.00 52.41 H new ATOM 0 HD13 LEU A 55 -14.435 -3.160 -11.738 1.00 52.41 H new ATOM 0 HD21 LEU A 55 -12.363 -3.774 -9.456 1.00 41.33 H new ATOM 0 HD22 LEU A 55 -12.077 -4.283 -11.137 1.00 41.33 H new ATOM 0 HD23 LEU A 55 -10.880 -3.267 -10.299 1.00 41.33 H new ATOM 848 N ASP A 56 -10.203 0.040 -14.251 1.00 4.23 N ATOM 849 CA ASP A 56 -9.844 0.410 -15.636 1.00 24.15 C ATOM 850 C ASP A 56 -8.316 0.365 -15.832 1.00 53.01 C ATOM 851 O ASP A 56 -7.820 -0.027 -16.892 1.00 61.44 O ATOM 852 CB ASP A 56 -10.416 1.812 -15.994 1.00 21.24 C ATOM 853 CG ASP A 56 -10.274 2.183 -17.480 1.00 45.22 C ATOM 854 OD1 ASP A 56 -10.688 1.377 -18.339 1.00 71.34 O ATOM 855 OD2 ASP A 56 -9.790 3.292 -17.802 1.00 53.13 O ATOM 0 H ASP A 56 -10.543 0.824 -13.694 1.00 4.23 H new ATOM 0 HA ASP A 56 -10.290 -0.317 -16.315 1.00 24.15 H new ATOM 0 HB2 ASP A 56 -11.471 1.844 -15.721 1.00 21.24 H new ATOM 0 HB3 ASP A 56 -9.908 2.565 -15.392 1.00 21.24 H new ATOM 860 N TYR A 57 -7.577 0.749 -14.780 1.00 10.43 N ATOM 861 CA TYR A 57 -6.109 0.662 -14.757 1.00 25.32 C ATOM 862 C TYR A 57 -5.673 -0.821 -14.786 1.00 65.14 C ATOM 863 O TYR A 57 -4.760 -1.200 -15.540 1.00 24.32 O ATOM 864 CB TYR A 57 -5.554 1.399 -13.506 1.00 12.32 C ATOM 865 CG TYR A 57 -4.031 1.298 -13.349 1.00 14.23 C ATOM 866 CD1 TYR A 57 -3.452 0.260 -12.614 1.00 73.44 C ATOM 867 CD2 TYR A 57 -3.172 2.210 -13.967 1.00 40.44 C ATOM 868 CE1 TYR A 57 -2.094 0.128 -12.515 1.00 74.12 C ATOM 869 CE2 TYR A 57 -1.800 2.083 -13.852 1.00 12.53 C ATOM 870 CZ TYR A 57 -1.270 1.036 -13.130 1.00 62.23 C ATOM 871 OH TYR A 57 0.095 0.866 -13.055 1.00 33.35 O ATOM 0 H TYR A 57 -7.979 1.128 -13.923 1.00 10.43 H new ATOM 0 HA TYR A 57 -5.697 1.150 -15.640 1.00 25.32 H new ATOM 0 HB2 TYR A 57 -5.835 2.451 -13.562 1.00 12.32 H new ATOM 0 HB3 TYR A 57 -6.029 0.989 -12.615 1.00 12.32 H new ATOM 0 HD1 TYR A 57 -4.090 -0.453 -12.113 1.00 73.44 H new ATOM 0 HD2 TYR A 57 -3.585 3.025 -14.542 1.00 40.44 H new ATOM 0 HE1 TYR A 57 -1.671 -0.691 -11.953 1.00 74.12 H new ATOM 0 HE2 TYR A 57 -1.147 2.801 -14.326 1.00 12.53 H new ATOM 0 HH TYR A 57 0.531 1.408 -13.746 1.00 33.35 H new ATOM 881 N CYS A 58 -6.351 -1.642 -13.956 1.00 25.10 N ATOM 882 CA CYS A 58 -6.114 -3.097 -13.866 1.00 12.25 C ATOM 883 C CYS A 58 -6.419 -3.811 -15.204 1.00 50.44 C ATOM 884 O CYS A 58 -5.804 -4.842 -15.518 1.00 74.53 O ATOM 885 CB CYS A 58 -6.936 -3.705 -12.706 1.00 33.15 C ATOM 886 SG CYS A 58 -6.440 -3.112 -11.071 1.00 2.12 S ATOM 0 H CYS A 58 -7.082 -1.311 -13.326 1.00 25.10 H new ATOM 0 HA CYS A 58 -5.056 -3.252 -13.657 1.00 12.25 H new ATOM 0 HB2 CYS A 58 -7.990 -3.476 -12.861 1.00 33.15 H new ATOM 0 HB3 CYS A 58 -6.838 -4.790 -12.734 1.00 33.15 H new ATOM 0 HG CYS A 58 -6.978 -1.949 -10.850 1.00 2.12 H new ATOM 892 N ARG A 59 -7.391 -3.253 -15.977 1.00 74.52 N ATOM 893 CA ARG A 59 -7.697 -3.715 -17.351 1.00 11.25 C ATOM 894 C ARG A 59 -6.442 -3.641 -18.237 1.00 61.14 C ATOM 895 O ARG A 59 -6.049 -4.642 -18.828 1.00 62.21 O ATOM 896 CB ARG A 59 -8.834 -2.874 -18.004 1.00 24.11 C ATOM 897 CG ARG A 59 -10.241 -3.090 -17.422 1.00 23.24 C ATOM 898 CD ARG A 59 -11.285 -2.158 -18.066 1.00 44.31 C ATOM 899 NE ARG A 59 -12.650 -2.472 -17.629 1.00 14.54 N ATOM 900 CZ ARG A 59 -13.494 -3.282 -18.281 1.00 71.41 C ATOM 901 NH1 ARG A 59 -13.131 -3.880 -19.417 1.00 74.32 N ATOM 902 NH2 ARG A 59 -14.694 -3.508 -17.782 1.00 54.42 N ATOM 0 H ARG A 59 -7.976 -2.478 -15.665 1.00 74.52 H new ATOM 0 HA ARG A 59 -8.033 -4.749 -17.273 1.00 11.25 H new ATOM 0 HB2 ARG A 59 -8.580 -1.818 -17.910 1.00 24.11 H new ATOM 0 HB3 ARG A 59 -8.863 -3.101 -19.070 1.00 24.11 H new ATOM 0 HG2 ARG A 59 -10.540 -4.127 -17.573 1.00 23.24 H new ATOM 0 HG3 ARG A 59 -10.218 -2.919 -16.346 1.00 23.24 H new ATOM 0 HD2 ARG A 59 -11.053 -1.124 -17.812 1.00 44.31 H new ATOM 0 HD3 ARG A 59 -11.224 -2.241 -19.151 1.00 44.31 H new ATOM 0 HE ARG A 59 -12.980 -2.042 -16.765 1.00 14.54 H new ATOM 0 HH11 ARG A 59 -12.199 -3.723 -19.801 1.00 74.32 H new ATOM 0 HH12 ARG A 59 -13.785 -4.494 -19.902 1.00 74.32 H new ATOM 0 HH21 ARG A 59 -14.973 -3.067 -16.906 1.00 54.42 H new ATOM 0 HH22 ARG A 59 -15.343 -4.124 -18.273 1.00 54.42 H new ATOM 916 N HIS A 60 -5.810 -2.442 -18.285 1.00 34.31 N ATOM 917 CA HIS A 60 -4.618 -2.192 -19.126 1.00 23.41 C ATOM 918 C HIS A 60 -3.459 -3.141 -18.756 1.00 14.53 C ATOM 919 O HIS A 60 -2.784 -3.678 -19.644 1.00 22.32 O ATOM 920 CB HIS A 60 -4.137 -0.718 -19.013 1.00 1.00 C ATOM 921 CG HIS A 60 -2.886 -0.452 -19.820 1.00 52.33 C ATOM 922 ND1 HIS A 60 -1.640 -0.310 -19.251 1.00 61.04 N ATOM 923 CD2 HIS A 60 -2.685 -0.403 -21.158 1.00 41.34 C ATOM 924 CE1 HIS A 60 -0.734 -0.197 -20.199 1.00 32.44 C ATOM 925 NE2 HIS A 60 -1.340 -0.242 -21.364 1.00 52.13 N ATOM 0 H HIS A 60 -6.111 -1.630 -17.746 1.00 34.31 H new ATOM 0 HA HIS A 60 -4.917 -2.384 -20.157 1.00 23.41 H new ATOM 0 HB2 HIS A 60 -4.932 -0.053 -19.352 1.00 1.00 H new ATOM 0 HB3 HIS A 60 -3.947 -0.481 -17.966 1.00 1.00 H new ATOM 0 HD1 HIS A 60 -1.449 -0.295 -18.249 1.00 61.04 H new ATOM 0 HD2 HIS A 60 -3.445 -0.477 -21.922 1.00 41.34 H new ATOM 0 HE1 HIS A 60 0.329 -0.086 -20.045 1.00 32.44 H new ATOM 934 N HIS A 61 -3.254 -3.330 -17.442 1.00 12.51 N ATOM 935 CA HIS A 61 -2.176 -4.180 -16.901 1.00 4.04 C ATOM 936 C HIS A 61 -2.362 -5.657 -17.322 1.00 21.12 C ATOM 937 O HIS A 61 -1.383 -6.398 -17.470 1.00 23.44 O ATOM 938 CB HIS A 61 -2.154 -4.066 -15.354 1.00 70.23 C ATOM 939 CG HIS A 61 -0.975 -4.735 -14.696 1.00 52.53 C ATOM 940 ND1 HIS A 61 -0.953 -6.071 -14.360 1.00 34.52 N ATOM 941 CD2 HIS A 61 0.232 -4.244 -14.337 1.00 51.34 C ATOM 942 CE1 HIS A 61 0.212 -6.368 -13.826 1.00 73.04 C ATOM 943 NE2 HIS A 61 0.954 -5.280 -13.800 1.00 20.42 N ATOM 0 H HIS A 61 -3.832 -2.897 -16.722 1.00 12.51 H new ATOM 0 HA HIS A 61 -1.226 -3.833 -17.308 1.00 4.04 H new ATOM 0 HB2 HIS A 61 -2.157 -3.011 -15.080 1.00 70.23 H new ATOM 0 HB3 HIS A 61 -3.071 -4.501 -14.957 1.00 70.23 H new ATOM 0 HD2 HIS A 61 0.567 -3.224 -14.452 1.00 51.34 H new ATOM 0 HE1 HIS A 61 0.511 -7.342 -13.468 1.00 73.04 H new ATOM 0 HE2 HIS A 61 1.907 -5.218 -13.441 1.00 20.42 H new ATOM 952 N HIS A 62 -3.633 -6.069 -17.468 1.00 74.24 N ATOM 953 CA HIS A 62 -4.007 -7.441 -17.852 1.00 63.24 C ATOM 954 C HIS A 62 -3.944 -7.655 -19.381 1.00 51.43 C ATOM 955 O HIS A 62 -3.397 -8.662 -19.852 1.00 4.32 O ATOM 956 CB HIS A 62 -5.418 -7.768 -17.302 1.00 54.11 C ATOM 957 CG HIS A 62 -5.948 -9.110 -17.731 1.00 3.43 C ATOM 958 ND1 HIS A 62 -5.236 -10.285 -17.589 1.00 42.55 N ATOM 959 CD2 HIS A 62 -7.103 -9.453 -18.338 1.00 21.23 C ATOM 960 CE1 HIS A 62 -5.929 -11.281 -18.098 1.00 31.10 C ATOM 961 NE2 HIS A 62 -7.062 -10.804 -18.554 1.00 2.34 N ATOM 0 H HIS A 62 -4.435 -5.456 -17.322 1.00 74.24 H new ATOM 0 HA HIS A 62 -3.282 -8.126 -17.412 1.00 63.24 H new ATOM 0 HB2 HIS A 62 -5.389 -7.732 -16.213 1.00 54.11 H new ATOM 0 HB3 HIS A 62 -6.112 -6.994 -17.629 1.00 54.11 H new ATOM 0 HD2 HIS A 62 -7.910 -8.786 -18.604 1.00 21.23 H new ATOM 0 HE1 HIS A 62 -5.618 -12.315 -18.134 1.00 31.10 H new ATOM 0 HE2 HIS A 62 -7.797 -11.353 -19.000 1.00 2.34 H new ATOM 970 N GLN A 63 -4.514 -6.695 -20.132 1.00 63.52 N ATOM 971 CA GLN A 63 -4.647 -6.769 -21.607 1.00 55.24 C ATOM 972 C GLN A 63 -3.280 -6.608 -22.289 1.00 44.12 C ATOM 973 O GLN A 63 -3.058 -7.107 -23.400 1.00 14.52 O ATOM 974 CB GLN A 63 -5.635 -5.676 -22.098 1.00 65.22 C ATOM 975 CG GLN A 63 -7.080 -5.841 -21.584 1.00 74.21 C ATOM 976 CD GLN A 63 -8.017 -4.701 -22.014 1.00 14.31 C ATOM 977 OE1 GLN A 63 -8.165 -3.701 -21.313 1.00 63.53 O ATOM 978 NE2 GLN A 63 -8.643 -4.840 -23.174 1.00 23.11 N ATOM 0 H GLN A 63 -4.899 -5.838 -19.734 1.00 63.52 H new ATOM 0 HA GLN A 63 -5.039 -7.750 -21.875 1.00 55.24 H new ATOM 0 HB2 GLN A 63 -5.261 -4.700 -21.787 1.00 65.22 H new ATOM 0 HB3 GLN A 63 -5.648 -5.679 -23.188 1.00 65.22 H new ATOM 0 HG2 GLN A 63 -7.481 -6.787 -21.948 1.00 74.21 H new ATOM 0 HG3 GLN A 63 -7.066 -5.898 -20.496 1.00 74.21 H new ATOM 0 HE21 GLN A 63 -8.500 -5.681 -23.733 1.00 23.11 H new ATOM 0 HE22 GLN A 63 -9.268 -4.106 -23.508 1.00 23.11 H new ATOM 987 N HIS A 64 -2.385 -5.878 -21.608 1.00 40.21 N ATOM 988 CA HIS A 64 -0.971 -5.757 -21.979 1.00 21.32 C ATOM 989 C HIS A 64 -0.138 -6.281 -20.791 1.00 70.22 C ATOM 990 O HIS A 64 0.188 -5.497 -19.884 1.00 23.32 O ATOM 991 CB HIS A 64 -0.611 -4.288 -22.332 1.00 24.51 C ATOM 992 CG HIS A 64 -1.348 -3.747 -23.533 1.00 71.11 C ATOM 993 ND1 HIS A 64 -0.776 -3.632 -24.783 1.00 70.40 N ATOM 994 CD2 HIS A 64 -2.625 -3.302 -23.672 1.00 14.14 C ATOM 995 CE1 HIS A 64 -1.662 -3.146 -25.628 1.00 53.54 C ATOM 996 NE2 HIS A 64 -2.789 -2.938 -24.980 1.00 20.35 N ATOM 0 H HIS A 64 -2.629 -5.348 -20.771 1.00 40.21 H new ATOM 0 HA HIS A 64 -0.755 -6.344 -22.872 1.00 21.32 H new ATOM 0 HB2 HIS A 64 -0.826 -3.655 -21.471 1.00 24.51 H new ATOM 0 HB3 HIS A 64 0.461 -4.222 -22.516 1.00 24.51 H new ATOM 0 HD2 HIS A 64 -3.372 -3.246 -22.894 1.00 14.14 H new ATOM 0 HE1 HIS A 64 -1.492 -2.951 -26.677 1.00 53.54 H new ATOM 0 HE2 HIS A 64 -3.646 -2.565 -25.388 1.00 20.35 H new ATOM 1005 N PRO A 65 0.118 -7.637 -20.724 1.00 55.32 N ATOM 1006 CA PRO A 65 0.891 -8.266 -19.626 1.00 51.54 C ATOM 1007 C PRO A 65 2.276 -7.614 -19.400 1.00 61.13 C ATOM 1008 O PRO A 65 3.238 -7.878 -20.134 1.00 42.14 O ATOM 1009 CB PRO A 65 1.010 -9.751 -20.063 1.00 24.03 C ATOM 1010 CG PRO A 65 -0.188 -9.972 -20.935 1.00 52.32 C ATOM 1011 CD PRO A 65 -0.367 -8.673 -21.690 1.00 61.23 C ATOM 0 HA PRO A 65 0.396 -8.144 -18.663 1.00 51.54 H new ATOM 0 HB2 PRO A 65 1.937 -9.934 -20.606 1.00 24.03 H new ATOM 0 HB3 PRO A 65 1.006 -10.421 -19.203 1.00 24.03 H new ATOM 0 HG2 PRO A 65 -0.031 -10.807 -21.618 1.00 52.32 H new ATOM 0 HG3 PRO A 65 -1.071 -10.208 -20.341 1.00 52.32 H new ATOM 0 HD2 PRO A 65 0.212 -8.663 -22.614 1.00 61.23 H new ATOM 0 HD3 PRO A 65 -1.409 -8.509 -21.965 1.00 61.23 H new ATOM 1019 N GLY A 66 2.333 -6.743 -18.389 1.00 3.32 N ATOM 1020 CA GLY A 66 3.542 -6.014 -18.028 1.00 65.11 C ATOM 1021 C GLY A 66 3.231 -4.997 -16.942 1.00 71.41 C ATOM 1022 O GLY A 66 3.185 -5.348 -15.756 1.00 13.15 O ATOM 0 H GLY A 66 1.532 -6.525 -17.796 1.00 3.32 H new ATOM 0 HA2 GLY A 66 4.305 -6.709 -17.679 1.00 65.11 H new ATOM 0 HA3 GLY A 66 3.948 -5.509 -18.905 1.00 65.11 H new ATOM 1026 N GLY A 67 2.971 -3.739 -17.353 1.00 62.11 N ATOM 1027 CA GLY A 67 2.592 -2.661 -16.432 1.00 22.02 C ATOM 1028 C GLY A 67 3.476 -1.435 -16.571 1.00 12.21 C ATOM 1029 O GLY A 67 3.841 -1.052 -17.692 1.00 23.44 O ATOM 0 H GLY A 67 3.019 -3.448 -18.329 1.00 62.11 H new ATOM 0 HA2 GLY A 67 1.555 -2.379 -16.616 1.00 22.02 H new ATOM 0 HA3 GLY A 67 2.646 -3.028 -15.407 1.00 22.02 H new ATOM 1033 N SER A 68 3.801 -0.803 -15.431 1.00 14.43 N ATOM 1034 CA SER A 68 4.630 0.407 -15.390 1.00 12.44 C ATOM 1035 C SER A 68 6.103 0.047 -15.624 1.00 34.43 C ATOM 1036 O SER A 68 6.755 -0.527 -14.740 1.00 51.33 O ATOM 1037 CB SER A 68 4.433 1.125 -14.037 1.00 23.54 C ATOM 1038 OG SER A 68 3.074 1.468 -13.838 1.00 12.32 O ATOM 0 H SER A 68 3.494 -1.120 -14.511 1.00 14.43 H new ATOM 0 HA SER A 68 4.324 1.087 -16.185 1.00 12.44 H new ATOM 0 HB2 SER A 68 4.771 0.480 -13.226 1.00 23.54 H new ATOM 0 HB3 SER A 68 5.047 2.025 -14.006 1.00 23.54 H new ATOM 0 HG SER A 68 2.741 1.028 -13.028 1.00 12.32 H new ATOM 1044 N GLY A 69 6.591 0.334 -16.844 1.00 11.12 N ATOM 1045 CA GLY A 69 8.002 0.174 -17.176 1.00 21.53 C ATOM 1046 C GLY A 69 8.897 1.113 -16.366 1.00 33.30 C ATOM 1047 O GLY A 69 8.470 2.224 -15.999 1.00 74.13 O ATOM 0 H GLY A 69 6.018 0.679 -17.614 1.00 11.12 H new ATOM 0 HA2 GLY A 69 8.302 -0.858 -16.993 1.00 21.53 H new ATOM 0 HA3 GLY A 69 8.147 0.364 -18.239 1.00 21.53 H new ATOM 1051 N LEU A 70 10.138 0.664 -16.114 1.00 43.41 N ATOM 1052 CA LEU A 70 11.116 1.374 -15.268 1.00 20.24 C ATOM 1053 C LEU A 70 11.509 2.709 -15.939 1.00 12.12 C ATOM 1054 O LEU A 70 12.268 2.710 -16.915 1.00 35.05 O ATOM 1055 CB LEU A 70 12.378 0.483 -15.001 1.00 10.41 C ATOM 1056 CG LEU A 70 12.187 -0.791 -14.088 1.00 32.30 C ATOM 1057 CD1 LEU A 70 11.269 -1.860 -14.724 1.00 61.10 C ATOM 1058 CD2 LEU A 70 13.554 -1.403 -13.714 1.00 10.03 C ATOM 0 H LEU A 70 10.496 -0.212 -16.496 1.00 43.41 H new ATOM 0 HA LEU A 70 10.659 1.588 -14.302 1.00 20.24 H new ATOM 0 HB2 LEU A 70 12.767 0.152 -15.964 1.00 10.41 H new ATOM 0 HB3 LEU A 70 13.144 1.111 -14.547 1.00 10.41 H new ATOM 0 HG LEU A 70 11.687 -0.450 -13.182 1.00 32.30 H new ATOM 0 HD11 LEU A 70 11.178 -2.710 -14.048 1.00 61.10 H new ATOM 0 HD12 LEU A 70 10.283 -1.432 -14.904 1.00 61.10 H new ATOM 0 HD13 LEU A 70 11.698 -2.193 -15.669 1.00 61.10 H new ATOM 0 HD21 LEU A 70 13.400 -2.280 -13.085 1.00 10.03 H new ATOM 0 HD22 LEU A 70 14.082 -1.696 -14.621 1.00 10.03 H new ATOM 0 HD23 LEU A 70 14.146 -0.666 -13.171 1.00 10.03 H new ATOM 1070 N ASP A 71 10.877 3.811 -15.453 1.00 62.12 N ATOM 1071 CA ASP A 71 11.031 5.206 -15.977 1.00 24.52 C ATOM 1072 C ASP A 71 10.286 5.395 -17.334 1.00 62.32 C ATOM 1073 O ASP A 71 10.195 6.511 -17.857 1.00 35.43 O ATOM 1074 CB ASP A 71 12.538 5.634 -16.088 1.00 61.14 C ATOM 1075 CG ASP A 71 12.745 7.144 -16.365 1.00 21.34 C ATOM 1076 OD1 ASP A 71 13.015 7.528 -17.528 1.00 24.13 O ATOM 1077 OD2 ASP A 71 12.634 7.956 -15.416 1.00 12.23 O ATOM 0 H ASP A 71 10.229 3.758 -14.667 1.00 62.12 H new ATOM 0 HA ASP A 71 10.564 5.869 -15.248 1.00 24.52 H new ATOM 0 HB2 ASP A 71 13.049 5.372 -15.162 1.00 61.14 H new ATOM 0 HB3 ASP A 71 13.010 5.061 -16.886 1.00 61.14 H new ATOM 1082 N ASP A 72 9.729 4.295 -17.876 1.00 54.32 N ATOM 1083 CA ASP A 72 9.000 4.293 -19.156 1.00 63.23 C ATOM 1084 C ASP A 72 7.610 4.933 -18.960 1.00 41.11 C ATOM 1085 O ASP A 72 7.335 6.002 -19.519 1.00 42.13 O ATOM 1086 CB ASP A 72 8.878 2.833 -19.677 1.00 3.25 C ATOM 1087 CG ASP A 72 8.041 2.713 -20.968 1.00 33.01 C ATOM 1088 OD1 ASP A 72 6.816 2.441 -20.888 1.00 31.35 O ATOM 1089 OD2 ASP A 72 8.604 2.895 -22.070 1.00 72.44 O ATOM 0 H ASP A 72 9.773 3.377 -17.434 1.00 54.32 H new ATOM 0 HA ASP A 72 9.543 4.879 -19.897 1.00 63.23 H new ATOM 0 HB2 ASP A 72 9.876 2.436 -19.861 1.00 3.25 H new ATOM 0 HB3 ASP A 72 8.427 2.214 -18.901 1.00 3.25 H new ATOM 1094 N ILE A 73 6.777 4.259 -18.124 1.00 74.53 N ATOM 1095 CA ILE A 73 5.400 4.678 -17.765 1.00 1.13 C ATOM 1096 C ILE A 73 4.497 4.851 -19.029 1.00 24.12 C ATOM 1097 O ILE A 73 4.603 5.867 -19.728 1.00 42.33 O ATOM 1098 CB ILE A 73 5.383 5.990 -16.874 1.00 73.11 C ATOM 1099 CG1 ILE A 73 6.331 5.845 -15.631 1.00 32.42 C ATOM 1100 CG2 ILE A 73 3.939 6.349 -16.434 1.00 40.42 C ATOM 1101 CD1 ILE A 73 5.971 4.725 -14.656 1.00 20.51 C ATOM 0 H ILE A 73 7.053 3.388 -17.671 1.00 74.53 H new ATOM 0 HA ILE A 73 4.982 3.871 -17.163 1.00 1.13 H new ATOM 0 HB ILE A 73 5.760 6.810 -17.486 1.00 73.11 H new ATOM 0 HG12 ILE A 73 7.347 5.679 -15.989 1.00 32.42 H new ATOM 0 HG13 ILE A 73 6.335 6.789 -15.087 1.00 32.42 H new ATOM 0 HG21 ILE A 73 3.958 7.253 -15.825 1.00 40.42 H new ATOM 0 HG22 ILE A 73 3.322 6.519 -17.316 1.00 40.42 H new ATOM 0 HG23 ILE A 73 3.521 5.528 -15.852 1.00 40.42 H new ATOM 0 HD11 ILE A 73 6.688 4.713 -13.835 1.00 20.51 H new ATOM 0 HD12 ILE A 73 4.970 4.895 -14.260 1.00 20.51 H new ATOM 0 HD13 ILE A 73 5.998 3.767 -15.176 1.00 20.51 H new ATOM 1113 N PRO A 74 3.606 3.854 -19.351 1.00 55.24 N ATOM 1114 CA PRO A 74 2.703 3.926 -20.540 1.00 23.53 C ATOM 1115 C PRO A 74 1.733 5.151 -20.511 1.00 64.24 C ATOM 1116 O PRO A 74 1.327 5.575 -19.424 1.00 51.35 O ATOM 1117 CB PRO A 74 1.937 2.574 -20.489 1.00 12.10 C ATOM 1118 CG PRO A 74 2.784 1.672 -19.643 1.00 73.11 C ATOM 1119 CD PRO A 74 3.417 2.574 -18.610 1.00 4.31 C ATOM 0 HA PRO A 74 3.260 4.072 -21.466 1.00 23.53 H new ATOM 0 HB2 PRO A 74 0.944 2.700 -20.057 1.00 12.10 H new ATOM 0 HB3 PRO A 74 1.800 2.162 -21.489 1.00 12.10 H new ATOM 0 HG2 PRO A 74 2.182 0.895 -19.171 1.00 73.11 H new ATOM 0 HG3 PRO A 74 3.542 1.168 -20.242 1.00 73.11 H new ATOM 0 HD2 PRO A 74 2.774 2.703 -17.739 1.00 4.31 H new ATOM 0 HD3 PRO A 74 4.364 2.173 -18.250 1.00 4.31 H new ATOM 1127 N PRO A 75 1.356 5.720 -21.719 1.00 21.30 N ATOM 1128 CA PRO A 75 0.579 6.994 -21.854 1.00 60.22 C ATOM 1129 C PRO A 75 -0.686 7.101 -20.968 1.00 54.43 C ATOM 1130 O PRO A 75 -0.795 8.042 -20.178 1.00 35.41 O ATOM 1131 CB PRO A 75 0.215 7.028 -23.361 1.00 64.00 C ATOM 1132 CG PRO A 75 1.336 6.292 -24.023 1.00 10.45 C ATOM 1133 CD PRO A 75 1.690 5.165 -23.070 1.00 61.42 C ATOM 0 HA PRO A 75 1.173 7.840 -21.509 1.00 60.22 H new ATOM 0 HB2 PRO A 75 -0.745 6.547 -23.550 1.00 64.00 H new ATOM 0 HB3 PRO A 75 0.137 8.051 -23.729 1.00 64.00 H new ATOM 0 HG2 PRO A 75 1.033 5.905 -24.996 1.00 10.45 H new ATOM 0 HG3 PRO A 75 2.191 6.947 -24.193 1.00 10.45 H new ATOM 0 HD2 PRO A 75 1.116 4.264 -23.285 1.00 61.42 H new ATOM 0 HD3 PRO A 75 2.744 4.896 -23.143 1.00 61.42 H new ATOM 1141 N TYR A 76 -1.628 6.134 -21.110 1.00 14.41 N ATOM 1142 CA TYR A 76 -2.878 6.087 -20.301 1.00 41.50 C ATOM 1143 C TYR A 76 -2.568 6.157 -18.789 1.00 74.22 C ATOM 1144 O TYR A 76 -3.197 6.905 -18.040 1.00 44.34 O ATOM 1145 CB TYR A 76 -3.702 4.785 -20.625 1.00 64.51 C ATOM 1146 CG TYR A 76 -4.682 4.355 -19.509 1.00 1.54 C ATOM 1147 CD1 TYR A 76 -5.813 5.113 -19.207 1.00 31.53 C ATOM 1148 CD2 TYR A 76 -4.423 3.232 -18.705 1.00 33.20 C ATOM 1149 CE1 TYR A 76 -6.639 4.780 -18.149 1.00 33.55 C ATOM 1150 CE2 TYR A 76 -5.257 2.890 -17.663 1.00 74.23 C ATOM 1151 CZ TYR A 76 -6.355 3.672 -17.383 1.00 53.44 C ATOM 1152 OH TYR A 76 -7.159 3.359 -16.313 1.00 12.12 O ATOM 0 H TYR A 76 -1.546 5.371 -21.781 1.00 14.41 H new ATOM 0 HA TYR A 76 -3.477 6.958 -20.568 1.00 41.50 H new ATOM 0 HB2 TYR A 76 -4.265 4.946 -21.544 1.00 64.51 H new ATOM 0 HB3 TYR A 76 -3.007 3.968 -20.816 1.00 64.51 H new ATOM 0 HD1 TYR A 76 -6.048 5.977 -19.811 1.00 31.53 H new ATOM 0 HD2 TYR A 76 -3.553 2.625 -18.908 1.00 33.20 H new ATOM 0 HE1 TYR A 76 -7.504 5.387 -17.925 1.00 33.55 H new ATOM 0 HE2 TYR A 76 -5.050 2.012 -17.068 1.00 74.23 H new ATOM 0 HH TYR A 76 -8.097 3.355 -16.598 1.00 12.12 H new ATOM 1162 N ASP A 77 -1.584 5.362 -18.389 1.00 3.41 N ATOM 1163 CA ASP A 77 -1.219 5.125 -16.987 1.00 44.14 C ATOM 1164 C ASP A 77 -0.539 6.374 -16.386 1.00 61.35 C ATOM 1165 O ASP A 77 -0.597 6.604 -15.177 1.00 10.42 O ATOM 1166 CB ASP A 77 -0.311 3.869 -16.920 1.00 11.04 C ATOM 1167 CG ASP A 77 -0.933 2.647 -17.646 1.00 51.13 C ATOM 1168 OD1 ASP A 77 -1.349 1.662 -16.987 1.00 30.50 O ATOM 1169 OD2 ASP A 77 -1.009 2.671 -18.893 1.00 73.10 O ATOM 0 H ASP A 77 -0.997 4.847 -19.045 1.00 3.41 H new ATOM 0 HA ASP A 77 -2.110 4.941 -16.388 1.00 44.14 H new ATOM 0 HB2 ASP A 77 0.656 4.099 -17.367 1.00 11.04 H new ATOM 0 HB3 ASP A 77 -0.127 3.613 -15.877 1.00 11.04 H new ATOM 1174 N ARG A 78 0.100 7.169 -17.267 1.00 62.15 N ATOM 1175 CA ARG A 78 0.686 8.478 -16.917 1.00 22.20 C ATOM 1176 C ARG A 78 -0.429 9.532 -16.727 1.00 71.52 C ATOM 1177 O ARG A 78 -0.337 10.400 -15.851 1.00 34.24 O ATOM 1178 CB ARG A 78 1.674 8.914 -18.030 1.00 74.21 C ATOM 1179 CG ARG A 78 2.423 10.239 -17.772 1.00 34.44 C ATOM 1180 CD ARG A 78 3.361 10.611 -18.929 1.00 72.30 C ATOM 1181 NE ARG A 78 4.087 11.865 -18.684 1.00 44.21 N ATOM 1182 CZ ARG A 78 5.061 12.357 -19.465 1.00 24.45 C ATOM 1183 NH1 ARG A 78 5.449 11.713 -20.569 1.00 61.20 N ATOM 1184 NH2 ARG A 78 5.652 13.494 -19.127 1.00 14.55 N ATOM 0 H ARG A 78 0.225 6.919 -18.248 1.00 62.15 H new ATOM 0 HA ARG A 78 1.230 8.392 -15.976 1.00 22.20 H new ATOM 0 HB2 ARG A 78 2.410 8.122 -18.169 1.00 74.21 H new ATOM 0 HB3 ARG A 78 1.123 9.005 -18.966 1.00 74.21 H new ATOM 0 HG2 ARG A 78 1.699 11.040 -17.622 1.00 34.44 H new ATOM 0 HG3 ARG A 78 3.000 10.154 -16.851 1.00 34.44 H new ATOM 0 HD2 ARG A 78 4.078 9.805 -19.085 1.00 72.30 H new ATOM 0 HD3 ARG A 78 2.781 10.704 -19.847 1.00 72.30 H new ATOM 0 HE ARG A 78 3.831 12.403 -17.856 1.00 44.21 H new ATOM 0 HH11 ARG A 78 5.003 10.833 -20.830 1.00 61.20 H new ATOM 0 HH12 ARG A 78 6.191 12.101 -21.152 1.00 61.20 H new ATOM 0 HH21 ARG A 78 5.365 13.986 -18.281 1.00 14.55 H new ATOM 0 HH22 ARG A 78 6.394 13.877 -19.713 1.00 14.55 H new ATOM 1198 N ASP A 79 -1.485 9.441 -17.561 1.00 63.33 N ATOM 1199 CA ASP A 79 -2.685 10.300 -17.435 1.00 72.00 C ATOM 1200 C ASP A 79 -3.503 9.922 -16.187 1.00 34.41 C ATOM 1201 O ASP A 79 -4.182 10.773 -15.606 1.00 1.41 O ATOM 1202 CB ASP A 79 -3.568 10.239 -18.714 1.00 53.00 C ATOM 1203 CG ASP A 79 -2.955 10.999 -19.907 1.00 13.41 C ATOM 1204 OD1 ASP A 79 -2.351 10.369 -20.800 1.00 55.25 O ATOM 1205 OD2 ASP A 79 -3.065 12.247 -19.940 1.00 43.11 O ATOM 0 H ASP A 79 -1.533 8.778 -18.334 1.00 63.33 H new ATOM 0 HA ASP A 79 -2.342 11.328 -17.320 1.00 72.00 H new ATOM 0 HB2 ASP A 79 -3.720 9.197 -18.994 1.00 53.00 H new ATOM 0 HB3 ASP A 79 -4.550 10.656 -18.491 1.00 53.00 H new ATOM 1210 N PHE A 80 -3.412 8.639 -15.788 1.00 12.23 N ATOM 1211 CA PHE A 80 -4.042 8.113 -14.560 1.00 4.22 C ATOM 1212 C PHE A 80 -3.439 8.791 -13.310 1.00 42.51 C ATOM 1213 O PHE A 80 -4.147 9.050 -12.328 1.00 4.31 O ATOM 1214 CB PHE A 80 -3.853 6.565 -14.502 1.00 33.41 C ATOM 1215 CG PHE A 80 -4.476 5.893 -13.276 1.00 74.14 C ATOM 1216 CD1 PHE A 80 -5.820 5.539 -13.271 1.00 35.23 C ATOM 1217 CD2 PHE A 80 -3.720 5.635 -12.124 1.00 54.12 C ATOM 1218 CE1 PHE A 80 -6.388 4.955 -12.163 1.00 31.21 C ATOM 1219 CE2 PHE A 80 -4.297 5.046 -11.016 1.00 31.43 C ATOM 1220 CZ PHE A 80 -5.633 4.711 -11.037 1.00 61.45 C ATOM 0 H PHE A 80 -2.896 7.933 -16.312 1.00 12.23 H new ATOM 0 HA PHE A 80 -5.109 8.337 -14.577 1.00 4.22 H new ATOM 0 HB2 PHE A 80 -4.286 6.125 -15.400 1.00 33.41 H new ATOM 0 HB3 PHE A 80 -2.786 6.341 -14.520 1.00 33.41 H new ATOM 0 HD1 PHE A 80 -6.425 5.724 -14.146 1.00 35.23 H new ATOM 0 HD2 PHE A 80 -2.673 5.900 -12.103 1.00 54.12 H new ATOM 0 HE1 PHE A 80 -7.434 4.686 -12.176 1.00 31.21 H new ATOM 0 HE2 PHE A 80 -3.703 4.849 -10.136 1.00 31.43 H new ATOM 0 HZ PHE A 80 -6.089 4.257 -10.170 1.00 61.45 H new ATOM 1230 N CYS A 81 -2.121 9.069 -13.375 1.00 75.34 N ATOM 1231 CA CYS A 81 -1.376 9.725 -12.285 1.00 44.15 C ATOM 1232 C CYS A 81 -1.855 11.178 -12.059 1.00 52.52 C ATOM 1233 O CYS A 81 -1.815 11.691 -10.934 1.00 62.31 O ATOM 1234 CB CYS A 81 0.128 9.719 -12.637 1.00 64.04 C ATOM 1235 SG CYS A 81 0.795 8.080 -12.997 1.00 53.44 S ATOM 0 H CYS A 81 -1.544 8.844 -14.186 1.00 75.34 H new ATOM 0 HA CYS A 81 -1.554 9.173 -11.362 1.00 44.15 H new ATOM 0 HB2 CYS A 81 0.290 10.363 -13.501 1.00 64.04 H new ATOM 0 HB3 CYS A 81 0.686 10.152 -11.807 1.00 64.04 H new ATOM 0 HG CYS A 81 0.024 7.476 -13.851 1.00 53.44 H new ATOM 1241 N LYS A 82 -2.354 11.815 -13.135 1.00 20.31 N ATOM 1242 CA LYS A 82 -2.806 13.213 -13.103 1.00 14.52 C ATOM 1243 C LYS A 82 -4.301 13.266 -12.761 1.00 63.42 C ATOM 1244 O LYS A 82 -5.159 13.219 -13.651 1.00 3.13 O ATOM 1245 CB LYS A 82 -2.529 13.900 -14.463 1.00 45.43 C ATOM 1246 CG LYS A 82 -1.036 13.980 -14.843 1.00 1.52 C ATOM 1247 CD LYS A 82 -0.821 14.600 -16.245 1.00 55.45 C ATOM 1248 CE LYS A 82 -1.504 13.780 -17.355 1.00 71.25 C ATOM 1249 NZ LYS A 82 -1.355 14.393 -18.700 1.00 23.52 N ATOM 0 H LYS A 82 -2.454 11.373 -14.049 1.00 20.31 H new ATOM 0 HA LYS A 82 -2.252 13.751 -12.334 1.00 14.52 H new ATOM 0 HB2 LYS A 82 -3.062 13.359 -15.245 1.00 45.43 H new ATOM 0 HB3 LYS A 82 -2.940 14.909 -14.437 1.00 45.43 H new ATOM 0 HG2 LYS A 82 -0.505 14.575 -14.100 1.00 1.52 H new ATOM 0 HG3 LYS A 82 -0.603 12.980 -14.820 1.00 1.52 H new ATOM 0 HD2 LYS A 82 -1.212 15.617 -16.254 1.00 55.45 H new ATOM 0 HD3 LYS A 82 0.247 14.667 -16.451 1.00 55.45 H new ATOM 0 HE2 LYS A 82 -1.081 12.775 -17.370 1.00 71.25 H new ATOM 0 HE3 LYS A 82 -2.564 13.677 -17.124 1.00 71.25 H new ATOM 0 HZ1 LYS A 82 -1.876 13.827 -19.399 1.00 23.52 H new ATOM 0 HZ2 LYS A 82 -1.736 15.361 -18.685 1.00 23.52 H new ATOM 0 HZ3 LYS A 82 -0.348 14.422 -18.959 1.00 23.52 H new ATOM 1263 N VAL A 83 -4.595 13.283 -11.459 1.00 32.23 N ATOM 1264 CA VAL A 83 -5.954 13.470 -10.917 1.00 63.44 C ATOM 1265 C VAL A 83 -5.946 14.640 -9.918 1.00 54.41 C ATOM 1266 O VAL A 83 -4.906 15.280 -9.707 1.00 4.42 O ATOM 1267 CB VAL A 83 -6.495 12.149 -10.229 1.00 52.14 C ATOM 1268 CG1 VAL A 83 -6.777 11.035 -11.272 1.00 11.21 C ATOM 1269 CG2 VAL A 83 -5.518 11.653 -9.132 1.00 11.25 C ATOM 0 H VAL A 83 -3.887 13.166 -10.734 1.00 32.23 H new ATOM 0 HA VAL A 83 -6.628 13.700 -11.742 1.00 63.44 H new ATOM 0 HB VAL A 83 -7.443 12.394 -9.750 1.00 52.14 H new ATOM 0 HG11 VAL A 83 -7.146 10.145 -10.763 1.00 11.21 H new ATOM 0 HG12 VAL A 83 -7.526 11.383 -11.983 1.00 11.21 H new ATOM 0 HG13 VAL A 83 -5.857 10.793 -11.804 1.00 11.21 H new ATOM 0 HG21 VAL A 83 -5.913 10.745 -8.676 1.00 11.25 H new ATOM 0 HG22 VAL A 83 -4.547 11.441 -9.579 1.00 11.25 H new ATOM 0 HG23 VAL A 83 -5.406 12.423 -8.369 1.00 11.25 H new ATOM 1279 N ASP A 84 -7.115 14.919 -9.329 1.00 41.14 N ATOM 1280 CA ASP A 84 -7.278 15.957 -8.298 1.00 15.24 C ATOM 1281 C ASP A 84 -6.543 15.524 -7.006 1.00 73.21 C ATOM 1282 O ASP A 84 -6.393 14.322 -6.768 1.00 1.21 O ATOM 1283 CB ASP A 84 -8.795 16.190 -8.065 1.00 10.30 C ATOM 1284 CG ASP A 84 -9.128 17.276 -7.037 1.00 31.35 C ATOM 1285 OD1 ASP A 84 -8.546 18.381 -7.117 1.00 20.14 O ATOM 1286 OD2 ASP A 84 -9.999 17.042 -6.164 1.00 34.11 O ATOM 0 H ASP A 84 -7.981 14.429 -9.554 1.00 41.14 H new ATOM 0 HA ASP A 84 -6.835 16.900 -8.619 1.00 15.24 H new ATOM 0 HB2 ASP A 84 -9.258 16.455 -9.016 1.00 10.30 H new ATOM 0 HB3 ASP A 84 -9.247 15.252 -7.741 1.00 10.30 H new ATOM 1291 N GLN A 85 -6.085 16.502 -6.194 1.00 42.35 N ATOM 1292 CA GLN A 85 -5.217 16.252 -5.011 1.00 34.34 C ATOM 1293 C GLN A 85 -5.887 15.300 -3.959 1.00 72.44 C ATOM 1294 O GLN A 85 -5.267 14.289 -3.597 1.00 14.21 O ATOM 1295 CB GLN A 85 -4.719 17.608 -4.380 1.00 31.55 C ATOM 1296 CG GLN A 85 -3.966 17.502 -3.025 1.00 22.30 C ATOM 1297 CD GLN A 85 -2.609 16.771 -3.066 1.00 71.53 C ATOM 1298 OE1 GLN A 85 -2.366 15.886 -3.882 1.00 35.52 O ATOM 1299 NE2 GLN A 85 -1.725 17.121 -2.146 1.00 51.32 N ATOM 0 H GLN A 85 -6.304 17.488 -6.336 1.00 42.35 H new ATOM 0 HA GLN A 85 -4.335 15.716 -5.362 1.00 34.34 H new ATOM 0 HB2 GLN A 85 -4.063 18.099 -5.099 1.00 31.55 H new ATOM 0 HB3 GLN A 85 -5.583 18.258 -4.241 1.00 31.55 H new ATOM 0 HG2 GLN A 85 -3.803 18.509 -2.642 1.00 22.30 H new ATOM 0 HG3 GLN A 85 -4.612 16.990 -2.311 1.00 22.30 H new ATOM 0 HE21 GLN A 85 -1.949 17.859 -1.478 1.00 51.32 H new ATOM 0 HE22 GLN A 85 -0.820 16.653 -2.104 1.00 51.32 H new ATOM 1308 N PRO A 86 -7.151 15.576 -3.451 1.00 22.22 N ATOM 1309 CA PRO A 86 -7.896 14.601 -2.600 1.00 23.50 C ATOM 1310 C PRO A 86 -8.106 13.242 -3.296 1.00 35.10 C ATOM 1311 O PRO A 86 -7.903 12.192 -2.687 1.00 15.43 O ATOM 1312 CB PRO A 86 -9.250 15.297 -2.340 1.00 34.41 C ATOM 1313 CG PRO A 86 -8.951 16.755 -2.483 1.00 35.32 C ATOM 1314 CD PRO A 86 -7.923 16.845 -3.586 1.00 45.40 C ATOM 0 HA PRO A 86 -7.347 14.364 -1.689 1.00 23.50 H new ATOM 0 HB2 PRO A 86 -10.007 14.974 -3.055 1.00 34.41 H new ATOM 0 HB3 PRO A 86 -9.632 15.065 -1.346 1.00 34.41 H new ATOM 0 HG2 PRO A 86 -9.850 17.318 -2.736 1.00 35.32 H new ATOM 0 HG3 PRO A 86 -8.566 17.171 -1.552 1.00 35.32 H new ATOM 0 HD2 PRO A 86 -8.393 16.926 -4.566 1.00 45.40 H new ATOM 0 HD3 PRO A 86 -7.282 17.719 -3.466 1.00 45.40 H new ATOM 1322 N THR A 87 -8.484 13.302 -4.595 1.00 25.43 N ATOM 1323 CA THR A 87 -8.759 12.123 -5.445 1.00 44.24 C ATOM 1324 C THR A 87 -7.541 11.174 -5.532 1.00 60.24 C ATOM 1325 O THR A 87 -7.698 9.948 -5.605 1.00 25.22 O ATOM 1326 CB THR A 87 -9.175 12.597 -6.876 1.00 71.54 C ATOM 1327 OG1 THR A 87 -10.295 13.489 -6.769 1.00 61.43 O ATOM 1328 CG2 THR A 87 -9.528 11.437 -7.826 1.00 30.32 C ATOM 0 H THR A 87 -8.608 14.186 -5.088 1.00 25.43 H new ATOM 0 HA THR A 87 -9.574 11.562 -4.988 1.00 44.24 H new ATOM 0 HB THR A 87 -8.312 13.102 -7.309 1.00 71.54 H new ATOM 0 HG1 THR A 87 -10.669 13.652 -7.660 1.00 61.43 H new ATOM 0 HG21 THR A 87 -9.807 11.837 -8.801 1.00 30.32 H new ATOM 0 HG22 THR A 87 -8.664 10.782 -7.937 1.00 30.32 H new ATOM 0 HG23 THR A 87 -10.363 10.870 -7.414 1.00 30.32 H new ATOM 1336 N LEU A 88 -6.335 11.766 -5.498 1.00 14.44 N ATOM 1337 CA LEU A 88 -5.058 11.034 -5.538 1.00 72.24 C ATOM 1338 C LEU A 88 -4.920 10.186 -4.263 1.00 63.21 C ATOM 1339 O LEU A 88 -4.585 9.002 -4.330 1.00 71.12 O ATOM 1340 CB LEU A 88 -3.885 12.051 -5.720 1.00 45.32 C ATOM 1341 CG LEU A 88 -2.479 11.472 -6.138 1.00 5.14 C ATOM 1342 CD1 LEU A 88 -1.623 12.543 -6.850 1.00 10.12 C ATOM 1343 CD2 LEU A 88 -1.705 10.882 -4.935 1.00 21.50 C ATOM 0 H LEU A 88 -6.218 12.778 -5.441 1.00 14.44 H new ATOM 0 HA LEU A 88 -5.027 10.350 -6.386 1.00 72.24 H new ATOM 0 HB2 LEU A 88 -4.186 12.780 -6.472 1.00 45.32 H new ATOM 0 HB3 LEU A 88 -3.761 12.593 -4.782 1.00 45.32 H new ATOM 0 HG LEU A 88 -2.674 10.658 -6.836 1.00 5.14 H new ATOM 0 HD11 LEU A 88 -0.660 12.114 -7.126 1.00 10.12 H new ATOM 0 HD12 LEU A 88 -2.139 12.884 -7.748 1.00 10.12 H new ATOM 0 HD13 LEU A 88 -1.465 13.388 -6.179 1.00 10.12 H new ATOM 0 HD21 LEU A 88 -0.744 10.496 -5.275 1.00 21.50 H new ATOM 0 HD22 LEU A 88 -1.541 11.661 -4.191 1.00 21.50 H new ATOM 0 HD23 LEU A 88 -2.284 10.072 -4.491 1.00 21.50 H new ATOM 1355 N PHE A 89 -5.230 10.802 -3.111 1.00 24.52 N ATOM 1356 CA PHE A 89 -5.205 10.121 -1.804 1.00 63.35 C ATOM 1357 C PHE A 89 -6.306 9.047 -1.708 1.00 50.50 C ATOM 1358 O PHE A 89 -6.111 8.034 -1.049 1.00 3.54 O ATOM 1359 CB PHE A 89 -5.313 11.153 -0.652 1.00 70.01 C ATOM 1360 CG PHE A 89 -4.130 12.127 -0.600 1.00 72.30 C ATOM 1361 CD1 PHE A 89 -4.317 13.510 -0.594 1.00 75.11 C ATOM 1362 CD2 PHE A 89 -2.820 11.645 -0.571 1.00 51.14 C ATOM 1363 CE1 PHE A 89 -3.237 14.375 -0.560 1.00 14.04 C ATOM 1364 CE2 PHE A 89 -1.746 12.509 -0.539 1.00 12.10 C ATOM 1365 CZ PHE A 89 -1.952 13.874 -0.534 1.00 22.24 C ATOM 0 H PHE A 89 -5.504 11.783 -3.058 1.00 24.52 H new ATOM 0 HA PHE A 89 -4.249 9.607 -1.707 1.00 63.35 H new ATOM 0 HB2 PHE A 89 -6.237 11.720 -0.766 1.00 70.01 H new ATOM 0 HB3 PHE A 89 -5.380 10.622 0.298 1.00 70.01 H new ATOM 0 HD1 PHE A 89 -5.319 13.911 -0.616 1.00 75.11 H new ATOM 0 HD2 PHE A 89 -2.645 10.579 -0.574 1.00 51.14 H new ATOM 0 HE1 PHE A 89 -3.400 15.443 -0.554 1.00 14.04 H new ATOM 0 HE2 PHE A 89 -0.740 12.117 -0.518 1.00 12.10 H new ATOM 0 HZ PHE A 89 -1.109 14.548 -0.510 1.00 22.24 H new ATOM 1375 N GLU A 90 -7.443 9.274 -2.396 1.00 40.30 N ATOM 1376 CA GLU A 90 -8.552 8.292 -2.469 1.00 72.25 C ATOM 1377 C GLU A 90 -8.123 7.025 -3.241 1.00 40.43 C ATOM 1378 O GLU A 90 -8.539 5.914 -2.901 1.00 64.33 O ATOM 1379 CB GLU A 90 -9.805 8.915 -3.137 1.00 3.31 C ATOM 1380 CG GLU A 90 -10.368 10.164 -2.431 1.00 54.53 C ATOM 1381 CD GLU A 90 -10.736 9.928 -0.955 1.00 62.14 C ATOM 1382 OE1 GLU A 90 -11.824 9.362 -0.690 1.00 15.11 O ATOM 1383 OE2 GLU A 90 -9.961 10.332 -0.058 1.00 41.25 O ATOM 0 H GLU A 90 -7.621 10.135 -2.914 1.00 40.30 H new ATOM 0 HA GLU A 90 -8.804 8.010 -1.447 1.00 72.25 H new ATOM 0 HB2 GLU A 90 -9.557 9.179 -4.165 1.00 3.31 H new ATOM 0 HB3 GLU A 90 -10.588 8.158 -3.182 1.00 3.31 H new ATOM 0 HG2 GLU A 90 -9.632 10.966 -2.489 1.00 54.53 H new ATOM 0 HG3 GLU A 90 -11.254 10.505 -2.967 1.00 54.53 H new ATOM 1390 N LEU A 91 -7.298 7.225 -4.294 1.00 51.14 N ATOM 1391 CA LEU A 91 -6.707 6.125 -5.089 1.00 61.30 C ATOM 1392 C LEU A 91 -5.678 5.328 -4.247 1.00 33.35 C ATOM 1393 O LEU A 91 -5.567 4.112 -4.400 1.00 44.24 O ATOM 1394 CB LEU A 91 -6.035 6.671 -6.384 1.00 43.51 C ATOM 1395 CG LEU A 91 -6.966 7.302 -7.476 1.00 33.22 C ATOM 1396 CD1 LEU A 91 -6.131 7.940 -8.615 1.00 52.11 C ATOM 1397 CD2 LEU A 91 -7.952 6.256 -8.039 1.00 41.53 C ATOM 0 H LEU A 91 -7.024 8.153 -4.616 1.00 51.14 H new ATOM 0 HA LEU A 91 -7.515 5.452 -5.378 1.00 61.30 H new ATOM 0 HB2 LEU A 91 -5.304 7.424 -6.091 1.00 43.51 H new ATOM 0 HB3 LEU A 91 -5.482 5.853 -6.846 1.00 43.51 H new ATOM 0 HG LEU A 91 -7.549 8.091 -7.000 1.00 33.22 H new ATOM 0 HD11 LEU A 91 -6.800 8.371 -9.360 1.00 52.11 H new ATOM 0 HD12 LEU A 91 -5.494 8.723 -8.204 1.00 52.11 H new ATOM 0 HD13 LEU A 91 -5.511 7.176 -9.083 1.00 52.11 H new ATOM 0 HD21 LEU A 91 -8.585 6.722 -8.794 1.00 41.53 H new ATOM 0 HD22 LEU A 91 -7.394 5.435 -8.490 1.00 41.53 H new ATOM 0 HD23 LEU A 91 -8.574 5.871 -7.231 1.00 41.53 H new ATOM 1409 N ILE A 92 -4.927 6.040 -3.363 1.00 2.44 N ATOM 1410 CA ILE A 92 -3.970 5.414 -2.413 1.00 13.20 C ATOM 1411 C ILE A 92 -4.736 4.544 -1.387 1.00 33.22 C ATOM 1412 O ILE A 92 -4.363 3.390 -1.126 1.00 11.22 O ATOM 1413 CB ILE A 92 -3.089 6.493 -1.651 1.00 63.25 C ATOM 1414 CG1 ILE A 92 -2.245 7.346 -2.654 1.00 25.24 C ATOM 1415 CG2 ILE A 92 -2.166 5.827 -0.592 1.00 54.15 C ATOM 1416 CD1 ILE A 92 -1.379 8.423 -2.015 1.00 22.52 C ATOM 0 H ILE A 92 -4.968 7.057 -3.290 1.00 2.44 H new ATOM 0 HA ILE A 92 -3.294 4.790 -2.997 1.00 13.20 H new ATOM 0 HB ILE A 92 -3.775 7.160 -1.129 1.00 63.25 H new ATOM 0 HG12 ILE A 92 -1.602 6.676 -3.225 1.00 25.24 H new ATOM 0 HG13 ILE A 92 -2.923 7.820 -3.364 1.00 25.24 H new ATOM 0 HG21 ILE A 92 -1.577 6.594 -0.089 1.00 54.15 H new ATOM 0 HG22 ILE A 92 -2.776 5.299 0.141 1.00 54.15 H new ATOM 0 HG23 ILE A 92 -1.498 5.121 -1.085 1.00 54.15 H new ATOM 0 HD11 ILE A 92 -0.833 8.959 -2.791 1.00 22.52 H new ATOM 0 HD12 ILE A 92 -2.012 9.122 -1.468 1.00 22.52 H new ATOM 0 HD13 ILE A 92 -0.671 7.960 -1.328 1.00 22.52 H new ATOM 1428 N LEU A 93 -5.833 5.117 -0.839 1.00 42.42 N ATOM 1429 CA LEU A 93 -6.695 4.454 0.166 1.00 11.22 C ATOM 1430 C LEU A 93 -7.365 3.198 -0.423 1.00 61.54 C ATOM 1431 O LEU A 93 -7.489 2.182 0.259 1.00 2.51 O ATOM 1432 CB LEU A 93 -7.774 5.448 0.697 1.00 32.43 C ATOM 1433 CG LEU A 93 -7.260 6.665 1.537 1.00 51.41 C ATOM 1434 CD1 LEU A 93 -8.429 7.606 1.921 1.00 31.23 C ATOM 1435 CD2 LEU A 93 -6.470 6.204 2.785 1.00 3.43 C ATOM 0 H LEU A 93 -6.146 6.057 -1.083 1.00 42.42 H new ATOM 0 HA LEU A 93 -6.065 4.142 0.999 1.00 11.22 H new ATOM 0 HB2 LEU A 93 -8.329 5.835 -0.157 1.00 32.43 H new ATOM 0 HB3 LEU A 93 -8.481 4.887 1.309 1.00 32.43 H new ATOM 0 HG LEU A 93 -6.569 7.230 0.912 1.00 51.41 H new ATOM 0 HD11 LEU A 93 -8.046 8.443 2.504 1.00 31.23 H new ATOM 0 HD12 LEU A 93 -8.906 7.982 1.016 1.00 31.23 H new ATOM 0 HD13 LEU A 93 -9.160 7.056 2.514 1.00 31.23 H new ATOM 0 HD21 LEU A 93 -6.129 7.076 3.343 1.00 3.43 H new ATOM 0 HD22 LEU A 93 -7.115 5.596 3.420 1.00 3.43 H new ATOM 0 HD23 LEU A 93 -5.608 5.614 2.473 1.00 3.43 H new ATOM 1447 N ALA A 94 -7.778 3.292 -1.701 1.00 12.44 N ATOM 1448 CA ALA A 94 -8.409 2.182 -2.441 1.00 33.45 C ATOM 1449 C ALA A 94 -7.383 1.090 -2.784 1.00 31.50 C ATOM 1450 O ALA A 94 -7.696 -0.093 -2.737 1.00 70.41 O ATOM 1451 CB ALA A 94 -9.078 2.712 -3.718 1.00 42.20 C ATOM 0 H ALA A 94 -7.683 4.145 -2.252 1.00 12.44 H new ATOM 0 HA ALA A 94 -9.171 1.735 -1.802 1.00 33.45 H new ATOM 0 HB1 ALA A 94 -9.541 1.885 -4.257 1.00 42.20 H new ATOM 0 HB2 ALA A 94 -9.841 3.444 -3.452 1.00 42.20 H new ATOM 0 HB3 ALA A 94 -8.328 3.184 -4.353 1.00 42.20 H new ATOM 1457 N ALA A 95 -6.154 1.514 -3.119 1.00 1.41 N ATOM 1458 CA ALA A 95 -5.043 0.600 -3.463 1.00 2.43 C ATOM 1459 C ALA A 95 -4.557 -0.192 -2.237 1.00 34.44 C ATOM 1460 O ALA A 95 -4.017 -1.285 -2.383 1.00 52.45 O ATOM 1461 CB ALA A 95 -3.891 1.387 -4.085 1.00 51.31 C ATOM 0 H ALA A 95 -5.898 2.501 -3.160 1.00 1.41 H new ATOM 0 HA ALA A 95 -5.416 -0.122 -4.190 1.00 2.43 H new ATOM 0 HB1 ALA A 95 -3.078 0.705 -4.335 1.00 51.31 H new ATOM 0 HB2 ALA A 95 -4.238 1.885 -4.990 1.00 51.31 H new ATOM 0 HB3 ALA A 95 -3.534 2.133 -3.374 1.00 51.31 H new ATOM 1467 N ASN A 96 -4.704 0.412 -1.044 1.00 30.21 N ATOM 1468 CA ASN A 96 -4.439 -0.249 0.254 1.00 54.44 C ATOM 1469 C ASN A 96 -5.595 -1.211 0.613 1.00 32.21 C ATOM 1470 O ASN A 96 -5.374 -2.389 0.924 1.00 13.42 O ATOM 1471 CB ASN A 96 -4.253 0.840 1.357 1.00 23.11 C ATOM 1472 CG ASN A 96 -4.160 0.298 2.798 1.00 24.25 C ATOM 1473 OD1 ASN A 96 -4.608 1.089 3.754 1.00 60.15 O flip ATOM 1474 ND2 ASN A 96 -3.674 -0.803 3.048 1.00 44.31 N flip ATOM 0 H ASN A 96 -5.012 1.380 -0.949 1.00 30.21 H new ATOM 0 HA ASN A 96 -3.525 -0.839 0.184 1.00 54.44 H new ATOM 0 HB2 ASN A 96 -3.348 1.406 1.139 1.00 23.11 H new ATOM 0 HB3 ASN A 96 -5.087 1.539 1.301 1.00 23.11 H new ATOM 0 HD21 ASN A 96 -3.335 -1.395 2.290 1.00 44.31 H new ATOM 0 HD22 ASN A 96 -3.610 -1.125 4.014 1.00 44.31 H new ATOM 1481 N TYR A 97 -6.830 -0.679 0.524 1.00 1.43 N ATOM 1482 CA TYR A 97 -8.073 -1.387 0.902 1.00 52.10 C ATOM 1483 C TYR A 97 -8.299 -2.653 0.046 1.00 4.52 C ATOM 1484 O TYR A 97 -8.794 -3.666 0.544 1.00 2.53 O ATOM 1485 CB TYR A 97 -9.283 -0.408 0.785 1.00 10.54 C ATOM 1486 CG TYR A 97 -10.672 -1.028 1.035 1.00 13.42 C ATOM 1487 CD1 TYR A 97 -11.632 -1.096 0.019 1.00 33.22 C ATOM 1488 CD2 TYR A 97 -11.016 -1.552 2.284 1.00 41.21 C ATOM 1489 CE1 TYR A 97 -12.876 -1.662 0.235 1.00 15.14 C ATOM 1490 CE2 TYR A 97 -12.261 -2.118 2.506 1.00 63.33 C ATOM 1491 CZ TYR A 97 -13.185 -2.172 1.479 1.00 21.10 C ATOM 1492 OH TYR A 97 -14.423 -2.740 1.694 1.00 53.31 O ATOM 0 H TYR A 97 -6.996 0.268 0.183 1.00 1.43 H new ATOM 0 HA TYR A 97 -7.978 -1.721 1.935 1.00 52.10 H new ATOM 0 HB2 TYR A 97 -9.137 0.407 1.493 1.00 10.54 H new ATOM 0 HB3 TYR A 97 -9.276 0.031 -0.212 1.00 10.54 H new ATOM 0 HD1 TYR A 97 -11.396 -0.697 -0.957 1.00 33.22 H new ATOM 0 HD2 TYR A 97 -10.299 -1.515 3.091 1.00 41.21 H new ATOM 0 HE1 TYR A 97 -13.600 -1.704 -0.565 1.00 15.14 H new ATOM 0 HE2 TYR A 97 -12.509 -2.516 3.479 1.00 63.33 H new ATOM 0 HH TYR A 97 -14.483 -3.052 2.621 1.00 53.31 H new ATOM 1502 N LEU A 98 -7.930 -2.573 -1.241 1.00 33.01 N ATOM 1503 CA LEU A 98 -8.112 -3.671 -2.214 1.00 65.43 C ATOM 1504 C LEU A 98 -6.799 -4.460 -2.415 1.00 4.31 C ATOM 1505 O LEU A 98 -6.821 -5.566 -2.966 1.00 4.54 O ATOM 1506 CB LEU A 98 -8.626 -3.085 -3.561 1.00 70.14 C ATOM 1507 CG LEU A 98 -9.966 -2.269 -3.489 1.00 65.23 C ATOM 1508 CD1 LEU A 98 -10.389 -1.740 -4.880 1.00 1.10 C ATOM 1509 CD2 LEU A 98 -11.094 -3.087 -2.822 1.00 41.03 C ATOM 0 H LEU A 98 -7.494 -1.743 -1.642 1.00 33.01 H new ATOM 0 HA LEU A 98 -8.852 -4.371 -1.826 1.00 65.43 H new ATOM 0 HB2 LEU A 98 -7.851 -2.438 -3.972 1.00 70.14 H new ATOM 0 HB3 LEU A 98 -8.761 -3.907 -4.264 1.00 70.14 H new ATOM 0 HG LEU A 98 -9.781 -1.400 -2.858 1.00 65.23 H new ATOM 0 HD11 LEU A 98 -11.320 -1.181 -4.789 1.00 1.10 H new ATOM 0 HD12 LEU A 98 -9.610 -1.086 -5.273 1.00 1.10 H new ATOM 0 HD13 LEU A 98 -10.535 -2.580 -5.560 1.00 1.10 H new ATOM 0 HD21 LEU A 98 -12.006 -2.490 -2.790 1.00 41.03 H new ATOM 0 HD22 LEU A 98 -11.275 -3.995 -3.398 1.00 41.03 H new ATOM 0 HD23 LEU A 98 -10.799 -3.354 -1.807 1.00 41.03 H new ATOM 1521 N ASP A 99 -5.685 -3.882 -1.919 1.00 31.25 N ATOM 1522 CA ASP A 99 -4.299 -4.365 -2.130 1.00 45.02 C ATOM 1523 C ASP A 99 -4.020 -4.698 -3.609 1.00 33.24 C ATOM 1524 O ASP A 99 -4.171 -5.849 -4.056 1.00 42.22 O ATOM 1525 CB ASP A 99 -3.893 -5.542 -1.197 1.00 35.34 C ATOM 1526 CG ASP A 99 -2.385 -5.901 -1.328 1.00 52.11 C ATOM 1527 OD1 ASP A 99 -2.039 -7.023 -1.747 1.00 40.01 O ATOM 1528 OD2 ASP A 99 -1.531 -5.045 -1.012 1.00 65.24 O ATOM 0 H ASP A 99 -5.723 -3.041 -1.343 1.00 31.25 H new ATOM 0 HA ASP A 99 -3.661 -3.527 -1.848 1.00 45.02 H new ATOM 0 HB2 ASP A 99 -4.113 -5.277 -0.163 1.00 35.34 H new ATOM 0 HB3 ASP A 99 -4.496 -6.418 -1.437 1.00 35.34 H new ATOM 1533 N ILE A 100 -3.694 -3.650 -4.369 1.00 72.45 N ATOM 1534 CA ILE A 100 -3.285 -3.748 -5.774 1.00 71.21 C ATOM 1535 C ILE A 100 -1.933 -3.035 -5.910 1.00 32.05 C ATOM 1536 O ILE A 100 -1.884 -1.805 -5.883 1.00 4.43 O ATOM 1537 CB ILE A 100 -4.354 -3.104 -6.742 1.00 62.00 C ATOM 1538 CG1 ILE A 100 -5.768 -3.690 -6.454 1.00 41.23 C ATOM 1539 CG2 ILE A 100 -3.954 -3.304 -8.231 1.00 14.30 C ATOM 1540 CD1 ILE A 100 -6.882 -3.156 -7.325 1.00 13.51 C ATOM 0 H ILE A 100 -3.707 -2.692 -4.020 1.00 72.45 H new ATOM 0 HA ILE A 100 -3.202 -4.796 -6.060 1.00 71.21 H new ATOM 0 HB ILE A 100 -4.385 -2.031 -6.554 1.00 62.00 H new ATOM 0 HG12 ILE A 100 -5.725 -4.773 -6.572 1.00 41.23 H new ATOM 0 HG13 ILE A 100 -6.019 -3.493 -5.412 1.00 41.23 H new ATOM 0 HG21 ILE A 100 -4.708 -2.851 -8.874 1.00 14.30 H new ATOM 0 HG22 ILE A 100 -2.989 -2.832 -8.415 1.00 14.30 H new ATOM 0 HG23 ILE A 100 -3.884 -4.370 -8.449 1.00 14.30 H new ATOM 0 HD11 ILE A 100 -7.823 -3.628 -7.043 1.00 13.51 H new ATOM 0 HD12 ILE A 100 -6.963 -2.077 -7.191 1.00 13.51 H new ATOM 0 HD13 ILE A 100 -6.665 -3.377 -8.370 1.00 13.51 H new ATOM 1552 N LYS A 101 -0.849 -3.833 -6.007 1.00 15.10 N ATOM 1553 CA LYS A 101 0.543 -3.336 -6.082 1.00 74.12 C ATOM 1554 C LYS A 101 0.789 -2.356 -7.272 1.00 34.10 C ATOM 1555 O LYS A 101 1.421 -1.321 -7.051 1.00 31.22 O ATOM 1556 CB LYS A 101 1.547 -4.529 -6.130 1.00 42.33 C ATOM 1557 CG LYS A 101 1.627 -5.365 -4.836 1.00 30.24 C ATOM 1558 CD LYS A 101 2.107 -4.531 -3.621 1.00 10.52 C ATOM 1559 CE LYS A 101 2.324 -5.381 -2.364 1.00 35.34 C ATOM 1560 NZ LYS A 101 1.060 -5.982 -1.863 1.00 55.33 N ATOM 0 H LYS A 101 -0.915 -4.850 -6.036 1.00 15.10 H new ATOM 0 HA LYS A 101 0.713 -2.758 -5.174 1.00 74.12 H new ATOM 0 HB2 LYS A 101 1.268 -5.187 -6.953 1.00 42.33 H new ATOM 0 HB3 LYS A 101 2.540 -4.140 -6.356 1.00 42.33 H new ATOM 0 HG2 LYS A 101 0.646 -5.787 -4.618 1.00 30.24 H new ATOM 0 HG3 LYS A 101 2.307 -6.203 -4.990 1.00 30.24 H new ATOM 0 HD2 LYS A 101 3.038 -4.027 -3.878 1.00 10.52 H new ATOM 0 HD3 LYS A 101 1.373 -3.755 -3.406 1.00 10.52 H new ATOM 0 HE2 LYS A 101 3.039 -6.174 -2.584 1.00 35.34 H new ATOM 0 HE3 LYS A 101 2.765 -4.763 -1.582 1.00 35.34 H new ATOM 0 HZ1 LYS A 101 1.265 -6.588 -1.043 1.00 55.33 H new ATOM 0 HZ2 LYS A 101 0.405 -5.226 -1.580 1.00 55.33 H new ATOM 0 HZ3 LYS A 101 0.625 -6.553 -2.615 1.00 55.33 H new ATOM 1574 N PRO A 102 0.329 -2.653 -8.557 1.00 41.21 N ATOM 1575 CA PRO A 102 0.447 -1.681 -9.690 1.00 12.22 C ATOM 1576 C PRO A 102 -0.242 -0.312 -9.409 1.00 33.34 C ATOM 1577 O PRO A 102 0.292 0.739 -9.773 1.00 74.15 O ATOM 1578 CB PRO A 102 -0.222 -2.426 -10.880 1.00 34.32 C ATOM 1579 CG PRO A 102 -0.099 -3.877 -10.538 1.00 3.43 C ATOM 1580 CD PRO A 102 -0.263 -3.944 -9.039 1.00 51.22 C ATOM 0 HA PRO A 102 1.486 -1.409 -9.878 1.00 12.22 H new ATOM 0 HB2 PRO A 102 -1.266 -2.133 -10.994 1.00 34.32 H new ATOM 0 HB3 PRO A 102 0.278 -2.197 -11.821 1.00 34.32 H new ATOM 0 HG2 PRO A 102 -0.862 -4.467 -11.045 1.00 3.43 H new ATOM 0 HG3 PRO A 102 0.868 -4.274 -10.847 1.00 3.43 H new ATOM 0 HD2 PRO A 102 -1.311 -4.034 -8.755 1.00 51.22 H new ATOM 0 HD3 PRO A 102 0.257 -4.805 -8.618 1.00 51.22 H new ATOM 1588 N LEU A 103 -1.411 -0.349 -8.737 1.00 60.22 N ATOM 1589 CA LEU A 103 -2.202 0.868 -8.406 1.00 13.15 C ATOM 1590 C LEU A 103 -1.454 1.671 -7.319 1.00 71.15 C ATOM 1591 O LEU A 103 -1.258 2.889 -7.442 1.00 70.34 O ATOM 1592 CB LEU A 103 -3.639 0.460 -7.898 1.00 25.02 C ATOM 1593 CG LEU A 103 -4.840 1.438 -8.189 1.00 44.25 C ATOM 1594 CD1 LEU A 103 -4.648 2.862 -7.601 1.00 15.32 C ATOM 1595 CD2 LEU A 103 -5.145 1.487 -9.699 1.00 42.34 C ATOM 0 H LEU A 103 -1.837 -1.215 -8.407 1.00 60.22 H new ATOM 0 HA LEU A 103 -2.318 1.485 -9.297 1.00 13.15 H new ATOM 0 HB2 LEU A 103 -3.884 -0.507 -8.336 1.00 25.02 H new ATOM 0 HB3 LEU A 103 -3.582 0.316 -6.819 1.00 25.02 H new ATOM 0 HG LEU A 103 -5.703 1.026 -7.667 1.00 44.25 H new ATOM 0 HD11 LEU A 103 -5.516 3.476 -7.843 1.00 15.32 H new ATOM 0 HD12 LEU A 103 -4.540 2.797 -6.518 1.00 15.32 H new ATOM 0 HD13 LEU A 103 -3.753 3.314 -8.028 1.00 15.32 H new ATOM 0 HD21 LEU A 103 -5.977 2.167 -9.880 1.00 42.34 H new ATOM 0 HD22 LEU A 103 -4.265 1.839 -10.237 1.00 42.34 H new ATOM 0 HD23 LEU A 103 -5.409 0.489 -10.049 1.00 42.34 H new ATOM 1607 N LEU A 104 -1.010 0.936 -6.286 1.00 73.03 N ATOM 1608 CA LEU A 104 -0.407 1.496 -5.068 1.00 34.34 C ATOM 1609 C LEU A 104 0.914 2.193 -5.382 1.00 63.41 C ATOM 1610 O LEU A 104 1.128 3.344 -4.978 1.00 13.35 O ATOM 1611 CB LEU A 104 -0.182 0.354 -4.030 1.00 10.13 C ATOM 1612 CG LEU A 104 0.289 0.769 -2.602 1.00 43.20 C ATOM 1613 CD1 LEU A 104 -0.744 1.696 -1.913 1.00 43.11 C ATOM 1614 CD2 LEU A 104 0.586 -0.487 -1.742 1.00 20.35 C ATOM 0 H LEU A 104 -1.062 -0.083 -6.275 1.00 73.03 H new ATOM 0 HA LEU A 104 -1.086 2.239 -4.650 1.00 34.34 H new ATOM 0 HB2 LEU A 104 -1.116 -0.200 -3.930 1.00 10.13 H new ATOM 0 HB3 LEU A 104 0.555 -0.336 -4.441 1.00 10.13 H new ATOM 0 HG LEU A 104 1.214 1.337 -2.702 1.00 43.20 H new ATOM 0 HD11 LEU A 104 -0.385 1.966 -0.920 1.00 43.11 H new ATOM 0 HD12 LEU A 104 -0.877 2.599 -2.509 1.00 43.11 H new ATOM 0 HD13 LEU A 104 -1.698 1.176 -1.825 1.00 43.11 H new ATOM 0 HD21 LEU A 104 0.913 -0.179 -0.749 1.00 20.35 H new ATOM 0 HD22 LEU A 104 -0.318 -1.091 -1.655 1.00 20.35 H new ATOM 0 HD23 LEU A 104 1.371 -1.076 -2.217 1.00 20.35 H new ATOM 1626 N ASP A 105 1.767 1.489 -6.152 1.00 72.33 N ATOM 1627 CA ASP A 105 3.118 1.951 -6.478 1.00 53.31 C ATOM 1628 C ASP A 105 3.067 3.256 -7.267 1.00 31.14 C ATOM 1629 O ASP A 105 3.685 4.235 -6.871 1.00 20.02 O ATOM 1630 CB ASP A 105 3.921 0.868 -7.255 1.00 21.12 C ATOM 1631 CG ASP A 105 5.378 1.310 -7.538 1.00 70.42 C ATOM 1632 OD1 ASP A 105 5.719 1.609 -8.712 1.00 1.25 O ATOM 1633 OD2 ASP A 105 6.178 1.400 -6.569 1.00 44.14 O ATOM 0 H ASP A 105 1.533 0.585 -6.562 1.00 72.33 H new ATOM 0 HA ASP A 105 3.639 2.136 -5.538 1.00 53.31 H new ATOM 0 HB2 ASP A 105 3.929 -0.058 -6.680 1.00 21.12 H new ATOM 0 HB3 ASP A 105 3.419 0.653 -8.198 1.00 21.12 H new ATOM 1638 N VAL A 106 2.263 3.256 -8.335 1.00 43.34 N ATOM 1639 CA VAL A 106 2.124 4.397 -9.248 1.00 11.52 C ATOM 1640 C VAL A 106 1.592 5.657 -8.536 1.00 65.13 C ATOM 1641 O VAL A 106 2.233 6.708 -8.586 1.00 23.34 O ATOM 1642 CB VAL A 106 1.197 3.991 -10.457 1.00 32.32 C ATOM 1643 CG1 VAL A 106 0.700 5.200 -11.285 1.00 70.31 C ATOM 1644 CG2 VAL A 106 1.933 2.975 -11.352 1.00 51.41 C ATOM 0 H VAL A 106 1.684 2.457 -8.593 1.00 43.34 H new ATOM 0 HA VAL A 106 3.115 4.654 -9.623 1.00 11.52 H new ATOM 0 HB VAL A 106 0.301 3.534 -10.037 1.00 32.32 H new ATOM 0 HG11 VAL A 106 0.068 4.848 -12.100 1.00 70.31 H new ATOM 0 HG12 VAL A 106 0.126 5.869 -10.644 1.00 70.31 H new ATOM 0 HG13 VAL A 106 1.556 5.736 -11.695 1.00 70.31 H new ATOM 0 HG21 VAL A 106 1.292 2.695 -12.188 1.00 51.41 H new ATOM 0 HG22 VAL A 106 2.850 3.423 -11.733 1.00 51.41 H new ATOM 0 HG23 VAL A 106 2.178 2.087 -10.769 1.00 51.41 H new ATOM 1654 N THR A 107 0.463 5.520 -7.827 1.00 23.23 N ATOM 1655 CA THR A 107 -0.252 6.673 -7.236 1.00 54.21 C ATOM 1656 C THR A 107 0.547 7.317 -6.071 1.00 22.44 C ATOM 1657 O THR A 107 0.630 8.552 -5.965 1.00 60.54 O ATOM 1658 CB THR A 107 -1.677 6.248 -6.761 1.00 4.30 C ATOM 1659 OG1 THR A 107 -2.368 5.607 -7.849 1.00 63.11 O ATOM 1660 CG2 THR A 107 -2.509 7.445 -6.285 1.00 10.23 C ATOM 0 H THR A 107 0.019 4.620 -7.645 1.00 23.23 H new ATOM 0 HA THR A 107 -0.353 7.429 -8.014 1.00 54.21 H new ATOM 0 HB THR A 107 -1.554 5.566 -5.920 1.00 4.30 H new ATOM 0 HG1 THR A 107 -2.071 4.676 -7.922 1.00 63.11 H new ATOM 0 HG21 THR A 107 -3.492 7.100 -5.964 1.00 10.23 H new ATOM 0 HG22 THR A 107 -2.004 7.930 -5.449 1.00 10.23 H new ATOM 0 HG23 THR A 107 -2.623 8.157 -7.102 1.00 10.23 H new ATOM 1668 N CYS A 108 1.159 6.468 -5.223 1.00 73.34 N ATOM 1669 CA CYS A 108 2.001 6.923 -4.092 1.00 12.43 C ATOM 1670 C CYS A 108 3.322 7.543 -4.603 1.00 63.32 C ATOM 1671 O CYS A 108 3.882 8.446 -3.976 1.00 73.11 O ATOM 1672 CB CYS A 108 2.287 5.749 -3.135 1.00 60.21 C ATOM 1673 SG CYS A 108 0.792 5.013 -2.432 1.00 35.01 S ATOM 0 H CYS A 108 1.087 5.453 -5.299 1.00 73.34 H new ATOM 0 HA CYS A 108 1.457 7.694 -3.546 1.00 12.43 H new ATOM 0 HB2 CYS A 108 2.844 4.980 -3.671 1.00 60.21 H new ATOM 0 HB3 CYS A 108 2.926 6.098 -2.324 1.00 60.21 H new ATOM 0 HG CYS A 108 0.347 4.088 -3.230 1.00 35.01 H new ATOM 1679 N LYS A 109 3.801 7.043 -5.757 1.00 53.33 N ATOM 1680 CA LYS A 109 5.011 7.557 -6.425 1.00 23.10 C ATOM 1681 C LYS A 109 4.716 8.917 -7.077 1.00 64.33 C ATOM 1682 O LYS A 109 5.586 9.777 -7.117 1.00 23.33 O ATOM 1683 CB LYS A 109 5.504 6.518 -7.465 1.00 34.44 C ATOM 1684 CG LYS A 109 6.860 6.806 -8.160 1.00 52.51 C ATOM 1685 CD LYS A 109 7.432 5.536 -8.849 1.00 30.10 C ATOM 1686 CE LYS A 109 7.813 4.443 -7.828 1.00 53.32 C ATOM 1687 NZ LYS A 109 8.171 3.154 -8.483 1.00 74.24 N ATOM 0 H LYS A 109 3.359 6.269 -6.254 1.00 53.33 H new ATOM 0 HA LYS A 109 5.804 7.710 -5.692 1.00 23.10 H new ATOM 0 HB2 LYS A 109 5.577 5.550 -6.969 1.00 34.44 H new ATOM 0 HB3 LYS A 109 4.741 6.424 -8.237 1.00 34.44 H new ATOM 0 HG2 LYS A 109 6.729 7.595 -8.901 1.00 52.51 H new ATOM 0 HG3 LYS A 109 7.575 7.175 -7.425 1.00 52.51 H new ATOM 0 HD2 LYS A 109 6.694 5.139 -9.546 1.00 30.10 H new ATOM 0 HD3 LYS A 109 8.311 5.806 -9.435 1.00 30.10 H new ATOM 0 HE2 LYS A 109 8.655 4.788 -7.227 1.00 53.32 H new ATOM 0 HE3 LYS A 109 6.979 4.281 -7.145 1.00 53.32 H new ATOM 0 HZ1 LYS A 109 8.853 2.640 -7.889 1.00 74.24 H new ATOM 0 HZ2 LYS A 109 7.314 2.577 -8.605 1.00 74.24 H new ATOM 0 HZ3 LYS A 109 8.596 3.344 -9.413 1.00 74.24 H new ATOM 1701 N THR A 110 3.457 9.100 -7.541 1.00 0.32 N ATOM 1702 CA THR A 110 2.999 10.351 -8.174 1.00 32.14 C ATOM 1703 C THR A 110 3.062 11.530 -7.194 1.00 22.40 C ATOM 1704 O THR A 110 3.609 12.579 -7.531 1.00 22.24 O ATOM 1705 CB THR A 110 1.547 10.221 -8.745 1.00 42.31 C ATOM 1706 OG1 THR A 110 1.527 9.207 -9.759 1.00 64.21 O ATOM 1707 CG2 THR A 110 1.027 11.547 -9.346 1.00 24.14 C ATOM 0 H THR A 110 2.734 8.383 -7.485 1.00 0.32 H new ATOM 0 HA THR A 110 3.679 10.543 -9.004 1.00 32.14 H new ATOM 0 HB THR A 110 0.892 9.956 -7.915 1.00 42.31 H new ATOM 0 HG1 THR A 110 1.770 8.344 -9.363 1.00 64.21 H new ATOM 0 HG21 THR A 110 0.016 11.402 -9.728 1.00 24.14 H new ATOM 0 HG22 THR A 110 1.016 12.317 -8.574 1.00 24.14 H new ATOM 0 HG23 THR A 110 1.681 11.859 -10.160 1.00 24.14 H new ATOM 1715 N VAL A 111 2.513 11.345 -5.974 1.00 11.51 N ATOM 1716 CA VAL A 111 2.533 12.402 -4.940 1.00 13.45 C ATOM 1717 C VAL A 111 3.985 12.700 -4.500 1.00 22.34 C ATOM 1718 O VAL A 111 4.329 13.852 -4.217 1.00 54.31 O ATOM 1719 CB VAL A 111 1.601 12.074 -3.706 1.00 34.13 C ATOM 1720 CG1 VAL A 111 2.052 10.821 -2.930 1.00 23.34 C ATOM 1721 CG2 VAL A 111 1.448 13.301 -2.775 1.00 24.23 C ATOM 0 H VAL A 111 2.054 10.482 -5.683 1.00 11.51 H new ATOM 0 HA VAL A 111 2.118 13.303 -5.392 1.00 13.45 H new ATOM 0 HB VAL A 111 0.618 11.839 -4.113 1.00 34.13 H new ATOM 0 HG11 VAL A 111 1.374 10.647 -2.095 1.00 23.34 H new ATOM 0 HG12 VAL A 111 2.039 9.957 -3.595 1.00 23.34 H new ATOM 0 HG13 VAL A 111 3.063 10.972 -2.551 1.00 23.34 H new ATOM 0 HG21 VAL A 111 0.801 13.043 -1.936 1.00 24.23 H new ATOM 0 HG22 VAL A 111 2.428 13.598 -2.400 1.00 24.23 H new ATOM 0 HG23 VAL A 111 1.007 14.128 -3.332 1.00 24.23 H new ATOM 1731 N ALA A 112 4.833 11.650 -4.507 1.00 14.21 N ATOM 1732 CA ALA A 112 6.281 11.766 -4.247 1.00 71.11 C ATOM 1733 C ALA A 112 7.008 12.546 -5.374 1.00 71.42 C ATOM 1734 O ALA A 112 8.022 13.213 -5.128 1.00 74.03 O ATOM 1735 CB ALA A 112 6.881 10.367 -4.077 1.00 2.14 C ATOM 0 H ALA A 112 4.530 10.694 -4.694 1.00 14.21 H new ATOM 0 HA ALA A 112 6.421 12.334 -3.328 1.00 71.11 H new ATOM 0 HB1 ALA A 112 7.951 10.451 -3.885 1.00 2.14 H new ATOM 0 HB2 ALA A 112 6.400 9.864 -3.238 1.00 2.14 H new ATOM 0 HB3 ALA A 112 6.720 9.789 -4.987 1.00 2.14 H new ATOM 1741 N ASN A 113 6.477 12.446 -6.609 1.00 42.42 N ATOM 1742 CA ASN A 113 6.994 13.181 -7.788 1.00 21.45 C ATOM 1743 C ASN A 113 6.502 14.643 -7.777 1.00 24.50 C ATOM 1744 O ASN A 113 7.202 15.531 -8.265 1.00 12.20 O ATOM 1745 CB ASN A 113 6.565 12.486 -9.120 1.00 50.22 C ATOM 1746 CG ASN A 113 7.178 11.090 -9.327 1.00 24.23 C ATOM 1747 OD1 ASN A 113 8.305 10.817 -8.907 1.00 2.21 O ATOM 1748 ND2 ASN A 113 6.435 10.190 -9.970 1.00 51.21 N ATOM 0 H ASN A 113 5.675 11.852 -6.821 1.00 42.42 H new ATOM 0 HA ASN A 113 8.082 13.173 -7.730 1.00 21.45 H new ATOM 0 HB2 ASN A 113 5.479 12.400 -9.139 1.00 50.22 H new ATOM 0 HB3 ASN A 113 6.849 13.123 -9.957 1.00 50.22 H new ATOM 0 HD21 ASN A 113 6.795 9.248 -10.125 1.00 51.21 H new ATOM 0 HD22 ASN A 113 5.506 10.443 -10.307 1.00 51.21 H new ATOM 1755 N MET A 114 5.290 14.877 -7.215 1.00 40.44 N ATOM 1756 CA MET A 114 4.687 16.231 -7.129 1.00 71.12 C ATOM 1757 C MET A 114 5.447 17.093 -6.114 1.00 42.53 C ATOM 1758 O MET A 114 5.723 18.273 -6.376 1.00 52.21 O ATOM 1759 CB MET A 114 3.183 16.185 -6.737 1.00 63.01 C ATOM 1760 CG MET A 114 2.254 15.483 -7.737 1.00 53.14 C ATOM 1761 SD MET A 114 0.501 15.834 -7.425 1.00 32.03 S ATOM 1762 CE MET A 114 0.328 15.484 -5.669 1.00 52.43 C ATOM 0 H MET A 114 4.709 14.142 -6.813 1.00 40.44 H new ATOM 0 HA MET A 114 4.763 16.671 -8.123 1.00 71.12 H new ATOM 0 HB2 MET A 114 3.093 15.684 -5.773 1.00 63.01 H new ATOM 0 HB3 MET A 114 2.831 17.207 -6.599 1.00 63.01 H new ATOM 0 HG2 MET A 114 2.510 15.799 -8.748 1.00 53.14 H new ATOM 0 HG3 MET A 114 2.420 14.407 -7.688 1.00 53.14 H new ATOM 0 HE1 MET A 114 -0.581 15.952 -5.293 1.00 52.43 H new ATOM 0 HE2 MET A 114 0.271 14.406 -5.517 1.00 52.43 H new ATOM 0 HE3 MET A 114 1.190 15.881 -5.132 1.00 52.43 H new ATOM 1772 N ILE A 115 5.771 16.496 -4.947 1.00 43.31 N ATOM 1773 CA ILE A 115 6.589 17.170 -3.921 1.00 33.21 C ATOM 1774 C ILE A 115 8.054 17.265 -4.406 1.00 41.53 C ATOM 1775 O ILE A 115 8.737 18.249 -4.116 1.00 44.52 O ATOM 1776 CB ILE A 115 6.499 16.466 -2.504 1.00 72.23 C ATOM 1777 CG1 ILE A 115 7.103 15.029 -2.521 1.00 53.35 C ATOM 1778 CG2 ILE A 115 5.032 16.442 -2.004 1.00 34.10 C ATOM 1779 CD1 ILE A 115 7.131 14.326 -1.172 1.00 74.01 C ATOM 0 H ILE A 115 5.479 15.552 -4.694 1.00 43.31 H new ATOM 0 HA ILE A 115 6.187 18.174 -3.783 1.00 33.21 H new ATOM 0 HB ILE A 115 7.098 17.054 -1.809 1.00 72.23 H new ATOM 0 HG12 ILE A 115 6.530 14.419 -3.220 1.00 53.35 H new ATOM 0 HG13 ILE A 115 8.121 15.084 -2.906 1.00 53.35 H new ATOM 0 HG21 ILE A 115 4.988 15.955 -1.030 1.00 34.10 H new ATOM 0 HG22 ILE A 115 4.661 17.463 -1.917 1.00 34.10 H new ATOM 0 HG23 ILE A 115 4.415 15.891 -2.713 1.00 34.10 H new ATOM 0 HD11 ILE A 115 7.568 13.334 -1.288 1.00 74.01 H new ATOM 0 HD12 ILE A 115 7.730 14.907 -0.471 1.00 74.01 H new ATOM 0 HD13 ILE A 115 6.115 14.232 -0.790 1.00 74.01 H new ATOM 1791 N ARG A 116 8.484 16.237 -5.187 1.00 64.15 N ATOM 1792 CA ARG A 116 9.810 16.156 -5.826 1.00 73.55 C ATOM 1793 C ARG A 116 10.956 16.323 -4.793 1.00 54.02 C ATOM 1794 O ARG A 116 11.478 17.424 -4.588 1.00 0.02 O ATOM 1795 CB ARG A 116 9.883 17.172 -7.012 1.00 40.31 C ATOM 1796 CG ARG A 116 11.191 17.206 -7.843 1.00 64.11 C ATOM 1797 CD ARG A 116 11.601 15.847 -8.459 1.00 2.34 C ATOM 1798 NE ARG A 116 12.360 14.996 -7.515 1.00 50.00 N ATOM 1799 CZ ARG A 116 12.799 13.751 -7.764 1.00 72.05 C ATOM 1800 NH1 ARG A 116 12.578 13.153 -8.936 1.00 24.05 N ATOM 1801 NH2 ARG A 116 13.493 13.113 -6.835 1.00 1.54 N ATOM 0 H ARG A 116 7.898 15.427 -5.389 1.00 64.15 H new ATOM 0 HA ARG A 116 9.950 15.159 -6.244 1.00 73.55 H new ATOM 0 HB2 ARG A 116 9.058 16.957 -7.691 1.00 40.31 H new ATOM 0 HB3 ARG A 116 9.713 18.171 -6.611 1.00 40.31 H new ATOM 0 HG2 ARG A 116 11.076 17.934 -8.646 1.00 64.11 H new ATOM 0 HG3 ARG A 116 12.001 17.560 -7.206 1.00 64.11 H new ATOM 0 HD2 ARG A 116 10.706 15.315 -8.782 1.00 2.34 H new ATOM 0 HD3 ARG A 116 12.206 16.024 -9.349 1.00 2.34 H new ATOM 0 HE ARG A 116 12.567 15.389 -6.597 1.00 50.00 H new ATOM 0 HH11 ARG A 116 12.065 13.642 -9.669 1.00 24.05 H new ATOM 0 HH12 ARG A 116 12.923 12.207 -9.099 1.00 24.05 H new ATOM 0 HH21 ARG A 116 13.689 13.567 -5.943 1.00 1.54 H new ATOM 0 HH22 ARG A 116 13.832 12.167 -7.011 1.00 1.54 H new ATOM 1815 N GLY A 117 11.302 15.214 -4.114 1.00 13.24 N ATOM 1816 CA GLY A 117 12.397 15.192 -3.130 1.00 64.13 C ATOM 1817 C GLY A 117 13.770 14.930 -3.762 1.00 35.11 C ATOM 1818 O GLY A 117 13.983 15.319 -4.932 1.00 14.42 O ATOM 1819 OXT GLY A 117 14.646 14.339 -3.097 1.00 38.24 O ATOM 0 H GLY A 117 10.834 14.315 -4.231 1.00 13.24 H new ATOM 0 HA2 GLY A 117 12.423 16.146 -2.603 1.00 64.13 H new ATOM 0 HA3 GLY A 117 12.193 14.422 -2.386 1.00 64.13 H new TER 1823 GLY A 117 ATOM 1824 N SER B 2 16.844 -14.741 16.604 1.00 2.43 N ATOM 1825 CA SER B 2 18.047 -14.115 16.019 1.00 21.03 C ATOM 1826 C SER B 2 17.683 -12.787 15.337 1.00 15.54 C ATOM 1827 O SER B 2 16.581 -12.640 14.783 1.00 75.33 O ATOM 1828 CB SER B 2 18.720 -15.081 15.027 1.00 54.44 C ATOM 1829 OG SER B 2 19.108 -16.288 15.668 1.00 23.20 O ATOM 0 HA SER B 2 18.756 -13.899 16.818 1.00 21.03 H new ATOM 0 HB2 SER B 2 18.033 -15.304 14.210 1.00 54.44 H new ATOM 0 HB3 SER B 2 19.595 -14.603 14.586 1.00 54.44 H new ATOM 0 HG SER B 2 18.444 -16.525 16.348 1.00 23.20 H new ATOM 1837 N LEU B 3 18.619 -11.823 15.397 1.00 1.11 N ATOM 1838 CA LEU B 3 18.456 -10.511 14.765 1.00 72.20 C ATOM 1839 C LEU B 3 18.934 -10.579 13.302 1.00 63.34 C ATOM 1840 O LEU B 3 20.082 -10.965 13.043 1.00 33.21 O ATOM 1841 CB LEU B 3 19.263 -9.426 15.538 1.00 20.04 C ATOM 1842 CG LEU B 3 18.939 -9.257 17.056 1.00 24.34 C ATOM 1843 CD1 LEU B 3 19.863 -8.203 17.705 1.00 62.24 C ATOM 1844 CD2 LEU B 3 17.456 -8.904 17.280 1.00 64.35 C ATOM 0 H LEU B 3 19.507 -11.936 15.886 1.00 1.11 H new ATOM 0 HA LEU B 3 17.401 -10.238 14.790 1.00 72.20 H new ATOM 0 HB2 LEU B 3 20.324 -9.658 15.441 1.00 20.04 H new ATOM 0 HB3 LEU B 3 19.100 -8.467 15.047 1.00 20.04 H new ATOM 0 HG LEU B 3 19.126 -10.215 17.541 1.00 24.34 H new ATOM 0 HD11 LEU B 3 19.616 -8.105 18.762 1.00 62.24 H new ATOM 0 HD12 LEU B 3 20.902 -8.517 17.602 1.00 62.24 H new ATOM 0 HD13 LEU B 3 19.724 -7.242 17.209 1.00 62.24 H new ATOM 0 HD21 LEU B 3 17.265 -8.794 18.348 1.00 64.35 H new ATOM 0 HD22 LEU B 3 17.224 -7.968 16.771 1.00 64.35 H new ATOM 0 HD23 LEU B 3 16.828 -9.700 16.880 1.00 64.35 H new ATOM 1856 N VAL B 4 18.042 -10.255 12.356 1.00 13.54 N ATOM 1857 CA VAL B 4 18.417 -10.053 10.945 1.00 53.12 C ATOM 1858 C VAL B 4 18.835 -8.590 10.744 1.00 11.43 C ATOM 1859 O VAL B 4 18.193 -7.662 11.264 1.00 65.41 O ATOM 1860 CB VAL B 4 17.269 -10.444 9.931 1.00 50.35 C ATOM 1861 CG1 VAL B 4 17.078 -11.973 9.869 1.00 20.12 C ATOM 1862 CG2 VAL B 4 15.940 -9.739 10.281 1.00 51.34 C ATOM 0 H VAL B 4 17.048 -10.126 12.542 1.00 13.54 H new ATOM 0 HA VAL B 4 19.250 -10.722 10.728 1.00 53.12 H new ATOM 0 HB VAL B 4 17.577 -10.101 8.943 1.00 50.35 H new ATOM 0 HG11 VAL B 4 16.282 -12.212 9.164 1.00 20.12 H new ATOM 0 HG12 VAL B 4 18.006 -12.443 9.542 1.00 20.12 H new ATOM 0 HG13 VAL B 4 16.811 -12.347 10.858 1.00 20.12 H new ATOM 0 HG21 VAL B 4 15.173 -10.031 9.563 1.00 51.34 H new ATOM 0 HG22 VAL B 4 15.627 -10.029 11.284 1.00 51.34 H new ATOM 0 HG23 VAL B 4 16.080 -8.659 10.243 1.00 51.34 H new ATOM 1872 N LYS B 5 19.929 -8.401 10.014 1.00 0.31 N ATOM 1873 CA LYS B 5 20.490 -7.081 9.730 1.00 44.24 C ATOM 1874 C LYS B 5 19.768 -6.461 8.521 1.00 51.42 C ATOM 1875 O LYS B 5 19.751 -7.045 7.440 1.00 54.11 O ATOM 1876 CB LYS B 5 22.011 -7.212 9.468 1.00 4.22 C ATOM 1877 CG LYS B 5 22.855 -7.607 10.701 1.00 62.14 C ATOM 1878 CD LYS B 5 24.370 -7.613 10.396 1.00 14.40 C ATOM 1879 CE LYS B 5 25.240 -7.901 11.627 1.00 50.13 C ATOM 1880 NZ LYS B 5 24.960 -9.235 12.207 1.00 71.41 N ATOM 0 H LYS B 5 20.458 -9.167 9.597 1.00 0.31 H new ATOM 0 HA LYS B 5 20.345 -6.423 10.587 1.00 44.24 H new ATOM 0 HB2 LYS B 5 22.167 -7.956 8.686 1.00 4.22 H new ATOM 0 HB3 LYS B 5 22.381 -6.262 9.082 1.00 4.22 H new ATOM 0 HG2 LYS B 5 22.653 -6.911 11.515 1.00 62.14 H new ATOM 0 HG3 LYS B 5 22.552 -8.596 11.045 1.00 62.14 H new ATOM 0 HD2 LYS B 5 24.576 -8.362 9.632 1.00 14.40 H new ATOM 0 HD3 LYS B 5 24.653 -6.646 9.979 1.00 14.40 H new ATOM 0 HE2 LYS B 5 26.292 -7.841 11.349 1.00 50.13 H new ATOM 0 HE3 LYS B 5 25.065 -7.134 12.382 1.00 50.13 H new ATOM 0 HZ1 LYS B 5 25.593 -9.402 13.015 1.00 71.41 H new ATOM 0 HZ2 LYS B 5 23.971 -9.274 12.528 1.00 71.41 H new ATOM 0 HZ3 LYS B 5 25.119 -9.967 11.486 1.00 71.41 H new ATOM 1894 N LEU B 6 19.139 -5.297 8.726 1.00 55.54 N ATOM 1895 CA LEU B 6 18.439 -4.545 7.663 1.00 22.10 C ATOM 1896 C LEU B 6 19.227 -3.275 7.341 1.00 0.34 C ATOM 1897 O LEU B 6 19.100 -2.261 8.035 1.00 13.11 O ATOM 1898 CB LEU B 6 16.973 -4.211 8.088 1.00 24.41 C ATOM 1899 CG LEU B 6 15.887 -5.271 7.714 1.00 35.02 C ATOM 1900 CD1 LEU B 6 16.207 -6.682 8.251 1.00 2.52 C ATOM 1901 CD2 LEU B 6 14.504 -4.801 8.181 1.00 12.04 C ATOM 0 H LEU B 6 19.098 -4.843 9.638 1.00 55.54 H new ATOM 0 HA LEU B 6 18.381 -5.161 6.766 1.00 22.10 H new ATOM 0 HB2 LEU B 6 16.954 -4.068 9.168 1.00 24.41 H new ATOM 0 HB3 LEU B 6 16.693 -3.260 7.635 1.00 24.41 H new ATOM 0 HG LEU B 6 15.887 -5.357 6.627 1.00 35.02 H new ATOM 0 HD11 LEU B 6 15.415 -7.371 7.958 1.00 2.52 H new ATOM 0 HD12 LEU B 6 17.156 -7.022 7.837 1.00 2.52 H new ATOM 0 HD13 LEU B 6 16.276 -6.650 9.338 1.00 2.52 H new ATOM 0 HD21 LEU B 6 13.757 -5.548 7.914 1.00 12.04 H new ATOM 0 HD22 LEU B 6 14.512 -4.665 9.263 1.00 12.04 H new ATOM 0 HD23 LEU B 6 14.259 -3.855 7.698 1.00 12.04 H new ATOM 1913 N GLU B 7 20.068 -3.361 6.308 1.00 2.40 N ATOM 1914 CA GLU B 7 20.857 -2.227 5.831 1.00 45.14 C ATOM 1915 C GLU B 7 19.970 -1.338 4.940 1.00 62.34 C ATOM 1916 O GLU B 7 19.401 -1.815 3.957 1.00 73.40 O ATOM 1917 CB GLU B 7 22.097 -2.738 5.059 1.00 64.02 C ATOM 1918 CG GLU B 7 23.022 -1.619 4.536 1.00 64.33 C ATOM 1919 CD GLU B 7 24.276 -2.171 3.848 1.00 52.11 C ATOM 1920 OE1 GLU B 7 24.242 -2.385 2.618 1.00 30.33 O ATOM 1921 OE2 GLU B 7 25.291 -2.416 4.539 1.00 34.33 O ATOM 0 H GLU B 7 20.220 -4.220 5.779 1.00 2.40 H new ATOM 0 HA GLU B 7 21.210 -1.633 6.674 1.00 45.14 H new ATOM 0 HB2 GLU B 7 22.673 -3.394 5.712 1.00 64.02 H new ATOM 0 HB3 GLU B 7 21.762 -3.341 4.215 1.00 64.02 H new ATOM 0 HG2 GLU B 7 22.471 -0.994 3.833 1.00 64.33 H new ATOM 0 HG3 GLU B 7 23.319 -0.979 5.367 1.00 64.33 H new ATOM 1928 N SER B 8 19.835 -0.063 5.317 1.00 21.40 N ATOM 1929 CA SER B 8 19.029 0.917 4.578 1.00 0.01 C ATOM 1930 C SER B 8 19.819 1.506 3.396 1.00 75.12 C ATOM 1931 O SER B 8 21.011 1.213 3.214 1.00 32.23 O ATOM 1932 CB SER B 8 18.584 2.032 5.551 1.00 65.44 C ATOM 1933 OG SER B 8 19.698 2.680 6.146 1.00 73.35 O ATOM 0 H SER B 8 20.284 0.322 6.148 1.00 21.40 H new ATOM 0 HA SER B 8 18.151 0.421 4.164 1.00 0.01 H new ATOM 0 HB2 SER B 8 17.980 2.764 5.015 1.00 65.44 H new ATOM 0 HB3 SER B 8 17.952 1.606 6.330 1.00 65.44 H new ATOM 0 HG SER B 8 20.041 2.131 6.881 1.00 73.35 H new ATOM 1939 N SER B 9 19.126 2.337 2.603 1.00 42.32 N ATOM 1940 CA SER B 9 19.726 3.135 1.519 1.00 22.44 C ATOM 1941 C SER B 9 20.726 4.171 2.077 1.00 64.44 C ATOM 1942 O SER B 9 21.647 4.599 1.376 1.00 34.31 O ATOM 1943 CB SER B 9 18.612 3.833 0.702 1.00 23.22 C ATOM 1944 OG SER B 9 19.142 4.576 -0.388 1.00 43.43 O ATOM 0 H SER B 9 18.120 2.477 2.696 1.00 42.32 H new ATOM 0 HA SER B 9 20.280 2.465 0.862 1.00 22.44 H new ATOM 0 HB2 SER B 9 17.914 3.085 0.326 1.00 23.22 H new ATOM 0 HB3 SER B 9 18.046 4.498 1.354 1.00 23.22 H new ATOM 0 HG SER B 9 18.409 5.001 -0.881 1.00 43.43 H new ATOM 1950 N ASP B 10 20.534 4.546 3.360 1.00 32.01 N ATOM 1951 CA ASP B 10 21.411 5.499 4.081 1.00 24.21 C ATOM 1952 C ASP B 10 22.632 4.764 4.706 1.00 42.51 C ATOM 1953 O ASP B 10 23.424 5.368 5.437 1.00 51.15 O ATOM 1954 CB ASP B 10 20.566 6.228 5.156 1.00 52.34 C ATOM 1955 CG ASP B 10 21.303 7.390 5.854 1.00 72.11 C ATOM 1956 OD1 ASP B 10 21.433 8.465 5.248 1.00 75.23 O ATOM 1957 OD2 ASP B 10 21.747 7.236 7.018 1.00 23.01 O ATOM 0 H ASP B 10 19.763 4.196 3.929 1.00 32.01 H new ATOM 0 HA ASP B 10 21.813 6.235 3.385 1.00 24.21 H new ATOM 0 HB2 ASP B 10 19.660 6.614 4.690 1.00 52.34 H new ATOM 0 HB3 ASP B 10 20.254 5.505 5.909 1.00 52.34 H new ATOM 1962 N GLU B 11 22.767 3.444 4.401 1.00 62.42 N ATOM 1963 CA GLU B 11 23.946 2.604 4.760 1.00 44.23 C ATOM 1964 C GLU B 11 23.998 2.254 6.271 1.00 61.02 C ATOM 1965 O GLU B 11 24.974 1.648 6.735 1.00 34.35 O ATOM 1966 CB GLU B 11 25.278 3.278 4.279 1.00 1.44 C ATOM 1967 CG GLU B 11 25.317 3.629 2.764 1.00 23.43 C ATOM 1968 CD GLU B 11 26.469 4.574 2.359 1.00 70.30 C ATOM 1969 OE1 GLU B 11 26.757 5.531 3.117 1.00 62.31 O ATOM 1970 OE2 GLU B 11 27.049 4.409 1.259 1.00 75.24 O ATOM 0 H GLU B 11 22.051 2.926 3.892 1.00 62.42 H new ATOM 0 HA GLU B 11 23.832 1.656 4.234 1.00 44.23 H new ATOM 0 HB2 GLU B 11 25.436 4.190 4.854 1.00 1.44 H new ATOM 0 HB3 GLU B 11 26.110 2.611 4.505 1.00 1.44 H new ATOM 0 HG2 GLU B 11 25.402 2.705 2.191 1.00 23.43 H new ATOM 0 HG3 GLU B 11 24.370 4.090 2.486 1.00 23.43 H new ATOM 1977 N LYS B 12 22.940 2.620 7.027 1.00 20.05 N ATOM 1978 CA LYS B 12 22.820 2.284 8.460 1.00 52.45 C ATOM 1979 C LYS B 12 22.059 0.958 8.620 1.00 62.23 C ATOM 1980 O LYS B 12 20.968 0.786 8.062 1.00 55.03 O ATOM 1981 CB LYS B 12 22.114 3.422 9.245 1.00 24.53 C ATOM 1982 CG LYS B 12 22.955 4.715 9.370 1.00 4.43 C ATOM 1983 CD LYS B 12 22.273 5.801 10.242 1.00 0.31 C ATOM 1984 CE LYS B 12 23.097 7.096 10.324 1.00 25.33 C ATOM 1985 NZ LYS B 12 22.384 8.161 11.079 1.00 14.13 N ATOM 0 H LYS B 12 22.151 3.153 6.663 1.00 20.05 H new ATOM 0 HA LYS B 12 23.821 2.171 8.876 1.00 52.45 H new ATOM 0 HB2 LYS B 12 21.172 3.660 8.751 1.00 24.53 H new ATOM 0 HB3 LYS B 12 21.868 3.062 10.244 1.00 24.53 H new ATOM 0 HG2 LYS B 12 23.926 4.470 9.799 1.00 4.43 H new ATOM 0 HG3 LYS B 12 23.139 5.119 8.375 1.00 4.43 H new ATOM 0 HD2 LYS B 12 21.289 6.026 9.831 1.00 0.31 H new ATOM 0 HD3 LYS B 12 22.117 5.410 11.247 1.00 0.31 H new ATOM 0 HE2 LYS B 12 24.053 6.888 10.805 1.00 25.33 H new ATOM 0 HE3 LYS B 12 23.317 7.450 9.317 1.00 25.33 H new ATOM 0 HZ1 LYS B 12 22.973 9.017 11.111 1.00 14.13 H new ATOM 0 HZ2 LYS B 12 21.483 8.378 10.606 1.00 14.13 H new ATOM 0 HZ3 LYS B 12 22.196 7.833 12.048 1.00 14.13 H new ATOM 1999 N VAL B 13 22.653 0.035 9.383 1.00 35.00 N ATOM 2000 CA VAL B 13 22.147 -1.330 9.573 1.00 5.41 C ATOM 2001 C VAL B 13 21.346 -1.427 10.890 1.00 71.00 C ATOM 2002 O VAL B 13 21.871 -1.110 11.965 1.00 62.30 O ATOM 2003 CB VAL B 13 23.348 -2.347 9.590 1.00 33.22 C ATOM 2004 CG1 VAL B 13 22.871 -3.794 9.809 1.00 53.42 C ATOM 2005 CG2 VAL B 13 24.192 -2.225 8.297 1.00 32.11 C ATOM 0 H VAL B 13 23.515 0.218 9.896 1.00 35.00 H new ATOM 0 HA VAL B 13 21.483 -1.579 8.745 1.00 5.41 H new ATOM 0 HB VAL B 13 23.984 -2.088 10.437 1.00 33.22 H new ATOM 0 HG11 VAL B 13 23.731 -4.464 9.814 1.00 53.42 H new ATOM 0 HG12 VAL B 13 22.350 -3.865 10.764 1.00 53.42 H new ATOM 0 HG13 VAL B 13 22.193 -4.079 9.004 1.00 53.42 H new ATOM 0 HG21 VAL B 13 25.016 -2.938 8.332 1.00 32.11 H new ATOM 0 HG22 VAL B 13 23.565 -2.438 7.431 1.00 32.11 H new ATOM 0 HG23 VAL B 13 24.590 -1.214 8.217 1.00 32.11 H new ATOM 2015 N PHE B 14 20.081 -1.862 10.786 1.00 11.13 N ATOM 2016 CA PHE B 14 19.170 -2.041 11.926 1.00 41.53 C ATOM 2017 C PHE B 14 18.953 -3.541 12.167 1.00 40.12 C ATOM 2018 O PHE B 14 18.274 -4.213 11.379 1.00 73.44 O ATOM 2019 CB PHE B 14 17.823 -1.324 11.637 1.00 45.31 C ATOM 2020 CG PHE B 14 17.975 0.184 11.470 1.00 73.02 C ATOM 2021 CD1 PHE B 14 17.890 1.034 12.570 1.00 64.44 C ATOM 2022 CD2 PHE B 14 18.233 0.749 10.216 1.00 24.40 C ATOM 2023 CE1 PHE B 14 18.057 2.395 12.427 1.00 64.23 C ATOM 2024 CE2 PHE B 14 18.395 2.108 10.077 1.00 24.54 C ATOM 2025 CZ PHE B 14 18.309 2.932 11.183 1.00 14.32 C ATOM 0 H PHE B 14 19.655 -2.103 9.891 1.00 11.13 H new ATOM 0 HA PHE B 14 19.604 -1.601 12.824 1.00 41.53 H new ATOM 0 HB2 PHE B 14 17.382 -1.742 10.732 1.00 45.31 H new ATOM 0 HB3 PHE B 14 17.128 -1.526 12.452 1.00 45.31 H new ATOM 0 HD1 PHE B 14 17.691 0.621 13.548 1.00 64.44 H new ATOM 0 HD2 PHE B 14 18.306 0.111 9.348 1.00 24.40 H new ATOM 0 HE1 PHE B 14 17.990 3.041 13.290 1.00 64.23 H new ATOM 0 HE2 PHE B 14 18.590 2.531 9.103 1.00 24.54 H new ATOM 0 HZ PHE B 14 18.439 3.998 11.072 1.00 14.32 H new ATOM 2035 N GLU B 15 19.571 -4.064 13.239 1.00 70.24 N ATOM 2036 CA GLU B 15 19.440 -5.471 13.636 1.00 1.21 C ATOM 2037 C GLU B 15 18.091 -5.681 14.345 1.00 75.12 C ATOM 2038 O GLU B 15 17.991 -5.603 15.578 1.00 1.32 O ATOM 2039 CB GLU B 15 20.616 -5.901 14.548 1.00 2.45 C ATOM 2040 CG GLU B 15 22.012 -5.669 13.944 1.00 20.11 C ATOM 2041 CD GLU B 15 23.138 -6.234 14.823 1.00 20.00 C ATOM 2042 OE1 GLU B 15 23.421 -5.644 15.883 1.00 74.21 O ATOM 2043 OE2 GLU B 15 23.745 -7.267 14.463 1.00 22.40 O ATOM 0 H GLU B 15 20.176 -3.520 13.854 1.00 70.24 H new ATOM 0 HA GLU B 15 19.473 -6.095 12.743 1.00 1.21 H new ATOM 0 HB2 GLU B 15 20.547 -5.356 15.489 1.00 2.45 H new ATOM 0 HB3 GLU B 15 20.508 -6.960 14.784 1.00 2.45 H new ATOM 0 HG2 GLU B 15 22.059 -6.132 12.958 1.00 20.11 H new ATOM 0 HG3 GLU B 15 22.169 -4.600 13.802 1.00 20.11 H new ATOM 2050 N ILE B 16 17.046 -5.868 13.539 1.00 62.51 N ATOM 2051 CA ILE B 16 15.684 -6.119 14.026 1.00 3.32 C ATOM 2052 C ILE B 16 15.484 -7.636 14.180 1.00 34.34 C ATOM 2053 O ILE B 16 16.144 -8.424 13.494 1.00 62.32 O ATOM 2054 CB ILE B 16 14.608 -5.498 13.043 1.00 4.20 C ATOM 2055 CG1 ILE B 16 13.154 -5.566 13.620 1.00 35.42 C ATOM 2056 CG2 ILE B 16 14.670 -6.151 11.645 1.00 14.12 C ATOM 2057 CD1 ILE B 16 12.935 -4.773 14.898 1.00 23.23 C ATOM 0 H ILE B 16 17.118 -5.850 12.522 1.00 62.51 H new ATOM 0 HA ILE B 16 15.549 -5.638 14.995 1.00 3.32 H new ATOM 0 HB ILE B 16 14.865 -4.444 12.940 1.00 4.20 H new ATOM 0 HG12 ILE B 16 12.460 -5.203 12.861 1.00 35.42 H new ATOM 0 HG13 ILE B 16 12.902 -6.609 13.809 1.00 35.42 H new ATOM 0 HG21 ILE B 16 13.917 -5.699 10.999 1.00 14.12 H new ATOM 0 HG22 ILE B 16 15.659 -5.995 11.214 1.00 14.12 H new ATOM 0 HG23 ILE B 16 14.477 -7.220 11.734 1.00 14.12 H new ATOM 0 HD11 ILE B 16 11.899 -4.881 15.220 1.00 23.23 H new ATOM 0 HD12 ILE B 16 13.599 -5.148 15.677 1.00 23.23 H new ATOM 0 HD13 ILE B 16 13.150 -3.720 14.714 1.00 23.23 H new ATOM 2069 N GLU B 17 14.602 -8.030 15.106 1.00 33.34 N ATOM 2070 CA GLU B 17 14.222 -9.435 15.308 1.00 52.31 C ATOM 2071 C GLU B 17 13.595 -9.985 14.015 1.00 25.30 C ATOM 2072 O GLU B 17 12.737 -9.319 13.416 1.00 14.41 O ATOM 2073 CB GLU B 17 13.238 -9.539 16.501 1.00 13.30 C ATOM 2074 CG GLU B 17 13.786 -8.949 17.819 1.00 1.02 C ATOM 2075 CD GLU B 17 12.763 -8.915 18.965 1.00 33.31 C ATOM 2076 OE1 GLU B 17 12.385 -7.809 19.411 1.00 51.45 O ATOM 2077 OE2 GLU B 17 12.347 -9.995 19.437 1.00 53.34 O ATOM 0 H GLU B 17 14.130 -7.383 15.738 1.00 33.34 H new ATOM 0 HA GLU B 17 15.103 -10.033 15.542 1.00 52.31 H new ATOM 0 HB2 GLU B 17 12.313 -9.025 16.242 1.00 13.30 H new ATOM 0 HB3 GLU B 17 12.986 -10.587 16.661 1.00 13.30 H new ATOM 0 HG2 GLU B 17 14.650 -9.534 18.135 1.00 1.02 H new ATOM 0 HG3 GLU B 17 14.139 -7.935 17.631 1.00 1.02 H new ATOM 2084 N LYS B 18 14.055 -11.185 13.593 1.00 45.43 N ATOM 2085 CA LYS B 18 13.635 -11.825 12.330 1.00 72.55 C ATOM 2086 C LYS B 18 12.102 -11.935 12.237 1.00 5.54 C ATOM 2087 O LYS B 18 11.520 -11.690 11.179 1.00 2.00 O ATOM 2088 CB LYS B 18 14.278 -13.232 12.175 1.00 61.11 C ATOM 2089 CG LYS B 18 13.908 -13.968 10.859 1.00 33.34 C ATOM 2090 CD LYS B 18 14.319 -15.461 10.857 1.00 71.15 C ATOM 2091 CE LYS B 18 13.832 -16.194 9.595 1.00 3.41 C ATOM 2092 NZ LYS B 18 14.071 -17.664 9.657 1.00 71.52 N ATOM 0 H LYS B 18 14.730 -11.737 14.122 1.00 45.43 H new ATOM 0 HA LYS B 18 13.983 -11.189 11.516 1.00 72.55 H new ATOM 0 HB2 LYS B 18 15.362 -13.130 12.227 1.00 61.11 H new ATOM 0 HB3 LYS B 18 13.976 -13.851 13.020 1.00 61.11 H new ATOM 0 HG2 LYS B 18 12.832 -13.894 10.699 1.00 33.34 H new ATOM 0 HG3 LYS B 18 14.390 -13.464 10.021 1.00 33.34 H new ATOM 0 HD2 LYS B 18 15.404 -15.538 10.924 1.00 71.15 H new ATOM 0 HD3 LYS B 18 13.909 -15.950 11.741 1.00 71.15 H new ATOM 0 HE2 LYS B 18 12.766 -16.008 9.460 1.00 3.41 H new ATOM 0 HE3 LYS B 18 14.340 -15.784 8.722 1.00 3.41 H new ATOM 0 HZ1 LYS B 18 13.725 -18.109 8.783 1.00 71.52 H new ATOM 0 HZ2 LYS B 18 15.090 -17.846 9.758 1.00 71.52 H new ATOM 0 HZ3 LYS B 18 13.565 -18.064 10.473 1.00 71.52 H new ATOM 2106 N GLU B 19 11.478 -12.265 13.380 1.00 53.55 N ATOM 2107 CA GLU B 19 10.019 -12.420 13.501 1.00 32.24 C ATOM 2108 C GLU B 19 9.269 -11.104 13.169 1.00 61.55 C ATOM 2109 O GLU B 19 8.194 -11.137 12.557 1.00 32.21 O ATOM 2110 CB GLU B 19 9.671 -12.951 14.921 1.00 5.53 C ATOM 2111 CG GLU B 19 10.154 -12.070 16.098 1.00 71.22 C ATOM 2112 CD GLU B 19 10.034 -12.771 17.464 1.00 51.54 C ATOM 2113 OE1 GLU B 19 8.900 -13.078 17.884 1.00 11.00 O ATOM 2114 OE2 GLU B 19 11.069 -13.024 18.121 1.00 13.44 O ATOM 0 H GLU B 19 11.977 -12.433 14.254 1.00 53.55 H new ATOM 0 HA GLU B 19 9.681 -13.150 12.766 1.00 32.24 H new ATOM 0 HB2 GLU B 19 8.589 -13.062 14.993 1.00 5.53 H new ATOM 0 HB3 GLU B 19 10.102 -13.946 15.034 1.00 5.53 H new ATOM 0 HG2 GLU B 19 11.194 -11.788 15.931 1.00 71.22 H new ATOM 0 HG3 GLU B 19 9.573 -11.148 16.117 1.00 71.22 H new ATOM 2121 N ILE B 20 9.862 -9.954 13.547 1.00 4.20 N ATOM 2122 CA ILE B 20 9.300 -8.606 13.273 1.00 2.31 C ATOM 2123 C ILE B 20 9.536 -8.215 11.792 1.00 60.22 C ATOM 2124 O ILE B 20 8.708 -7.538 11.173 1.00 60.42 O ATOM 2125 CB ILE B 20 9.909 -7.524 14.255 1.00 33.10 C ATOM 2126 CG1 ILE B 20 9.674 -7.946 15.745 1.00 51.03 C ATOM 2127 CG2 ILE B 20 9.330 -6.108 13.987 1.00 42.14 C ATOM 2128 CD1 ILE B 20 10.208 -6.973 16.787 1.00 73.44 C ATOM 0 H ILE B 20 10.747 -9.928 14.053 1.00 4.20 H new ATOM 0 HA ILE B 20 8.225 -8.640 13.450 1.00 2.31 H new ATOM 0 HB ILE B 20 10.982 -7.475 14.068 1.00 33.10 H new ATOM 0 HG12 ILE B 20 8.603 -8.073 15.905 1.00 51.03 H new ATOM 0 HG13 ILE B 20 10.138 -8.919 15.908 1.00 51.03 H new ATOM 0 HG21 ILE B 20 9.774 -5.396 14.682 1.00 42.14 H new ATOM 0 HG22 ILE B 20 9.560 -5.808 12.964 1.00 42.14 H new ATOM 0 HG23 ILE B 20 8.249 -6.125 14.126 1.00 42.14 H new ATOM 0 HD11 ILE B 20 9.995 -7.356 17.785 1.00 73.44 H new ATOM 0 HD12 ILE B 20 11.285 -6.862 16.663 1.00 73.44 H new ATOM 0 HD13 ILE B 20 9.726 -6.003 16.660 1.00 73.44 H new ATOM 2140 N ALA B 21 10.660 -8.684 11.226 1.00 52.12 N ATOM 2141 CA ALA B 21 11.004 -8.459 9.803 1.00 44.42 C ATOM 2142 C ALA B 21 10.153 -9.335 8.855 1.00 4.34 C ATOM 2143 O ALA B 21 10.032 -9.032 7.664 1.00 15.24 O ATOM 2144 CB ALA B 21 12.502 -8.708 9.588 1.00 34.22 C ATOM 0 H ALA B 21 11.356 -9.228 11.735 1.00 52.12 H new ATOM 0 HA ALA B 21 10.775 -7.422 9.559 1.00 44.42 H new ATOM 0 HB1 ALA B 21 12.752 -8.542 8.540 1.00 34.22 H new ATOM 0 HB2 ALA B 21 13.078 -8.024 10.211 1.00 34.22 H new ATOM 0 HB3 ALA B 21 12.743 -9.736 9.860 1.00 34.22 H new ATOM 2150 N CYS B 22 9.580 -10.428 9.404 1.00 44.45 N ATOM 2151 CA CYS B 22 8.657 -11.323 8.675 1.00 72.33 C ATOM 2152 C CYS B 22 7.265 -10.675 8.483 1.00 21.34 C ATOM 2153 O CYS B 22 6.514 -11.071 7.586 1.00 0.21 O ATOM 2154 CB CYS B 22 8.545 -12.673 9.414 1.00 24.03 C ATOM 2155 SG CYS B 22 10.106 -13.592 9.489 1.00 64.13 S ATOM 0 H CYS B 22 9.746 -10.715 10.369 1.00 44.45 H new ATOM 0 HA CYS B 22 9.065 -11.498 7.680 1.00 72.33 H new ATOM 0 HB2 CYS B 22 8.190 -12.494 10.429 1.00 24.03 H new ATOM 0 HB3 CYS B 22 7.795 -13.288 8.918 1.00 24.03 H new ATOM 0 HG CYS B 22 11.012 -12.862 10.069 1.00 64.13 H new ATOM 2161 N MET B 23 6.928 -9.697 9.354 1.00 51.42 N ATOM 2162 CA MET B 23 5.689 -8.880 9.227 1.00 10.04 C ATOM 2163 C MET B 23 5.706 -8.090 7.905 1.00 50.40 C ATOM 2164 O MET B 23 4.669 -7.908 7.245 1.00 44.45 O ATOM 2165 CB MET B 23 5.566 -7.904 10.424 1.00 32.34 C ATOM 2166 CG MET B 23 5.498 -8.579 11.801 1.00 14.13 C ATOM 2167 SD MET B 23 5.542 -7.391 13.167 1.00 21.14 S ATOM 2168 CE MET B 23 4.104 -6.373 12.819 1.00 45.00 C ATOM 0 H MET B 23 7.500 -9.449 10.161 1.00 51.42 H new ATOM 0 HA MET B 23 4.829 -9.550 9.228 1.00 10.04 H new ATOM 0 HB2 MET B 23 6.418 -7.225 10.410 1.00 32.34 H new ATOM 0 HB3 MET B 23 4.672 -7.296 10.288 1.00 32.34 H new ATOM 0 HG2 MET B 23 4.583 -9.168 11.867 1.00 14.13 H new ATOM 0 HG3 MET B 23 6.332 -9.273 11.902 1.00 14.13 H new ATOM 0 HE1 MET B 23 3.551 -6.197 13.742 1.00 45.00 H new ATOM 0 HE2 MET B 23 4.426 -5.419 12.401 1.00 45.00 H new ATOM 0 HE3 MET B 23 3.461 -6.884 12.103 1.00 45.00 H new ATOM 2178 N SER B 24 6.908 -7.617 7.555 1.00 65.45 N ATOM 2179 CA SER B 24 7.195 -7.037 6.249 1.00 34.23 C ATOM 2180 C SER B 24 7.257 -8.168 5.215 1.00 63.22 C ATOM 2181 O SER B 24 8.160 -9.007 5.280 1.00 71.32 O ATOM 2182 CB SER B 24 8.529 -6.267 6.298 1.00 25.31 C ATOM 2183 OG SER B 24 8.834 -5.705 5.036 1.00 50.33 O ATOM 0 H SER B 24 7.713 -7.629 8.181 1.00 65.45 H new ATOM 0 HA SER B 24 6.411 -6.334 5.968 1.00 34.23 H new ATOM 0 HB2 SER B 24 8.471 -5.478 7.048 1.00 25.31 H new ATOM 0 HB3 SER B 24 9.330 -6.939 6.605 1.00 25.31 H new ATOM 0 HG SER B 24 8.026 -5.687 4.482 1.00 50.33 H new ATOM 2189 N VAL B 25 6.288 -8.188 4.282 1.00 40.22 N ATOM 2190 CA VAL B 25 6.147 -9.263 3.287 1.00 10.00 C ATOM 2191 C VAL B 25 7.367 -9.317 2.342 1.00 15.13 C ATOM 2192 O VAL B 25 7.914 -10.397 2.109 1.00 34.42 O ATOM 2193 CB VAL B 25 4.803 -9.112 2.472 1.00 44.44 C ATOM 2194 CG1 VAL B 25 4.673 -10.177 1.352 1.00 74.04 C ATOM 2195 CG2 VAL B 25 3.582 -9.161 3.429 1.00 14.12 C ATOM 0 H VAL B 25 5.581 -7.458 4.198 1.00 40.22 H new ATOM 0 HA VAL B 25 6.105 -10.209 3.827 1.00 10.00 H new ATOM 0 HB VAL B 25 4.826 -8.139 1.981 1.00 44.44 H new ATOM 0 HG11 VAL B 25 3.733 -10.032 0.820 1.00 74.04 H new ATOM 0 HG12 VAL B 25 5.504 -10.075 0.655 1.00 74.04 H new ATOM 0 HG13 VAL B 25 4.690 -11.173 1.794 1.00 74.04 H new ATOM 0 HG21 VAL B 25 2.663 -9.056 2.852 1.00 14.12 H new ATOM 0 HG22 VAL B 25 3.572 -10.115 3.957 1.00 14.12 H new ATOM 0 HG23 VAL B 25 3.653 -8.347 4.151 1.00 14.12 H new ATOM 2205 N THR B 26 7.806 -8.145 1.850 1.00 51.45 N ATOM 2206 CA THR B 26 8.928 -8.038 0.894 1.00 25.31 C ATOM 2207 C THR B 26 10.269 -8.512 1.513 1.00 41.12 C ATOM 2208 O THR B 26 10.969 -9.325 0.905 1.00 53.05 O ATOM 2209 CB THR B 26 9.066 -6.578 0.357 1.00 33.35 C ATOM 2210 OG1 THR B 26 7.807 -6.146 -0.187 1.00 1.11 O ATOM 2211 CG2 THR B 26 10.160 -6.436 -0.722 1.00 42.24 C ATOM 0 H THR B 26 7.396 -7.246 2.102 1.00 51.45 H new ATOM 0 HA THR B 26 8.698 -8.700 0.059 1.00 25.31 H new ATOM 0 HB THR B 26 9.359 -5.954 1.201 1.00 33.35 H new ATOM 0 HG1 THR B 26 7.858 -5.194 -0.414 1.00 1.11 H new ATOM 0 HG21 THR B 26 10.209 -5.400 -1.056 1.00 42.24 H new ATOM 0 HG22 THR B 26 11.123 -6.728 -0.304 1.00 42.24 H new ATOM 0 HG23 THR B 26 9.922 -7.080 -1.569 1.00 42.24 H new ATOM 2219 N ILE B 27 10.592 -8.017 2.731 1.00 21.24 N ATOM 2220 CA ILE B 27 11.850 -8.366 3.446 1.00 72.33 C ATOM 2221 C ILE B 27 11.882 -9.874 3.765 1.00 53.13 C ATOM 2222 O ILE B 27 12.916 -10.535 3.605 1.00 0.32 O ATOM 2223 CB ILE B 27 12.007 -7.524 4.770 1.00 41.30 C ATOM 2224 CG1 ILE B 27 12.076 -6.002 4.434 1.00 15.40 C ATOM 2225 CG2 ILE B 27 13.242 -7.970 5.604 1.00 64.15 C ATOM 2226 CD1 ILE B 27 12.056 -5.083 5.642 1.00 62.03 C ATOM 0 H ILE B 27 9.995 -7.369 3.245 1.00 21.24 H new ATOM 0 HA ILE B 27 12.688 -8.124 2.792 1.00 72.33 H new ATOM 0 HB ILE B 27 11.128 -7.708 5.388 1.00 41.30 H new ATOM 0 HG12 ILE B 27 12.985 -5.811 3.864 1.00 15.40 H new ATOM 0 HG13 ILE B 27 11.236 -5.748 3.788 1.00 15.40 H new ATOM 0 HG21 ILE B 27 13.310 -7.363 6.507 1.00 64.15 H new ATOM 0 HG22 ILE B 27 13.135 -9.019 5.880 1.00 64.15 H new ATOM 0 HG23 ILE B 27 14.147 -7.841 5.011 1.00 64.15 H new ATOM 0 HD11 ILE B 27 12.108 -4.046 5.311 1.00 62.03 H new ATOM 0 HD12 ILE B 27 11.135 -5.240 6.203 1.00 62.03 H new ATOM 0 HD13 ILE B 27 12.911 -5.303 6.281 1.00 62.03 H new ATOM 2238 N LYS B 28 10.715 -10.390 4.193 1.00 24.15 N ATOM 2239 CA LYS B 28 10.487 -11.823 4.447 1.00 54.34 C ATOM 2240 C LYS B 28 10.806 -12.649 3.183 1.00 24.12 C ATOM 2241 O LYS B 28 11.567 -13.614 3.246 1.00 33.53 O ATOM 2242 CB LYS B 28 9.010 -12.033 4.877 1.00 42.53 C ATOM 2243 CG LYS B 28 8.615 -13.483 5.228 1.00 10.45 C ATOM 2244 CD LYS B 28 7.090 -13.644 5.461 1.00 43.31 C ATOM 2245 CE LYS B 28 6.242 -13.262 4.228 1.00 73.04 C ATOM 2246 NZ LYS B 28 6.553 -14.095 3.034 1.00 40.30 N ATOM 0 H LYS B 28 9.893 -9.814 4.374 1.00 24.15 H new ATOM 0 HA LYS B 28 11.147 -12.161 5.246 1.00 54.34 H new ATOM 0 HB2 LYS B 28 8.810 -11.402 5.743 1.00 42.53 H new ATOM 0 HB3 LYS B 28 8.363 -11.685 4.072 1.00 42.53 H new ATOM 0 HG2 LYS B 28 8.928 -14.147 4.422 1.00 10.45 H new ATOM 0 HG3 LYS B 28 9.151 -13.795 6.124 1.00 10.45 H new ATOM 0 HD2 LYS B 28 6.878 -14.678 5.733 1.00 43.31 H new ATOM 0 HD3 LYS B 28 6.791 -13.024 6.306 1.00 43.31 H new ATOM 0 HE2 LYS B 28 5.185 -13.367 4.473 1.00 73.04 H new ATOM 0 HE3 LYS B 28 6.411 -12.212 3.987 1.00 73.04 H new ATOM 0 HZ1 LYS B 28 6.869 -13.482 2.256 1.00 40.30 H new ATOM 0 HZ2 LYS B 28 7.307 -14.771 3.269 1.00 40.30 H new ATOM 0 HZ3 LYS B 28 5.701 -14.615 2.742 1.00 40.30 H new ATOM 2260 N ASN B 29 10.260 -12.198 2.030 1.00 2.43 N ATOM 2261 CA ASN B 29 10.437 -12.873 0.722 1.00 51.13 C ATOM 2262 C ASN B 29 11.902 -12.819 0.260 1.00 55.30 C ATOM 2263 O ASN B 29 12.359 -13.732 -0.416 1.00 3.31 O ATOM 2264 CB ASN B 29 9.521 -12.248 -0.376 1.00 70.05 C ATOM 2265 CG ASN B 29 8.017 -12.437 -0.121 1.00 53.03 C ATOM 2266 OD1 ASN B 29 7.586 -13.388 0.538 1.00 61.14 O ATOM 2267 ND2 ASN B 29 7.202 -11.535 -0.653 1.00 12.42 N ATOM 0 H ASN B 29 9.685 -11.357 1.980 1.00 2.43 H new ATOM 0 HA ASN B 29 10.149 -13.914 0.864 1.00 51.13 H new ATOM 0 HB2 ASN B 29 9.735 -11.182 -0.449 1.00 70.05 H new ATOM 0 HB3 ASN B 29 9.774 -12.690 -1.340 1.00 70.05 H new ATOM 0 HD21 ASN B 29 6.194 -11.618 -0.522 1.00 12.42 H new ATOM 0 HD22 ASN B 29 7.584 -10.759 -1.193 1.00 12.42 H new ATOM 2274 N MET B 30 12.619 -11.731 0.628 1.00 44.33 N ATOM 2275 CA MET B 30 14.053 -11.555 0.298 1.00 0.43 C ATOM 2276 C MET B 30 14.907 -12.630 0.997 1.00 40.03 C ATOM 2277 O MET B 30 15.792 -13.237 0.381 1.00 51.24 O ATOM 2278 CB MET B 30 14.550 -10.127 0.684 1.00 63.21 C ATOM 2279 CG MET B 30 13.981 -8.990 -0.180 1.00 32.41 C ATOM 2280 SD MET B 30 14.663 -7.374 0.264 1.00 55.52 S ATOM 2281 CE MET B 30 13.962 -6.311 -0.999 1.00 12.42 C ATOM 0 H MET B 30 12.223 -10.955 1.159 1.00 44.33 H new ATOM 0 HA MET B 30 14.164 -11.670 -0.780 1.00 0.43 H new ATOM 0 HB2 MET B 30 14.291 -9.937 1.726 1.00 63.21 H new ATOM 0 HB3 MET B 30 15.638 -10.106 0.617 1.00 63.21 H new ATOM 0 HG2 MET B 30 14.193 -9.194 -1.229 1.00 32.41 H new ATOM 0 HG3 MET B 30 12.897 -8.965 -0.073 1.00 32.41 H new ATOM 0 HE1 MET B 30 14.747 -5.687 -1.426 1.00 12.42 H new ATOM 0 HE2 MET B 30 13.517 -6.923 -1.784 1.00 12.42 H new ATOM 0 HE3 MET B 30 13.195 -5.676 -0.556 1.00 12.42 H new ATOM 2291 N ILE B 31 14.595 -12.874 2.287 1.00 62.41 N ATOM 2292 CA ILE B 31 15.278 -13.887 3.112 1.00 40.25 C ATOM 2293 C ILE B 31 14.960 -15.304 2.583 1.00 74.24 C ATOM 2294 O ILE B 31 15.858 -16.140 2.454 1.00 15.14 O ATOM 2295 CB ILE B 31 14.870 -13.749 4.634 1.00 35.33 C ATOM 2296 CG1 ILE B 31 15.224 -12.316 5.161 1.00 41.24 C ATOM 2297 CG2 ILE B 31 15.544 -14.845 5.507 1.00 74.30 C ATOM 2298 CD1 ILE B 31 14.775 -12.023 6.583 1.00 51.43 C ATOM 0 H ILE B 31 13.860 -12.372 2.785 1.00 62.41 H new ATOM 0 HA ILE B 31 16.353 -13.722 3.042 1.00 40.25 H new ATOM 0 HB ILE B 31 13.792 -13.893 4.710 1.00 35.33 H new ATOM 0 HG12 ILE B 31 16.304 -12.181 5.102 1.00 41.24 H new ATOM 0 HG13 ILE B 31 14.774 -11.580 4.495 1.00 41.24 H new ATOM 0 HG21 ILE B 31 15.241 -14.719 6.547 1.00 74.30 H new ATOM 0 HG22 ILE B 31 15.236 -15.830 5.156 1.00 74.30 H new ATOM 0 HG23 ILE B 31 16.628 -14.755 5.431 1.00 74.30 H new ATOM 0 HD11 ILE B 31 15.066 -11.008 6.855 1.00 51.43 H new ATOM 0 HD12 ILE B 31 13.691 -12.120 6.650 1.00 51.43 H new ATOM 0 HD13 ILE B 31 15.245 -12.730 7.266 1.00 51.43 H new ATOM 2310 N GLU B 32 13.674 -15.532 2.240 1.00 61.03 N ATOM 2311 CA GLU B 32 13.174 -16.834 1.739 1.00 55.22 C ATOM 2312 C GLU B 32 13.689 -17.144 0.317 1.00 3.34 C ATOM 2313 O GLU B 32 13.827 -18.316 -0.054 1.00 2.10 O ATOM 2314 CB GLU B 32 11.626 -16.864 1.752 1.00 55.44 C ATOM 2315 CG GLU B 32 10.990 -16.719 3.151 1.00 65.31 C ATOM 2316 CD GLU B 32 9.455 -16.702 3.094 1.00 10.24 C ATOM 2317 OE1 GLU B 32 8.806 -17.719 3.450 1.00 60.24 O ATOM 2318 OE2 GLU B 32 8.888 -15.675 2.664 1.00 33.40 O ATOM 0 H GLU B 32 12.950 -14.817 2.302 1.00 61.03 H new ATOM 0 HA GLU B 32 13.558 -17.603 2.410 1.00 55.22 H new ATOM 0 HB2 GLU B 32 11.255 -16.062 1.114 1.00 55.44 H new ATOM 0 HB3 GLU B 32 11.291 -17.803 1.311 1.00 55.44 H new ATOM 0 HG2 GLU B 32 11.319 -17.543 3.784 1.00 65.31 H new ATOM 0 HG3 GLU B 32 11.344 -15.799 3.615 1.00 65.31 H new ATOM 2325 N ASP B 33 13.970 -16.084 -0.465 1.00 4.20 N ATOM 2326 CA ASP B 33 14.491 -16.197 -1.848 1.00 0.05 C ATOM 2327 C ASP B 33 15.942 -16.711 -1.830 1.00 15.53 C ATOM 2328 O ASP B 33 16.337 -17.554 -2.644 1.00 32.22 O ATOM 2329 CB ASP B 33 14.398 -14.821 -2.562 1.00 53.23 C ATOM 2330 CG ASP B 33 14.873 -14.868 -4.024 1.00 52.32 C ATOM 2331 OD1 ASP B 33 14.067 -15.230 -4.911 1.00 65.54 O ATOM 2332 OD2 ASP B 33 16.049 -14.548 -4.295 1.00 70.14 O ATOM 0 H ASP B 33 13.843 -15.120 -0.157 1.00 4.20 H new ATOM 0 HA ASP B 33 13.885 -16.914 -2.402 1.00 0.05 H new ATOM 0 HB2 ASP B 33 13.366 -14.472 -2.532 1.00 53.23 H new ATOM 0 HB3 ASP B 33 14.997 -14.093 -2.015 1.00 53.23 H new ATOM 2337 N ILE B 34 16.718 -16.184 -0.871 1.00 12.24 N ATOM 2338 CA ILE B 34 18.087 -16.647 -0.570 1.00 11.52 C ATOM 2339 C ILE B 34 18.019 -17.968 0.251 1.00 41.23 C ATOM 2340 O ILE B 34 19.003 -18.710 0.374 1.00 63.32 O ATOM 2341 CB ILE B 34 18.877 -15.521 0.213 1.00 62.42 C ATOM 2342 CG1 ILE B 34 18.824 -14.168 -0.583 1.00 13.31 C ATOM 2343 CG2 ILE B 34 20.345 -15.940 0.493 1.00 64.33 C ATOM 2344 CD1 ILE B 34 19.439 -12.969 0.128 1.00 53.35 C ATOM 0 H ILE B 34 16.412 -15.416 -0.274 1.00 12.24 H new ATOM 0 HA ILE B 34 18.622 -16.847 -1.498 1.00 11.52 H new ATOM 0 HB ILE B 34 18.391 -15.380 1.179 1.00 62.42 H new ATOM 0 HG12 ILE B 34 19.335 -14.306 -1.536 1.00 13.31 H new ATOM 0 HG13 ILE B 34 17.783 -13.940 -0.810 1.00 13.31 H new ATOM 0 HG21 ILE B 34 20.855 -15.141 1.032 1.00 64.33 H new ATOM 0 HG22 ILE B 34 20.356 -16.848 1.095 1.00 64.33 H new ATOM 0 HG23 ILE B 34 20.857 -16.125 -0.451 1.00 64.33 H new ATOM 0 HD11 ILE B 34 19.351 -12.086 -0.505 1.00 53.35 H new ATOM 0 HD12 ILE B 34 18.915 -12.795 1.068 1.00 53.35 H new ATOM 0 HD13 ILE B 34 20.492 -13.167 0.331 1.00 53.35 H new ATOM 2356 N GLY B 35 16.815 -18.256 0.777 1.00 44.45 N ATOM 2357 CA GLY B 35 16.553 -19.440 1.576 1.00 53.34 C ATOM 2358 C GLY B 35 16.664 -19.126 3.051 1.00 11.14 C ATOM 2359 O GLY B 35 15.653 -19.025 3.763 1.00 33.55 O ATOM 0 H GLY B 35 15.997 -17.660 0.651 1.00 44.45 H new ATOM 0 HA2 GLY B 35 15.556 -19.821 1.354 1.00 53.34 H new ATOM 0 HA3 GLY B 35 17.260 -20.226 1.312 1.00 53.34 H new ATOM 2363 N GLU B 36 17.912 -18.941 3.502 1.00 43.32 N ATOM 2364 CA GLU B 36 18.240 -18.594 4.892 1.00 14.11 C ATOM 2365 C GLU B 36 19.335 -17.512 4.877 1.00 73.14 C ATOM 2366 O GLU B 36 20.485 -17.804 4.519 1.00 43.31 O ATOM 2367 CB GLU B 36 18.706 -19.866 5.674 1.00 51.14 C ATOM 2368 CG GLU B 36 17.681 -21.031 5.677 1.00 51.42 C ATOM 2369 CD GLU B 36 18.125 -22.264 6.486 1.00 12.43 C ATOM 2370 OE1 GLU B 36 17.674 -22.427 7.645 1.00 65.33 O ATOM 2371 OE2 GLU B 36 18.937 -23.065 5.974 1.00 42.32 O ATOM 0 H GLU B 36 18.733 -19.029 2.904 1.00 43.32 H new ATOM 0 HA GLU B 36 17.359 -18.206 5.403 1.00 14.11 H new ATOM 0 HB2 GLU B 36 19.640 -20.222 5.240 1.00 51.14 H new ATOM 0 HB3 GLU B 36 18.920 -19.585 6.705 1.00 51.14 H new ATOM 0 HG2 GLU B 36 16.736 -20.667 6.081 1.00 51.42 H new ATOM 0 HG3 GLU B 36 17.492 -21.335 4.648 1.00 51.42 H new ATOM 2378 N SER B 37 18.964 -16.261 5.211 1.00 64.35 N ATOM 2379 CA SER B 37 19.896 -15.121 5.233 1.00 4.32 C ATOM 2380 C SER B 37 19.591 -14.178 6.415 1.00 3.24 C ATOM 2381 O SER B 37 18.576 -13.469 6.420 1.00 13.35 O ATOM 2382 CB SER B 37 19.839 -14.350 3.888 1.00 55.20 C ATOM 2383 OG SER B 37 18.515 -13.971 3.556 1.00 73.31 O ATOM 0 H SER B 37 18.010 -16.014 5.473 1.00 64.35 H new ATOM 0 HA SER B 37 20.905 -15.510 5.368 1.00 4.32 H new ATOM 0 HB2 SER B 37 20.467 -13.461 3.951 1.00 55.20 H new ATOM 0 HB3 SER B 37 20.249 -14.974 3.094 1.00 55.20 H new ATOM 0 HG SER B 37 18.079 -13.581 4.343 1.00 73.31 H new ATOM 2389 N ASP B 38 20.462 -14.221 7.438 1.00 14.23 N ATOM 2390 CA ASP B 38 20.476 -13.239 8.546 1.00 21.53 C ATOM 2391 C ASP B 38 21.435 -12.071 8.208 1.00 23.21 C ATOM 2392 O ASP B 38 21.426 -11.033 8.887 1.00 72.42 O ATOM 2393 CB ASP B 38 20.889 -13.929 9.876 1.00 14.23 C ATOM 2394 CG ASP B 38 22.341 -14.455 9.877 1.00 44.23 C ATOM 2395 OD1 ASP B 38 22.624 -15.445 9.166 1.00 73.22 O ATOM 2396 OD2 ASP B 38 23.200 -13.887 10.588 1.00 2.02 O ATOM 0 H ASP B 38 21.181 -14.940 7.524 1.00 14.23 H new ATOM 0 HA ASP B 38 19.472 -12.834 8.673 1.00 21.53 H new ATOM 0 HB2 ASP B 38 20.768 -13.221 10.696 1.00 14.23 H new ATOM 0 HB3 ASP B 38 20.211 -14.760 10.070 1.00 14.23 H new ATOM 2401 N SER B 39 22.261 -12.280 7.154 1.00 50.15 N ATOM 2402 CA SER B 39 23.210 -11.281 6.616 1.00 42.42 C ATOM 2403 C SER B 39 22.480 -9.987 6.158 1.00 10.20 C ATOM 2404 O SER B 39 21.307 -10.067 5.784 1.00 0.41 O ATOM 2405 CB SER B 39 24.000 -11.922 5.442 1.00 20.13 C ATOM 2406 OG SER B 39 24.766 -13.033 5.883 1.00 32.53 O ATOM 0 H SER B 39 22.285 -13.164 6.646 1.00 50.15 H new ATOM 0 HA SER B 39 23.902 -10.987 7.405 1.00 42.42 H new ATOM 0 HB2 SER B 39 23.306 -12.241 4.665 1.00 20.13 H new ATOM 0 HB3 SER B 39 24.659 -11.178 4.995 1.00 20.13 H new ATOM 0 HG SER B 39 25.251 -13.418 5.124 1.00 32.53 H new ATOM 2412 N PRO B 40 23.165 -8.783 6.189 1.00 22.44 N ATOM 2413 CA PRO B 40 22.525 -7.472 5.891 1.00 0.43 C ATOM 2414 C PRO B 40 21.762 -7.443 4.552 1.00 11.25 C ATOM 2415 O PRO B 40 22.378 -7.476 3.482 1.00 13.02 O ATOM 2416 CB PRO B 40 23.710 -6.469 5.891 1.00 44.31 C ATOM 2417 CG PRO B 40 24.763 -7.117 6.738 1.00 23.43 C ATOM 2418 CD PRO B 40 24.614 -8.606 6.511 1.00 22.43 C ATOM 0 HA PRO B 40 21.757 -7.235 6.627 1.00 0.43 H new ATOM 0 HB2 PRO B 40 24.073 -6.287 4.880 1.00 44.31 H new ATOM 0 HB3 PRO B 40 23.411 -5.504 6.301 1.00 44.31 H new ATOM 0 HG2 PRO B 40 25.758 -6.776 6.454 1.00 23.43 H new ATOM 0 HG3 PRO B 40 24.628 -6.866 7.790 1.00 23.43 H new ATOM 0 HD2 PRO B 40 25.249 -8.950 5.694 1.00 22.43 H new ATOM 0 HD3 PRO B 40 24.898 -9.175 7.397 1.00 22.43 H new ATOM 2426 N ILE B 41 20.415 -7.448 4.643 1.00 61.32 N ATOM 2427 CA ILE B 41 19.524 -7.243 3.497 1.00 42.45 C ATOM 2428 C ILE B 41 19.599 -5.744 3.092 1.00 32.33 C ATOM 2429 O ILE B 41 19.127 -4.888 3.859 1.00 65.51 O ATOM 2430 CB ILE B 41 18.014 -7.650 3.819 1.00 31.44 C ATOM 2431 CG1 ILE B 41 17.873 -9.164 4.262 1.00 2.31 C ATOM 2432 CG2 ILE B 41 17.083 -7.340 2.613 1.00 73.22 C ATOM 2433 CD1 ILE B 41 18.126 -9.445 5.747 1.00 53.10 C ATOM 0 H ILE B 41 19.919 -7.596 5.522 1.00 61.32 H new ATOM 0 HA ILE B 41 19.851 -7.886 2.680 1.00 42.45 H new ATOM 0 HB ILE B 41 17.701 -7.040 4.667 1.00 31.44 H new ATOM 0 HG12 ILE B 41 16.868 -9.505 4.012 1.00 2.31 H new ATOM 0 HG13 ILE B 41 18.569 -9.762 3.674 1.00 2.31 H new ATOM 0 HG21 ILE B 41 16.061 -7.627 2.859 1.00 73.22 H new ATOM 0 HG22 ILE B 41 17.117 -6.273 2.392 1.00 73.22 H new ATOM 0 HG23 ILE B 41 17.418 -7.902 1.741 1.00 73.22 H new ATOM 0 HD11 ILE B 41 18.003 -10.510 5.942 1.00 53.10 H new ATOM 0 HD12 ILE B 41 19.141 -9.143 6.007 1.00 53.10 H new ATOM 0 HD13 ILE B 41 17.414 -8.882 6.350 1.00 53.10 H new ATOM 2445 N PRO B 42 20.233 -5.388 1.919 1.00 41.35 N ATOM 2446 CA PRO B 42 20.326 -3.987 1.469 1.00 24.22 C ATOM 2447 C PRO B 42 18.985 -3.517 0.848 1.00 65.13 C ATOM 2448 O PRO B 42 18.416 -4.187 -0.027 1.00 33.20 O ATOM 2449 CB PRO B 42 21.483 -4.022 0.436 1.00 61.31 C ATOM 2450 CG PRO B 42 21.439 -5.405 -0.149 1.00 72.12 C ATOM 2451 CD PRO B 42 20.891 -6.317 0.945 1.00 52.24 C ATOM 0 HA PRO B 42 20.519 -3.278 2.274 1.00 24.22 H new ATOM 0 HB2 PRO B 42 21.348 -3.263 -0.334 1.00 61.31 H new ATOM 0 HB3 PRO B 42 22.444 -3.825 0.912 1.00 61.31 H new ATOM 0 HG2 PRO B 42 20.802 -5.433 -1.033 1.00 72.12 H new ATOM 0 HG3 PRO B 42 22.433 -5.727 -0.461 1.00 72.12 H new ATOM 0 HD2 PRO B 42 20.179 -7.037 0.541 1.00 52.24 H new ATOM 0 HD3 PRO B 42 21.688 -6.889 1.420 1.00 52.24 H new ATOM 2459 N LEU B 43 18.472 -2.383 1.340 1.00 71.33 N ATOM 2460 CA LEU B 43 17.189 -1.806 0.912 1.00 62.41 C ATOM 2461 C LEU B 43 17.459 -0.427 0.257 1.00 73.05 C ATOM 2462 O LEU B 43 17.451 0.603 0.948 1.00 53.11 O ATOM 2463 CB LEU B 43 16.218 -1.696 2.134 1.00 44.52 C ATOM 2464 CG LEU B 43 15.841 -3.042 2.849 1.00 42.11 C ATOM 2465 CD1 LEU B 43 14.990 -2.797 4.119 1.00 62.01 C ATOM 2466 CD2 LEU B 43 15.133 -4.019 1.881 1.00 61.40 C ATOM 0 H LEU B 43 18.942 -1.831 2.057 1.00 71.33 H new ATOM 0 HA LEU B 43 16.706 -2.449 0.176 1.00 62.41 H new ATOM 0 HB2 LEU B 43 16.670 -1.033 2.871 1.00 44.52 H new ATOM 0 HB3 LEU B 43 15.298 -1.218 1.797 1.00 44.52 H new ATOM 0 HG LEU B 43 16.774 -3.509 3.166 1.00 42.11 H new ATOM 0 HD11 LEU B 43 14.749 -3.752 4.586 1.00 62.01 H new ATOM 0 HD12 LEU B 43 15.553 -2.182 4.821 1.00 62.01 H new ATOM 0 HD13 LEU B 43 14.068 -2.284 3.846 1.00 62.01 H new ATOM 0 HD21 LEU B 43 14.887 -4.940 2.409 1.00 61.40 H new ATOM 0 HD22 LEU B 43 14.218 -3.560 1.505 1.00 61.40 H new ATOM 0 HD23 LEU B 43 15.795 -4.246 1.045 1.00 61.40 H new ATOM 2478 N PRO B 44 17.732 -0.382 -1.095 1.00 52.10 N ATOM 2479 CA PRO B 44 18.133 0.845 -1.807 1.00 14.34 C ATOM 2480 C PRO B 44 16.907 1.669 -2.259 1.00 31.01 C ATOM 2481 O PRO B 44 16.679 1.890 -3.457 1.00 14.01 O ATOM 2482 CB PRO B 44 18.979 0.296 -2.996 1.00 5.24 C ATOM 2483 CG PRO B 44 18.653 -1.181 -3.118 1.00 44.00 C ATOM 2484 CD PRO B 44 17.624 -1.510 -2.051 1.00 63.54 C ATOM 0 HA PRO B 44 18.696 1.546 -1.191 1.00 14.34 H new ATOM 0 HB2 PRO B 44 18.737 0.823 -3.919 1.00 5.24 H new ATOM 0 HB3 PRO B 44 20.044 0.444 -2.814 1.00 5.24 H new ATOM 0 HG2 PRO B 44 18.262 -1.407 -4.110 1.00 44.00 H new ATOM 0 HG3 PRO B 44 19.551 -1.784 -2.984 1.00 44.00 H new ATOM 0 HD2 PRO B 44 16.621 -1.583 -2.472 1.00 63.54 H new ATOM 0 HD3 PRO B 44 17.838 -2.464 -1.570 1.00 63.54 H new ATOM 2492 N ASN B 45 16.139 2.136 -1.263 1.00 71.10 N ATOM 2493 CA ASN B 45 14.888 2.885 -1.476 1.00 62.12 C ATOM 2494 C ASN B 45 14.521 3.620 -0.177 1.00 30.32 C ATOM 2495 O ASN B 45 14.372 4.848 -0.156 1.00 73.33 O ATOM 2496 CB ASN B 45 13.745 1.916 -1.899 1.00 15.23 C ATOM 2497 CG ASN B 45 12.425 2.621 -2.246 1.00 30.15 C ATOM 2498 OD1 ASN B 45 11.586 2.872 -1.379 1.00 51.03 O ATOM 2499 ND2 ASN B 45 12.230 2.929 -3.521 1.00 11.30 N ATOM 0 H ASN B 45 16.369 2.004 -0.278 1.00 71.10 H new ATOM 0 HA ASN B 45 15.026 3.612 -2.276 1.00 62.12 H new ATOM 0 HB2 ASN B 45 14.074 1.337 -2.762 1.00 15.23 H new ATOM 0 HB3 ASN B 45 13.565 1.208 -1.090 1.00 15.23 H new ATOM 0 HD21 ASN B 45 11.365 3.387 -3.808 1.00 11.30 H new ATOM 0 HD22 ASN B 45 12.945 2.708 -4.214 1.00 11.30 H new ATOM 2506 N VAL B 46 14.390 2.839 0.910 1.00 24.31 N ATOM 2507 CA VAL B 46 14.037 3.360 2.244 1.00 12.31 C ATOM 2508 C VAL B 46 15.314 3.813 2.994 1.00 44.04 C ATOM 2509 O VAL B 46 16.296 3.068 3.071 1.00 44.55 O ATOM 2510 CB VAL B 46 13.224 2.283 3.076 1.00 55.41 C ATOM 2511 CG1 VAL B 46 14.004 0.962 3.268 1.00 74.13 C ATOM 2512 CG2 VAL B 46 12.751 2.851 4.431 1.00 55.22 C ATOM 0 H VAL B 46 14.526 1.828 0.889 1.00 24.31 H new ATOM 0 HA VAL B 46 13.390 4.229 2.121 1.00 12.31 H new ATOM 0 HB VAL B 46 12.341 2.043 2.483 1.00 55.41 H new ATOM 0 HG11 VAL B 46 13.399 0.262 3.844 1.00 74.13 H new ATOM 0 HG12 VAL B 46 14.231 0.528 2.294 1.00 74.13 H new ATOM 0 HG13 VAL B 46 14.933 1.162 3.801 1.00 74.13 H new ATOM 0 HG21 VAL B 46 12.197 2.085 4.973 1.00 55.22 H new ATOM 0 HG22 VAL B 46 13.616 3.158 5.019 1.00 55.22 H new ATOM 0 HG23 VAL B 46 12.105 3.712 4.259 1.00 55.22 H new ATOM 2522 N THR B 47 15.305 5.054 3.513 1.00 14.42 N ATOM 2523 CA THR B 47 16.438 5.622 4.272 1.00 42.00 C ATOM 2524 C THR B 47 16.431 5.106 5.726 1.00 62.34 C ATOM 2525 O THR B 47 15.498 4.409 6.136 1.00 3.04 O ATOM 2526 CB THR B 47 16.395 7.185 4.248 1.00 12.11 C ATOM 2527 OG1 THR B 47 15.154 7.646 4.805 1.00 72.23 O ATOM 2528 CG2 THR B 47 16.558 7.742 2.818 1.00 62.50 C ATOM 0 H THR B 47 14.514 5.692 3.419 1.00 14.42 H new ATOM 0 HA THR B 47 17.362 5.297 3.794 1.00 42.00 H new ATOM 0 HB THR B 47 17.231 7.548 4.846 1.00 12.11 H new ATOM 0 HG1 THR B 47 15.132 8.626 4.789 1.00 72.23 H new ATOM 0 HG21 THR B 47 16.522 8.831 2.845 1.00 62.50 H new ATOM 0 HG22 THR B 47 17.516 7.420 2.409 1.00 62.50 H new ATOM 0 HG23 THR B 47 15.751 7.368 2.188 1.00 62.50 H new ATOM 2536 N SER B 48 17.479 5.467 6.491 1.00 32.03 N ATOM 2537 CA SER B 48 17.700 4.960 7.861 1.00 14.25 C ATOM 2538 C SER B 48 16.601 5.408 8.829 1.00 50.41 C ATOM 2539 O SER B 48 16.051 4.588 9.558 1.00 0.34 O ATOM 2540 CB SER B 48 19.066 5.439 8.380 1.00 23.14 C ATOM 2541 OG SER B 48 19.150 6.858 8.357 1.00 11.13 O ATOM 0 H SER B 48 18.198 6.119 6.177 1.00 32.03 H new ATOM 0 HA SER B 48 17.676 3.871 7.812 1.00 14.25 H new ATOM 0 HB2 SER B 48 19.220 5.078 9.397 1.00 23.14 H new ATOM 0 HB3 SER B 48 19.861 5.014 7.768 1.00 23.14 H new ATOM 0 HG SER B 48 20.040 7.128 8.047 1.00 11.13 H new ATOM 2547 N THR B 49 16.289 6.711 8.798 1.00 72.21 N ATOM 2548 CA THR B 49 15.322 7.341 9.709 1.00 30.21 C ATOM 2549 C THR B 49 13.908 6.761 9.503 1.00 13.51 C ATOM 2550 O THR B 49 13.159 6.537 10.466 1.00 11.43 O ATOM 2551 CB THR B 49 15.298 8.884 9.479 1.00 65.11 C ATOM 2552 OG1 THR B 49 14.946 9.158 8.110 1.00 53.14 O ATOM 2553 CG2 THR B 49 16.655 9.547 9.807 1.00 22.25 C ATOM 0 H THR B 49 16.705 7.364 8.134 1.00 72.21 H new ATOM 0 HA THR B 49 15.634 7.132 10.732 1.00 30.21 H new ATOM 0 HB THR B 49 14.555 9.307 10.155 1.00 65.11 H new ATOM 0 HG1 THR B 49 14.929 10.127 7.964 1.00 53.14 H new ATOM 0 HG21 THR B 49 16.587 10.621 9.631 1.00 22.25 H new ATOM 0 HG22 THR B 49 16.905 9.366 10.852 1.00 22.25 H new ATOM 0 HG23 THR B 49 17.431 9.123 9.169 1.00 22.25 H new ATOM 2561 N ILE B 50 13.571 6.513 8.226 1.00 11.14 N ATOM 2562 CA ILE B 50 12.263 5.985 7.826 1.00 41.24 C ATOM 2563 C ILE B 50 12.162 4.501 8.214 1.00 33.14 C ATOM 2564 O ILE B 50 11.183 4.096 8.835 1.00 3.21 O ATOM 2565 CB ILE B 50 12.021 6.199 6.281 1.00 12.20 C ATOM 2566 CG1 ILE B 50 12.101 7.720 5.927 1.00 30.04 C ATOM 2567 CG2 ILE B 50 10.677 5.595 5.810 1.00 2.41 C ATOM 2568 CD1 ILE B 50 11.097 8.607 6.658 1.00 22.44 C ATOM 0 H ILE B 50 14.203 6.675 7.442 1.00 11.14 H new ATOM 0 HA ILE B 50 11.481 6.531 8.353 1.00 41.24 H new ATOM 0 HB ILE B 50 12.810 5.668 5.749 1.00 12.20 H new ATOM 0 HG12 ILE B 50 13.107 8.077 6.149 1.00 30.04 H new ATOM 0 HG13 ILE B 50 11.951 7.836 4.854 1.00 30.04 H new ATOM 0 HG21 ILE B 50 10.556 5.767 4.741 1.00 2.41 H new ATOM 0 HG22 ILE B 50 10.671 4.523 6.008 1.00 2.41 H new ATOM 0 HG23 ILE B 50 9.857 6.068 6.349 1.00 2.41 H new ATOM 0 HD11 ILE B 50 11.231 9.643 6.346 1.00 22.44 H new ATOM 0 HD12 ILE B 50 10.084 8.284 6.418 1.00 22.44 H new ATOM 0 HD13 ILE B 50 11.258 8.529 7.733 1.00 22.44 H new ATOM 2580 N LEU B 51 13.223 3.722 7.897 1.00 5.44 N ATOM 2581 CA LEU B 51 13.303 2.275 8.216 1.00 35.41 C ATOM 2582 C LEU B 51 13.271 2.039 9.741 1.00 34.31 C ATOM 2583 O LEU B 51 12.689 1.062 10.210 1.00 33.33 O ATOM 2584 CB LEU B 51 14.590 1.647 7.596 1.00 51.41 C ATOM 2585 CG LEU B 51 14.752 0.093 7.751 1.00 52.34 C ATOM 2586 CD1 LEU B 51 13.582 -0.671 7.083 1.00 31.35 C ATOM 2587 CD2 LEU B 51 16.121 -0.389 7.212 1.00 14.13 C ATOM 0 H LEU B 51 14.048 4.078 7.413 1.00 5.44 H new ATOM 0 HA LEU B 51 12.431 1.787 7.779 1.00 35.41 H new ATOM 0 HB2 LEU B 51 14.610 1.888 6.533 1.00 51.41 H new ATOM 0 HB3 LEU B 51 15.457 2.128 8.049 1.00 51.41 H new ATOM 0 HG LEU B 51 14.721 -0.132 8.817 1.00 52.34 H new ATOM 0 HD11 LEU B 51 13.728 -1.744 7.210 1.00 31.35 H new ATOM 0 HD12 LEU B 51 12.642 -0.375 7.548 1.00 31.35 H new ATOM 0 HD13 LEU B 51 13.552 -0.433 6.020 1.00 31.35 H new ATOM 0 HD21 LEU B 51 16.200 -1.469 7.335 1.00 14.13 H new ATOM 0 HD22 LEU B 51 16.205 -0.137 6.155 1.00 14.13 H new ATOM 0 HD23 LEU B 51 16.923 0.099 7.767 1.00 14.13 H new ATOM 2599 N GLU B 52 13.884 2.974 10.489 1.00 24.31 N ATOM 2600 CA GLU B 52 13.908 2.965 11.965 1.00 35.11 C ATOM 2601 C GLU B 52 12.478 3.046 12.512 1.00 61.20 C ATOM 2602 O GLU B 52 12.063 2.210 13.321 1.00 63.32 O ATOM 2603 CB GLU B 52 14.790 4.153 12.467 1.00 62.01 C ATOM 2604 CG GLU B 52 14.831 4.385 14.006 1.00 64.21 C ATOM 2605 CD GLU B 52 13.783 5.400 14.532 1.00 33.22 C ATOM 2606 OE1 GLU B 52 14.021 6.617 14.418 1.00 24.05 O ATOM 2607 OE2 GLU B 52 12.734 4.988 15.076 1.00 50.24 O ATOM 0 H GLU B 52 14.382 3.766 10.083 1.00 24.31 H new ATOM 0 HA GLU B 52 14.344 2.035 12.330 1.00 35.11 H new ATOM 0 HB2 GLU B 52 15.810 3.992 12.119 1.00 62.01 H new ATOM 0 HB3 GLU B 52 14.433 5.067 11.993 1.00 62.01 H new ATOM 0 HG2 GLU B 52 14.677 3.430 14.509 1.00 64.21 H new ATOM 0 HG3 GLU B 52 15.826 4.734 14.282 1.00 64.21 H new ATOM 2614 N LYS B 53 11.735 4.055 12.020 1.00 55.44 N ATOM 2615 CA LYS B 53 10.328 4.300 12.393 1.00 22.34 C ATOM 2616 C LYS B 53 9.416 3.117 12.000 1.00 5.40 C ATOM 2617 O LYS B 53 8.535 2.728 12.770 1.00 52.11 O ATOM 2618 CB LYS B 53 9.824 5.624 11.734 1.00 42.22 C ATOM 2619 CG LYS B 53 10.093 6.910 12.553 1.00 12.14 C ATOM 2620 CD LYS B 53 9.517 8.177 11.865 1.00 71.20 C ATOM 2621 CE LYS B 53 10.271 8.555 10.579 1.00 53.31 C ATOM 2622 NZ LYS B 53 11.681 8.937 10.867 1.00 45.22 N ATOM 0 H LYS B 53 12.097 4.730 11.346 1.00 55.44 H new ATOM 0 HA LYS B 53 10.281 4.399 13.478 1.00 22.34 H new ATOM 0 HB2 LYS B 53 10.297 5.728 10.758 1.00 42.22 H new ATOM 0 HB3 LYS B 53 8.751 5.540 11.561 1.00 42.22 H new ATOM 0 HG2 LYS B 53 9.653 6.806 13.545 1.00 12.14 H new ATOM 0 HG3 LYS B 53 11.167 7.031 12.693 1.00 12.14 H new ATOM 0 HD2 LYS B 53 8.466 8.010 11.628 1.00 71.20 H new ATOM 0 HD3 LYS B 53 9.557 9.013 12.563 1.00 71.20 H new ATOM 0 HE2 LYS B 53 10.255 7.714 9.886 1.00 53.31 H new ATOM 0 HE3 LYS B 53 9.761 9.384 10.087 1.00 53.31 H new ATOM 0 HZ1 LYS B 53 12.003 9.632 10.163 1.00 45.22 H new ATOM 0 HZ2 LYS B 53 11.740 9.354 11.818 1.00 45.22 H new ATOM 0 HZ3 LYS B 53 12.286 8.092 10.821 1.00 45.22 H new ATOM 2636 N VAL B 54 9.651 2.567 10.797 1.00 34.45 N ATOM 2637 CA VAL B 54 8.864 1.456 10.238 1.00 14.44 C ATOM 2638 C VAL B 54 9.010 0.185 11.108 1.00 34.33 C ATOM 2639 O VAL B 54 8.009 -0.456 11.459 1.00 64.50 O ATOM 2640 CB VAL B 54 9.283 1.187 8.732 1.00 61.35 C ATOM 2641 CG1 VAL B 54 8.742 -0.152 8.200 1.00 3.24 C ATOM 2642 CG2 VAL B 54 8.818 2.349 7.813 1.00 72.42 C ATOM 0 H VAL B 54 10.399 2.884 10.180 1.00 34.45 H new ATOM 0 HA VAL B 54 7.810 1.735 10.247 1.00 14.44 H new ATOM 0 HB VAL B 54 10.371 1.130 8.718 1.00 61.35 H new ATOM 0 HG11 VAL B 54 9.058 -0.287 7.165 1.00 3.24 H new ATOM 0 HG12 VAL B 54 9.132 -0.969 8.807 1.00 3.24 H new ATOM 0 HG13 VAL B 54 7.653 -0.150 8.250 1.00 3.24 H new ATOM 0 HG21 VAL B 54 9.117 2.142 6.785 1.00 72.42 H new ATOM 0 HG22 VAL B 54 7.733 2.441 7.864 1.00 72.42 H new ATOM 0 HG23 VAL B 54 9.277 3.281 8.144 1.00 72.42 H new ATOM 2652 N LEU B 55 10.262 -0.128 11.495 1.00 25.43 N ATOM 2653 CA LEU B 55 10.576 -1.317 12.315 1.00 62.45 C ATOM 2654 C LEU B 55 10.086 -1.140 13.759 1.00 11.15 C ATOM 2655 O LEU B 55 9.619 -2.104 14.376 1.00 51.32 O ATOM 2656 CB LEU B 55 12.101 -1.613 12.293 1.00 31.32 C ATOM 2657 CG LEU B 55 12.681 -2.045 10.909 1.00 31.45 C ATOM 2658 CD1 LEU B 55 14.216 -2.222 10.977 1.00 65.13 C ATOM 2659 CD2 LEU B 55 11.976 -3.319 10.376 1.00 51.41 C ATOM 0 H LEU B 55 11.080 0.431 11.251 1.00 25.43 H new ATOM 0 HA LEU B 55 10.051 -2.168 11.881 1.00 62.45 H new ATOM 0 HB2 LEU B 55 12.632 -0.722 12.628 1.00 31.32 H new ATOM 0 HB3 LEU B 55 12.311 -2.400 13.017 1.00 31.32 H new ATOM 0 HG LEU B 55 12.479 -1.245 10.197 1.00 31.45 H new ATOM 0 HD11 LEU B 55 14.591 -2.523 9.999 1.00 65.13 H new ATOM 0 HD12 LEU B 55 14.678 -1.279 11.269 1.00 65.13 H new ATOM 0 HD13 LEU B 55 14.462 -2.989 11.712 1.00 65.13 H new ATOM 0 HD21 LEU B 55 12.402 -3.594 9.411 1.00 51.41 H new ATOM 0 HD22 LEU B 55 12.119 -4.137 11.082 1.00 51.41 H new ATOM 0 HD23 LEU B 55 10.910 -3.123 10.259 1.00 51.41 H new ATOM 2671 N ASP B 56 10.182 0.107 14.272 1.00 21.23 N ATOM 2672 CA ASP B 56 9.810 0.435 15.663 1.00 12.32 C ATOM 2673 C ASP B 56 8.286 0.377 15.846 1.00 4.42 C ATOM 2674 O ASP B 56 7.791 -0.049 16.892 1.00 73.12 O ATOM 2675 CB ASP B 56 10.372 1.818 16.087 1.00 64.34 C ATOM 2676 CG ASP B 56 10.219 2.086 17.600 1.00 70.51 C ATOM 2677 OD1 ASP B 56 10.726 1.275 18.405 1.00 72.44 O ATOM 2678 OD2 ASP B 56 9.630 3.115 17.995 1.00 41.24 O ATOM 0 H ASP B 56 10.517 0.908 13.736 1.00 21.23 H new ATOM 0 HA ASP B 56 10.259 -0.314 16.315 1.00 12.32 H new ATOM 0 HB2 ASP B 56 11.426 1.875 15.817 1.00 64.34 H new ATOM 0 HB3 ASP B 56 9.857 2.601 15.530 1.00 64.34 H new ATOM 2683 N TYR B 57 7.549 0.783 14.802 1.00 22.51 N ATOM 2684 CA TYR B 57 6.082 0.677 14.769 1.00 64.24 C ATOM 2685 C TYR B 57 5.662 -0.812 14.769 1.00 74.24 C ATOM 2686 O TYR B 57 4.748 -1.216 15.508 1.00 41.40 O ATOM 2687 CB TYR B 57 5.527 1.426 13.527 1.00 22.32 C ATOM 2688 CG TYR B 57 4.010 1.318 13.353 1.00 11.11 C ATOM 2689 CD1 TYR B 57 3.449 0.287 12.596 1.00 42.14 C ATOM 2690 CD2 TYR B 57 3.138 2.214 13.972 1.00 73.43 C ATOM 2691 CE1 TYR B 57 2.098 0.147 12.470 1.00 54.45 C ATOM 2692 CE2 TYR B 57 1.769 2.079 13.832 1.00 43.24 C ATOM 2693 CZ TYR B 57 1.258 1.039 13.085 1.00 23.13 C ATOM 2694 OH TYR B 57 -0.103 0.866 12.977 1.00 21.20 O ATOM 0 H TYR B 57 7.951 1.193 13.959 1.00 22.51 H new ATOM 0 HA TYR B 57 5.660 1.144 15.659 1.00 64.24 H new ATOM 0 HB2 TYR B 57 5.799 2.479 13.601 1.00 22.32 H new ATOM 0 HB3 TYR B 57 6.012 1.034 12.633 1.00 22.32 H new ATOM 0 HD1 TYR B 57 4.100 -0.416 12.098 1.00 42.14 H new ATOM 0 HD2 TYR B 57 3.537 3.022 14.567 1.00 73.43 H new ATOM 0 HE1 TYR B 57 1.691 -0.665 11.887 1.00 54.45 H new ATOM 0 HE2 TYR B 57 1.103 2.785 14.306 1.00 43.24 H new ATOM 0 HH TYR B 57 -0.348 0.780 12.032 1.00 21.20 H new ATOM 2704 N CYS B 58 6.353 -1.612 13.926 1.00 61.41 N ATOM 2705 CA CYS B 58 6.132 -3.067 13.815 1.00 35.43 C ATOM 2706 C CYS B 58 6.444 -3.797 15.143 1.00 72.43 C ATOM 2707 O CYS B 58 5.836 -4.837 15.442 1.00 15.51 O ATOM 2708 CB CYS B 58 6.964 -3.647 12.646 1.00 4.42 C ATOM 2709 SG CYS B 58 6.458 -3.034 11.021 1.00 50.45 S ATOM 0 H CYS B 58 7.081 -1.263 13.303 1.00 61.41 H new ATOM 0 HA CYS B 58 5.076 -3.232 13.603 1.00 35.43 H new ATOM 0 HB2 CYS B 58 8.015 -3.406 12.805 1.00 4.42 H new ATOM 0 HB3 CYS B 58 6.881 -4.734 12.657 1.00 4.42 H new ATOM 0 HG CYS B 58 6.965 -1.853 10.825 1.00 50.45 H new ATOM 2715 N ARG B 59 7.406 -3.239 15.926 1.00 64.42 N ATOM 2716 CA ARG B 59 7.715 -3.719 17.293 1.00 4.21 C ATOM 2717 C ARG B 59 6.457 -3.670 18.179 1.00 4.20 C ATOM 2718 O ARG B 59 6.077 -4.681 18.757 1.00 12.01 O ATOM 2719 CB ARG B 59 8.847 -2.882 17.964 1.00 41.42 C ATOM 2720 CG ARG B 59 10.258 -3.084 17.384 1.00 73.32 C ATOM 2721 CD ARG B 59 11.302 -2.169 18.053 1.00 70.23 C ATOM 2722 NE ARG B 59 12.673 -2.464 17.612 1.00 32.25 N ATOM 2723 CZ ARG B 59 13.530 -3.277 18.248 1.00 32.32 C ATOM 2724 NH1 ARG B 59 13.175 -3.903 19.370 1.00 42.40 N ATOM 2725 NH2 ARG B 59 14.741 -3.457 17.756 1.00 11.23 N ATOM 0 H ARG B 59 7.982 -2.452 15.628 1.00 64.42 H new ATOM 0 HA ARG B 59 8.061 -4.748 17.197 1.00 4.21 H new ATOM 0 HB2 ARG B 59 8.589 -1.826 17.884 1.00 41.42 H new ATOM 0 HB3 ARG B 59 8.872 -3.125 19.026 1.00 41.42 H new ATOM 0 HG2 ARG B 59 10.555 -4.125 17.512 1.00 73.32 H new ATOM 0 HG3 ARG B 59 10.239 -2.887 16.312 1.00 73.32 H new ATOM 0 HD2 ARG B 59 11.067 -1.129 17.827 1.00 70.23 H new ATOM 0 HD3 ARG B 59 11.239 -2.282 19.135 1.00 70.23 H new ATOM 0 HE ARG B 59 12.998 -2.016 16.756 1.00 32.25 H new ATOM 0 HH11 ARG B 59 12.241 -3.767 19.756 1.00 42.40 H new ATOM 0 HH12 ARG B 59 13.838 -4.518 19.842 1.00 42.40 H new ATOM 0 HH21 ARG B 59 15.019 -2.980 16.899 1.00 11.23 H new ATOM 0 HH22 ARG B 59 15.399 -4.073 18.233 1.00 11.23 H new ATOM 2739 N HIS B 60 5.811 -2.481 18.243 1.00 50.44 N ATOM 2740 CA HIS B 60 4.607 -2.260 19.082 1.00 75.43 C ATOM 2741 C HIS B 60 3.465 -3.212 18.688 1.00 75.31 C ATOM 2742 O HIS B 60 2.790 -3.773 19.561 1.00 4.34 O ATOM 2743 CB HIS B 60 4.101 -0.791 18.991 1.00 34.34 C ATOM 2744 CG HIS B 60 2.837 -0.560 19.791 1.00 42.20 C ATOM 2745 ND1 HIS B 60 1.600 -0.403 19.210 1.00 4.25 N ATOM 2746 CD2 HIS B 60 2.617 -0.563 21.129 1.00 71.32 C ATOM 2747 CE1 HIS B 60 0.679 -0.333 20.150 1.00 51.01 C ATOM 2748 NE2 HIS B 60 1.271 -0.428 21.320 1.00 73.10 N ATOM 0 H HIS B 60 6.105 -1.656 17.721 1.00 50.44 H new ATOM 0 HA HIS B 60 4.906 -2.466 20.110 1.00 75.43 H new ATOM 0 HB2 HIS B 60 4.881 -0.119 19.349 1.00 34.34 H new ATOM 0 HB3 HIS B 60 3.917 -0.538 17.947 1.00 34.34 H new ATOM 0 HD1 HIS B 60 1.423 -0.349 18.207 1.00 4.25 H new ATOM 0 HD2 HIS B 60 3.367 -0.655 21.901 1.00 71.32 H new ATOM 0 HE1 HIS B 60 -0.382 -0.217 19.987 1.00 51.01 H new ATOM 2757 N HIS B 61 3.265 -3.367 17.370 1.00 13.40 N ATOM 2758 CA HIS B 61 2.199 -4.216 16.809 1.00 73.25 C ATOM 2759 C HIS B 61 2.397 -5.698 17.210 1.00 21.42 C ATOM 2760 O HIS B 61 1.420 -6.430 17.393 1.00 41.31 O ATOM 2761 CB HIS B 61 2.180 -4.072 15.267 1.00 54.03 C ATOM 2762 CG HIS B 61 1.011 -4.748 14.596 1.00 12.14 C ATOM 2763 ND1 HIS B 61 1.001 -6.082 14.254 1.00 53.11 N ATOM 2764 CD2 HIS B 61 -0.196 -4.264 14.227 1.00 53.41 C ATOM 2765 CE1 HIS B 61 -0.156 -6.387 13.709 1.00 52.11 C ATOM 2766 NE2 HIS B 61 -0.905 -5.304 13.681 1.00 3.32 N ATOM 0 H HIS B 61 3.837 -2.908 16.662 1.00 13.40 H new ATOM 0 HA HIS B 61 1.242 -3.887 17.215 1.00 73.25 H new ATOM 0 HB2 HIS B 61 2.167 -3.012 15.013 1.00 54.03 H new ATOM 0 HB3 HIS B 61 3.104 -4.485 14.864 1.00 54.03 H new ATOM 0 HD2 HIS B 61 -0.539 -3.246 14.341 1.00 53.41 H new ATOM 0 HE1 HIS B 61 -0.444 -7.362 13.345 1.00 52.11 H new ATOM 0 HE2 HIS B 61 -1.855 -5.248 13.314 1.00 3.32 H new ATOM 2775 N HIS B 62 3.672 -6.113 17.324 1.00 50.42 N ATOM 2776 CA HIS B 62 4.050 -7.492 17.688 1.00 75.41 C ATOM 2777 C HIS B 62 3.974 -7.724 19.208 1.00 74.24 C ATOM 2778 O HIS B 62 3.413 -8.730 19.659 1.00 20.41 O ATOM 2779 CB HIS B 62 5.477 -7.791 17.166 1.00 4.31 C ATOM 2780 CG HIS B 62 6.025 -9.128 17.597 1.00 54.40 C ATOM 2781 ND1 HIS B 62 5.341 -10.314 17.418 1.00 22.15 N ATOM 2782 CD2 HIS B 62 7.185 -9.460 18.213 1.00 21.14 C ATOM 2783 CE1 HIS B 62 6.051 -11.306 17.905 1.00 74.34 C ATOM 2784 NE2 HIS B 62 7.170 -10.815 18.390 1.00 51.31 N ATOM 0 H HIS B 62 4.472 -5.500 17.166 1.00 50.42 H new ATOM 0 HA HIS B 62 3.339 -8.174 17.222 1.00 75.41 H new ATOM 0 HB2 HIS B 62 5.470 -7.748 16.077 1.00 4.31 H new ATOM 0 HB3 HIS B 62 6.150 -7.006 17.512 1.00 4.31 H new ATOM 0 HD2 HIS B 62 7.972 -8.782 18.508 1.00 21.14 H new ATOM 0 HE1 HIS B 62 5.764 -12.347 17.907 1.00 74.34 H new ATOM 0 HE2 HIS B 62 7.911 -11.360 18.830 1.00 51.31 H new ATOM 2793 N GLN B 63 4.543 -6.781 19.976 1.00 31.41 N ATOM 2794 CA GLN B 63 4.676 -6.880 21.451 1.00 13.34 C ATOM 2795 C GLN B 63 3.310 -6.742 22.137 1.00 73.21 C ATOM 2796 O GLN B 63 3.092 -7.258 23.240 1.00 64.05 O ATOM 2797 CB GLN B 63 5.656 -5.790 21.962 1.00 52.52 C ATOM 2798 CG GLN B 63 7.111 -5.955 21.472 1.00 53.04 C ATOM 2799 CD GLN B 63 8.040 -4.813 21.901 1.00 4.43 C ATOM 2800 OE1 GLN B 63 8.202 -3.823 21.184 1.00 2.15 O ATOM 2801 NE2 GLN B 63 8.641 -4.934 23.077 1.00 0.14 N ATOM 0 H GLN B 63 4.929 -5.918 19.594 1.00 31.41 H new ATOM 0 HA GLN B 63 5.075 -7.863 21.700 1.00 13.34 H new ATOM 0 HB2 GLN B 63 5.289 -4.813 21.647 1.00 52.52 H new ATOM 0 HB3 GLN B 63 5.650 -5.797 23.052 1.00 52.52 H new ATOM 0 HG2 GLN B 63 7.508 -6.896 21.852 1.00 53.04 H new ATOM 0 HG3 GLN B 63 7.113 -6.024 20.384 1.00 53.04 H new ATOM 0 HE21 GLN B 63 8.486 -5.766 23.646 1.00 0.14 H new ATOM 0 HE22 GLN B 63 9.259 -4.195 23.413 1.00 0.14 H new ATOM 2810 N HIS B 64 2.404 -6.015 21.469 1.00 72.44 N ATOM 2811 CA HIS B 64 0.991 -5.914 21.850 1.00 3.32 C ATOM 2812 C HIS B 64 0.157 -6.420 20.651 1.00 74.41 C ATOM 2813 O HIS B 64 -0.201 -5.617 19.775 1.00 73.12 O ATOM 2814 CB HIS B 64 0.630 -4.453 22.238 1.00 61.32 C ATOM 2815 CG HIS B 64 1.380 -3.935 23.444 1.00 1.03 C ATOM 2816 ND1 HIS B 64 0.819 -3.854 24.700 1.00 55.13 N ATOM 2817 CD2 HIS B 64 2.654 -3.483 23.585 1.00 52.13 C ATOM 2818 CE1 HIS B 64 1.708 -3.382 25.552 1.00 71.32 C ATOM 2819 NE2 HIS B 64 2.826 -3.148 24.903 1.00 43.52 N ATOM 0 H HIS B 64 2.637 -5.473 20.637 1.00 72.44 H new ATOM 0 HA HIS B 64 0.777 -6.522 22.729 1.00 3.32 H new ATOM 0 HB2 HIS B 64 0.834 -3.801 21.388 1.00 61.32 H new ATOM 0 HB3 HIS B 64 -0.440 -4.394 22.435 1.00 61.32 H new ATOM 0 HD2 HIS B 64 3.394 -3.403 22.803 1.00 52.13 H new ATOM 0 HE1 HIS B 64 1.544 -3.216 26.607 1.00 71.32 H new ATOM 0 HE2 HIS B 64 3.683 -2.777 25.313 1.00 43.52 H new ATOM 2828 N PRO B 65 -0.068 -7.783 20.544 1.00 1.33 N ATOM 2829 CA PRO B 65 -0.809 -8.409 19.417 1.00 63.13 C ATOM 2830 C PRO B 65 -2.209 -7.791 19.190 1.00 41.24 C ATOM 2831 O PRO B 65 -3.175 -8.117 19.889 1.00 32.14 O ATOM 2832 CB PRO B 65 -0.892 -9.903 19.824 1.00 24.11 C ATOM 2833 CG PRO B 65 0.290 -10.109 20.717 1.00 70.13 C ATOM 2834 CD PRO B 65 0.420 -8.824 21.499 1.00 52.01 C ATOM 0 HA PRO B 65 -0.306 -8.253 18.463 1.00 63.13 H new ATOM 0 HB2 PRO B 65 -1.825 -10.123 20.342 1.00 24.11 H new ATOM 0 HB3 PRO B 65 -0.850 -10.556 18.952 1.00 24.11 H new ATOM 0 HG2 PRO B 65 0.139 -10.961 21.380 1.00 70.13 H new ATOM 0 HG3 PRO B 65 1.191 -10.311 20.138 1.00 70.13 H new ATOM 0 HD2 PRO B 65 -0.179 -8.846 22.409 1.00 52.01 H new ATOM 0 HD3 PRO B 65 1.451 -8.640 21.800 1.00 52.01 H new ATOM 2842 N GLY B 66 -2.270 -6.866 18.233 1.00 74.02 N ATOM 2843 CA GLY B 66 -3.495 -6.158 17.881 1.00 73.42 C ATOM 2844 C GLY B 66 -3.200 -5.120 16.816 1.00 55.43 C ATOM 2845 O GLY B 66 -3.160 -5.446 15.623 1.00 21.21 O ATOM 0 H GLY B 66 -1.462 -6.586 17.677 1.00 74.02 H new ATOM 0 HA2 GLY B 66 -4.242 -6.864 17.517 1.00 73.42 H new ATOM 0 HA3 GLY B 66 -3.915 -5.677 18.765 1.00 73.42 H new ATOM 2849 N GLY B 67 -2.940 -3.871 17.252 1.00 2.53 N ATOM 2850 CA GLY B 67 -2.573 -2.774 16.354 1.00 34.33 C ATOM 2851 C GLY B 67 -3.450 -1.549 16.524 1.00 53.55 C ATOM 2852 O GLY B 67 -3.801 -1.187 17.651 1.00 72.53 O ATOM 0 H GLY B 67 -2.980 -3.602 18.235 1.00 2.53 H new ATOM 0 HA2 GLY B 67 -1.534 -2.498 16.533 1.00 34.33 H new ATOM 0 HA3 GLY B 67 -2.638 -3.120 15.322 1.00 34.33 H new ATOM 2856 N SER B 68 -3.785 -0.902 15.398 1.00 30.12 N ATOM 2857 CA SER B 68 -4.619 0.300 15.373 1.00 34.33 C ATOM 2858 C SER B 68 -6.096 -0.076 15.567 1.00 33.43 C ATOM 2859 O SER B 68 -6.728 -0.626 14.655 1.00 12.35 O ATOM 2860 CB SER B 68 -4.390 1.051 14.046 1.00 52.51 C ATOM 2861 OG SER B 68 -3.021 1.394 13.901 1.00 31.43 O ATOM 0 H SER B 68 -3.480 -1.204 14.473 1.00 30.12 H new ATOM 0 HA SER B 68 -4.341 0.962 16.193 1.00 34.33 H new ATOM 0 HB2 SER B 68 -4.706 0.428 13.209 1.00 52.51 H new ATOM 0 HB3 SER B 68 -5.002 1.953 14.021 1.00 52.51 H new ATOM 0 HG SER B 68 -2.549 0.669 13.441 1.00 31.43 H new ATOM 2867 N GLY B 69 -6.608 0.171 16.788 1.00 42.31 N ATOM 2868 CA GLY B 69 -8.023 -0.023 17.099 1.00 51.11 C ATOM 2869 C GLY B 69 -8.932 0.922 16.311 1.00 52.22 C ATOM 2870 O GLY B 69 -8.522 2.045 15.968 1.00 21.44 O ATOM 0 H GLY B 69 -6.052 0.507 17.574 1.00 42.31 H new ATOM 0 HA2 GLY B 69 -8.301 -1.054 16.882 1.00 51.11 H new ATOM 0 HA3 GLY B 69 -8.181 0.132 18.166 1.00 51.11 H new ATOM 2874 N LEU B 70 -10.171 0.461 16.051 1.00 34.02 N ATOM 2875 CA LEU B 70 -11.167 1.182 15.236 1.00 40.30 C ATOM 2876 C LEU B 70 -11.567 2.493 15.946 1.00 4.35 C ATOM 2877 O LEU B 70 -12.315 2.464 16.935 1.00 11.33 O ATOM 2878 CB LEU B 70 -12.423 0.292 14.955 1.00 74.52 C ATOM 2879 CG LEU B 70 -12.223 -0.963 14.021 1.00 64.32 C ATOM 2880 CD1 LEU B 70 -11.294 -2.032 14.640 1.00 1.42 C ATOM 2881 CD2 LEU B 70 -13.585 -1.578 13.637 1.00 3.23 C ATOM 0 H LEU B 70 -10.512 -0.433 16.405 1.00 34.02 H new ATOM 0 HA LEU B 70 -10.719 1.423 14.272 1.00 40.30 H new ATOM 0 HB2 LEU B 70 -12.810 -0.058 15.912 1.00 74.52 H new ATOM 0 HB3 LEU B 70 -13.192 0.924 14.511 1.00 74.52 H new ATOM 0 HG LEU B 70 -11.727 -0.606 13.118 1.00 64.32 H new ATOM 0 HD11 LEU B 70 -11.195 -2.871 13.951 1.00 1.42 H new ATOM 0 HD12 LEU B 70 -10.312 -1.597 14.826 1.00 1.42 H new ATOM 0 HD13 LEU B 70 -11.719 -2.383 15.580 1.00 1.42 H new ATOM 0 HD21 LEU B 70 -13.425 -2.442 12.993 1.00 3.23 H new ATOM 0 HD22 LEU B 70 -14.111 -1.890 14.539 1.00 3.23 H new ATOM 0 HD23 LEU B 70 -14.183 -0.836 13.107 1.00 3.23 H new ATOM 2893 N ASP B 71 -10.948 3.610 15.477 1.00 25.25 N ATOM 2894 CA ASP B 71 -11.103 4.991 16.025 1.00 64.41 C ATOM 2895 C ASP B 71 -10.356 5.167 17.381 1.00 2.34 C ATOM 2896 O ASP B 71 -10.268 6.279 17.922 1.00 12.31 O ATOM 2897 CB ASP B 71 -12.605 5.413 16.142 1.00 22.31 C ATOM 2898 CG ASP B 71 -12.809 6.914 16.454 1.00 15.22 C ATOM 2899 OD1 ASP B 71 -13.248 7.254 17.574 1.00 4.40 O ATOM 2900 OD2 ASP B 71 -12.533 7.758 15.571 1.00 35.23 O ATOM 0 H ASP B 71 -10.308 3.576 14.684 1.00 25.25 H new ATOM 0 HA ASP B 71 -10.635 5.664 15.307 1.00 64.41 H new ATOM 0 HB2 ASP B 71 -13.114 5.173 15.208 1.00 22.31 H new ATOM 0 HB3 ASP B 71 -13.079 4.821 16.925 1.00 22.31 H new ATOM 2905 N ASP B 72 -9.797 4.062 17.903 1.00 72.13 N ATOM 2906 CA ASP B 72 -9.056 4.042 19.173 1.00 41.30 C ATOM 2907 C ASP B 72 -7.681 4.709 18.978 1.00 65.04 C ATOM 2908 O ASP B 72 -7.425 5.782 19.538 1.00 53.33 O ATOM 2909 CB ASP B 72 -8.920 2.573 19.663 1.00 30.41 C ATOM 2910 CG ASP B 72 -8.016 2.419 20.897 1.00 71.51 C ATOM 2911 OD1 ASP B 72 -6.808 2.108 20.736 1.00 3.44 O ATOM 2912 OD2 ASP B 72 -8.502 2.613 22.030 1.00 73.11 O ATOM 0 H ASP B 72 -9.848 3.150 17.450 1.00 72.13 H new ATOM 0 HA ASP B 72 -9.594 4.605 19.936 1.00 41.30 H new ATOM 0 HB2 ASP B 72 -9.911 2.183 19.897 1.00 30.41 H new ATOM 0 HB3 ASP B 72 -8.521 1.963 18.852 1.00 30.41 H new ATOM 2917 N ILE B 73 -6.841 4.060 18.132 1.00 61.12 N ATOM 2918 CA ILE B 73 -5.474 4.508 17.782 1.00 72.01 C ATOM 2919 C ILE B 73 -4.578 4.682 19.051 1.00 21.13 C ATOM 2920 O ILE B 73 -4.697 5.700 19.756 1.00 15.52 O ATOM 2921 CB ILE B 73 -5.478 5.829 16.909 1.00 22.24 C ATOM 2922 CG1 ILE B 73 -6.420 5.685 15.661 1.00 53.42 C ATOM 2923 CG2 ILE B 73 -4.038 6.212 16.477 1.00 12.33 C ATOM 2924 CD1 ILE B 73 -6.040 4.585 14.674 1.00 75.14 C ATOM 0 H ILE B 73 -7.104 3.192 17.665 1.00 61.12 H new ATOM 0 HA ILE B 73 -5.040 3.717 17.171 1.00 72.01 H new ATOM 0 HB ILE B 73 -5.871 6.635 17.529 1.00 22.24 H new ATOM 0 HG12 ILE B 73 -7.435 5.498 16.013 1.00 53.42 H new ATOM 0 HG13 ILE B 73 -6.437 6.636 15.129 1.00 53.42 H new ATOM 0 HG21 ILE B 73 -4.068 7.123 15.879 1.00 12.33 H new ATOM 0 HG22 ILE B 73 -3.425 6.380 17.363 1.00 12.33 H new ATOM 0 HG23 ILE B 73 -3.608 5.403 15.886 1.00 12.33 H new ATOM 0 HD11 ILE B 73 -6.755 4.572 13.851 1.00 75.14 H new ATOM 0 HD12 ILE B 73 -5.040 4.776 14.284 1.00 75.14 H new ATOM 0 HD13 ILE B 73 -6.053 3.620 15.181 1.00 75.14 H new ATOM 2936 N PRO B 74 -3.678 3.690 19.369 1.00 62.04 N ATOM 2937 CA PRO B 74 -2.787 3.757 20.564 1.00 33.13 C ATOM 2938 C PRO B 74 -1.838 4.998 20.555 1.00 34.01 C ATOM 2939 O PRO B 74 -1.433 5.441 19.477 1.00 55.03 O ATOM 2940 CB PRO B 74 -1.995 2.420 20.502 1.00 33.34 C ATOM 2941 CG PRO B 74 -2.811 1.519 19.627 1.00 31.31 C ATOM 2942 CD PRO B 74 -3.458 2.427 18.607 1.00 60.23 C ATOM 0 HA PRO B 74 -3.354 3.877 21.487 1.00 33.13 H new ATOM 0 HB2 PRO B 74 -0.998 2.572 20.089 1.00 33.34 H new ATOM 0 HB3 PRO B 74 -1.866 1.992 21.496 1.00 33.34 H new ATOM 0 HG2 PRO B 74 -2.185 0.769 19.144 1.00 31.31 H new ATOM 0 HG3 PRO B 74 -3.562 0.982 20.207 1.00 31.31 H new ATOM 0 HD2 PRO B 74 -2.814 2.585 17.742 1.00 60.23 H new ATOM 0 HD3 PRO B 74 -4.395 2.012 18.235 1.00 60.23 H new ATOM 2950 N PRO B 75 -1.479 5.560 21.769 1.00 2.15 N ATOM 2951 CA PRO B 75 -0.726 6.844 21.923 1.00 43.03 C ATOM 2952 C PRO B 75 0.546 6.979 21.049 1.00 0.12 C ATOM 2953 O PRO B 75 0.659 7.944 20.289 1.00 21.11 O ATOM 2954 CB PRO B 75 -0.379 6.870 23.432 1.00 35.00 C ATOM 2955 CG PRO B 75 -1.485 6.100 24.078 1.00 25.53 C ATOM 2956 CD PRO B 75 -1.812 4.984 23.108 1.00 53.05 C ATOM 0 HA PRO B 75 -1.330 7.684 21.581 1.00 43.03 H new ATOM 0 HB2 PRO B 75 0.591 6.411 23.625 1.00 35.00 H new ATOM 0 HB3 PRO B 75 -0.330 7.891 23.812 1.00 35.00 H new ATOM 0 HG2 PRO B 75 -1.176 5.703 25.045 1.00 25.53 H new ATOM 0 HG3 PRO B 75 -2.354 6.734 24.257 1.00 25.53 H new ATOM 0 HD2 PRO B 75 -1.224 4.090 23.315 1.00 53.05 H new ATOM 0 HD3 PRO B 75 -2.862 4.697 23.169 1.00 53.05 H new ATOM 2964 N TYR B 76 1.490 6.009 21.167 1.00 63.12 N ATOM 2965 CA TYR B 76 2.738 5.981 20.360 1.00 41.31 C ATOM 2966 C TYR B 76 2.431 6.064 18.851 1.00 1.24 C ATOM 2967 O TYR B 76 3.048 6.837 18.116 1.00 74.50 O ATOM 2968 CB TYR B 76 3.580 4.687 20.671 1.00 25.22 C ATOM 2969 CG TYR B 76 4.571 4.296 19.551 1.00 74.41 C ATOM 2970 CD1 TYR B 76 5.699 5.074 19.277 1.00 14.45 C ATOM 2971 CD2 TYR B 76 4.329 3.192 18.719 1.00 52.42 C ATOM 2972 CE1 TYR B 76 6.532 4.773 18.218 1.00 62.43 C ATOM 2973 CE2 TYR B 76 5.170 2.882 17.674 1.00 32.14 C ATOM 2974 CZ TYR B 76 6.266 3.681 17.423 1.00 33.13 C ATOM 2975 OH TYR B 76 7.085 3.399 16.354 1.00 44.32 O ATOM 0 H TYR B 76 1.408 5.229 21.820 1.00 63.12 H new ATOM 0 HA TYR B 76 3.326 6.855 20.638 1.00 41.31 H new ATOM 0 HB2 TYR B 76 4.136 4.841 21.596 1.00 25.22 H new ATOM 0 HB3 TYR B 76 2.897 3.855 20.844 1.00 25.22 H new ATOM 0 HD1 TYR B 76 5.923 5.925 19.904 1.00 14.45 H new ATOM 0 HD2 TYR B 76 3.464 2.572 18.903 1.00 52.42 H new ATOM 0 HE1 TYR B 76 7.392 5.394 18.013 1.00 62.43 H new ATOM 0 HE2 TYR B 76 4.973 2.019 17.055 1.00 32.14 H new ATOM 0 HH TYR B 76 8.002 3.265 16.671 1.00 44.32 H new ATOM 2985 N ASP B 77 1.468 5.249 18.435 1.00 74.13 N ATOM 2986 CA ASP B 77 1.107 5.032 17.026 1.00 11.02 C ATOM 2987 C ASP B 77 0.422 6.286 16.448 1.00 24.00 C ATOM 2988 O ASP B 77 0.476 6.540 15.243 1.00 70.11 O ATOM 2989 CB ASP B 77 0.203 3.772 16.925 1.00 55.34 C ATOM 2990 CG ASP B 77 0.828 2.535 17.622 1.00 63.23 C ATOM 2991 OD1 ASP B 77 1.238 1.565 16.944 1.00 61.40 O ATOM 2992 OD2 ASP B 77 0.923 2.540 18.866 1.00 53.23 O ATOM 0 H ASP B 77 0.897 4.703 19.081 1.00 74.13 H new ATOM 0 HA ASP B 77 2.004 4.859 16.431 1.00 11.02 H new ATOM 0 HB2 ASP B 77 -0.766 3.987 17.375 1.00 55.34 H new ATOM 0 HB3 ASP B 77 0.023 3.541 15.875 1.00 55.34 H new ATOM 2997 N ARG B 78 -0.223 7.058 17.343 1.00 31.41 N ATOM 2998 CA ARG B 78 -0.826 8.364 17.023 1.00 11.03 C ATOM 2999 C ARG B 78 0.273 9.437 16.853 1.00 23.12 C ATOM 3000 O ARG B 78 0.170 10.316 15.990 1.00 31.22 O ATOM 3001 CB ARG B 78 -1.821 8.758 18.145 1.00 20.02 C ATOM 3002 CG ARG B 78 -2.602 10.066 17.904 1.00 44.21 C ATOM 3003 CD ARG B 78 -3.575 10.389 19.051 1.00 1.32 C ATOM 3004 NE ARG B 78 -4.306 11.646 18.821 1.00 10.01 N ATOM 3005 CZ ARG B 78 -5.274 12.135 19.613 1.00 34.45 C ATOM 3006 NH1 ARG B 78 -5.650 11.485 20.720 1.00 21.54 N ATOM 3007 NH2 ARG B 78 -5.861 13.280 19.292 1.00 32.42 N ATOM 0 H ARG B 78 -0.341 6.788 18.320 1.00 31.41 H new ATOM 0 HA ARG B 78 -1.369 8.293 16.081 1.00 11.03 H new ATOM 0 HB2 ARG B 78 -2.536 7.946 18.275 1.00 20.02 H new ATOM 0 HB3 ARG B 78 -1.270 8.850 19.081 1.00 20.02 H new ATOM 0 HG2 ARG B 78 -1.898 10.890 17.786 1.00 44.21 H new ATOM 0 HG3 ARG B 78 -3.159 9.986 16.970 1.00 44.21 H new ATOM 0 HD2 ARG B 78 -4.287 9.571 19.162 1.00 1.32 H new ATOM 0 HD3 ARG B 78 -3.021 10.459 19.987 1.00 1.32 H new ATOM 0 HE ARG B 78 -4.057 12.189 17.994 1.00 10.01 H new ATOM 0 HH11 ARG B 78 -5.200 10.605 20.973 1.00 21.54 H new ATOM 0 HH12 ARG B 78 -6.387 11.869 21.312 1.00 21.54 H new ATOM 0 HH21 ARG B 78 -5.576 13.781 18.450 1.00 32.42 H new ATOM 0 HH22 ARG B 78 -6.597 13.660 19.887 1.00 32.42 H new ATOM 3021 N ASP B 79 1.331 9.350 17.690 1.00 41.32 N ATOM 3022 CA ASP B 79 2.517 10.230 17.578 1.00 32.43 C ATOM 3023 C ASP B 79 3.323 9.897 16.309 1.00 45.13 C ATOM 3024 O ASP B 79 3.952 10.783 15.722 1.00 4.41 O ATOM 3025 CB ASP B 79 3.422 10.150 18.843 1.00 21.41 C ATOM 3026 CG ASP B 79 2.829 10.871 20.071 1.00 72.44 C ATOM 3027 OD1 ASP B 79 2.293 10.203 20.975 1.00 52.10 O ATOM 3028 OD2 ASP B 79 2.894 12.122 20.123 1.00 63.23 O ATOM 0 H ASP B 79 1.388 8.676 18.454 1.00 41.32 H new ATOM 0 HA ASP B 79 2.156 11.256 17.502 1.00 32.43 H new ATOM 0 HB2 ASP B 79 3.591 9.103 19.093 1.00 21.41 H new ATOM 0 HB3 ASP B 79 4.395 10.584 18.612 1.00 21.41 H new ATOM 3033 N PHE B 80 3.275 8.611 15.901 1.00 41.54 N ATOM 3034 CA PHE B 80 3.913 8.108 14.666 1.00 34.44 C ATOM 3035 C PHE B 80 3.308 8.799 13.427 1.00 62.45 C ATOM 3036 O PHE B 80 4.019 9.085 12.454 1.00 0.41 O ATOM 3037 CB PHE B 80 3.743 6.557 14.584 1.00 31.05 C ATOM 3038 CG PHE B 80 4.375 5.910 13.350 1.00 22.03 C ATOM 3039 CD1 PHE B 80 5.720 5.561 13.346 1.00 24.34 C ATOM 3040 CD2 PHE B 80 3.627 5.672 12.189 1.00 62.13 C ATOM 3041 CE1 PHE B 80 6.298 5.003 12.231 1.00 22.53 C ATOM 3042 CE2 PHE B 80 4.214 5.107 11.073 1.00 44.43 C ATOM 3043 CZ PHE B 80 5.552 4.777 11.096 1.00 55.12 C ATOM 0 H PHE B 80 2.787 7.885 16.426 1.00 41.54 H new ATOM 0 HA PHE B 80 4.977 8.341 14.689 1.00 34.44 H new ATOM 0 HB2 PHE B 80 4.180 6.109 15.477 1.00 31.05 H new ATOM 0 HB3 PHE B 80 2.679 6.320 14.597 1.00 31.05 H new ATOM 0 HD1 PHE B 80 6.318 5.730 14.229 1.00 24.34 H new ATOM 0 HD2 PHE B 80 2.579 5.933 12.166 1.00 62.13 H new ATOM 0 HE1 PHE B 80 7.345 4.740 12.245 1.00 22.53 H new ATOM 0 HE2 PHE B 80 3.626 4.925 10.186 1.00 44.43 H new ATOM 0 HZ PHE B 80 6.015 4.341 10.223 1.00 55.12 H new ATOM 3053 N CYS B 81 1.989 9.059 13.491 1.00 12.33 N ATOM 3054 CA CYS B 81 1.238 9.723 12.410 1.00 24.00 C ATOM 3055 C CYS B 81 1.698 11.187 12.211 1.00 30.53 C ATOM 3056 O CYS B 81 1.666 11.713 11.091 1.00 22.30 O ATOM 3057 CB CYS B 81 -0.267 9.689 12.759 1.00 63.13 C ATOM 3058 SG CYS B 81 -0.905 8.038 13.096 1.00 52.24 S ATOM 0 H CYS B 81 1.413 8.814 14.296 1.00 12.33 H new ATOM 0 HA CYS B 81 1.426 9.191 11.477 1.00 24.00 H new ATOM 0 HB2 CYS B 81 -0.441 10.320 13.631 1.00 63.13 H new ATOM 0 HB3 CYS B 81 -0.831 10.124 11.933 1.00 63.13 H new ATOM 0 HG CYS B 81 -0.042 7.376 13.808 1.00 52.24 H new ATOM 3064 N LYS B 82 2.178 11.813 13.301 1.00 70.12 N ATOM 3065 CA LYS B 82 2.628 13.211 13.290 1.00 63.33 C ATOM 3066 C LYS B 82 4.126 13.265 12.958 1.00 73.10 C ATOM 3067 O LYS B 82 4.979 13.154 13.846 1.00 43.35 O ATOM 3068 CB LYS B 82 2.341 13.883 14.655 1.00 12.20 C ATOM 3069 CG LYS B 82 0.847 13.941 15.033 1.00 62.32 C ATOM 3070 CD LYS B 82 0.625 14.511 16.455 1.00 55.01 C ATOM 3071 CE LYS B 82 1.308 13.654 17.535 1.00 53.21 C ATOM 3072 NZ LYS B 82 1.121 14.194 18.902 1.00 51.31 N ATOM 0 H LYS B 82 2.263 11.362 14.212 1.00 70.12 H new ATOM 0 HA LYS B 82 2.078 13.760 12.525 1.00 63.33 H new ATOM 0 HB2 LYS B 82 2.880 13.342 15.433 1.00 12.20 H new ATOM 0 HB3 LYS B 82 2.739 14.898 14.638 1.00 12.20 H new ATOM 0 HG2 LYS B 82 0.315 14.558 14.309 1.00 62.32 H new ATOM 0 HG3 LYS B 82 0.420 12.940 14.974 1.00 62.32 H new ATOM 0 HD2 LYS B 82 1.012 15.529 16.502 1.00 55.01 H new ATOM 0 HD3 LYS B 82 -0.444 14.567 16.660 1.00 55.01 H new ATOM 0 HE2 LYS B 82 0.910 12.640 17.493 1.00 53.21 H new ATOM 0 HE3 LYS B 82 2.374 13.587 17.319 1.00 53.21 H new ATOM 0 HZ1 LYS B 82 1.671 13.626 19.578 1.00 51.31 H new ATOM 0 HZ2 LYS B 82 1.447 15.181 18.933 1.00 51.31 H new ATOM 0 HZ3 LYS B 82 0.113 14.154 19.156 1.00 51.31 H new ATOM 3086 N VAL B 83 4.425 13.344 11.658 1.00 42.33 N ATOM 3087 CA VAL B 83 5.785 13.553 11.126 1.00 71.52 C ATOM 3088 C VAL B 83 5.763 14.736 10.138 1.00 33.42 C ATOM 3089 O VAL B 83 4.706 15.351 9.918 1.00 53.52 O ATOM 3090 CB VAL B 83 6.342 12.244 10.420 1.00 45.43 C ATOM 3091 CG1 VAL B 83 6.630 11.115 11.444 1.00 52.01 C ATOM 3092 CG2 VAL B 83 5.377 11.759 9.309 1.00 32.02 C ATOM 0 H VAL B 83 3.718 13.263 10.927 1.00 42.33 H new ATOM 0 HA VAL B 83 6.455 13.780 11.955 1.00 71.52 H new ATOM 0 HB VAL B 83 7.292 12.505 9.953 1.00 45.43 H new ATOM 0 HG11 VAL B 83 7.009 10.237 10.921 1.00 52.01 H new ATOM 0 HG12 VAL B 83 7.373 11.458 12.164 1.00 52.01 H new ATOM 0 HG13 VAL B 83 5.710 10.856 11.968 1.00 52.01 H new ATOM 0 HG21 VAL B 83 5.782 10.861 8.842 1.00 32.02 H new ATOM 0 HG22 VAL B 83 4.404 11.533 9.745 1.00 32.02 H new ATOM 0 HG23 VAL B 83 5.265 12.541 8.557 1.00 32.02 H new ATOM 3102 N ASP B 84 6.932 15.051 9.561 1.00 43.30 N ATOM 3103 CA ASP B 84 7.077 16.108 8.541 1.00 13.24 C ATOM 3104 C ASP B 84 6.351 15.678 7.246 1.00 74.15 C ATOM 3105 O ASP B 84 6.215 14.475 6.996 1.00 22.23 O ATOM 3106 CB ASP B 84 8.590 16.357 8.306 1.00 20.54 C ATOM 3107 CG ASP B 84 8.926 17.455 7.290 1.00 62.53 C ATOM 3108 OD1 ASP B 84 8.342 18.558 7.377 1.00 0.42 O ATOM 3109 OD2 ASP B 84 9.807 17.232 6.426 1.00 11.13 O ATOM 0 H ASP B 84 7.808 14.580 9.787 1.00 43.30 H new ATOM 0 HA ASP B 84 6.621 17.040 8.875 1.00 13.24 H new ATOM 0 HB2 ASP B 84 9.051 16.615 9.260 1.00 20.54 H new ATOM 0 HB3 ASP B 84 9.047 15.425 7.973 1.00 20.54 H new ATOM 3114 N GLN B 85 5.887 16.657 6.447 1.00 21.04 N ATOM 3115 CA GLN B 85 5.038 16.407 5.253 1.00 22.24 C ATOM 3116 C GLN B 85 5.736 15.484 4.193 1.00 54.24 C ATOM 3117 O GLN B 85 5.139 14.462 3.820 1.00 33.22 O ATOM 3118 CB GLN B 85 4.525 17.763 4.644 1.00 13.33 C ATOM 3119 CG GLN B 85 3.780 17.667 3.290 1.00 54.22 C ATOM 3120 CD GLN B 85 2.433 16.929 3.316 1.00 62.31 C ATOM 3121 OE1 GLN B 85 2.182 16.044 4.128 1.00 63.22 O ATOM 3122 NE2 GLN B 85 1.565 17.272 2.384 1.00 63.21 N ATOM 0 H GLN B 85 6.086 17.645 6.605 1.00 21.04 H new ATOM 0 HA GLN B 85 4.163 15.846 5.582 1.00 22.24 H new ATOM 0 HB2 GLN B 85 3.860 18.234 5.368 1.00 13.33 H new ATOM 0 HB3 GLN B 85 5.380 18.427 4.518 1.00 13.33 H new ATOM 0 HG2 GLN B 85 3.611 18.677 2.918 1.00 54.22 H new ATOM 0 HG3 GLN B 85 4.432 17.168 2.573 1.00 54.22 H new ATOM 0 HE21 GLN B 85 1.795 18.011 1.720 1.00 63.21 H new ATOM 0 HE22 GLN B 85 0.663 16.798 2.328 1.00 63.21 H new ATOM 3131 N PRO B 86 6.998 15.788 3.690 1.00 64.11 N ATOM 3132 CA PRO B 86 7.760 14.837 2.827 1.00 52.32 C ATOM 3133 C PRO B 86 7.977 13.467 3.507 1.00 25.14 C ATOM 3134 O PRO B 86 7.774 12.425 2.881 1.00 4.20 O ATOM 3135 CB PRO B 86 9.115 15.551 2.584 1.00 21.43 C ATOM 3136 CG PRO B 86 8.796 17.005 2.751 1.00 42.22 C ATOM 3137 CD PRO B 86 7.750 17.066 3.843 1.00 72.15 C ATOM 0 HA PRO B 86 7.221 14.612 1.906 1.00 52.32 H new ATOM 0 HB2 PRO B 86 9.871 15.224 3.297 1.00 21.43 H new ATOM 0 HB3 PRO B 86 9.504 15.340 1.588 1.00 21.43 H new ATOM 0 HG2 PRO B 86 9.685 17.573 3.027 1.00 42.22 H new ATOM 0 HG3 PRO B 86 8.419 17.433 1.822 1.00 42.22 H new ATOM 0 HD2 PRO B 86 8.206 17.145 4.830 1.00 72.15 H new ATOM 0 HD3 PRO B 86 7.097 17.931 3.723 1.00 72.15 H new ATOM 3145 N THR B 87 8.348 13.509 4.812 1.00 31.24 N ATOM 3146 CA THR B 87 8.621 12.313 5.645 1.00 45.32 C ATOM 3147 C THR B 87 7.408 11.356 5.709 1.00 73.30 C ATOM 3148 O THR B 87 7.576 10.131 5.765 1.00 24.21 O ATOM 3149 CB THR B 87 9.037 12.754 7.087 1.00 0.43 C ATOM 3150 OG1 THR B 87 10.182 13.612 7.006 1.00 32.34 O ATOM 3151 CG2 THR B 87 9.360 11.575 8.021 1.00 63.34 C ATOM 0 H THR B 87 8.467 14.385 5.320 1.00 31.24 H new ATOM 0 HA THR B 87 9.440 11.766 5.177 1.00 45.32 H new ATOM 0 HB THR B 87 8.180 13.273 7.515 1.00 0.43 H new ATOM 0 HG1 THR B 87 10.542 13.763 7.905 1.00 32.34 H new ATOM 0 HG21 THR B 87 9.640 11.955 9.003 1.00 63.34 H new ATOM 0 HG22 THR B 87 8.483 10.935 8.116 1.00 63.34 H new ATOM 0 HG23 THR B 87 10.186 10.998 7.606 1.00 63.34 H new ATOM 3159 N LEU B 88 6.199 11.938 5.676 1.00 34.20 N ATOM 3160 CA LEU B 88 4.930 11.188 5.704 1.00 22.23 C ATOM 3161 C LEU B 88 4.804 10.356 4.416 1.00 64.13 C ATOM 3162 O LEU B 88 4.480 9.170 4.463 1.00 44.22 O ATOM 3163 CB LEU B 88 3.744 12.188 5.898 1.00 31.20 C ATOM 3164 CG LEU B 88 2.345 11.584 6.304 1.00 71.54 C ATOM 3165 CD1 LEU B 88 1.472 12.633 7.029 1.00 4.35 C ATOM 3166 CD2 LEU B 88 1.580 11.001 5.089 1.00 64.21 C ATOM 0 H LEU B 88 6.072 12.949 5.629 1.00 34.20 H new ATOM 0 HA LEU B 88 4.907 10.492 6.543 1.00 22.23 H new ATOM 0 HB2 LEU B 88 4.034 12.910 6.661 1.00 31.20 H new ATOM 0 HB3 LEU B 88 3.615 12.742 4.968 1.00 31.20 H new ATOM 0 HG LEU B 88 2.550 10.762 6.990 1.00 71.54 H new ATOM 0 HD11 LEU B 88 0.514 12.187 7.296 1.00 4.35 H new ATOM 0 HD12 LEU B 88 1.981 12.968 7.933 1.00 4.35 H new ATOM 0 HD13 LEU B 88 1.304 13.485 6.370 1.00 4.35 H new ATOM 0 HD21 LEU B 88 0.623 10.598 5.421 1.00 64.21 H new ATOM 0 HD22 LEU B 88 1.407 11.789 4.356 1.00 64.21 H new ATOM 0 HD23 LEU B 88 2.171 10.206 4.634 1.00 64.21 H new ATOM 3178 N PHE B 89 5.116 10.992 3.274 1.00 31.12 N ATOM 3179 CA PHE B 89 5.100 10.332 1.957 1.00 21.30 C ATOM 3180 C PHE B 89 6.212 9.273 1.848 1.00 52.10 C ATOM 3181 O PHE B 89 6.030 8.267 1.172 1.00 75.54 O ATOM 3182 CB PHE B 89 5.200 11.385 0.824 1.00 72.52 C ATOM 3183 CG PHE B 89 4.005 12.344 0.786 1.00 54.01 C ATOM 3184 CD1 PHE B 89 4.172 13.731 0.809 1.00 10.41 C ATOM 3185 CD2 PHE B 89 2.703 11.846 0.740 1.00 74.43 C ATOM 3186 CE1 PHE B 89 3.081 14.580 0.783 1.00 62.34 C ATOM 3187 CE2 PHE B 89 1.617 12.694 0.715 1.00 22.43 C ATOM 3188 CZ PHE B 89 1.803 14.061 0.736 1.00 15.04 C ATOM 0 H PHE B 89 5.386 11.975 3.237 1.00 31.12 H new ATOM 0 HA PHE B 89 4.150 9.809 1.847 1.00 21.30 H new ATOM 0 HB2 PHE B 89 6.116 11.961 0.952 1.00 72.52 H new ATOM 0 HB3 PHE B 89 5.277 10.872 -0.135 1.00 72.52 H new ATOM 0 HD1 PHE B 89 5.168 14.146 0.848 1.00 10.41 H new ATOM 0 HD2 PHE B 89 2.543 10.778 0.724 1.00 74.43 H new ATOM 0 HE1 PHE B 89 3.229 15.650 0.799 1.00 62.34 H new ATOM 0 HE2 PHE B 89 0.617 12.287 0.679 1.00 22.43 H new ATOM 0 HZ PHE B 89 0.950 14.724 0.716 1.00 15.04 H new ATOM 3198 N GLU B 90 7.342 9.505 2.543 1.00 34.44 N ATOM 3199 CA GLU B 90 8.464 8.540 2.605 1.00 1.02 C ATOM 3200 C GLU B 90 8.052 7.255 3.359 1.00 74.30 C ATOM 3201 O GLU B 90 8.485 6.154 3.003 1.00 30.44 O ATOM 3202 CB GLU B 90 9.704 9.174 3.286 1.00 63.30 C ATOM 3203 CG GLU B 90 10.265 10.430 2.595 1.00 71.12 C ATOM 3204 CD GLU B 90 10.700 10.188 1.139 1.00 4.12 C ATOM 3205 OE1 GLU B 90 11.768 9.566 0.935 1.00 30.03 O ATOM 3206 OE2 GLU B 90 9.997 10.630 0.197 1.00 70.03 O ATOM 0 H GLU B 90 7.505 10.360 3.075 1.00 34.44 H new ATOM 0 HA GLU B 90 8.724 8.275 1.580 1.00 1.02 H new ATOM 0 HB2 GLU B 90 9.442 9.431 4.313 1.00 63.30 H new ATOM 0 HB3 GLU B 90 10.493 8.424 3.336 1.00 63.30 H new ATOM 0 HG2 GLU B 90 9.508 11.214 2.614 1.00 71.12 H new ATOM 0 HG3 GLU B 90 11.119 10.797 3.164 1.00 71.12 H new ATOM 3213 N LEU B 91 7.222 7.423 4.413 1.00 0.32 N ATOM 3214 CA LEU B 91 6.640 6.301 5.186 1.00 64.12 C ATOM 3215 C LEU B 91 5.621 5.507 4.327 1.00 32.24 C ATOM 3216 O LEU B 91 5.515 4.289 4.470 1.00 51.23 O ATOM 3217 CB LEU B 91 5.956 6.818 6.488 1.00 25.25 C ATOM 3218 CG LEU B 91 6.876 7.446 7.591 1.00 43.33 C ATOM 3219 CD1 LEU B 91 6.031 8.061 8.739 1.00 42.01 C ATOM 3220 CD2 LEU B 91 7.874 6.406 8.141 1.00 20.25 C ATOM 0 H LEU B 91 6.936 8.341 4.753 1.00 0.32 H new ATOM 0 HA LEU B 91 7.454 5.632 5.464 1.00 64.12 H new ATOM 0 HB2 LEU B 91 5.214 7.565 6.204 1.00 25.25 H new ATOM 0 HB3 LEU B 91 5.414 5.985 6.936 1.00 25.25 H new ATOM 0 HG LEU B 91 7.449 8.249 7.127 1.00 43.33 H new ATOM 0 HD11 LEU B 91 6.695 8.489 9.490 1.00 42.01 H new ATOM 0 HD12 LEU B 91 5.385 8.842 8.337 1.00 42.01 H new ATOM 0 HD13 LEU B 91 5.419 7.284 9.197 1.00 42.01 H new ATOM 0 HD21 LEU B 91 8.499 6.870 8.904 1.00 20.25 H new ATOM 0 HD22 LEU B 91 7.326 5.572 8.579 1.00 20.25 H new ATOM 0 HD23 LEU B 91 8.503 6.041 7.329 1.00 20.25 H new ATOM 3232 N ILE B 92 4.870 6.221 3.448 1.00 20.13 N ATOM 3233 CA ILE B 92 3.925 5.599 2.483 1.00 41.31 C ATOM 3234 C ILE B 92 4.706 4.753 1.446 1.00 20.12 C ATOM 3235 O ILE B 92 4.347 3.598 1.172 1.00 55.02 O ATOM 3236 CB ILE B 92 3.034 6.682 1.735 1.00 2.35 C ATOM 3237 CG1 ILE B 92 2.178 7.508 2.749 1.00 34.04 C ATOM 3238 CG2 ILE B 92 2.126 6.026 0.658 1.00 54.10 C ATOM 3239 CD1 ILE B 92 1.299 8.586 2.125 1.00 33.23 C ATOM 0 H ILE B 92 4.902 7.239 3.388 1.00 20.13 H new ATOM 0 HA ILE B 92 3.253 4.957 3.052 1.00 41.31 H new ATOM 0 HB ILE B 92 3.714 7.366 1.228 1.00 2.35 H new ATOM 0 HG12 ILE B 92 1.542 6.821 3.308 1.00 34.04 H new ATOM 0 HG13 ILE B 92 2.849 7.979 3.468 1.00 34.04 H new ATOM 0 HG21 ILE B 92 1.531 6.795 0.166 1.00 54.10 H new ATOM 0 HG22 ILE B 92 2.746 5.519 -0.081 1.00 54.10 H new ATOM 0 HG23 ILE B 92 1.463 5.302 1.133 1.00 54.10 H new ATOM 0 HD11 ILE B 92 0.745 9.103 2.909 1.00 33.23 H new ATOM 0 HD12 ILE B 92 1.924 9.301 1.591 1.00 33.23 H new ATOM 0 HD13 ILE B 92 0.598 8.126 1.429 1.00 33.23 H new ATOM 3251 N LEU B 93 5.797 5.346 0.908 1.00 71.13 N ATOM 3252 CA LEU B 93 6.669 4.705 -0.104 1.00 53.32 C ATOM 3253 C LEU B 93 7.352 3.450 0.474 1.00 71.34 C ATOM 3254 O LEU B 93 7.492 2.445 -0.222 1.00 23.44 O ATOM 3255 CB LEU B 93 7.741 5.711 -0.619 1.00 21.14 C ATOM 3256 CG LEU B 93 7.213 6.946 -1.421 1.00 5.31 C ATOM 3257 CD1 LEU B 93 8.370 7.909 -1.776 1.00 72.35 C ATOM 3258 CD2 LEU B 93 6.429 6.511 -2.682 1.00 42.11 C ATOM 0 H LEU B 93 6.098 6.286 1.165 1.00 71.13 H new ATOM 0 HA LEU B 93 6.043 4.400 -0.943 1.00 53.32 H new ATOM 0 HB2 LEU B 93 8.305 6.077 0.239 1.00 21.14 H new ATOM 0 HB3 LEU B 93 8.442 5.168 -1.252 1.00 21.14 H new ATOM 0 HG LEU B 93 6.516 7.486 -0.780 1.00 5.31 H new ATOM 0 HD11 LEU B 93 7.977 8.760 -2.333 1.00 72.35 H new ATOM 0 HD12 LEU B 93 8.843 8.263 -0.860 1.00 72.35 H new ATOM 0 HD13 LEU B 93 9.106 7.384 -2.385 1.00 72.35 H new ATOM 0 HD21 LEU B 93 6.077 7.395 -3.214 1.00 42.11 H new ATOM 0 HD22 LEU B 93 7.082 5.930 -3.334 1.00 42.11 H new ATOM 0 HD23 LEU B 93 5.575 5.901 -2.387 1.00 42.11 H new ATOM 3270 N ALA B 94 7.760 3.536 1.753 1.00 14.31 N ATOM 3271 CA ALA B 94 8.403 2.424 2.481 1.00 10.32 C ATOM 3272 C ALA B 94 7.389 1.317 2.806 1.00 1.43 C ATOM 3273 O ALA B 94 7.714 0.138 2.745 1.00 51.02 O ATOM 3274 CB ALA B 94 9.059 2.945 3.769 1.00 35.41 C ATOM 0 H ALA B 94 7.653 4.381 2.314 1.00 14.31 H new ATOM 0 HA ALA B 94 9.173 1.996 1.840 1.00 10.32 H new ATOM 0 HB1 ALA B 94 9.530 2.117 4.298 1.00 35.41 H new ATOM 0 HB2 ALA B 94 9.813 3.691 3.517 1.00 35.41 H new ATOM 0 HB3 ALA B 94 8.300 3.398 4.407 1.00 35.41 H new ATOM 3280 N ALA B 95 6.154 1.722 3.144 1.00 20.31 N ATOM 3281 CA ALA B 95 5.054 0.790 3.474 1.00 32.51 C ATOM 3282 C ALA B 95 4.580 0.012 2.237 1.00 2.40 C ATOM 3283 O ALA B 95 4.055 -1.089 2.363 1.00 14.25 O ATOM 3284 CB ALA B 95 3.892 1.555 4.102 1.00 51.22 C ATOM 0 H ALA B 95 5.886 2.705 3.197 1.00 20.31 H new ATOM 0 HA ALA B 95 5.433 0.063 4.192 1.00 32.51 H new ATOM 0 HB1 ALA B 95 3.087 0.861 4.342 1.00 51.22 H new ATOM 0 HB2 ALA B 95 4.231 2.047 5.014 1.00 51.22 H new ATOM 0 HB3 ALA B 95 3.528 2.305 3.399 1.00 51.22 H new ATOM 3290 N ASN B 96 4.721 0.640 1.056 1.00 14.05 N ATOM 3291 CA ASN B 96 4.464 -0.005 -0.248 1.00 52.14 C ATOM 3292 C ASN B 96 5.636 -0.943 -0.618 1.00 64.41 C ATOM 3293 O ASN B 96 5.429 -2.121 -0.936 1.00 43.15 O ATOM 3294 CB ASN B 96 4.261 1.094 -1.337 1.00 75.01 C ATOM 3295 CG ASN B 96 4.164 0.556 -2.775 1.00 41.35 C ATOM 3296 OD1 ASN B 96 4.604 1.344 -3.725 1.00 25.51 O flip ATOM 3297 ND2 ASN B 96 3.676 -0.545 -3.027 1.00 61.24 N flip ATOM 0 H ASN B 96 5.017 1.613 0.977 1.00 14.05 H new ATOM 0 HA ASN B 96 3.558 -0.608 -0.186 1.00 52.14 H new ATOM 0 HB2 ASN B 96 3.352 1.651 -1.109 1.00 75.01 H new ATOM 0 HB3 ASN B 96 5.090 1.800 -1.282 1.00 75.01 H new ATOM 0 HD21 ASN B 96 3.341 -1.140 -2.269 1.00 61.24 H new ATOM 0 HD22 ASN B 96 3.607 -0.863 -3.994 1.00 61.24 H new ATOM 3304 N TYR B 97 6.865 -0.397 -0.528 1.00 34.11 N ATOM 3305 CA TYR B 97 8.116 -1.086 -0.921 1.00 52.54 C ATOM 3306 C TYR B 97 8.357 -2.364 -0.085 1.00 14.01 C ATOM 3307 O TYR B 97 8.867 -3.361 -0.600 1.00 13.53 O ATOM 3308 CB TYR B 97 9.317 -0.097 -0.789 1.00 64.31 C ATOM 3309 CG TYR B 97 10.715 -0.700 -1.048 1.00 45.41 C ATOM 3310 CD1 TYR B 97 11.676 -0.775 -0.029 1.00 55.31 C ATOM 3311 CD2 TYR B 97 11.070 -1.200 -2.305 1.00 21.42 C ATOM 3312 CE1 TYR B 97 12.926 -1.323 -0.253 1.00 3.24 C ATOM 3313 CE2 TYR B 97 12.322 -1.749 -2.532 1.00 12.33 C ATOM 3314 CZ TYR B 97 13.245 -1.809 -1.505 1.00 34.25 C ATOM 3315 OH TYR B 97 14.491 -2.356 -1.731 1.00 33.20 O ATOM 0 H TYR B 97 7.022 0.547 -0.176 1.00 34.11 H new ATOM 0 HA TYR B 97 8.022 -1.403 -1.960 1.00 52.54 H new ATOM 0 HB2 TYR B 97 9.163 0.727 -1.485 1.00 64.31 H new ATOM 0 HB3 TYR B 97 9.305 0.327 0.215 1.00 64.31 H new ATOM 0 HD1 TYR B 97 11.434 -0.396 0.953 1.00 55.31 H new ATOM 0 HD2 TYR B 97 10.355 -1.157 -3.114 1.00 21.42 H new ATOM 0 HE1 TYR B 97 13.649 -1.370 0.548 1.00 3.24 H new ATOM 0 HE2 TYR B 97 12.576 -2.130 -3.510 1.00 12.33 H new ATOM 0 HH TYR B 97 14.554 -2.652 -2.663 1.00 33.20 H new ATOM 3325 N LEU B 98 7.980 -2.312 1.202 1.00 72.21 N ATOM 3326 CA LEU B 98 8.173 -3.424 2.160 1.00 23.43 C ATOM 3327 C LEU B 98 6.867 -4.233 2.350 1.00 12.01 C ATOM 3328 O LEU B 98 6.899 -5.343 2.894 1.00 32.13 O ATOM 3329 CB LEU B 98 8.679 -2.853 3.518 1.00 4.14 C ATOM 3330 CG LEU B 98 10.009 -2.021 3.463 1.00 73.14 C ATOM 3331 CD1 LEU B 98 10.425 -1.510 4.863 1.00 23.32 C ATOM 3332 CD2 LEU B 98 11.149 -2.815 2.787 1.00 55.33 C ATOM 0 H LEU B 98 7.530 -1.495 1.615 1.00 72.21 H new ATOM 0 HA LEU B 98 8.920 -4.109 1.760 1.00 23.43 H new ATOM 0 HB2 LEU B 98 7.896 -2.222 3.938 1.00 4.14 H new ATOM 0 HB3 LEU B 98 8.822 -3.684 4.208 1.00 4.14 H new ATOM 0 HG LEU B 98 9.813 -1.144 2.846 1.00 73.14 H new ATOM 0 HD11 LEU B 98 11.350 -0.939 4.782 1.00 23.32 H new ATOM 0 HD12 LEU B 98 9.639 -0.872 5.266 1.00 23.32 H new ATOM 0 HD13 LEU B 98 10.580 -2.359 5.529 1.00 23.32 H new ATOM 0 HD21 LEU B 98 12.054 -2.207 2.767 1.00 55.33 H new ATOM 0 HD22 LEU B 98 11.339 -3.729 3.349 1.00 55.33 H new ATOM 0 HD23 LEU B 98 10.860 -3.069 1.767 1.00 55.33 H new ATOM 3344 N ASP B 99 5.748 -3.663 1.859 1.00 20.12 N ATOM 3345 CA ASP B 99 4.365 -4.169 2.045 1.00 64.21 C ATOM 3346 C ASP B 99 4.069 -4.531 3.515 1.00 64.23 C ATOM 3347 O ASP B 99 4.192 -5.696 3.937 1.00 4.13 O ATOM 3348 CB ASP B 99 3.982 -5.333 1.088 1.00 4.35 C ATOM 3349 CG ASP B 99 2.472 -5.699 1.184 1.00 3.32 C ATOM 3350 OD1 ASP B 99 2.123 -6.835 1.558 1.00 34.45 O ATOM 3351 OD2 ASP B 99 1.621 -4.830 0.877 1.00 34.33 O ATOM 0 H ASP B 99 5.779 -2.809 1.303 1.00 20.12 H new ATOM 0 HA ASP B 99 3.723 -3.333 1.769 1.00 64.21 H new ATOM 0 HB2 ASP B 99 4.222 -5.052 0.062 1.00 4.35 H new ATOM 0 HB3 ASP B 99 4.583 -6.210 1.327 1.00 4.35 H new ATOM 3356 N ILE B 100 3.749 -3.496 4.295 1.00 44.33 N ATOM 3357 CA ILE B 100 3.340 -3.618 5.698 1.00 74.33 C ATOM 3358 C ILE B 100 1.981 -2.926 5.842 1.00 2.24 C ATOM 3359 O ILE B 100 1.914 -1.697 5.842 1.00 35.20 O ATOM 3360 CB ILE B 100 4.400 -2.975 6.678 1.00 31.52 C ATOM 3361 CG1 ILE B 100 5.821 -3.540 6.384 1.00 51.15 C ATOM 3362 CG2 ILE B 100 3.999 -3.201 8.164 1.00 54.11 C ATOM 3363 CD1 ILE B 100 6.926 -3.008 7.270 1.00 14.21 C ATOM 0 H ILE B 100 3.767 -2.531 3.964 1.00 44.33 H new ATOM 0 HA ILE B 100 3.270 -4.671 5.969 1.00 74.33 H new ATOM 0 HB ILE B 100 4.419 -1.899 6.506 1.00 31.52 H new ATOM 0 HG12 ILE B 100 5.790 -4.625 6.483 1.00 51.15 H new ATOM 0 HG13 ILE B 100 6.073 -3.321 5.346 1.00 51.15 H new ATOM 0 HG21 ILE B 100 4.746 -2.748 8.815 1.00 54.11 H new ATOM 0 HG22 ILE B 100 3.028 -2.743 8.352 1.00 54.11 H new ATOM 0 HG23 ILE B 100 3.941 -4.270 8.367 1.00 54.11 H new ATOM 0 HD11 ILE B 100 7.874 -3.464 6.983 1.00 14.21 H new ATOM 0 HD12 ILE B 100 6.995 -1.926 7.156 1.00 14.21 H new ATOM 0 HD13 ILE B 100 6.707 -3.250 8.310 1.00 14.21 H new ATOM 3375 N LYS B 101 0.908 -3.740 5.918 1.00 53.42 N ATOM 3376 CA LYS B 101 -0.491 -3.262 5.998 1.00 52.10 C ATOM 3377 C LYS B 101 -0.753 -2.304 7.203 1.00 73.25 C ATOM 3378 O LYS B 101 -1.396 -1.275 6.998 1.00 63.20 O ATOM 3379 CB LYS B 101 -1.478 -4.472 6.027 1.00 11.44 C ATOM 3380 CG LYS B 101 -1.538 -5.286 4.719 1.00 62.03 C ATOM 3381 CD LYS B 101 -2.037 -4.439 3.522 1.00 1.21 C ATOM 3382 CE LYS B 101 -2.228 -5.266 2.249 1.00 74.05 C ATOM 3383 NZ LYS B 101 -0.950 -5.843 1.753 1.00 4.30 N ATOM 0 H LYS B 101 0.987 -4.757 5.926 1.00 53.42 H new ATOM 0 HA LYS B 101 -0.668 -2.671 5.099 1.00 52.10 H new ATOM 0 HB2 LYS B 101 -1.191 -5.138 6.841 1.00 11.44 H new ATOM 0 HB3 LYS B 101 -2.478 -4.103 6.255 1.00 11.44 H new ATOM 0 HG2 LYS B 101 -0.547 -5.681 4.494 1.00 62.03 H new ATOM 0 HG3 LYS B 101 -2.199 -6.142 4.856 1.00 62.03 H new ATOM 0 HD2 LYS B 101 -2.982 -3.965 3.787 1.00 1.21 H new ATOM 0 HD3 LYS B 101 -1.323 -3.639 3.326 1.00 1.21 H new ATOM 0 HE2 LYS B 101 -2.936 -6.071 2.445 1.00 74.05 H new ATOM 0 HE3 LYS B 101 -2.666 -4.638 1.473 1.00 74.05 H new ATOM 0 HZ1 LYS B 101 -0.875 -5.690 0.727 1.00 4.30 H new ATOM 0 HZ2 LYS B 101 -0.151 -5.380 2.231 1.00 4.30 H new ATOM 0 HZ3 LYS B 101 -0.929 -6.863 1.954 1.00 4.30 H new ATOM 3397 N PRO B 102 -0.289 -2.615 8.484 1.00 1.01 N ATOM 3398 CA PRO B 102 -0.425 -1.661 9.633 1.00 5.43 C ATOM 3399 C PRO B 102 0.246 -0.280 9.377 1.00 62.20 C ATOM 3400 O PRO B 102 -0.301 0.759 9.758 1.00 24.30 O ATOM 3401 CB PRO B 102 0.250 -2.415 10.814 1.00 14.32 C ATOM 3402 CG PRO B 102 0.148 -3.863 10.446 1.00 54.01 C ATOM 3403 CD PRO B 102 0.322 -3.905 8.948 1.00 54.20 C ATOM 0 HA PRO B 102 -1.468 -1.406 9.820 1.00 5.43 H new ATOM 0 HB2 PRO B 102 1.289 -2.110 10.937 1.00 14.32 H new ATOM 0 HB3 PRO B 102 -0.257 -2.209 11.757 1.00 14.32 H new ATOM 0 HG2 PRO B 102 0.916 -4.452 10.948 1.00 54.01 H new ATOM 0 HG3 PRO B 102 -0.816 -4.277 10.742 1.00 54.01 H new ATOM 0 HD2 PRO B 102 1.373 -3.974 8.669 1.00 54.20 H new ATOM 0 HD3 PRO B 102 -0.181 -4.767 8.510 1.00 54.20 H new ATOM 3411 N LEU B 103 1.417 -0.292 8.708 1.00 13.43 N ATOM 3412 CA LEU B 103 2.193 0.941 8.400 1.00 22.32 C ATOM 3413 C LEU B 103 1.437 1.752 7.323 1.00 31.24 C ATOM 3414 O LEU B 103 1.223 2.965 7.464 1.00 3.45 O ATOM 3415 CB LEU B 103 3.636 0.560 7.890 1.00 4.04 C ATOM 3416 CG LEU B 103 4.824 1.547 8.201 1.00 61.32 C ATOM 3417 CD1 LEU B 103 4.615 2.979 7.639 1.00 30.52 C ATOM 3418 CD2 LEU B 103 5.125 1.572 9.713 1.00 73.31 C ATOM 0 H LEU B 103 1.855 -1.147 8.365 1.00 13.43 H new ATOM 0 HA LEU B 103 2.299 1.545 9.301 1.00 22.32 H new ATOM 0 HB2 LEU B 103 3.892 -0.412 8.313 1.00 4.04 H new ATOM 0 HB3 LEU B 103 3.584 0.433 6.809 1.00 4.04 H new ATOM 0 HG LEU B 103 5.693 1.156 7.673 1.00 61.32 H new ATOM 0 HD11 LEU B 103 5.475 3.599 7.894 1.00 30.52 H new ATOM 0 HD12 LEU B 103 4.510 2.933 6.555 1.00 30.52 H new ATOM 0 HD13 LEU B 103 3.714 3.412 8.073 1.00 30.52 H new ATOM 0 HD21 LEU B 103 5.948 2.259 9.909 1.00 73.31 H new ATOM 0 HD22 LEU B 103 4.239 1.903 10.255 1.00 73.31 H new ATOM 0 HD23 LEU B 103 5.401 0.571 10.046 1.00 73.31 H new ATOM 3430 N LEU B 104 1.006 1.027 6.277 1.00 15.40 N ATOM 3431 CA LEU B 104 0.403 1.595 5.065 1.00 61.45 C ATOM 3432 C LEU B 104 -0.933 2.268 5.379 1.00 4.00 C ATOM 3433 O LEU B 104 -1.165 3.418 4.982 1.00 11.13 O ATOM 3434 CB LEU B 104 0.206 0.467 4.007 1.00 12.11 C ATOM 3435 CG LEU B 104 -0.273 0.900 2.586 1.00 41.00 C ATOM 3436 CD1 LEU B 104 0.748 1.853 1.914 1.00 64.04 C ATOM 3437 CD2 LEU B 104 -0.555 -0.343 1.707 1.00 54.04 C ATOM 0 H LEU B 104 1.070 0.009 6.252 1.00 15.40 H new ATOM 0 HA LEU B 104 1.073 2.356 4.665 1.00 61.45 H new ATOM 0 HB2 LEU B 104 1.152 -0.063 3.898 1.00 12.11 H new ATOM 0 HB3 LEU B 104 -0.516 -0.247 4.404 1.00 12.11 H new ATOM 0 HG LEU B 104 -1.206 1.454 2.694 1.00 41.00 H new ATOM 0 HD11 LEU B 104 0.385 2.136 0.926 1.00 64.04 H new ATOM 0 HD12 LEU B 104 0.869 2.747 2.526 1.00 64.04 H new ATOM 0 HD13 LEU B 104 1.709 1.347 1.817 1.00 64.04 H new ATOM 0 HD21 LEU B 104 -0.888 -0.023 0.720 1.00 54.04 H new ATOM 0 HD22 LEU B 104 0.356 -0.933 1.609 1.00 54.04 H new ATOM 0 HD23 LEU B 104 -1.332 -0.949 2.173 1.00 54.04 H new ATOM 3449 N ASP B 105 -1.782 1.545 6.136 1.00 23.34 N ATOM 3450 CA ASP B 105 -3.142 1.988 6.461 1.00 62.31 C ATOM 3451 C ASP B 105 -3.105 3.289 7.261 1.00 50.45 C ATOM 3452 O ASP B 105 -3.713 4.271 6.863 1.00 45.21 O ATOM 3453 CB ASP B 105 -3.931 0.892 7.234 1.00 41.32 C ATOM 3454 CG ASP B 105 -5.397 1.308 7.506 1.00 4.42 C ATOM 3455 OD1 ASP B 105 -5.755 1.606 8.672 1.00 71.30 O ATOM 3456 OD2 ASP B 105 -6.191 1.372 6.534 1.00 63.41 O ATOM 0 H ASP B 105 -1.539 0.639 6.537 1.00 23.34 H new ATOM 0 HA ASP B 105 -3.664 2.170 5.522 1.00 62.31 H new ATOM 0 HB2 ASP B 105 -3.919 -0.035 6.660 1.00 41.32 H new ATOM 0 HB3 ASP B 105 -3.432 0.687 8.181 1.00 41.32 H new ATOM 3461 N VAL B 106 -2.312 3.279 8.341 1.00 1.40 N ATOM 3462 CA VAL B 106 -2.189 4.409 9.274 1.00 50.02 C ATOM 3463 C VAL B 106 -1.667 5.685 8.586 1.00 24.42 C ATOM 3464 O VAL B 106 -2.319 6.729 8.652 1.00 51.12 O ATOM 3465 CB VAL B 106 -1.262 3.992 10.480 1.00 52.43 C ATOM 3466 CG1 VAL B 106 -0.778 5.190 11.332 1.00 11.50 C ATOM 3467 CG2 VAL B 106 -1.991 2.954 11.355 1.00 53.10 C ATOM 0 H VAL B 106 -1.732 2.479 8.595 1.00 1.40 H new ATOM 0 HA VAL B 106 -3.184 4.651 9.647 1.00 50.02 H new ATOM 0 HB VAL B 106 -0.360 3.552 10.054 1.00 52.43 H new ATOM 0 HG11 VAL B 106 -0.146 4.828 12.143 1.00 11.50 H new ATOM 0 HG12 VAL B 106 -0.208 5.875 10.705 1.00 11.50 H new ATOM 0 HG13 VAL B 106 -1.640 5.711 11.749 1.00 11.50 H new ATOM 0 HG21 VAL B 106 -1.350 2.666 12.188 1.00 53.10 H new ATOM 0 HG22 VAL B 106 -2.914 3.387 11.740 1.00 53.10 H new ATOM 0 HG23 VAL B 106 -2.225 2.074 10.756 1.00 53.10 H new ATOM 3477 N THR B 107 -0.529 5.573 7.885 1.00 11.01 N ATOM 3478 CA THR B 107 0.172 6.742 7.317 1.00 10.33 C ATOM 3479 C THR B 107 -0.630 7.395 6.160 1.00 45.42 C ATOM 3480 O THR B 107 -0.732 8.630 6.076 1.00 64.53 O ATOM 3481 CB THR B 107 1.604 6.341 6.840 1.00 42.43 C ATOM 3482 OG1 THR B 107 2.301 5.690 7.919 1.00 5.51 O ATOM 3483 CG2 THR B 107 2.423 7.556 6.385 1.00 12.04 C ATOM 0 H THR B 107 -0.070 4.682 7.695 1.00 11.01 H new ATOM 0 HA THR B 107 0.261 7.487 8.108 1.00 10.33 H new ATOM 0 HB THR B 107 1.491 5.671 5.988 1.00 42.43 H new ATOM 0 HG1 THR B 107 2.027 4.750 7.965 1.00 5.51 H new ATOM 0 HG21 THR B 107 3.411 7.228 6.062 1.00 12.04 H new ATOM 0 HG22 THR B 107 1.915 8.047 5.555 1.00 12.04 H new ATOM 0 HG23 THR B 107 2.526 8.257 7.214 1.00 12.04 H new ATOM 3491 N CYS B 108 -1.228 6.551 5.296 1.00 74.13 N ATOM 3492 CA CYS B 108 -2.069 7.014 4.170 1.00 5.11 C ATOM 3493 C CYS B 108 -3.405 7.604 4.679 1.00 12.15 C ATOM 3494 O CYS B 108 -3.983 8.497 4.056 1.00 40.22 O ATOM 3495 CB CYS B 108 -2.328 5.851 3.192 1.00 52.41 C ATOM 3496 SG CYS B 108 -0.816 5.151 2.493 1.00 54.20 S ATOM 0 H CYS B 108 -1.144 5.536 5.356 1.00 74.13 H new ATOM 0 HA CYS B 108 -1.534 7.805 3.644 1.00 5.11 H new ATOM 0 HB2 CYS B 108 -2.877 5.065 3.711 1.00 52.41 H new ATOM 0 HB3 CYS B 108 -2.965 6.203 2.381 1.00 52.41 H new ATOM 0 HG CYS B 108 -0.302 4.302 3.333 1.00 54.20 H new ATOM 3502 N LYS B 109 -3.879 7.085 5.825 1.00 71.02 N ATOM 3503 CA LYS B 109 -5.100 7.567 6.495 1.00 2.55 C ATOM 3504 C LYS B 109 -4.828 8.923 7.166 1.00 73.22 C ATOM 3505 O LYS B 109 -5.708 9.774 7.201 1.00 21.44 O ATOM 3506 CB LYS B 109 -5.578 6.505 7.516 1.00 71.33 C ATOM 3507 CG LYS B 109 -6.938 6.761 8.210 1.00 41.54 C ATOM 3508 CD LYS B 109 -7.495 5.472 8.878 1.00 40.31 C ATOM 3509 CE LYS B 109 -7.880 4.398 7.841 1.00 41.14 C ATOM 3510 NZ LYS B 109 -8.249 3.102 8.473 1.00 34.24 N ATOM 0 H LYS B 109 -3.424 6.315 6.315 1.00 71.02 H new ATOM 0 HA LYS B 109 -5.895 7.716 5.764 1.00 2.55 H new ATOM 0 HB2 LYS B 109 -5.634 5.544 7.004 1.00 71.33 H new ATOM 0 HB3 LYS B 109 -4.815 6.411 8.289 1.00 71.33 H new ATOM 0 HG2 LYS B 109 -6.821 7.540 8.964 1.00 41.54 H new ATOM 0 HG3 LYS B 109 -7.656 7.131 7.478 1.00 41.54 H new ATOM 0 HD2 LYS B 109 -6.747 5.066 9.559 1.00 40.31 H new ATOM 0 HD3 LYS B 109 -8.369 5.725 9.478 1.00 40.31 H new ATOM 0 HE2 LYS B 109 -8.717 4.758 7.243 1.00 41.14 H new ATOM 0 HE3 LYS B 109 -7.045 4.241 7.158 1.00 41.14 H new ATOM 0 HZ1 LYS B 109 -8.932 2.603 7.868 1.00 34.24 H new ATOM 0 HZ2 LYS B 109 -7.397 2.517 8.588 1.00 34.24 H new ATOM 0 HZ3 LYS B 109 -8.676 3.279 9.405 1.00 34.24 H new ATOM 3524 N THR B 110 -3.578 9.115 7.649 1.00 51.02 N ATOM 3525 CA THR B 110 -3.137 10.359 8.308 1.00 20.00 C ATOM 3526 C THR B 110 -3.209 11.553 7.347 1.00 12.05 C ATOM 3527 O THR B 110 -3.774 12.589 7.695 1.00 21.30 O ATOM 3528 CB THR B 110 -1.686 10.236 8.882 1.00 21.35 C ATOM 3529 OG1 THR B 110 -1.655 9.204 9.873 1.00 34.42 O ATOM 3530 CG2 THR B 110 -1.182 11.559 9.510 1.00 24.34 C ATOM 0 H THR B 110 -2.847 8.406 7.590 1.00 51.02 H new ATOM 0 HA THR B 110 -3.821 10.528 9.140 1.00 20.00 H new ATOM 0 HB THR B 110 -1.025 9.995 8.049 1.00 21.35 H new ATOM 0 HG1 THR B 110 -1.869 8.343 9.456 1.00 34.42 H new ATOM 0 HG21 THR B 110 -0.171 11.418 9.893 1.00 24.34 H new ATOM 0 HG22 THR B 110 -1.177 12.343 8.753 1.00 24.34 H new ATOM 0 HG23 THR B 110 -1.842 11.848 10.328 1.00 24.34 H new ATOM 3538 N VAL B 111 -2.644 11.396 6.129 1.00 0.34 N ATOM 3539 CA VAL B 111 -2.670 12.469 5.112 1.00 14.52 C ATOM 3540 C VAL B 111 -4.121 12.759 4.666 1.00 4.44 C ATOM 3541 O VAL B 111 -4.473 13.910 4.391 1.00 70.04 O ATOM 3542 CB VAL B 111 -1.729 12.167 3.879 1.00 3.23 C ATOM 3543 CG1 VAL B 111 -2.165 10.921 3.082 1.00 4.54 C ATOM 3544 CG2 VAL B 111 -1.584 13.410 2.965 1.00 2.35 C ATOM 0 H VAL B 111 -2.169 10.545 5.829 1.00 0.34 H new ATOM 0 HA VAL B 111 -2.269 13.367 5.581 1.00 14.52 H new ATOM 0 HB VAL B 111 -0.746 11.935 4.288 1.00 3.23 H new ATOM 0 HG11 VAL B 111 -1.481 10.765 2.248 1.00 4.54 H new ATOM 0 HG12 VAL B 111 -2.148 10.048 3.734 1.00 4.54 H new ATOM 0 HG13 VAL B 111 -3.175 11.069 2.700 1.00 4.54 H new ATOM 0 HG21 VAL B 111 -0.931 13.170 2.126 1.00 2.35 H new ATOM 0 HG22 VAL B 111 -2.565 13.702 2.590 1.00 2.35 H new ATOM 0 HG23 VAL B 111 -1.154 14.233 3.536 1.00 2.35 H new ATOM 3554 N ALA B 112 -4.959 11.701 4.650 1.00 23.11 N ATOM 3555 CA ALA B 112 -6.405 11.808 4.370 1.00 51.55 C ATOM 3556 C ALA B 112 -7.157 12.547 5.514 1.00 70.45 C ATOM 3557 O ALA B 112 -8.189 13.192 5.281 1.00 32.05 O ATOM 3558 CB ALA B 112 -6.984 10.407 4.139 1.00 45.13 C ATOM 0 H ALA B 112 -4.650 10.746 4.832 1.00 23.11 H new ATOM 0 HA ALA B 112 -6.543 12.404 3.468 1.00 51.55 H new ATOM 0 HB1 ALA B 112 -8.051 10.484 3.932 1.00 45.13 H new ATOM 0 HB2 ALA B 112 -6.483 9.941 3.290 1.00 45.13 H new ATOM 0 HB3 ALA B 112 -6.830 9.798 5.030 1.00 45.13 H new ATOM 3564 N ASN B 113 -6.623 12.440 6.748 1.00 11.13 N ATOM 3565 CA ASN B 113 -7.152 13.152 7.937 1.00 72.51 C ATOM 3566 C ASN B 113 -6.680 14.621 7.949 1.00 21.21 C ATOM 3567 O ASN B 113 -7.393 15.495 8.443 1.00 3.31 O ATOM 3568 CB ASN B 113 -6.714 12.447 9.258 1.00 0.24 C ATOM 3569 CG ASN B 113 -7.301 11.043 9.447 1.00 24.44 C ATOM 3570 OD1 ASN B 113 -8.433 10.764 9.042 1.00 14.21 O ATOM 3571 ND2 ASN B 113 -6.531 10.141 10.055 1.00 11.21 N ATOM 0 H ASN B 113 -5.811 11.857 6.952 1.00 11.13 H new ATOM 0 HA ASN B 113 -8.240 13.129 7.876 1.00 72.51 H new ATOM 0 HB2 ASN B 113 -5.626 12.379 9.277 1.00 0.24 H new ATOM 0 HB3 ASN B 113 -7.009 13.069 10.103 1.00 0.24 H new ATOM 0 HD21 ASN B 113 -6.873 9.191 10.196 1.00 11.21 H new ATOM 0 HD22 ASN B 113 -5.599 10.401 10.379 1.00 11.21 H new ATOM 3578 N MET B 114 -5.465 14.878 7.406 1.00 51.32 N ATOM 3579 CA MET B 114 -4.882 16.240 7.336 1.00 63.10 C ATOM 3580 C MET B 114 -5.644 17.100 6.319 1.00 42.42 C ATOM 3581 O MET B 114 -5.911 18.281 6.572 1.00 1.23 O ATOM 3582 CB MET B 114 -3.375 16.220 6.955 1.00 1.33 C ATOM 3583 CG MET B 114 -2.444 15.509 7.950 1.00 61.45 C ATOM 3584 SD MET B 114 -0.695 15.871 7.644 1.00 31.03 S ATOM 3585 CE MET B 114 -0.523 15.568 5.879 1.00 1.43 C ATOM 0 H MET B 114 -4.867 14.154 7.008 1.00 51.32 H new ATOM 0 HA MET B 114 -4.974 16.670 8.333 1.00 63.10 H new ATOM 0 HB2 MET B 114 -3.272 15.739 5.982 1.00 1.33 H new ATOM 0 HB3 MET B 114 -3.035 17.249 6.840 1.00 1.33 H new ATOM 0 HG2 MET B 114 -2.702 15.812 8.965 1.00 61.45 H new ATOM 0 HG3 MET B 114 -2.605 14.433 7.888 1.00 61.45 H new ATOM 0 HE1 MET B 114 0.366 16.078 5.507 1.00 1.43 H new ATOM 0 HE2 MET B 114 -0.428 14.497 5.701 1.00 1.43 H new ATOM 0 HE3 MET B 114 -1.403 15.946 5.358 1.00 1.43 H new ATOM 3595 N ILE B 115 -5.973 16.505 5.153 1.00 62.32 N ATOM 3596 CA ILE B 115 -6.794 17.184 4.134 1.00 64.41 C ATOM 3597 C ILE B 115 -8.262 17.260 4.614 1.00 21.21 C ATOM 3598 O ILE B 115 -8.954 18.241 4.331 1.00 15.14 O ATOM 3599 CB ILE B 115 -6.690 16.500 2.711 1.00 64.55 C ATOM 3600 CG1 ILE B 115 -7.266 15.053 2.716 1.00 51.24 C ATOM 3601 CG2 ILE B 115 -5.220 16.511 2.213 1.00 2.22 C ATOM 3602 CD1 ILE B 115 -7.278 14.355 1.366 1.00 60.43 C ATOM 0 H ILE B 115 -5.684 15.561 4.897 1.00 62.32 H new ATOM 0 HA ILE B 115 -6.403 18.194 4.012 1.00 64.41 H new ATOM 0 HB ILE B 115 -7.298 17.082 2.019 1.00 64.55 H new ATOM 0 HG12 ILE B 115 -6.684 14.450 3.413 1.00 51.24 H new ATOM 0 HG13 ILE B 115 -8.286 15.087 3.098 1.00 51.24 H new ATOM 0 HG21 ILE B 115 -5.164 16.037 1.233 1.00 2.22 H new ATOM 0 HG22 ILE B 115 -4.869 17.540 2.139 1.00 2.22 H new ATOM 0 HG23 ILE B 115 -4.593 15.963 2.917 1.00 2.22 H new ATOM 0 HD11 ILE B 115 -7.697 13.355 1.477 1.00 60.43 H new ATOM 0 HD12 ILE B 115 -7.886 14.928 0.666 1.00 60.43 H new ATOM 0 HD13 ILE B 115 -6.259 14.281 0.986 1.00 60.43 H new ATOM 3614 N ARG B 116 -8.681 16.217 5.379 1.00 20.23 N ATOM 3615 CA ARG B 116 -10.004 16.115 6.021 1.00 60.41 C ATOM 3616 C ARG B 116 -11.150 16.311 5.001 1.00 40.23 C ATOM 3617 O ARG B 116 -11.667 17.423 4.822 1.00 12.12 O ATOM 3618 CB ARG B 116 -10.078 17.092 7.239 1.00 73.41 C ATOM 3619 CG ARG B 116 -11.382 17.088 8.077 1.00 41.14 C ATOM 3620 CD ARG B 116 -11.780 15.713 8.663 1.00 24.43 C ATOM 3621 NE ARG B 116 -12.530 14.879 7.696 1.00 25.22 N ATOM 3622 CZ ARG B 116 -12.955 13.624 7.918 1.00 43.12 C ATOM 3623 NH1 ARG B 116 -12.716 12.999 9.071 1.00 53.14 N ATOM 3624 NH2 ARG B 116 -13.641 12.992 6.974 1.00 75.11 N ATOM 0 H ARG B 116 -8.088 15.408 5.566 1.00 20.23 H new ATOM 0 HA ARG B 116 -10.138 15.105 6.409 1.00 60.41 H new ATOM 0 HB2 ARG B 116 -9.248 16.862 7.907 1.00 73.41 H new ATOM 0 HB3 ARG B 116 -9.918 18.105 6.869 1.00 73.41 H new ATOM 0 HG2 ARG B 116 -11.271 17.797 8.897 1.00 41.14 H new ATOM 0 HG3 ARG B 116 -12.199 17.450 7.452 1.00 41.14 H new ATOM 0 HD2 ARG B 116 -10.881 15.181 8.976 1.00 24.43 H new ATOM 0 HD3 ARG B 116 -12.388 15.864 9.555 1.00 24.43 H new ATOM 0 HE ARG B 116 -12.741 15.291 6.787 1.00 25.22 H new ATOM 0 HH11 ARG B 116 -12.199 13.474 9.811 1.00 53.14 H new ATOM 0 HH12 ARG B 116 -13.050 12.046 9.213 1.00 53.14 H new ATOM 0 HH21 ARG B 116 -13.841 13.459 6.090 1.00 75.11 H new ATOM 0 HH22 ARG B 116 -13.968 12.039 7.133 1.00 75.11 H new ATOM 3638 N GLY B 117 -11.507 15.213 4.309 1.00 44.33 N ATOM 3639 CA GLY B 117 -12.587 15.222 3.313 1.00 43.51 C ATOM 3640 C GLY B 117 -13.964 14.932 3.909 1.00 41.31 C ATOM 3641 O GLY B 117 -14.188 15.221 5.105 1.00 3.41 O ATOM 3642 OXT GLY B 117 -14.846 14.435 3.177 1.00 38.24 O ATOM 0 H GLY B 117 -11.058 14.304 4.425 1.00 44.33 H new ATOM 0 HA2 GLY B 117 -12.610 16.194 2.821 1.00 43.51 H new ATOM 0 HA3 GLY B 117 -12.369 14.481 2.544 1.00 43.51 H new TER 3646 GLY B 117