USER MOD reduce.3.24.130724 H: found=0, std=0, add=1822, rem=0, adj=65 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 47 THR OG1 : rot 180:sc= -0.327 USER MOD Set 1.2: B 49 THR OG1 : rot 180:sc= 0.00288 USER MOD Set 2.1: B 12 LYS NZ :NH3+ 153:sc= 0.401 (180deg=-1.26) USER MOD Set 2.2: B 48 SER OG : rot 110:sc= 0.598 USER MOD Set 3.1: A 47 THR OG1 : rot 180:sc= -0.368 USER MOD Set 3.2: A 49 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 12 LYS NZ :NH3+ 151:sc= 0.467 (180deg=-1.36!) USER MOD Set 4.2: A 48 SER OG : rot 100:sc= 0.656 USER MOD Single : A 2 SER OG : rot 31:sc= 0.121 USER MOD Single : A 5 LYS NZ :NH3+ -133:sc= 0.931 (180deg=-0.25) USER MOD Single : A 8 SER OG : rot -91:sc= -0.235 USER MOD Single : A 9 SER OG : rot 180:sc= -1.04 USER MOD Single : A 18 LYS NZ :NH3+ 172:sc= 0.151 (180deg=0.0185) USER MOD Single : A 22 CYS SG : rot 58:sc= 1.2 USER MOD Single : A 23 MET CE :methyl -169:sc= -0.161 (180deg=-0.492) USER MOD Single : A 24 SER OG : rot 31:sc= 1.06 USER MOD Single : A 26 THR OG1 : rot -17:sc= 0.387 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN : amide:sc= -0.547 X(o=-0.55,f=-0.46) USER MOD Single : A 30 MET CE :methyl -129:sc= 0 (180deg=-2.09!) USER MOD Single : A 37 SER OG : rot -160:sc= -0.0122 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 53 LYS NZ :NH3+ 161:sc= 0.213 (180deg=-0.565) USER MOD Single : A 57 TYR OH : rot -26:sc= -0.173 USER MOD Single : A 58 CYS SG : rot 79:sc= -2.71! USER MOD Single : A 60 HIS : no HD1:sc= -0.084 K(o=-0.084,f=-0.64) USER MOD Single : A 61 HIS : no HD1:sc= -0.0321 K(o=-0.032,f=-0.71) USER MOD Single : A 62 HIS : no HE2:sc= -1.18 X(o=-1.2,f=-1.2) USER MOD Single : A 63 GLN : amide:sc= 0.08 K(o=0.08,f=-1) USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 76 TYR OH : rot -131:sc= 0.0839 USER MOD Single : A 81 CYS SG : rot 70:sc= 1.19 USER MOD Single : A 82 LYS NZ :NH3+ 167:sc= 0.622 (180deg=0.424) USER MOD Single : A 85 GLN : amide:sc= -0.619 K(o=-0.62,f=-6!) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 ASN : amide:sc= -2.37! X(o=-2.4!,f=-2.3) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ -136:sc= 0.754 (180deg=-1.01) USER MOD Single : A 107 THR OG1 : rot 78:sc= 0.292 USER MOD Single : A 108 CYS SG : rot 86:sc= -0.214 USER MOD Single : A 109 LYS NZ :NH3+ 133:sc= 0.583 (180deg=-0.234) USER MOD Single : A 110 THR OG1 : rot 75:sc= 0.888 USER MOD Single : A 113 ASN : amide:sc= -0.312 K(o=-0.31,f=-4.6!) USER MOD Single : A 114 MET CE :methyl -136:sc= -0.706 (180deg=-2.8!) USER MOD Single : B 2 SER OG : rot 33:sc= 0.151 USER MOD Single : B 5 LYS NZ :NH3+ -135:sc= 0.955 (180deg=-0.138) USER MOD Single : B 8 SER OG : rot -90:sc= -0.189 USER MOD Single : B 9 SER OG : rot 180:sc= -0.926 USER MOD Single : B 18 LYS NZ :NH3+ 175:sc= 0.165 (180deg=0.00851) USER MOD Single : B 22 CYS SG : rot 66:sc= 1.21 USER MOD Single : B 23 MET CE :methyl -173:sc= -0.203 (180deg=-0.384) USER MOD Single : B 24 SER OG : rot 35:sc= 0.999 USER MOD Single : B 26 THR OG1 : rot -18:sc= 0.267 USER MOD Single : B 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 ASN : amide:sc= -0.475 X(o=-0.48,f=-0.66) USER MOD Single : B 30 MET CE :methyl -131:sc= 0 (180deg=-1.77!) USER MOD Single : B 37 SER OG : rot -160:sc= -0.0234 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 53 LYS NZ :NH3+ 162:sc= 0.0663 (180deg=-0.548) USER MOD Single : B 57 TYR OH : rot -39:sc= 0.301 USER MOD Single : B 58 CYS SG : rot 78:sc= -2.78! USER MOD Single : B 60 HIS : no HD1:sc= -0.0843 K(o=-0.084,f=-0.68) USER MOD Single : B 61 HIS : no HE2:sc= -0.0767 K(o=-0.077,f=-0.91) USER MOD Single : B 62 HIS : no HE2:sc= -1.27 X(o=-1.3,f=-1.3) USER MOD Single : B 63 GLN : amide:sc= 0.261 K(o=0.26,f=-0.88) USER MOD Single : B 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 68 SER OG : rot 180:sc= 0 USER MOD Single : B 76 TYR OH : rot -136:sc= 0.255 USER MOD Single : B 81 CYS SG : rot 72:sc= 1.21 USER MOD Single : B 82 LYS NZ :NH3+ 165:sc= 0.654 (180deg=0.428) USER MOD Single : B 85 GLN : amide:sc= -0.564 K(o=-0.56,f=-5.9!) USER MOD Single : B 87 THR OG1 : rot 180:sc= 0 USER MOD Single : B 96 ASN : amide:sc= -1.18 X(o=-1.2,f=-1.4) USER MOD Single : B 97 TYR OH : rot 180:sc= 0 USER MOD Single : B 101 LYS NZ :NH3+ -132:sc= 0.96 (180deg=-1.16!) USER MOD Single : B 107 THR OG1 : rot 78:sc= 0.298 USER MOD Single : B 108 CYS SG : rot 83:sc= -0.224 USER MOD Single : B 109 LYS NZ :NH3+ 137:sc= 0.527 (180deg=-0.0566) USER MOD Single : B 110 THR OG1 : rot 75:sc= 0.965 USER MOD Single : B 113 ASN : amide:sc= -0.382 K(o=-0.38,f=-4.6!) USER MOD Single : B 114 MET CE :methyl -135:sc= -0.6 (180deg=-2.61) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 -15.259 -14.327 -17.698 1.00 11.21 N ATOM 2 CA SER A 2 -16.524 -14.077 -16.990 1.00 61.51 C ATOM 3 C SER A 2 -16.438 -12.787 -16.163 1.00 21.44 C ATOM 4 O SER A 2 -15.398 -12.503 -15.560 1.00 72.40 O ATOM 5 CB SER A 2 -16.851 -15.284 -16.096 1.00 32.31 C ATOM 6 OG SER A 2 -16.889 -16.484 -16.855 1.00 71.23 O ATOM 0 HA SER A 2 -17.325 -13.946 -17.718 1.00 61.51 H new ATOM 0 HB2 SER A 2 -16.102 -15.371 -15.308 1.00 32.31 H new ATOM 0 HB3 SER A 2 -17.812 -15.129 -15.606 1.00 32.31 H new ATOM 0 HG SER A 2 -16.263 -16.416 -17.606 1.00 71.23 H new ATOM 14 N LEU A 3 -17.543 -12.018 -16.132 1.00 60.12 N ATOM 15 CA LEU A 3 -17.616 -10.733 -15.413 1.00 41.11 C ATOM 16 C LEU A 3 -18.167 -10.933 -13.987 1.00 2.33 C ATOM 17 O LEU A 3 -19.305 -11.390 -13.820 1.00 22.20 O ATOM 18 CB LEU A 3 -18.537 -9.745 -16.182 1.00 22.23 C ATOM 19 CG LEU A 3 -18.145 -9.443 -17.659 1.00 54.35 C ATOM 20 CD1 LEU A 3 -19.220 -8.584 -18.349 1.00 61.22 C ATOM 21 CD2 LEU A 3 -16.756 -8.782 -17.747 1.00 23.01 C ATOM 0 H LEU A 3 -18.410 -12.271 -16.605 1.00 60.12 H new ATOM 0 HA LEU A 3 -16.608 -10.324 -15.349 1.00 41.11 H new ATOM 0 HB2 LEU A 3 -19.551 -10.145 -16.172 1.00 22.23 H new ATOM 0 HB3 LEU A 3 -18.560 -8.803 -15.635 1.00 22.23 H new ATOM 0 HG LEU A 3 -18.087 -10.393 -18.190 1.00 54.35 H new ATOM 0 HD11 LEU A 3 -18.923 -8.387 -19.379 1.00 61.22 H new ATOM 0 HD12 LEU A 3 -20.171 -9.116 -18.341 1.00 61.22 H new ATOM 0 HD13 LEU A 3 -19.329 -7.640 -17.816 1.00 61.22 H new ATOM 0 HD21 LEU A 3 -16.513 -8.584 -18.791 1.00 23.01 H new ATOM 0 HD22 LEU A 3 -16.764 -7.844 -17.192 1.00 23.01 H new ATOM 0 HD23 LEU A 3 -16.008 -9.450 -17.320 1.00 23.01 H new ATOM 33 N VAL A 4 -17.358 -10.600 -12.966 1.00 51.13 N ATOM 34 CA VAL A 4 -17.835 -10.485 -11.573 1.00 72.15 C ATOM 35 C VAL A 4 -18.341 -9.048 -11.340 1.00 43.40 C ATOM 36 O VAL A 4 -17.679 -8.074 -11.714 1.00 32.23 O ATOM 37 CB VAL A 4 -16.724 -10.876 -10.517 1.00 74.40 C ATOM 38 CG1 VAL A 4 -16.390 -12.382 -10.612 1.00 43.11 C ATOM 39 CG2 VAL A 4 -15.442 -10.014 -10.671 1.00 41.32 C ATOM 0 H VAL A 4 -16.363 -10.404 -13.079 1.00 51.13 H new ATOM 0 HA VAL A 4 -18.649 -11.195 -11.428 1.00 72.15 H new ATOM 0 HB VAL A 4 -17.130 -10.670 -9.527 1.00 74.40 H new ATOM 0 HG11 VAL A 4 -15.624 -12.632 -9.878 1.00 43.11 H new ATOM 0 HG12 VAL A 4 -17.288 -12.967 -10.413 1.00 43.11 H new ATOM 0 HG13 VAL A 4 -16.022 -12.611 -11.612 1.00 43.11 H new ATOM 0 HG21 VAL A 4 -14.707 -10.318 -9.925 1.00 41.32 H new ATOM 0 HG22 VAL A 4 -15.026 -10.155 -11.669 1.00 41.32 H new ATOM 0 HG23 VAL A 4 -15.691 -8.963 -10.527 1.00 41.32 H new ATOM 49 N LYS A 5 -19.546 -8.932 -10.768 1.00 61.22 N ATOM 50 CA LYS A 5 -20.180 -7.634 -10.496 1.00 14.21 C ATOM 51 C LYS A 5 -19.632 -7.092 -9.169 1.00 41.31 C ATOM 52 O LYS A 5 -19.753 -7.758 -8.137 1.00 11.41 O ATOM 53 CB LYS A 5 -21.720 -7.797 -10.415 1.00 25.00 C ATOM 54 CG LYS A 5 -22.362 -8.626 -11.553 1.00 1.15 C ATOM 55 CD LYS A 5 -23.896 -8.743 -11.399 1.00 50.31 C ATOM 56 CE LYS A 5 -24.530 -9.716 -12.402 1.00 34.02 C ATOM 57 NZ LYS A 5 -24.338 -9.301 -13.809 1.00 72.21 N ATOM 0 H LYS A 5 -20.109 -9.733 -10.481 1.00 61.22 H new ATOM 0 HA LYS A 5 -19.955 -6.935 -11.302 1.00 14.21 H new ATOM 0 HB2 LYS A 5 -21.969 -8.265 -9.463 1.00 25.00 H new ATOM 0 HB3 LYS A 5 -22.173 -6.806 -10.411 1.00 25.00 H new ATOM 0 HG2 LYS A 5 -22.129 -8.164 -12.512 1.00 1.15 H new ATOM 0 HG3 LYS A 5 -21.923 -9.624 -11.565 1.00 1.15 H new ATOM 0 HD2 LYS A 5 -24.129 -9.072 -10.386 1.00 50.31 H new ATOM 0 HD3 LYS A 5 -24.344 -7.757 -11.525 1.00 50.31 H new ATOM 0 HE2 LYS A 5 -24.100 -10.708 -12.259 1.00 34.02 H new ATOM 0 HE3 LYS A 5 -25.597 -9.798 -12.195 1.00 34.02 H new ATOM 0 HZ1 LYS A 5 -25.242 -9.371 -14.318 1.00 72.21 H new ATOM 0 HZ2 LYS A 5 -24.000 -8.318 -13.838 1.00 72.21 H new ATOM 0 HZ3 LYS A 5 -23.637 -9.922 -14.261 1.00 72.21 H new ATOM 71 N LEU A 6 -18.998 -5.913 -9.209 1.00 60.35 N ATOM 72 CA LEU A 6 -18.394 -5.280 -8.018 1.00 23.13 C ATOM 73 C LEU A 6 -19.031 -3.909 -7.786 1.00 62.43 C ATOM 74 O LEU A 6 -18.730 -2.948 -8.499 1.00 20.55 O ATOM 75 CB LEU A 6 -16.852 -5.163 -8.191 1.00 72.43 C ATOM 76 CG LEU A 6 -16.086 -6.516 -8.338 1.00 64.20 C ATOM 77 CD1 LEU A 6 -14.582 -6.280 -8.552 1.00 22.22 C ATOM 78 CD2 LEU A 6 -16.341 -7.451 -7.130 1.00 71.42 C ATOM 0 H LEU A 6 -18.887 -5.368 -10.064 1.00 60.35 H new ATOM 0 HA LEU A 6 -18.584 -5.901 -7.143 1.00 23.13 H new ATOM 0 HB2 LEU A 6 -16.648 -4.553 -9.071 1.00 72.43 H new ATOM 0 HB3 LEU A 6 -16.447 -4.628 -7.332 1.00 72.43 H new ATOM 0 HG LEU A 6 -16.476 -7.018 -9.224 1.00 64.20 H new ATOM 0 HD11 LEU A 6 -14.074 -7.239 -8.651 1.00 22.22 H new ATOM 0 HD12 LEU A 6 -14.431 -5.694 -9.459 1.00 22.22 H new ATOM 0 HD13 LEU A 6 -14.173 -5.739 -7.698 1.00 22.22 H new ATOM 0 HD21 LEU A 6 -15.792 -8.382 -7.268 1.00 71.42 H new ATOM 0 HD22 LEU A 6 -16.004 -6.963 -6.215 1.00 71.42 H new ATOM 0 HD23 LEU A 6 -17.407 -7.666 -7.055 1.00 71.42 H new ATOM 90 N GLU A 7 -19.940 -3.838 -6.805 1.00 33.12 N ATOM 91 CA GLU A 7 -20.619 -2.593 -6.439 1.00 41.33 C ATOM 92 C GLU A 7 -19.722 -1.746 -5.538 1.00 25.43 C ATOM 93 O GLU A 7 -18.836 -2.255 -4.855 1.00 31.22 O ATOM 94 CB GLU A 7 -21.987 -2.859 -5.746 1.00 53.02 C ATOM 95 CG GLU A 7 -23.045 -3.530 -6.643 1.00 64.31 C ATOM 96 CD GLU A 7 -22.706 -4.987 -6.985 1.00 35.41 C ATOM 97 OE1 GLU A 7 -22.678 -5.815 -6.051 1.00 45.13 O ATOM 98 OE2 GLU A 7 -22.473 -5.309 -8.173 1.00 13.11 O ATOM 0 H GLU A 7 -20.224 -4.642 -6.245 1.00 33.12 H new ATOM 0 HA GLU A 7 -20.821 -2.046 -7.360 1.00 41.33 H new ATOM 0 HB2 GLU A 7 -21.820 -3.489 -4.872 1.00 53.02 H new ATOM 0 HB3 GLU A 7 -22.386 -1.911 -5.384 1.00 53.02 H new ATOM 0 HG2 GLU A 7 -24.012 -3.496 -6.142 1.00 64.31 H new ATOM 0 HG3 GLU A 7 -23.144 -2.960 -7.567 1.00 64.31 H new ATOM 105 N SER A 8 -19.963 -0.447 -5.574 1.00 65.20 N ATOM 106 CA SER A 8 -19.260 0.540 -4.761 1.00 55.25 C ATOM 107 C SER A 8 -20.003 0.796 -3.439 1.00 21.43 C ATOM 108 O SER A 8 -20.980 0.101 -3.112 1.00 11.40 O ATOM 109 CB SER A 8 -19.153 1.825 -5.597 1.00 2.05 C ATOM 110 OG SER A 8 -20.419 2.182 -6.146 1.00 1.21 O ATOM 0 H SER A 8 -20.670 -0.035 -6.183 1.00 65.20 H new ATOM 0 HA SER A 8 -18.267 0.178 -4.493 1.00 55.25 H new ATOM 0 HB2 SER A 8 -18.780 2.638 -4.975 1.00 2.05 H new ATOM 0 HB3 SER A 8 -18.431 1.681 -6.401 1.00 2.05 H new ATOM 0 HG SER A 8 -20.518 1.774 -7.031 1.00 1.21 H new ATOM 116 N SER A 9 -19.496 1.771 -2.672 1.00 75.11 N ATOM 117 CA SER A 9 -20.212 2.356 -1.530 1.00 13.14 C ATOM 118 C SER A 9 -21.514 3.044 -2.019 1.00 64.33 C ATOM 119 O SER A 9 -22.530 3.038 -1.323 1.00 51.25 O ATOM 120 CB SER A 9 -19.284 3.353 -0.807 1.00 73.05 C ATOM 121 OG SER A 9 -18.844 4.378 -1.678 1.00 11.02 O ATOM 0 H SER A 9 -18.574 2.178 -2.827 1.00 75.11 H new ATOM 0 HA SER A 9 -20.495 1.574 -0.825 1.00 13.14 H new ATOM 0 HB2 SER A 9 -19.811 3.794 0.039 1.00 73.05 H new ATOM 0 HB3 SER A 9 -18.422 2.822 -0.403 1.00 73.05 H new ATOM 0 HG SER A 9 -18.259 4.994 -1.189 1.00 11.02 H new ATOM 127 N ASP A 10 -21.456 3.604 -3.253 1.00 43.33 N ATOM 128 CA ASP A 10 -22.621 4.192 -3.964 1.00 33.21 C ATOM 129 C ASP A 10 -23.552 3.102 -4.550 1.00 42.34 C ATOM 130 O ASP A 10 -24.571 3.431 -5.175 1.00 45.22 O ATOM 131 CB ASP A 10 -22.124 5.101 -5.125 1.00 63.31 C ATOM 132 CG ASP A 10 -21.302 6.318 -4.670 1.00 12.35 C ATOM 133 OD1 ASP A 10 -21.792 7.463 -4.785 1.00 72.41 O ATOM 134 OD2 ASP A 10 -20.150 6.129 -4.217 1.00 13.23 O ATOM 0 H ASP A 10 -20.590 3.661 -3.789 1.00 43.33 H new ATOM 0 HA ASP A 10 -23.187 4.773 -3.236 1.00 33.21 H new ATOM 0 HB2 ASP A 10 -21.518 4.502 -5.805 1.00 63.31 H new ATOM 0 HB3 ASP A 10 -22.987 5.452 -5.691 1.00 63.31 H new ATOM 139 N GLU A 11 -23.155 1.816 -4.381 1.00 11.43 N ATOM 140 CA GLU A 11 -23.911 0.619 -4.835 1.00 34.55 C ATOM 141 C GLU A 11 -24.003 0.507 -6.372 1.00 11.20 C ATOM 142 O GLU A 11 -24.776 -0.316 -6.882 1.00 21.41 O ATOM 143 CB GLU A 11 -25.329 0.560 -4.183 1.00 42.54 C ATOM 144 CG GLU A 11 -25.324 0.445 -2.644 1.00 34.04 C ATOM 145 CD GLU A 11 -26.739 0.432 -2.035 1.00 3.43 C ATOM 146 OE1 GLU A 11 -27.254 1.515 -1.676 1.00 53.43 O ATOM 147 OE2 GLU A 11 -27.345 -0.658 -1.917 1.00 31.12 O ATOM 0 H GLU A 11 -22.280 1.576 -3.915 1.00 11.43 H new ATOM 0 HA GLU A 11 -23.340 -0.245 -4.496 1.00 34.55 H new ATOM 0 HB2 GLU A 11 -25.882 1.456 -4.466 1.00 42.54 H new ATOM 0 HB3 GLU A 11 -25.869 -0.292 -4.596 1.00 42.54 H new ATOM 0 HG2 GLU A 11 -24.802 -0.467 -2.355 1.00 34.04 H new ATOM 0 HG3 GLU A 11 -24.762 1.280 -2.225 1.00 34.04 H new ATOM 154 N LYS A 12 -23.205 1.311 -7.104 1.00 72.14 N ATOM 155 CA LYS A 12 -23.166 1.260 -8.577 1.00 34.41 C ATOM 156 C LYS A 12 -22.410 0.000 -9.031 1.00 32.33 C ATOM 157 O LYS A 12 -21.297 -0.246 -8.562 1.00 43.14 O ATOM 158 CB LYS A 12 -22.510 2.530 -9.177 1.00 45.43 C ATOM 159 CG LYS A 12 -23.235 3.859 -8.856 1.00 43.41 C ATOM 160 CD LYS A 12 -22.736 5.033 -9.741 1.00 31.01 C ATOM 161 CE LYS A 12 -23.333 6.395 -9.350 1.00 44.34 C ATOM 162 NZ LYS A 12 -22.911 6.822 -7.990 1.00 55.23 N ATOM 0 H LYS A 12 -22.578 2.004 -6.696 1.00 72.14 H new ATOM 0 HA LYS A 12 -24.192 1.220 -8.943 1.00 34.41 H new ATOM 0 HB2 LYS A 12 -21.485 2.597 -8.813 1.00 45.43 H new ATOM 0 HB3 LYS A 12 -22.457 2.416 -10.260 1.00 45.43 H new ATOM 0 HG2 LYS A 12 -24.308 3.729 -9.000 1.00 43.41 H new ATOM 0 HG3 LYS A 12 -23.083 4.109 -7.806 1.00 43.41 H new ATOM 0 HD2 LYS A 12 -21.649 5.090 -9.676 1.00 31.01 H new ATOM 0 HD3 LYS A 12 -22.983 4.823 -10.782 1.00 31.01 H new ATOM 0 HE2 LYS A 12 -23.026 7.147 -10.077 1.00 44.34 H new ATOM 0 HE3 LYS A 12 -24.421 6.338 -9.390 1.00 44.34 H new ATOM 0 HZ1 LYS A 12 -22.893 7.861 -7.942 1.00 55.23 H new ATOM 0 HZ2 LYS A 12 -23.583 6.455 -7.287 1.00 55.23 H new ATOM 0 HZ3 LYS A 12 -21.961 6.449 -7.788 1.00 55.23 H new ATOM 176 N VAL A 13 -23.040 -0.776 -9.928 1.00 65.35 N ATOM 177 CA VAL A 13 -22.529 -2.076 -10.404 1.00 44.34 C ATOM 178 C VAL A 13 -21.381 -1.874 -11.406 1.00 42.01 C ATOM 179 O VAL A 13 -21.584 -1.286 -12.476 1.00 33.54 O ATOM 180 CB VAL A 13 -23.677 -2.907 -11.097 1.00 33.21 C ATOM 181 CG1 VAL A 13 -23.175 -4.302 -11.558 1.00 72.44 C ATOM 182 CG2 VAL A 13 -24.911 -3.023 -10.171 1.00 34.50 C ATOM 0 H VAL A 13 -23.931 -0.516 -10.350 1.00 65.35 H new ATOM 0 HA VAL A 13 -22.160 -2.624 -9.537 1.00 44.34 H new ATOM 0 HB VAL A 13 -23.983 -2.367 -11.993 1.00 33.21 H new ATOM 0 HG11 VAL A 13 -23.993 -4.845 -12.031 1.00 72.44 H new ATOM 0 HG12 VAL A 13 -22.361 -4.178 -12.273 1.00 72.44 H new ATOM 0 HG13 VAL A 13 -22.817 -4.864 -10.695 1.00 72.44 H new ATOM 0 HG21 VAL A 13 -25.688 -3.600 -10.671 1.00 34.50 H new ATOM 0 HG22 VAL A 13 -24.626 -3.524 -9.246 1.00 34.50 H new ATOM 0 HG23 VAL A 13 -25.289 -2.027 -9.942 1.00 34.50 H new ATOM 192 N PHE A 14 -20.178 -2.341 -11.052 1.00 11.40 N ATOM 193 CA PHE A 14 -19.014 -2.325 -11.950 1.00 75.40 C ATOM 194 C PHE A 14 -18.611 -3.766 -12.261 1.00 32.24 C ATOM 195 O PHE A 14 -17.830 -4.383 -11.527 1.00 64.22 O ATOM 196 CB PHE A 14 -17.839 -1.529 -11.324 1.00 25.14 C ATOM 197 CG PHE A 14 -18.172 -0.065 -11.077 1.00 10.54 C ATOM 198 CD1 PHE A 14 -18.424 0.418 -9.795 1.00 24.40 C ATOM 199 CD2 PHE A 14 -18.257 0.823 -12.147 1.00 21.25 C ATOM 200 CE1 PHE A 14 -18.757 1.736 -9.594 1.00 63.10 C ATOM 201 CE2 PHE A 14 -18.587 2.146 -11.944 1.00 62.31 C ATOM 202 CZ PHE A 14 -18.835 2.604 -10.670 1.00 35.14 C ATOM 0 H PHE A 14 -19.982 -2.741 -10.134 1.00 11.40 H new ATOM 0 HA PHE A 14 -19.277 -1.820 -12.879 1.00 75.40 H new ATOM 0 HB2 PHE A 14 -17.555 -1.995 -10.380 1.00 25.14 H new ATOM 0 HB3 PHE A 14 -16.974 -1.592 -11.984 1.00 25.14 H new ATOM 0 HD1 PHE A 14 -18.357 -0.251 -8.950 1.00 24.40 H new ATOM 0 HD2 PHE A 14 -18.062 0.470 -13.149 1.00 21.25 H new ATOM 0 HE1 PHE A 14 -18.958 2.095 -8.596 1.00 63.10 H new ATOM 0 HE2 PHE A 14 -18.651 2.822 -12.784 1.00 62.31 H new ATOM 0 HZ PHE A 14 -19.091 3.641 -10.509 1.00 35.14 H new ATOM 212 N GLU A 15 -19.233 -4.316 -13.316 1.00 74.55 N ATOM 213 CA GLU A 15 -18.870 -5.627 -13.860 1.00 70.40 C ATOM 214 C GLU A 15 -17.461 -5.548 -14.466 1.00 71.31 C ATOM 215 O GLU A 15 -17.166 -4.654 -15.267 1.00 2.33 O ATOM 216 CB GLU A 15 -19.896 -6.072 -14.929 1.00 42.32 C ATOM 217 CG GLU A 15 -21.337 -6.252 -14.393 1.00 10.42 C ATOM 218 CD GLU A 15 -22.375 -6.662 -15.457 1.00 23.13 C ATOM 219 OE1 GLU A 15 -22.081 -6.590 -16.672 1.00 73.41 O ATOM 220 OE2 GLU A 15 -23.504 -7.033 -15.079 1.00 55.15 O ATOM 0 H GLU A 15 -20.000 -3.862 -13.813 1.00 74.55 H new ATOM 0 HA GLU A 15 -18.877 -6.366 -13.059 1.00 70.40 H new ATOM 0 HB2 GLU A 15 -19.909 -5.335 -15.732 1.00 42.32 H new ATOM 0 HB3 GLU A 15 -19.563 -7.014 -15.366 1.00 42.32 H new ATOM 0 HG2 GLU A 15 -21.326 -7.007 -13.607 1.00 10.42 H new ATOM 0 HG3 GLU A 15 -21.658 -5.317 -13.933 1.00 10.42 H new ATOM 227 N ILE A 16 -16.598 -6.465 -14.049 1.00 31.40 N ATOM 228 CA ILE A 16 -15.208 -6.553 -14.519 1.00 33.25 C ATOM 229 C ILE A 16 -14.835 -8.031 -14.645 1.00 52.21 C ATOM 230 O ILE A 16 -15.363 -8.862 -13.897 1.00 70.54 O ATOM 231 CB ILE A 16 -14.222 -5.808 -13.534 1.00 54.12 C ATOM 232 CG1 ILE A 16 -12.750 -5.852 -14.059 1.00 31.00 C ATOM 233 CG2 ILE A 16 -14.336 -6.364 -12.095 1.00 43.04 C ATOM 234 CD1 ILE A 16 -11.725 -5.193 -13.155 1.00 34.54 C ATOM 0 H ILE A 16 -16.840 -7.182 -13.365 1.00 31.40 H new ATOM 0 HA ILE A 16 -15.120 -6.063 -15.489 1.00 33.25 H new ATOM 0 HB ILE A 16 -14.520 -4.760 -13.499 1.00 54.12 H new ATOM 0 HG12 ILE A 16 -12.465 -6.893 -14.208 1.00 31.00 H new ATOM 0 HG13 ILE A 16 -12.714 -5.369 -15.036 1.00 31.00 H new ATOM 0 HG21 ILE A 16 -13.645 -5.830 -11.443 1.00 43.04 H new ATOM 0 HG22 ILE A 16 -15.355 -6.229 -11.732 1.00 43.04 H new ATOM 0 HG23 ILE A 16 -14.089 -7.426 -12.094 1.00 43.04 H new ATOM 0 HD11 ILE A 16 -10.736 -5.276 -13.606 1.00 34.54 H new ATOM 0 HD12 ILE A 16 -11.978 -4.141 -13.025 1.00 34.54 H new ATOM 0 HD13 ILE A 16 -11.724 -5.689 -12.184 1.00 34.54 H new ATOM 246 N GLU A 17 -13.957 -8.358 -15.609 1.00 73.24 N ATOM 247 CA GLU A 17 -13.444 -9.723 -15.784 1.00 4.32 C ATOM 248 C GLU A 17 -12.738 -10.187 -14.493 1.00 40.10 C ATOM 249 O GLU A 17 -11.920 -9.454 -13.925 1.00 54.50 O ATOM 250 CB GLU A 17 -12.488 -9.793 -17.000 1.00 55.20 C ATOM 251 CG GLU A 17 -13.123 -9.385 -18.346 1.00 21.40 C ATOM 252 CD GLU A 17 -12.151 -9.461 -19.535 1.00 11.23 C ATOM 253 OE1 GLU A 17 -11.751 -8.409 -20.070 1.00 22.45 O ATOM 254 OE2 GLU A 17 -11.770 -10.577 -19.943 1.00 35.53 O ATOM 0 H GLU A 17 -13.587 -7.688 -16.283 1.00 73.24 H new ATOM 0 HA GLU A 17 -14.280 -10.395 -15.980 1.00 4.32 H new ATOM 0 HB2 GLU A 17 -11.631 -9.148 -16.808 1.00 55.20 H new ATOM 0 HB3 GLU A 17 -12.108 -10.811 -17.087 1.00 55.20 H new ATOM 0 HG2 GLU A 17 -13.978 -10.031 -18.545 1.00 21.40 H new ATOM 0 HG3 GLU A 17 -13.505 -8.367 -18.264 1.00 21.40 H new ATOM 261 N LYS A 18 -13.084 -11.403 -14.053 1.00 42.13 N ATOM 262 CA LYS A 18 -12.641 -11.984 -12.772 1.00 73.42 C ATOM 263 C LYS A 18 -11.109 -12.111 -12.712 1.00 51.54 C ATOM 264 O LYS A 18 -10.494 -11.801 -11.691 1.00 14.24 O ATOM 265 CB LYS A 18 -13.321 -13.363 -12.594 1.00 73.45 C ATOM 266 CG LYS A 18 -12.921 -14.141 -11.317 1.00 23.42 C ATOM 267 CD LYS A 18 -13.652 -15.502 -11.205 1.00 41.11 C ATOM 268 CE LYS A 18 -13.438 -16.394 -12.444 1.00 51.10 C ATOM 269 NZ LYS A 18 -14.121 -17.709 -12.329 1.00 72.24 N ATOM 0 H LYS A 18 -13.692 -12.026 -14.585 1.00 42.13 H new ATOM 0 HA LYS A 18 -12.933 -11.323 -11.956 1.00 73.42 H new ATOM 0 HB2 LYS A 18 -14.401 -13.218 -12.587 1.00 73.45 H new ATOM 0 HB3 LYS A 18 -13.087 -13.979 -13.462 1.00 73.45 H new ATOM 0 HG2 LYS A 18 -11.844 -14.309 -11.319 1.00 23.42 H new ATOM 0 HG3 LYS A 18 -13.148 -13.536 -10.439 1.00 23.42 H new ATOM 0 HD2 LYS A 18 -13.299 -16.028 -10.318 1.00 41.11 H new ATOM 0 HD3 LYS A 18 -14.719 -15.327 -11.068 1.00 41.11 H new ATOM 0 HE2 LYS A 18 -13.806 -15.874 -13.329 1.00 51.10 H new ATOM 0 HE3 LYS A 18 -12.370 -16.555 -12.590 1.00 51.10 H new ATOM 0 HZ1 LYS A 18 -14.060 -18.213 -13.237 1.00 72.24 H new ATOM 0 HZ2 LYS A 18 -13.662 -18.275 -11.587 1.00 72.24 H new ATOM 0 HZ3 LYS A 18 -15.120 -17.561 -12.082 1.00 72.24 H new ATOM 283 N GLU A 19 -10.526 -12.539 -13.838 1.00 21.30 N ATOM 284 CA GLU A 19 -9.064 -12.680 -14.023 1.00 11.13 C ATOM 285 C GLU A 19 -8.327 -11.324 -13.881 1.00 75.32 C ATOM 286 O GLU A 19 -7.160 -11.283 -13.471 1.00 44.22 O ATOM 287 CB GLU A 19 -8.744 -13.328 -15.407 1.00 35.24 C ATOM 288 CG GLU A 19 -9.463 -12.696 -16.638 1.00 23.22 C ATOM 289 CD GLU A 19 -10.799 -13.386 -17.020 1.00 43.23 C ATOM 290 OE1 GLU A 19 -10.793 -14.271 -17.899 1.00 1.20 O ATOM 291 OE2 GLU A 19 -11.856 -13.060 -16.439 1.00 33.32 O ATOM 0 H GLU A 19 -11.061 -12.804 -14.665 1.00 21.30 H new ATOM 0 HA GLU A 19 -8.701 -13.336 -13.232 1.00 11.13 H new ATOM 0 HB2 GLU A 19 -7.668 -13.273 -15.572 1.00 35.24 H new ATOM 0 HB3 GLU A 19 -9.006 -14.385 -15.361 1.00 35.24 H new ATOM 0 HG2 GLU A 19 -9.657 -11.644 -16.430 1.00 23.22 H new ATOM 0 HG3 GLU A 19 -8.791 -12.732 -17.495 1.00 23.22 H new ATOM 298 N ILE A 20 -9.016 -10.220 -14.236 1.00 53.01 N ATOM 299 CA ILE A 20 -8.496 -8.852 -14.045 1.00 24.33 C ATOM 300 C ILE A 20 -8.611 -8.460 -12.551 1.00 42.13 C ATOM 301 O ILE A 20 -7.694 -7.868 -11.973 1.00 74.01 O ATOM 302 CB ILE A 20 -9.274 -7.801 -14.934 1.00 61.31 C ATOM 303 CG1 ILE A 20 -9.208 -8.170 -16.452 1.00 64.44 C ATOM 304 CG2 ILE A 20 -8.736 -6.380 -14.695 1.00 33.23 C ATOM 305 CD1 ILE A 20 -9.854 -7.161 -17.401 1.00 12.02 C ATOM 0 H ILE A 20 -9.943 -10.252 -14.661 1.00 53.01 H new ATOM 0 HA ILE A 20 -7.451 -8.842 -14.355 1.00 24.33 H new ATOM 0 HB ILE A 20 -10.322 -7.828 -14.634 1.00 61.31 H new ATOM 0 HG12 ILE A 20 -8.162 -8.290 -16.734 1.00 64.44 H new ATOM 0 HG13 ILE A 20 -9.690 -9.137 -16.595 1.00 64.44 H new ATOM 0 HG21 ILE A 20 -9.286 -5.673 -15.317 1.00 33.23 H new ATOM 0 HG22 ILE A 20 -8.863 -6.115 -13.645 1.00 33.23 H new ATOM 0 HG23 ILE A 20 -7.678 -6.343 -14.953 1.00 33.23 H new ATOM 0 HD11 ILE A 20 -9.753 -7.512 -18.428 1.00 12.02 H new ATOM 0 HD12 ILE A 20 -10.911 -7.055 -17.155 1.00 12.02 H new ATOM 0 HD13 ILE A 20 -9.359 -6.195 -17.297 1.00 12.02 H new ATOM 317 N ALA A 21 -9.751 -8.828 -11.942 1.00 73.33 N ATOM 318 CA ALA A 21 -10.059 -8.542 -10.526 1.00 11.32 C ATOM 319 C ALA A 21 -9.208 -9.397 -9.559 1.00 12.05 C ATOM 320 O ALA A 21 -9.116 -9.079 -8.374 1.00 54.32 O ATOM 321 CB ALA A 21 -11.562 -8.753 -10.274 1.00 5.05 C ATOM 0 H ALA A 21 -10.493 -9.337 -12.422 1.00 73.33 H new ATOM 0 HA ALA A 21 -9.802 -7.502 -10.327 1.00 11.32 H new ATOM 0 HB1 ALA A 21 -11.789 -8.542 -9.229 1.00 5.05 H new ATOM 0 HB2 ALA A 21 -12.136 -8.082 -10.913 1.00 5.05 H new ATOM 0 HB3 ALA A 21 -11.828 -9.785 -10.502 1.00 5.05 H new ATOM 327 N CYS A 22 -8.600 -10.484 -10.073 1.00 62.20 N ATOM 328 CA CYS A 22 -7.686 -11.342 -9.298 1.00 61.13 C ATOM 329 C CYS A 22 -6.328 -10.656 -9.043 1.00 65.45 C ATOM 330 O CYS A 22 -5.619 -11.035 -8.104 1.00 3.41 O ATOM 331 CB CYS A 22 -7.497 -12.694 -10.010 1.00 71.32 C ATOM 332 SG CYS A 22 -9.011 -13.683 -10.085 1.00 72.44 S ATOM 0 H CYS A 22 -8.729 -10.791 -11.037 1.00 62.20 H new ATOM 0 HA CYS A 22 -8.140 -11.518 -8.323 1.00 61.13 H new ATOM 0 HB2 CYS A 22 -7.137 -12.516 -11.023 1.00 71.32 H new ATOM 0 HB3 CYS A 22 -6.725 -13.264 -9.493 1.00 71.32 H new ATOM 0 HG CYS A 22 -9.942 -13.007 -10.690 1.00 72.44 H new ATOM 338 N MET A 23 -5.961 -9.658 -9.891 1.00 43.12 N ATOM 339 CA MET A 23 -4.730 -8.840 -9.691 1.00 14.11 C ATOM 340 C MET A 23 -4.840 -8.016 -8.394 1.00 41.43 C ATOM 341 O MET A 23 -3.834 -7.692 -7.744 1.00 0.44 O ATOM 342 CB MET A 23 -4.458 -7.908 -10.901 1.00 72.30 C ATOM 343 CG MET A 23 -4.484 -8.594 -12.278 1.00 43.12 C ATOM 344 SD MET A 23 -3.812 -7.556 -13.601 1.00 73.41 S ATOM 345 CE MET A 23 -4.610 -5.978 -13.302 1.00 62.12 C ATOM 0 H MET A 23 -6.498 -9.400 -10.719 1.00 43.12 H new ATOM 0 HA MET A 23 -3.887 -9.526 -9.607 1.00 14.11 H new ATOM 0 HB2 MET A 23 -5.200 -7.109 -10.897 1.00 72.30 H new ATOM 0 HB3 MET A 23 -3.484 -7.439 -10.765 1.00 72.30 H new ATOM 0 HG2 MET A 23 -3.913 -9.521 -12.226 1.00 43.12 H new ATOM 0 HG3 MET A 23 -5.511 -8.865 -12.523 1.00 43.12 H new ATOM 0 HE1 MET A 23 -4.437 -5.316 -14.151 1.00 62.12 H new ATOM 0 HE2 MET A 23 -5.682 -6.131 -13.174 1.00 62.12 H new ATOM 0 HE3 MET A 23 -4.197 -5.527 -12.400 1.00 62.12 H new ATOM 355 N SER A 24 -6.088 -7.678 -8.047 1.00 14.00 N ATOM 356 CA SER A 24 -6.451 -7.198 -6.719 1.00 53.31 C ATOM 357 C SER A 24 -6.360 -8.382 -5.743 1.00 22.30 C ATOM 358 O SER A 24 -7.140 -9.334 -5.862 1.00 61.31 O ATOM 359 CB SER A 24 -7.881 -6.619 -6.747 1.00 30.31 C ATOM 360 OG SER A 24 -8.304 -6.204 -5.466 1.00 63.21 O ATOM 0 H SER A 24 -6.878 -7.733 -8.690 1.00 14.00 H new ATOM 0 HA SER A 24 -5.775 -6.406 -6.397 1.00 53.31 H new ATOM 0 HB2 SER A 24 -7.917 -5.773 -7.433 1.00 30.31 H new ATOM 0 HB3 SER A 24 -8.570 -7.371 -7.131 1.00 30.31 H new ATOM 0 HG SER A 24 -7.530 -5.895 -4.950 1.00 63.21 H new ATOM 366 N VAL A 25 -5.381 -8.335 -4.814 1.00 21.43 N ATOM 367 CA VAL A 25 -5.135 -9.438 -3.865 1.00 52.04 C ATOM 368 C VAL A 25 -6.327 -9.588 -2.895 1.00 2.30 C ATOM 369 O VAL A 25 -6.679 -10.707 -2.547 1.00 15.12 O ATOM 370 CB VAL A 25 -3.789 -9.257 -3.057 1.00 23.35 C ATOM 371 CG1 VAL A 25 -3.499 -10.465 -2.129 1.00 62.22 C ATOM 372 CG2 VAL A 25 -2.594 -8.976 -4.005 1.00 14.54 C ATOM 0 H VAL A 25 -4.748 -7.543 -4.702 1.00 21.43 H new ATOM 0 HA VAL A 25 -5.032 -10.348 -4.456 1.00 52.04 H new ATOM 0 HB VAL A 25 -3.918 -8.385 -2.416 1.00 23.35 H new ATOM 0 HG11 VAL A 25 -2.564 -10.297 -1.594 1.00 62.22 H new ATOM 0 HG12 VAL A 25 -4.313 -10.577 -1.412 1.00 62.22 H new ATOM 0 HG13 VAL A 25 -3.416 -11.372 -2.728 1.00 62.22 H new ATOM 0 HG21 VAL A 25 -1.684 -8.857 -3.417 1.00 14.54 H new ATOM 0 HG22 VAL A 25 -2.473 -9.811 -4.696 1.00 14.54 H new ATOM 0 HG23 VAL A 25 -2.784 -8.063 -4.569 1.00 14.54 H new ATOM 382 N THR A 26 -6.960 -8.455 -2.508 1.00 52.12 N ATOM 383 CA THR A 26 -8.139 -8.454 -1.609 1.00 14.11 C ATOM 384 C THR A 26 -9.334 -9.199 -2.242 1.00 11.30 C ATOM 385 O THR A 26 -9.929 -10.073 -1.606 1.00 2.33 O ATOM 386 CB THR A 26 -8.574 -6.999 -1.229 1.00 0.41 C ATOM 387 OG1 THR A 26 -7.456 -6.292 -0.693 1.00 42.33 O ATOM 388 CG2 THR A 26 -9.721 -6.971 -0.198 1.00 41.41 C ATOM 0 H THR A 26 -6.671 -7.524 -2.807 1.00 52.12 H new ATOM 0 HA THR A 26 -7.838 -8.977 -0.702 1.00 14.11 H new ATOM 0 HB THR A 26 -8.936 -6.525 -2.142 1.00 0.41 H new ATOM 0 HG1 THR A 26 -6.760 -6.930 -0.432 1.00 42.33 H new ATOM 0 HG21 THR A 26 -9.982 -5.937 0.028 1.00 41.41 H new ATOM 0 HG22 THR A 26 -10.591 -7.483 -0.608 1.00 41.41 H new ATOM 0 HG23 THR A 26 -9.402 -7.473 0.715 1.00 41.41 H new ATOM 396 N ILE A 27 -9.652 -8.855 -3.510 1.00 4.55 N ATOM 397 CA ILE A 27 -10.752 -9.490 -4.263 1.00 61.52 C ATOM 398 C ILE A 27 -10.428 -10.982 -4.507 1.00 62.41 C ATOM 399 O ILE A 27 -11.312 -11.837 -4.409 1.00 13.33 O ATOM 400 CB ILE A 27 -11.027 -8.740 -5.622 1.00 54.54 C ATOM 401 CG1 ILE A 27 -11.440 -7.250 -5.351 1.00 53.32 C ATOM 402 CG2 ILE A 27 -12.096 -9.472 -6.480 1.00 33.21 C ATOM 403 CD1 ILE A 27 -11.575 -6.387 -6.597 1.00 0.42 C ATOM 0 H ILE A 27 -9.156 -8.135 -4.035 1.00 4.55 H new ATOM 0 HA ILE A 27 -11.663 -9.421 -3.668 1.00 61.52 H new ATOM 0 HB ILE A 27 -10.101 -8.743 -6.197 1.00 54.54 H new ATOM 0 HG12 ILE A 27 -12.390 -7.243 -4.817 1.00 53.32 H new ATOM 0 HG13 ILE A 27 -10.700 -6.797 -4.691 1.00 53.32 H new ATOM 0 HG21 ILE A 27 -12.256 -8.923 -7.408 1.00 33.21 H new ATOM 0 HG22 ILE A 27 -11.750 -10.480 -6.710 1.00 33.21 H new ATOM 0 HG23 ILE A 27 -13.032 -9.527 -5.925 1.00 33.21 H new ATOM 0 HD11 ILE A 27 -11.863 -5.376 -6.310 1.00 0.42 H new ATOM 0 HD12 ILE A 27 -10.621 -6.357 -7.124 1.00 0.42 H new ATOM 0 HD13 ILE A 27 -12.338 -6.809 -7.251 1.00 0.42 H new ATOM 415 N LYS A 28 -9.133 -11.275 -4.766 1.00 63.31 N ATOM 416 CA LYS A 28 -8.625 -12.653 -4.908 1.00 73.40 C ATOM 417 C LYS A 28 -8.848 -13.442 -3.597 1.00 44.43 C ATOM 418 O LYS A 28 -9.275 -14.592 -3.632 1.00 71.12 O ATOM 419 CB LYS A 28 -7.113 -12.648 -5.271 1.00 71.04 C ATOM 420 CG LYS A 28 -6.507 -14.055 -5.499 1.00 52.01 C ATOM 421 CD LYS A 28 -4.956 -14.067 -5.529 1.00 75.23 C ATOM 422 CE LYS A 28 -4.326 -13.625 -4.191 1.00 15.01 C ATOM 423 NZ LYS A 28 -2.847 -13.822 -4.175 1.00 12.32 N ATOM 0 H LYS A 28 -8.414 -10.561 -4.882 1.00 63.31 H new ATOM 0 HA LYS A 28 -9.174 -13.138 -5.715 1.00 73.40 H new ATOM 0 HB2 LYS A 28 -6.970 -12.053 -6.173 1.00 71.04 H new ATOM 0 HB3 LYS A 28 -6.561 -12.153 -4.472 1.00 71.04 H new ATOM 0 HG2 LYS A 28 -6.852 -14.722 -4.709 1.00 52.01 H new ATOM 0 HG3 LYS A 28 -6.883 -14.455 -6.441 1.00 52.01 H new ATOM 0 HD2 LYS A 28 -4.610 -15.071 -5.773 1.00 75.23 H new ATOM 0 HD3 LYS A 28 -4.608 -13.408 -6.324 1.00 75.23 H new ATOM 0 HE2 LYS A 28 -4.553 -12.574 -4.014 1.00 15.01 H new ATOM 0 HE3 LYS A 28 -4.776 -14.191 -3.375 1.00 15.01 H new ATOM 0 HZ1 LYS A 28 -2.465 -13.512 -3.258 1.00 12.32 H new ATOM 0 HZ2 LYS A 28 -2.629 -14.829 -4.318 1.00 12.32 H new ATOM 0 HZ3 LYS A 28 -2.414 -13.262 -4.937 1.00 12.32 H new ATOM 437 N ASN A 29 -8.595 -12.777 -2.446 1.00 23.32 N ATOM 438 CA ASN A 29 -8.756 -13.386 -1.105 1.00 30.45 C ATOM 439 C ASN A 29 -10.239 -13.635 -0.788 1.00 64.31 C ATOM 440 O ASN A 29 -10.564 -14.569 -0.060 1.00 10.41 O ATOM 441 CB ASN A 29 -8.117 -12.501 0.010 1.00 63.51 C ATOM 442 CG ASN A 29 -6.583 -12.371 -0.056 1.00 15.30 C ATOM 443 OD1 ASN A 29 -6.019 -11.365 0.383 1.00 32.33 O ATOM 444 ND2 ASN A 29 -5.891 -13.362 -0.608 1.00 12.51 N ATOM 0 H ASN A 29 -8.275 -11.809 -2.420 1.00 23.32 H new ATOM 0 HA ASN A 29 -8.233 -14.342 -1.123 1.00 30.45 H new ATOM 0 HB2 ASN A 29 -8.553 -11.504 -0.045 1.00 63.51 H new ATOM 0 HB3 ASN A 29 -8.389 -12.915 0.981 1.00 63.51 H new ATOM 0 HD21 ASN A 29 -4.875 -13.299 -0.675 1.00 12.51 H new ATOM 0 HD22 ASN A 29 -6.376 -14.185 -0.965 1.00 12.51 H new ATOM 451 N MET A 30 -11.126 -12.772 -1.334 1.00 61.05 N ATOM 452 CA MET A 30 -12.593 -12.948 -1.239 1.00 65.05 C ATOM 453 C MET A 30 -13.026 -14.194 -2.040 1.00 41.22 C ATOM 454 O MET A 30 -13.864 -14.974 -1.593 1.00 4.34 O ATOM 455 CB MET A 30 -13.345 -11.685 -1.761 1.00 22.21 C ATOM 456 CG MET A 30 -13.119 -10.405 -0.941 1.00 52.13 C ATOM 457 SD MET A 30 -14.004 -8.976 -1.605 1.00 30.01 S ATOM 458 CE MET A 30 -13.491 -7.671 -0.483 1.00 41.25 C ATOM 0 H MET A 30 -10.847 -11.938 -1.850 1.00 61.05 H new ATOM 0 HA MET A 30 -12.854 -13.087 -0.190 1.00 65.05 H new ATOM 0 HB2 MET A 30 -13.037 -11.498 -2.790 1.00 22.21 H new ATOM 0 HB3 MET A 30 -14.413 -11.900 -1.782 1.00 22.21 H new ATOM 0 HG2 MET A 30 -13.438 -10.578 0.087 1.00 52.13 H new ATOM 0 HG3 MET A 30 -12.052 -10.183 -0.911 1.00 52.13 H new ATOM 0 HE1 MET A 30 -14.370 -7.147 -0.108 1.00 41.25 H new ATOM 0 HE2 MET A 30 -12.943 -8.105 0.354 1.00 41.25 H new ATOM 0 HE3 MET A 30 -12.848 -6.968 -1.012 1.00 41.25 H new ATOM 468 N ILE A 31 -12.409 -14.367 -3.222 1.00 15.01 N ATOM 469 CA ILE A 31 -12.634 -15.529 -4.105 1.00 72.52 C ATOM 470 C ILE A 31 -12.139 -16.832 -3.424 1.00 25.13 C ATOM 471 O ILE A 31 -12.782 -17.878 -3.517 1.00 42.53 O ATOM 472 CB ILE A 31 -11.923 -15.304 -5.502 1.00 54.13 C ATOM 473 CG1 ILE A 31 -12.590 -14.109 -6.265 1.00 63.44 C ATOM 474 CG2 ILE A 31 -11.914 -16.584 -6.371 1.00 51.03 C ATOM 475 CD1 ILE A 31 -11.914 -13.720 -7.574 1.00 63.23 C ATOM 0 H ILE A 31 -11.734 -13.700 -3.596 1.00 15.01 H new ATOM 0 HA ILE A 31 -13.704 -15.633 -4.285 1.00 72.52 H new ATOM 0 HB ILE A 31 -10.881 -15.056 -5.302 1.00 54.13 H new ATOM 0 HG12 ILE A 31 -13.629 -14.365 -6.473 1.00 63.44 H new ATOM 0 HG13 ILE A 31 -12.602 -13.240 -5.608 1.00 63.44 H new ATOM 0 HG21 ILE A 31 -11.416 -16.377 -7.318 1.00 51.03 H new ATOM 0 HG22 ILE A 31 -11.381 -17.377 -5.846 1.00 51.03 H new ATOM 0 HG23 ILE A 31 -12.939 -16.901 -6.562 1.00 51.03 H new ATOM 0 HD11 ILE A 31 -12.449 -12.885 -8.026 1.00 63.23 H new ATOM 0 HD12 ILE A 31 -10.883 -13.427 -7.378 1.00 63.23 H new ATOM 0 HD13 ILE A 31 -11.926 -14.570 -8.256 1.00 63.23 H new ATOM 487 N GLU A 32 -11.011 -16.742 -2.704 1.00 73.01 N ATOM 488 CA GLU A 32 -10.401 -17.901 -2.016 1.00 42.24 C ATOM 489 C GLU A 32 -11.182 -18.281 -0.736 1.00 54.21 C ATOM 490 O GLU A 32 -11.348 -19.471 -0.439 1.00 51.54 O ATOM 491 CB GLU A 32 -8.912 -17.604 -1.688 1.00 4.13 C ATOM 492 CG GLU A 32 -8.012 -17.401 -2.924 1.00 52.15 C ATOM 493 CD GLU A 32 -6.563 -17.035 -2.571 1.00 13.15 C ATOM 494 OE1 GLU A 32 -5.693 -17.938 -2.534 1.00 3.34 O ATOM 495 OE2 GLU A 32 -6.286 -15.845 -2.317 1.00 2.13 O ATOM 0 H GLU A 32 -10.495 -15.871 -2.580 1.00 73.01 H new ATOM 0 HA GLU A 32 -10.450 -18.757 -2.689 1.00 42.24 H new ATOM 0 HB2 GLU A 32 -8.862 -16.710 -1.067 1.00 4.13 H new ATOM 0 HB3 GLU A 32 -8.513 -18.427 -1.095 1.00 4.13 H new ATOM 0 HG2 GLU A 32 -8.013 -18.314 -3.519 1.00 52.15 H new ATOM 0 HG3 GLU A 32 -8.436 -16.614 -3.547 1.00 52.15 H new ATOM 502 N ASP A 33 -11.665 -17.262 0.004 1.00 74.33 N ATOM 503 CA ASP A 33 -12.331 -17.449 1.318 1.00 12.23 C ATOM 504 C ASP A 33 -13.786 -17.937 1.152 1.00 42.35 C ATOM 505 O ASP A 33 -14.212 -18.894 1.810 1.00 3.21 O ATOM 506 CB ASP A 33 -12.311 -16.112 2.113 1.00 0.04 C ATOM 507 CG ASP A 33 -13.019 -16.196 3.481 1.00 44.33 C ATOM 508 OD1 ASP A 33 -12.425 -16.751 4.432 1.00 33.44 O ATOM 509 OD2 ASP A 33 -14.168 -15.711 3.614 1.00 22.11 O ATOM 0 H ASP A 33 -11.607 -16.286 -0.288 1.00 74.33 H new ATOM 0 HA ASP A 33 -11.781 -18.213 1.868 1.00 12.23 H new ATOM 0 HB2 ASP A 33 -11.276 -15.806 2.267 1.00 0.04 H new ATOM 0 HB3 ASP A 33 -12.787 -15.336 1.514 1.00 0.04 H new ATOM 514 N ILE A 34 -14.522 -17.281 0.239 1.00 24.42 N ATOM 515 CA ILE A 34 -15.958 -17.557 -0.007 1.00 54.20 C ATOM 516 C ILE A 34 -16.126 -18.778 -0.942 1.00 15.24 C ATOM 517 O ILE A 34 -17.184 -19.421 -0.964 1.00 15.41 O ATOM 518 CB ILE A 34 -16.675 -16.266 -0.603 1.00 51.25 C ATOM 519 CG1 ILE A 34 -16.449 -15.032 0.338 1.00 51.44 C ATOM 520 CG2 ILE A 34 -18.193 -16.498 -0.838 1.00 33.24 C ATOM 521 CD1 ILE A 34 -17.001 -13.710 -0.189 1.00 71.32 C ATOM 0 H ILE A 34 -14.142 -16.542 -0.353 1.00 24.42 H new ATOM 0 HA ILE A 34 -16.436 -17.799 0.942 1.00 54.20 H new ATOM 0 HB ILE A 34 -16.223 -16.062 -1.574 1.00 51.25 H new ATOM 0 HG12 ILE A 34 -16.909 -15.241 1.304 1.00 51.44 H new ATOM 0 HG13 ILE A 34 -15.379 -14.918 0.512 1.00 51.44 H new ATOM 0 HG21 ILE A 34 -18.641 -15.591 -1.245 1.00 33.24 H new ATOM 0 HG22 ILE A 34 -18.331 -17.319 -1.542 1.00 33.24 H new ATOM 0 HG23 ILE A 34 -18.674 -16.747 0.108 1.00 33.24 H new ATOM 0 HD11 ILE A 34 -16.796 -12.917 0.531 1.00 71.32 H new ATOM 0 HD12 ILE A 34 -16.524 -13.469 -1.139 1.00 71.32 H new ATOM 0 HD13 ILE A 34 -18.078 -13.798 -0.335 1.00 71.32 H new ATOM 533 N GLY A 35 -15.051 -19.121 -1.679 1.00 45.32 N ATOM 534 CA GLY A 35 -15.088 -20.209 -2.663 1.00 0.32 C ATOM 535 C GLY A 35 -15.555 -19.732 -4.033 1.00 73.00 C ATOM 536 O GLY A 35 -16.123 -20.517 -4.801 1.00 72.45 O ATOM 0 H GLY A 35 -14.146 -18.656 -1.607 1.00 45.32 H new ATOM 0 HA2 GLY A 35 -14.095 -20.649 -2.753 1.00 0.32 H new ATOM 0 HA3 GLY A 35 -15.754 -20.995 -2.308 1.00 0.32 H new ATOM 540 N GLU A 36 -15.314 -18.428 -4.298 1.00 32.31 N ATOM 541 CA GLU A 36 -15.650 -17.714 -5.544 1.00 42.32 C ATOM 542 C GLU A 36 -17.148 -17.388 -5.626 1.00 40.20 C ATOM 543 O GLU A 36 -17.995 -18.271 -5.474 1.00 54.30 O ATOM 544 CB GLU A 36 -15.178 -18.460 -6.822 1.00 53.43 C ATOM 545 CG GLU A 36 -15.397 -17.670 -8.127 1.00 43.04 C ATOM 546 CD GLU A 36 -14.932 -18.442 -9.365 1.00 34.24 C ATOM 547 OE1 GLU A 36 -15.773 -18.891 -10.169 1.00 13.12 O ATOM 548 OE2 GLU A 36 -13.707 -18.611 -9.536 1.00 34.43 O ATOM 0 H GLU A 36 -14.859 -17.820 -3.616 1.00 32.31 H new ATOM 0 HA GLU A 36 -15.096 -16.776 -5.505 1.00 42.32 H new ATOM 0 HB2 GLU A 36 -14.118 -18.692 -6.724 1.00 53.43 H new ATOM 0 HB3 GLU A 36 -15.707 -19.410 -6.892 1.00 53.43 H new ATOM 0 HG2 GLU A 36 -16.455 -17.430 -8.229 1.00 43.04 H new ATOM 0 HG3 GLU A 36 -14.859 -16.724 -8.070 1.00 43.04 H new ATOM 555 N SER A 37 -17.456 -16.105 -5.873 1.00 41.40 N ATOM 556 CA SER A 37 -18.825 -15.615 -6.050 1.00 12.13 C ATOM 557 C SER A 37 -19.001 -15.077 -7.478 1.00 0.31 C ATOM 558 O SER A 37 -18.338 -14.110 -7.875 1.00 42.10 O ATOM 559 CB SER A 37 -19.127 -14.510 -5.013 1.00 33.40 C ATOM 560 OG SER A 37 -18.934 -14.981 -3.687 1.00 64.05 O ATOM 0 H SER A 37 -16.750 -15.373 -5.956 1.00 41.40 H new ATOM 0 HA SER A 37 -19.526 -16.435 -5.895 1.00 12.13 H new ATOM 0 HB2 SER A 37 -18.480 -13.652 -5.194 1.00 33.40 H new ATOM 0 HB3 SER A 37 -20.154 -14.166 -5.133 1.00 33.40 H new ATOM 0 HG SER A 37 -19.418 -14.403 -3.061 1.00 64.05 H new ATOM 566 N ASP A 38 -19.854 -15.764 -8.252 1.00 41.21 N ATOM 567 CA ASP A 38 -20.370 -15.269 -9.543 1.00 31.34 C ATOM 568 C ASP A 38 -21.413 -14.172 -9.260 1.00 24.25 C ATOM 569 O ASP A 38 -21.593 -13.236 -10.050 1.00 52.54 O ATOM 570 CB ASP A 38 -20.993 -16.452 -10.342 1.00 4.41 C ATOM 571 CG ASP A 38 -21.532 -16.050 -11.733 1.00 34.02 C ATOM 572 OD1 ASP A 38 -22.764 -15.871 -11.895 1.00 3.43 O ATOM 573 OD2 ASP A 38 -20.722 -15.916 -12.679 1.00 60.04 O ATOM 0 H ASP A 38 -20.210 -16.686 -8.000 1.00 41.21 H new ATOM 0 HA ASP A 38 -19.566 -14.846 -10.146 1.00 31.34 H new ATOM 0 HB2 ASP A 38 -20.241 -17.231 -10.466 1.00 4.41 H new ATOM 0 HB3 ASP A 38 -21.806 -16.884 -9.759 1.00 4.41 H new ATOM 578 N SER A 39 -22.079 -14.325 -8.096 1.00 43.14 N ATOM 579 CA SER A 39 -23.011 -13.350 -7.519 1.00 70.24 C ATOM 580 C SER A 39 -22.323 -11.977 -7.257 1.00 42.24 C ATOM 581 O SER A 39 -21.103 -11.934 -7.034 1.00 40.11 O ATOM 582 CB SER A 39 -23.568 -13.933 -6.194 1.00 51.41 C ATOM 583 OG SER A 39 -24.154 -15.205 -6.414 1.00 13.12 O ATOM 0 H SER A 39 -21.975 -15.159 -7.518 1.00 43.14 H new ATOM 0 HA SER A 39 -23.820 -13.171 -8.228 1.00 70.24 H new ATOM 0 HB2 SER A 39 -22.765 -14.019 -5.462 1.00 51.41 H new ATOM 0 HB3 SER A 39 -24.310 -13.253 -5.775 1.00 51.41 H new ATOM 0 HG SER A 39 -24.498 -15.558 -5.567 1.00 13.12 H new ATOM 589 N PRO A 40 -23.097 -10.843 -7.272 1.00 24.31 N ATOM 590 CA PRO A 40 -22.533 -9.484 -7.070 1.00 54.30 C ATOM 591 C PRO A 40 -21.991 -9.274 -5.631 1.00 75.31 C ATOM 592 O PRO A 40 -22.566 -9.782 -4.658 1.00 42.50 O ATOM 593 CB PRO A 40 -23.736 -8.557 -7.387 1.00 72.31 C ATOM 594 CG PRO A 40 -24.944 -9.374 -7.094 1.00 52.22 C ATOM 595 CD PRO A 40 -24.575 -10.787 -7.498 1.00 71.22 C ATOM 0 HA PRO A 40 -21.666 -9.288 -7.701 1.00 54.30 H new ATOM 0 HB2 PRO A 40 -23.711 -7.656 -6.774 1.00 72.31 H new ATOM 0 HB3 PRO A 40 -23.721 -8.235 -8.428 1.00 72.31 H new ATOM 0 HG2 PRO A 40 -25.208 -9.323 -6.038 1.00 52.22 H new ATOM 0 HG3 PRO A 40 -25.807 -9.016 -7.656 1.00 52.22 H new ATOM 0 HD2 PRO A 40 -25.101 -11.527 -6.895 1.00 71.22 H new ATOM 0 HD3 PRO A 40 -24.829 -10.986 -8.539 1.00 71.22 H new ATOM 603 N ILE A 41 -20.869 -8.538 -5.521 1.00 45.41 N ATOM 604 CA ILE A 41 -20.180 -8.265 -4.249 1.00 74.25 C ATOM 605 C ILE A 41 -20.062 -6.735 -4.062 1.00 72.52 C ATOM 606 O ILE A 41 -19.433 -6.069 -4.892 1.00 15.02 O ATOM 607 CB ILE A 41 -18.737 -8.925 -4.210 1.00 50.30 C ATOM 608 CG1 ILE A 41 -18.819 -10.481 -4.364 1.00 43.11 C ATOM 609 CG2 ILE A 41 -17.964 -8.545 -2.916 1.00 15.12 C ATOM 610 CD1 ILE A 41 -19.583 -11.202 -3.255 1.00 14.23 C ATOM 0 H ILE A 41 -20.410 -8.111 -6.326 1.00 45.41 H new ATOM 0 HA ILE A 41 -20.763 -8.703 -3.439 1.00 74.25 H new ATOM 0 HB ILE A 41 -18.182 -8.526 -5.059 1.00 50.30 H new ATOM 0 HG12 ILE A 41 -19.291 -10.712 -5.319 1.00 43.11 H new ATOM 0 HG13 ILE A 41 -17.806 -10.881 -4.405 1.00 43.11 H new ATOM 0 HG21 ILE A 41 -16.981 -9.016 -2.928 1.00 15.12 H new ATOM 0 HG22 ILE A 41 -17.847 -7.462 -2.867 1.00 15.12 H new ATOM 0 HG23 ILE A 41 -18.521 -8.889 -2.045 1.00 15.12 H new ATOM 0 HD11 ILE A 41 -19.584 -12.274 -3.452 1.00 14.23 H new ATOM 0 HD12 ILE A 41 -19.101 -11.009 -2.297 1.00 14.23 H new ATOM 0 HD13 ILE A 41 -20.610 -10.838 -3.225 1.00 14.23 H new ATOM 622 N PRO A 42 -20.687 -6.144 -2.994 1.00 35.15 N ATOM 623 CA PRO A 42 -20.520 -4.715 -2.679 1.00 61.32 C ATOM 624 C PRO A 42 -19.202 -4.452 -1.912 1.00 25.23 C ATOM 625 O PRO A 42 -18.773 -5.265 -1.075 1.00 33.14 O ATOM 626 CB PRO A 42 -21.774 -4.401 -1.830 1.00 30.32 C ATOM 627 CG PRO A 42 -22.091 -5.687 -1.120 1.00 3.13 C ATOM 628 CD PRO A 42 -21.609 -6.812 -2.032 1.00 34.21 C ATOM 0 HA PRO A 42 -20.443 -4.080 -3.562 1.00 61.32 H new ATOM 0 HB2 PRO A 42 -21.580 -3.596 -1.121 1.00 30.32 H new ATOM 0 HB3 PRO A 42 -22.606 -4.080 -2.457 1.00 30.32 H new ATOM 0 HG2 PRO A 42 -21.591 -5.730 -0.152 1.00 3.13 H new ATOM 0 HG3 PRO A 42 -23.161 -5.772 -0.930 1.00 3.13 H new ATOM 0 HD2 PRO A 42 -21.096 -7.590 -1.466 1.00 34.21 H new ATOM 0 HD3 PRO A 42 -22.442 -7.290 -2.547 1.00 34.21 H new ATOM 636 N LEU A 43 -18.552 -3.328 -2.239 1.00 53.45 N ATOM 637 CA LEU A 43 -17.307 -2.877 -1.595 1.00 3.25 C ATOM 638 C LEU A 43 -17.641 -1.617 -0.752 1.00 3.03 C ATOM 639 O LEU A 43 -17.648 -0.495 -1.284 1.00 1.52 O ATOM 640 CB LEU A 43 -16.184 -2.577 -2.655 1.00 73.12 C ATOM 641 CG LEU A 43 -15.546 -3.806 -3.423 1.00 23.33 C ATOM 642 CD1 LEU A 43 -16.550 -4.535 -4.342 1.00 72.32 C ATOM 643 CD2 LEU A 43 -14.307 -3.362 -4.231 1.00 14.42 C ATOM 0 H LEU A 43 -18.879 -2.695 -2.969 1.00 53.45 H new ATOM 0 HA LEU A 43 -16.914 -3.665 -0.952 1.00 3.25 H new ATOM 0 HB2 LEU A 43 -16.599 -1.896 -3.398 1.00 73.12 H new ATOM 0 HB3 LEU A 43 -15.379 -2.044 -2.149 1.00 73.12 H new ATOM 0 HG LEU A 43 -15.243 -4.521 -2.658 1.00 23.33 H new ATOM 0 HD11 LEU A 43 -16.051 -5.367 -4.839 1.00 72.32 H new ATOM 0 HD12 LEU A 43 -17.380 -4.914 -3.746 1.00 72.32 H new ATOM 0 HD13 LEU A 43 -16.929 -3.840 -5.091 1.00 72.32 H new ATOM 0 HD21 LEU A 43 -13.884 -4.222 -4.751 1.00 14.42 H new ATOM 0 HD22 LEU A 43 -14.599 -2.606 -4.959 1.00 14.42 H new ATOM 0 HD23 LEU A 43 -13.561 -2.945 -3.554 1.00 14.42 H new ATOM 655 N PRO A 44 -17.976 -1.789 0.576 1.00 23.02 N ATOM 656 CA PRO A 44 -18.428 -0.675 1.445 1.00 42.44 C ATOM 657 C PRO A 44 -17.240 0.148 2.001 1.00 15.42 C ATOM 658 O PRO A 44 -16.925 0.095 3.200 1.00 41.41 O ATOM 659 CB PRO A 44 -19.218 -1.430 2.551 1.00 51.41 C ATOM 660 CG PRO A 44 -18.495 -2.738 2.710 1.00 64.52 C ATOM 661 CD PRO A 44 -17.930 -3.079 1.335 1.00 3.33 C ATOM 0 HA PRO A 44 -19.028 0.075 0.929 1.00 42.44 H new ATOM 0 HB2 PRO A 44 -19.229 -0.867 3.484 1.00 51.41 H new ATOM 0 HB3 PRO A 44 -20.257 -1.585 2.260 1.00 51.41 H new ATOM 0 HG2 PRO A 44 -17.698 -2.655 3.449 1.00 64.52 H new ATOM 0 HG3 PRO A 44 -19.172 -3.518 3.057 1.00 64.52 H new ATOM 0 HD2 PRO A 44 -16.911 -3.459 1.408 1.00 3.33 H new ATOM 0 HD3 PRO A 44 -18.523 -3.850 0.843 1.00 3.33 H new ATOM 669 N ASN A 45 -16.589 0.909 1.101 1.00 72.02 N ATOM 670 CA ASN A 45 -15.391 1.712 1.422 1.00 42.15 C ATOM 671 C ASN A 45 -15.070 2.656 0.256 1.00 15.12 C ATOM 672 O ASN A 45 -14.992 3.881 0.422 1.00 13.00 O ATOM 673 CB ASN A 45 -14.162 0.792 1.711 1.00 44.01 C ATOM 674 CG ASN A 45 -12.856 1.561 1.974 1.00 22.20 C ATOM 675 OD1 ASN A 45 -12.058 1.805 1.063 1.00 4.20 O ATOM 676 ND2 ASN A 45 -12.630 1.954 3.214 1.00 35.14 N ATOM 0 H ASN A 45 -16.880 0.985 0.126 1.00 72.02 H new ATOM 0 HA ASN A 45 -15.600 2.297 2.318 1.00 42.15 H new ATOM 0 HB2 ASN A 45 -14.384 0.166 2.576 1.00 44.01 H new ATOM 0 HB3 ASN A 45 -14.014 0.123 0.863 1.00 44.01 H new ATOM 0 HD21 ASN A 45 -11.780 2.472 3.438 1.00 35.14 H new ATOM 0 HD22 ASN A 45 -13.305 1.740 3.948 1.00 35.14 H new ATOM 683 N VAL A 46 -14.874 2.057 -0.926 1.00 71.42 N ATOM 684 CA VAL A 46 -14.445 2.772 -2.136 1.00 61.24 C ATOM 685 C VAL A 46 -15.678 3.309 -2.901 1.00 22.31 C ATOM 686 O VAL A 46 -16.635 2.565 -3.153 1.00 33.23 O ATOM 687 CB VAL A 46 -13.544 1.843 -3.047 1.00 32.44 C ATOM 688 CG1 VAL A 46 -14.268 0.538 -3.449 1.00 75.51 C ATOM 689 CG2 VAL A 46 -13.010 2.601 -4.285 1.00 62.10 C ATOM 0 H VAL A 46 -15.009 1.056 -1.071 1.00 71.42 H new ATOM 0 HA VAL A 46 -13.834 3.627 -1.846 1.00 61.24 H new ATOM 0 HB VAL A 46 -12.683 1.554 -2.444 1.00 32.44 H new ATOM 0 HG11 VAL A 46 -13.610 -0.066 -4.073 1.00 75.51 H new ATOM 0 HG12 VAL A 46 -14.532 -0.022 -2.552 1.00 75.51 H new ATOM 0 HG13 VAL A 46 -15.173 0.781 -4.005 1.00 75.51 H new ATOM 0 HG21 VAL A 46 -12.396 1.930 -4.886 1.00 62.10 H new ATOM 0 HG22 VAL A 46 -13.849 2.958 -4.883 1.00 62.10 H new ATOM 0 HG23 VAL A 46 -12.409 3.450 -3.960 1.00 62.10 H new ATOM 699 N THR A 47 -15.656 4.616 -3.231 1.00 2.40 N ATOM 700 CA THR A 47 -16.755 5.295 -3.949 1.00 24.01 C ATOM 701 C THR A 47 -16.805 4.851 -5.419 1.00 1.14 C ATOM 702 O THR A 47 -15.855 4.248 -5.910 1.00 33.21 O ATOM 703 CB THR A 47 -16.605 6.847 -3.857 1.00 64.02 C ATOM 704 OG1 THR A 47 -15.358 7.255 -4.429 1.00 73.13 O ATOM 705 CG2 THR A 47 -16.692 7.345 -2.403 1.00 5.31 C ATOM 0 H THR A 47 -14.875 5.232 -3.007 1.00 2.40 H new ATOM 0 HA THR A 47 -17.692 5.010 -3.471 1.00 24.01 H new ATOM 0 HB THR A 47 -17.430 7.289 -4.415 1.00 64.02 H new ATOM 0 HG1 THR A 47 -15.274 8.229 -4.368 1.00 73.13 H new ATOM 0 HG21 THR A 47 -16.583 8.429 -2.383 1.00 5.31 H new ATOM 0 HG22 THR A 47 -17.659 7.069 -1.981 1.00 5.31 H new ATOM 0 HG23 THR A 47 -15.896 6.889 -1.814 1.00 5.31 H new ATOM 713 N SER A 48 -17.919 5.157 -6.106 1.00 10.11 N ATOM 714 CA SER A 48 -18.169 4.692 -7.483 1.00 14.03 C ATOM 715 C SER A 48 -17.226 5.340 -8.504 1.00 41.15 C ATOM 716 O SER A 48 -16.756 4.665 -9.418 1.00 71.12 O ATOM 717 CB SER A 48 -19.642 4.925 -7.861 1.00 52.50 C ATOM 718 OG SER A 48 -20.045 6.266 -7.670 1.00 70.43 O ATOM 0 H SER A 48 -18.670 5.732 -5.724 1.00 10.11 H new ATOM 0 HA SER A 48 -17.961 3.622 -7.510 1.00 14.03 H new ATOM 0 HB2 SER A 48 -19.794 4.649 -8.904 1.00 52.50 H new ATOM 0 HB3 SER A 48 -20.275 4.270 -7.262 1.00 52.50 H new ATOM 0 HG SER A 48 -20.034 6.736 -8.530 1.00 70.43 H new ATOM 724 N THR A 49 -16.946 6.642 -8.327 1.00 42.11 N ATOM 725 CA THR A 49 -16.046 7.397 -9.216 1.00 73.33 C ATOM 726 C THR A 49 -14.608 6.844 -9.143 1.00 74.33 C ATOM 727 O THR A 49 -13.932 6.703 -10.169 1.00 51.54 O ATOM 728 CB THR A 49 -16.064 8.913 -8.844 1.00 0.44 C ATOM 729 OG1 THR A 49 -15.830 9.055 -7.438 1.00 53.01 O ATOM 730 CG2 THR A 49 -17.404 9.585 -9.218 1.00 23.00 C ATOM 0 H THR A 49 -17.335 7.199 -7.567 1.00 42.11 H new ATOM 0 HA THR A 49 -16.403 7.282 -10.240 1.00 73.33 H new ATOM 0 HB THR A 49 -15.278 9.409 -9.413 1.00 0.44 H new ATOM 0 HG1 THR A 49 -15.839 10.005 -7.199 1.00 53.01 H new ATOM 0 HG21 THR A 49 -17.372 10.639 -8.941 1.00 23.00 H new ATOM 0 HG22 THR A 49 -17.568 9.496 -10.292 1.00 23.00 H new ATOM 0 HG23 THR A 49 -18.218 9.094 -8.685 1.00 23.00 H new ATOM 738 N ILE A 50 -14.170 6.501 -7.917 1.00 73.31 N ATOM 739 CA ILE A 50 -12.826 5.961 -7.673 1.00 25.22 C ATOM 740 C ILE A 50 -12.755 4.495 -8.148 1.00 52.04 C ATOM 741 O ILE A 50 -11.842 4.139 -8.884 1.00 35.54 O ATOM 742 CB ILE A 50 -12.422 6.091 -6.154 1.00 34.53 C ATOM 743 CG1 ILE A 50 -12.491 7.586 -5.695 1.00 30.22 C ATOM 744 CG2 ILE A 50 -11.022 5.494 -5.874 1.00 44.41 C ATOM 745 CD1 ILE A 50 -11.604 8.549 -6.478 1.00 74.53 C ATOM 0 H ILE A 50 -14.737 6.591 -7.074 1.00 73.31 H new ATOM 0 HA ILE A 50 -12.108 6.547 -8.246 1.00 25.22 H new ATOM 0 HB ILE A 50 -13.140 5.513 -5.573 1.00 34.53 H new ATOM 0 HG12 ILE A 50 -13.524 7.925 -5.772 1.00 30.22 H new ATOM 0 HG13 ILE A 50 -12.216 7.639 -4.642 1.00 30.22 H new ATOM 0 HG21 ILE A 50 -10.784 5.605 -4.816 1.00 44.41 H new ATOM 0 HG22 ILE A 50 -11.018 4.436 -6.138 1.00 44.41 H new ATOM 0 HG23 ILE A 50 -10.276 6.020 -6.471 1.00 44.41 H new ATOM 0 HD11 ILE A 50 -11.724 9.558 -6.083 1.00 74.53 H new ATOM 0 HD12 ILE A 50 -10.562 8.244 -6.382 1.00 74.53 H new ATOM 0 HD13 ILE A 50 -11.891 8.535 -7.529 1.00 74.53 H new ATOM 757 N LEU A 51 -13.776 3.679 -7.774 1.00 23.11 N ATOM 758 CA LEU A 51 -13.811 2.222 -8.065 1.00 41.40 C ATOM 759 C LEU A 51 -13.872 1.958 -9.576 1.00 12.12 C ATOM 760 O LEU A 51 -13.288 0.982 -10.054 1.00 22.23 O ATOM 761 CB LEU A 51 -15.004 1.514 -7.354 1.00 3.52 C ATOM 762 CG LEU A 51 -15.067 -0.048 -7.521 1.00 64.32 C ATOM 763 CD1 LEU A 51 -13.783 -0.734 -6.997 1.00 74.43 C ATOM 764 CD2 LEU A 51 -16.327 -0.645 -6.857 1.00 13.02 C ATOM 0 H LEU A 51 -14.594 4.012 -7.264 1.00 23.11 H new ATOM 0 HA LEU A 51 -12.885 1.802 -7.671 1.00 41.40 H new ATOM 0 HB2 LEU A 51 -14.958 1.746 -6.290 1.00 3.52 H new ATOM 0 HB3 LEU A 51 -15.933 1.939 -7.733 1.00 3.52 H new ATOM 0 HG LEU A 51 -15.133 -0.248 -8.590 1.00 64.32 H new ATOM 0 HD11 LEU A 51 -13.866 -1.813 -7.130 1.00 74.43 H new ATOM 0 HD12 LEU A 51 -12.921 -0.365 -7.553 1.00 74.43 H new ATOM 0 HD13 LEU A 51 -13.656 -0.508 -5.938 1.00 74.43 H new ATOM 0 HD21 LEU A 51 -16.333 -1.726 -6.995 1.00 13.02 H new ATOM 0 HD22 LEU A 51 -16.321 -0.415 -5.792 1.00 13.02 H new ATOM 0 HD23 LEU A 51 -17.218 -0.216 -7.315 1.00 13.02 H new ATOM 776 N GLU A 52 -14.582 2.843 -10.311 1.00 25.42 N ATOM 777 CA GLU A 52 -14.627 2.807 -11.782 1.00 51.42 C ATOM 778 C GLU A 52 -13.203 2.882 -12.341 1.00 1.43 C ATOM 779 O GLU A 52 -12.803 2.041 -13.138 1.00 12.12 O ATOM 780 CB GLU A 52 -15.469 3.980 -12.347 1.00 25.23 C ATOM 781 CG GLU A 52 -15.493 4.047 -13.889 1.00 34.34 C ATOM 782 CD GLU A 52 -16.327 5.203 -14.445 1.00 60.31 C ATOM 783 OE1 GLU A 52 -15.966 6.375 -14.197 1.00 21.44 O ATOM 784 OE2 GLU A 52 -17.321 4.954 -15.160 1.00 51.21 O ATOM 0 H GLU A 52 -15.135 3.596 -9.901 1.00 25.42 H new ATOM 0 HA GLU A 52 -15.097 1.872 -12.086 1.00 51.42 H new ATOM 0 HB2 GLU A 52 -16.492 3.889 -11.981 1.00 25.23 H new ATOM 0 HB3 GLU A 52 -15.073 4.918 -11.958 1.00 25.23 H new ATOM 0 HG2 GLU A 52 -14.471 4.140 -14.255 1.00 34.34 H new ATOM 0 HG3 GLU A 52 -15.886 3.108 -14.278 1.00 34.34 H new ATOM 791 N LYS A 53 -12.449 3.878 -11.842 1.00 51.11 N ATOM 792 CA LYS A 53 -11.075 4.160 -12.284 1.00 31.14 C ATOM 793 C LYS A 53 -10.087 3.068 -11.835 1.00 23.14 C ATOM 794 O LYS A 53 -9.146 2.762 -12.555 1.00 22.23 O ATOM 795 CB LYS A 53 -10.621 5.543 -11.751 1.00 11.54 C ATOM 796 CG LYS A 53 -11.422 6.735 -12.313 1.00 31.12 C ATOM 797 CD LYS A 53 -10.843 8.113 -11.894 1.00 62.15 C ATOM 798 CE LYS A 53 -9.369 8.302 -12.321 1.00 25.51 C ATOM 799 NZ LYS A 53 -8.972 9.733 -12.362 1.00 5.55 N ATOM 0 H LYS A 53 -12.780 4.513 -11.116 1.00 51.11 H new ATOM 0 HA LYS A 53 -11.075 4.170 -13.374 1.00 31.14 H new ATOM 0 HB2 LYS A 53 -10.704 5.545 -10.664 1.00 11.54 H new ATOM 0 HB3 LYS A 53 -9.567 5.683 -11.991 1.00 11.54 H new ATOM 0 HG2 LYS A 53 -11.440 6.671 -13.401 1.00 31.12 H new ATOM 0 HG3 LYS A 53 -12.455 6.663 -11.972 1.00 31.12 H new ATOM 0 HD2 LYS A 53 -11.448 8.905 -12.335 1.00 62.15 H new ATOM 0 HD3 LYS A 53 -10.919 8.219 -10.812 1.00 62.15 H new ATOM 0 HE2 LYS A 53 -8.721 7.767 -11.627 1.00 25.51 H new ATOM 0 HE3 LYS A 53 -9.218 7.857 -13.305 1.00 25.51 H new ATOM 0 HZ1 LYS A 53 -7.935 9.807 -12.332 1.00 5.55 H new ATOM 0 HZ2 LYS A 53 -9.325 10.166 -13.239 1.00 5.55 H new ATOM 0 HZ3 LYS A 53 -9.378 10.229 -11.543 1.00 5.55 H new ATOM 813 N VAL A 54 -10.323 2.491 -10.642 1.00 32.21 N ATOM 814 CA VAL A 54 -9.473 1.434 -10.067 1.00 33.52 C ATOM 815 C VAL A 54 -9.567 0.162 -10.933 1.00 65.42 C ATOM 816 O VAL A 54 -8.546 -0.415 -11.330 1.00 60.31 O ATOM 817 CB VAL A 54 -9.887 1.137 -8.567 1.00 75.45 C ATOM 818 CG1 VAL A 54 -9.200 -0.127 -8.015 1.00 41.32 C ATOM 819 CG2 VAL A 54 -9.580 2.350 -7.653 1.00 54.43 C ATOM 0 H VAL A 54 -11.112 2.747 -10.048 1.00 32.21 H new ATOM 0 HA VAL A 54 -8.437 1.774 -10.061 1.00 33.52 H new ATOM 0 HB VAL A 54 -10.962 0.959 -8.568 1.00 75.45 H new ATOM 0 HG11 VAL A 54 -9.514 -0.291 -6.984 1.00 41.32 H new ATOM 0 HG12 VAL A 54 -9.481 -0.988 -8.621 1.00 41.32 H new ATOM 0 HG13 VAL A 54 -8.118 0.003 -8.049 1.00 41.32 H new ATOM 0 HG21 VAL A 54 -9.874 2.118 -6.629 1.00 54.43 H new ATOM 0 HG22 VAL A 54 -8.512 2.567 -7.683 1.00 54.43 H new ATOM 0 HG23 VAL A 54 -10.137 3.219 -8.003 1.00 54.43 H new ATOM 829 N LEU A 55 -10.811 -0.224 -11.259 1.00 43.43 N ATOM 830 CA LEU A 55 -11.102 -1.405 -12.087 1.00 3.31 C ATOM 831 C LEU A 55 -10.752 -1.149 -13.566 1.00 73.12 C ATOM 832 O LEU A 55 -10.444 -2.089 -14.294 1.00 52.42 O ATOM 833 CB LEU A 55 -12.591 -1.828 -11.927 1.00 1.32 C ATOM 834 CG LEU A 55 -13.038 -2.244 -10.483 1.00 34.11 C ATOM 835 CD1 LEU A 55 -14.507 -2.716 -10.468 1.00 54.11 C ATOM 836 CD2 LEU A 55 -12.100 -3.312 -9.867 1.00 54.22 C ATOM 0 H LEU A 55 -11.646 0.276 -10.954 1.00 43.43 H new ATOM 0 HA LEU A 55 -10.475 -2.226 -11.740 1.00 3.31 H new ATOM 0 HB2 LEU A 55 -13.220 -1.001 -12.256 1.00 1.32 H new ATOM 0 HB3 LEU A 55 -12.785 -2.663 -12.600 1.00 1.32 H new ATOM 0 HG LEU A 55 -12.963 -1.355 -9.857 1.00 34.11 H new ATOM 0 HD11 LEU A 55 -14.788 -2.998 -9.453 1.00 54.11 H new ATOM 0 HD12 LEU A 55 -15.152 -1.908 -10.812 1.00 54.11 H new ATOM 0 HD13 LEU A 55 -14.620 -3.576 -11.128 1.00 54.11 H new ATOM 0 HD21 LEU A 55 -12.449 -3.569 -8.867 1.00 54.22 H new ATOM 0 HD22 LEU A 55 -12.104 -4.204 -10.493 1.00 54.22 H new ATOM 0 HD23 LEU A 55 -11.087 -2.915 -9.807 1.00 54.22 H new ATOM 848 N ASP A 56 -10.826 0.133 -13.991 1.00 20.24 N ATOM 849 CA ASP A 56 -10.464 0.571 -15.361 1.00 32.24 C ATOM 850 C ASP A 56 -8.938 0.571 -15.561 1.00 14.01 C ATOM 851 O ASP A 56 -8.448 0.268 -16.654 1.00 33.21 O ATOM 852 CB ASP A 56 -11.040 1.982 -15.653 1.00 40.41 C ATOM 853 CG ASP A 56 -10.683 2.511 -17.052 1.00 51.10 C ATOM 854 OD1 ASP A 56 -9.924 3.503 -17.168 1.00 35.45 O ATOM 855 OD2 ASP A 56 -11.160 1.926 -18.054 1.00 71.02 O ATOM 0 H ASP A 56 -11.140 0.897 -13.392 1.00 20.24 H new ATOM 0 HA ASP A 56 -10.900 -0.140 -16.063 1.00 32.24 H new ATOM 0 HB2 ASP A 56 -12.125 1.952 -15.550 1.00 40.41 H new ATOM 0 HB3 ASP A 56 -10.668 2.680 -14.903 1.00 40.41 H new ATOM 860 N TYR A 57 -8.200 0.918 -14.490 1.00 4.14 N ATOM 861 CA TYR A 57 -6.724 0.907 -14.484 1.00 25.44 C ATOM 862 C TYR A 57 -6.232 -0.541 -14.531 1.00 5.11 C ATOM 863 O TYR A 57 -5.282 -0.860 -15.253 1.00 4.32 O ATOM 864 CB TYR A 57 -6.168 1.617 -13.222 1.00 61.41 C ATOM 865 CG TYR A 57 -4.630 1.671 -13.150 1.00 32.50 C ATOM 866 CD1 TYR A 57 -3.893 0.722 -12.426 1.00 11.33 C ATOM 867 CD2 TYR A 57 -3.916 2.666 -13.825 1.00 13.30 C ATOM 868 CE1 TYR A 57 -2.511 0.779 -12.373 1.00 44.22 C ATOM 869 CE2 TYR A 57 -2.539 2.721 -13.771 1.00 31.10 C ATOM 870 CZ TYR A 57 -1.842 1.781 -13.050 1.00 24.21 C ATOM 871 OH TYR A 57 -0.467 1.861 -12.999 1.00 50.21 O ATOM 0 H TYR A 57 -8.610 1.214 -13.604 1.00 4.14 H new ATOM 0 HA TYR A 57 -6.364 1.448 -15.359 1.00 25.44 H new ATOM 0 HB2 TYR A 57 -6.557 2.635 -13.191 1.00 61.41 H new ATOM 0 HB3 TYR A 57 -6.544 1.105 -12.336 1.00 61.41 H new ATOM 0 HD1 TYR A 57 -4.413 -0.066 -11.901 1.00 11.33 H new ATOM 0 HD2 TYR A 57 -4.453 3.406 -14.400 1.00 13.30 H new ATOM 0 HE1 TYR A 57 -1.959 0.045 -11.806 1.00 44.22 H new ATOM 0 HE2 TYR A 57 -2.009 3.502 -14.295 1.00 31.10 H new ATOM 0 HH TYR A 57 -0.146 1.450 -12.169 1.00 50.21 H new ATOM 881 N CYS A 58 -6.888 -1.400 -13.727 1.00 0.54 N ATOM 882 CA CYS A 58 -6.625 -2.841 -13.708 1.00 4.54 C ATOM 883 C CYS A 58 -6.959 -3.468 -15.072 1.00 0.42 C ATOM 884 O CYS A 58 -6.207 -4.306 -15.577 1.00 64.14 O ATOM 885 CB CYS A 58 -7.437 -3.515 -12.581 1.00 45.21 C ATOM 886 SG CYS A 58 -6.956 -2.977 -10.932 1.00 52.14 S ATOM 0 H CYS A 58 -7.615 -1.108 -13.074 1.00 0.54 H new ATOM 0 HA CYS A 58 -5.565 -3.001 -13.513 1.00 4.54 H new ATOM 0 HB2 CYS A 58 -8.496 -3.303 -12.730 1.00 45.21 H new ATOM 0 HB3 CYS A 58 -7.315 -4.596 -12.652 1.00 45.21 H new ATOM 0 HG CYS A 58 -7.494 -1.821 -10.679 1.00 52.14 H new ATOM 892 N ARG A 59 -8.098 -3.029 -15.658 1.00 52.23 N ATOM 893 CA ARG A 59 -8.577 -3.498 -16.980 1.00 43.43 C ATOM 894 C ARG A 59 -7.530 -3.178 -18.052 1.00 31.32 C ATOM 895 O ARG A 59 -7.154 -4.039 -18.853 1.00 13.24 O ATOM 896 CB ARG A 59 -9.934 -2.827 -17.333 1.00 72.22 C ATOM 897 CG ARG A 59 -10.594 -3.324 -18.639 1.00 11.42 C ATOM 898 CD ARG A 59 -11.779 -2.439 -19.066 1.00 71.44 C ATOM 899 NE ARG A 59 -11.361 -1.048 -19.362 1.00 21.42 N ATOM 900 CZ ARG A 59 -11.204 -0.520 -20.591 1.00 62.43 C ATOM 901 NH1 ARG A 59 -11.426 -1.244 -21.686 1.00 50.31 N ATOM 902 NH2 ARG A 59 -10.819 0.735 -20.715 1.00 64.33 N ATOM 0 H ARG A 59 -8.712 -2.338 -15.226 1.00 52.23 H new ATOM 0 HA ARG A 59 -8.727 -4.577 -16.941 1.00 43.43 H new ATOM 0 HB2 ARG A 59 -10.628 -2.992 -16.509 1.00 72.22 H new ATOM 0 HB3 ARG A 59 -9.780 -1.751 -17.409 1.00 72.22 H new ATOM 0 HG2 ARG A 59 -9.850 -3.342 -19.436 1.00 11.42 H new ATOM 0 HG3 ARG A 59 -10.939 -4.349 -18.502 1.00 11.42 H new ATOM 0 HD2 ARG A 59 -12.253 -2.870 -19.948 1.00 71.44 H new ATOM 0 HD3 ARG A 59 -12.528 -2.431 -18.274 1.00 71.44 H new ATOM 0 HE ARG A 59 -11.176 -0.438 -18.566 1.00 21.42 H new ATOM 0 HH11 ARG A 59 -11.721 -2.217 -21.603 1.00 50.31 H new ATOM 0 HH12 ARG A 59 -11.302 -0.826 -22.608 1.00 50.31 H new ATOM 0 HH21 ARG A 59 -10.642 1.299 -19.884 1.00 64.33 H new ATOM 0 HH22 ARG A 59 -10.698 1.142 -21.642 1.00 64.33 H new ATOM 916 N HIS A 60 -7.041 -1.928 -17.993 1.00 31.21 N ATOM 917 CA HIS A 60 -5.978 -1.415 -18.859 1.00 11.34 C ATOM 918 C HIS A 60 -4.689 -2.236 -18.699 1.00 51.02 C ATOM 919 O HIS A 60 -4.099 -2.637 -19.686 1.00 43.15 O ATOM 920 CB HIS A 60 -5.715 0.085 -18.530 1.00 3.21 C ATOM 921 CG HIS A 60 -4.453 0.651 -19.141 1.00 54.22 C ATOM 922 ND1 HIS A 60 -4.362 1.065 -20.451 1.00 0.45 N ATOM 923 CD2 HIS A 60 -3.220 0.833 -18.615 1.00 13.32 C ATOM 924 CE1 HIS A 60 -3.133 1.475 -20.694 1.00 24.43 C ATOM 925 NE2 HIS A 60 -2.425 1.341 -19.598 1.00 53.43 N ATOM 0 H HIS A 60 -7.384 -1.236 -17.327 1.00 31.21 H new ATOM 0 HA HIS A 60 -6.300 -1.504 -19.896 1.00 11.34 H new ATOM 0 HB2 HIS A 60 -6.565 0.674 -18.874 1.00 3.21 H new ATOM 0 HB3 HIS A 60 -5.663 0.202 -17.448 1.00 3.21 H new ATOM 0 HD2 HIS A 60 -2.920 0.615 -17.601 1.00 13.32 H new ATOM 0 HE1 HIS A 60 -2.770 1.857 -21.637 1.00 24.43 H new ATOM 0 HE2 HIS A 60 -1.438 1.579 -19.498 1.00 53.43 H new ATOM 934 N HIS A 61 -4.287 -2.483 -17.442 1.00 45.40 N ATOM 935 CA HIS A 61 -2.978 -3.089 -17.118 1.00 22.14 C ATOM 936 C HIS A 61 -2.939 -4.591 -17.478 1.00 43.52 C ATOM 937 O HIS A 61 -1.878 -5.125 -17.803 1.00 13.25 O ATOM 938 CB HIS A 61 -2.670 -2.894 -15.608 1.00 24.51 C ATOM 939 CG HIS A 61 -1.233 -3.155 -15.223 1.00 15.11 C ATOM 940 ND1 HIS A 61 -0.652 -4.407 -15.249 1.00 15.31 N ATOM 941 CD2 HIS A 61 -0.258 -2.307 -14.819 1.00 44.23 C ATOM 942 CE1 HIS A 61 0.608 -4.313 -14.883 1.00 61.21 C ATOM 943 NE2 HIS A 61 0.874 -3.050 -14.621 1.00 4.05 N ATOM 0 H HIS A 61 -4.855 -2.271 -16.622 1.00 45.40 H new ATOM 0 HA HIS A 61 -2.217 -2.587 -17.716 1.00 22.14 H new ATOM 0 HB2 HIS A 61 -2.929 -1.873 -15.326 1.00 24.51 H new ATOM 0 HB3 HIS A 61 -3.314 -3.557 -15.030 1.00 24.51 H new ATOM 0 HD2 HIS A 61 -0.356 -1.241 -14.679 1.00 44.23 H new ATOM 0 HE1 HIS A 61 1.307 -5.133 -14.810 1.00 61.21 H new ATOM 0 HE2 HIS A 61 1.777 -2.685 -14.319 1.00 4.05 H new ATOM 952 N HIS A 62 -4.095 -5.263 -17.387 1.00 45.01 N ATOM 953 CA HIS A 62 -4.204 -6.713 -17.642 1.00 61.14 C ATOM 954 C HIS A 62 -4.271 -6.998 -19.157 1.00 10.11 C ATOM 955 O HIS A 62 -3.598 -7.907 -19.659 1.00 41.14 O ATOM 956 CB HIS A 62 -5.450 -7.278 -16.913 1.00 75.44 C ATOM 957 CG HIS A 62 -5.666 -8.772 -17.054 1.00 22.51 C ATOM 958 ND1 HIS A 62 -5.308 -9.682 -16.081 1.00 64.03 N ATOM 959 CD2 HIS A 62 -6.244 -9.503 -18.045 1.00 21.53 C ATOM 960 CE1 HIS A 62 -5.662 -10.894 -16.466 1.00 72.35 C ATOM 961 NE2 HIS A 62 -6.232 -10.806 -17.644 1.00 62.01 N ATOM 0 H HIS A 62 -4.980 -4.822 -17.136 1.00 45.01 H new ATOM 0 HA HIS A 62 -3.316 -7.210 -17.253 1.00 61.14 H new ATOM 0 HB2 HIS A 62 -5.369 -7.039 -15.853 1.00 75.44 H new ATOM 0 HB3 HIS A 62 -6.334 -6.763 -17.289 1.00 75.44 H new ATOM 0 HD1 HIS A 62 -4.843 -9.454 -15.202 1.00 64.03 H new ATOM 0 HD2 HIS A 62 -6.639 -9.122 -18.975 1.00 21.53 H new ATOM 0 HE1 HIS A 62 -5.508 -11.804 -15.906 1.00 72.35 H new ATOM 970 N GLN A 63 -5.109 -6.217 -19.863 1.00 45.11 N ATOM 971 CA GLN A 63 -5.325 -6.359 -21.320 1.00 52.33 C ATOM 972 C GLN A 63 -4.158 -5.750 -22.114 1.00 42.14 C ATOM 973 O GLN A 63 -3.821 -6.215 -23.210 1.00 70.15 O ATOM 974 CB GLN A 63 -6.663 -5.685 -21.713 1.00 62.35 C ATOM 975 CG GLN A 63 -7.901 -6.299 -21.020 1.00 24.30 C ATOM 976 CD GLN A 63 -9.213 -5.589 -21.353 1.00 42.21 C ATOM 977 OE1 GLN A 63 -9.244 -4.383 -21.597 1.00 40.25 O ATOM 978 NE2 GLN A 63 -10.307 -6.322 -21.355 1.00 43.41 N ATOM 0 H GLN A 63 -5.658 -5.468 -19.441 1.00 45.11 H new ATOM 0 HA GLN A 63 -5.372 -7.420 -21.565 1.00 52.33 H new ATOM 0 HB2 GLN A 63 -6.610 -4.624 -21.467 1.00 62.35 H new ATOM 0 HB3 GLN A 63 -6.791 -5.756 -22.793 1.00 62.35 H new ATOM 0 HG2 GLN A 63 -7.983 -7.347 -21.307 1.00 24.30 H new ATOM 0 HG3 GLN A 63 -7.750 -6.275 -19.941 1.00 24.30 H new ATOM 0 HE21 GLN A 63 -10.253 -7.320 -21.149 1.00 43.41 H new ATOM 0 HE22 GLN A 63 -11.208 -5.892 -21.562 1.00 43.41 H new ATOM 987 N HIS A 64 -3.572 -4.687 -21.549 1.00 62.45 N ATOM 988 CA HIS A 64 -2.396 -3.998 -22.102 1.00 1.53 C ATOM 989 C HIS A 64 -1.315 -3.912 -20.993 1.00 64.33 C ATOM 990 O HIS A 64 -1.328 -2.966 -20.191 1.00 44.13 O ATOM 991 CB HIS A 64 -2.767 -2.570 -22.607 1.00 14.32 C ATOM 992 CG HIS A 64 -3.751 -2.520 -23.748 1.00 23.24 C ATOM 993 ND1 HIS A 64 -3.370 -2.357 -25.063 1.00 70.42 N ATOM 994 CD2 HIS A 64 -5.104 -2.559 -23.760 1.00 41.33 C ATOM 995 CE1 HIS A 64 -4.442 -2.297 -25.827 1.00 52.42 C ATOM 996 NE2 HIS A 64 -5.505 -2.415 -25.062 1.00 24.24 N ATOM 0 H HIS A 64 -3.907 -4.273 -20.679 1.00 62.45 H new ATOM 0 HA HIS A 64 -2.017 -4.558 -22.957 1.00 1.53 H new ATOM 0 HB2 HIS A 64 -3.177 -2.003 -21.771 1.00 14.32 H new ATOM 0 HB3 HIS A 64 -1.852 -2.064 -22.917 1.00 14.32 H new ATOM 0 HD2 HIS A 64 -5.748 -2.681 -22.902 1.00 41.33 H new ATOM 0 HE1 HIS A 64 -4.447 -2.172 -26.900 1.00 52.42 H new ATOM 0 HE2 HIS A 64 -6.472 -2.401 -25.386 1.00 24.24 H new ATOM 1005 N PRO A 65 -0.398 -4.933 -20.893 1.00 4.43 N ATOM 1006 CA PRO A 65 0.679 -4.974 -19.849 1.00 73.51 C ATOM 1007 C PRO A 65 1.599 -3.724 -19.822 1.00 51.53 C ATOM 1008 O PRO A 65 2.220 -3.426 -18.790 1.00 52.40 O ATOM 1009 CB PRO A 65 1.473 -6.250 -20.216 1.00 33.44 C ATOM 1010 CG PRO A 65 0.479 -7.117 -20.933 1.00 4.21 C ATOM 1011 CD PRO A 65 -0.364 -6.157 -21.745 1.00 32.02 C ATOM 0 HA PRO A 65 0.254 -4.983 -18.845 1.00 73.51 H new ATOM 0 HB2 PRO A 65 2.328 -6.017 -20.851 1.00 33.44 H new ATOM 0 HB3 PRO A 65 1.863 -6.745 -19.326 1.00 33.44 H new ATOM 0 HG2 PRO A 65 0.979 -7.843 -21.574 1.00 4.21 H new ATOM 0 HG3 PRO A 65 -0.133 -7.681 -20.229 1.00 4.21 H new ATOM 0 HD2 PRO A 65 0.079 -5.957 -22.720 1.00 32.02 H new ATOM 0 HD3 PRO A 65 -1.364 -6.551 -21.924 1.00 32.02 H new ATOM 1019 N GLY A 66 1.686 -3.015 -20.970 1.00 53.14 N ATOM 1020 CA GLY A 66 2.453 -1.766 -21.075 1.00 20.10 C ATOM 1021 C GLY A 66 3.939 -1.989 -21.351 1.00 5.21 C ATOM 1022 O GLY A 66 4.759 -1.105 -21.077 1.00 51.41 O ATOM 0 H GLY A 66 1.229 -3.294 -21.838 1.00 53.14 H new ATOM 0 HA2 GLY A 66 2.031 -1.155 -21.872 1.00 20.10 H new ATOM 0 HA3 GLY A 66 2.344 -1.202 -20.149 1.00 20.10 H new ATOM 1026 N GLY A 67 4.283 -3.163 -21.923 1.00 62.40 N ATOM 1027 CA GLY A 67 5.672 -3.514 -22.243 1.00 14.23 C ATOM 1028 C GLY A 67 6.106 -3.018 -23.622 1.00 14.32 C ATOM 1029 O GLY A 67 6.428 -3.824 -24.506 1.00 11.33 O ATOM 0 H GLY A 67 3.607 -3.885 -22.172 1.00 62.40 H new ATOM 0 HA2 GLY A 67 6.332 -3.091 -21.486 1.00 14.23 H new ATOM 0 HA3 GLY A 67 5.788 -4.597 -22.199 1.00 14.23 H new ATOM 1033 N SER A 68 6.078 -1.684 -23.811 1.00 55.20 N ATOM 1034 CA SER A 68 6.515 -1.016 -25.051 1.00 3.42 C ATOM 1035 C SER A 68 7.139 0.343 -24.705 1.00 31.33 C ATOM 1036 O SER A 68 6.446 1.375 -24.687 1.00 0.14 O ATOM 1037 CB SER A 68 5.329 -0.850 -26.040 1.00 63.11 C ATOM 1038 OG SER A 68 4.804 -2.108 -26.442 1.00 1.34 O ATOM 0 H SER A 68 5.747 -1.033 -23.098 1.00 55.20 H new ATOM 0 HA SER A 68 7.265 -1.635 -25.544 1.00 3.42 H new ATOM 0 HB2 SER A 68 4.542 -0.260 -25.570 1.00 63.11 H new ATOM 0 HB3 SER A 68 5.661 -0.296 -26.918 1.00 63.11 H new ATOM 0 HG SER A 68 4.058 -1.968 -27.063 1.00 1.34 H new ATOM 1044 N GLY A 69 8.445 0.311 -24.373 1.00 1.44 N ATOM 1045 CA GLY A 69 9.197 1.511 -24.001 1.00 34.54 C ATOM 1046 C GLY A 69 8.817 2.024 -22.618 1.00 70.14 C ATOM 1047 O GLY A 69 7.864 2.800 -22.485 1.00 11.44 O ATOM 0 H GLY A 69 8.999 -0.545 -24.357 1.00 1.44 H new ATOM 0 HA2 GLY A 69 10.264 1.290 -24.024 1.00 34.54 H new ATOM 0 HA3 GLY A 69 9.017 2.293 -24.739 1.00 34.54 H new ATOM 1051 N LEU A 70 9.559 1.582 -21.584 1.00 14.32 N ATOM 1052 CA LEU A 70 9.344 2.001 -20.186 1.00 31.11 C ATOM 1053 C LEU A 70 9.967 3.404 -19.995 1.00 22.21 C ATOM 1054 O LEU A 70 11.004 3.573 -19.337 1.00 31.04 O ATOM 1055 CB LEU A 70 9.938 0.956 -19.185 1.00 1.20 C ATOM 1056 CG LEU A 70 9.204 -0.435 -19.083 1.00 51.40 C ATOM 1057 CD1 LEU A 70 9.240 -1.237 -20.405 1.00 44.55 C ATOM 1058 CD2 LEU A 70 9.769 -1.279 -17.916 1.00 33.05 C ATOM 0 H LEU A 70 10.328 0.921 -21.696 1.00 14.32 H new ATOM 0 HA LEU A 70 8.276 2.053 -19.974 1.00 31.11 H new ATOM 0 HB2 LEU A 70 10.976 0.772 -19.464 1.00 1.20 H new ATOM 0 HB3 LEU A 70 9.950 1.406 -18.192 1.00 1.20 H new ATOM 0 HG LEU A 70 8.156 -0.212 -18.880 1.00 51.40 H new ATOM 0 HD11 LEU A 70 8.718 -2.184 -20.270 1.00 44.55 H new ATOM 0 HD12 LEU A 70 8.752 -0.663 -21.192 1.00 44.55 H new ATOM 0 HD13 LEU A 70 10.275 -1.430 -20.686 1.00 44.55 H new ATOM 0 HD21 LEU A 70 9.244 -2.233 -17.870 1.00 33.05 H new ATOM 0 HD22 LEU A 70 10.832 -1.457 -18.077 1.00 33.05 H new ATOM 0 HD23 LEU A 70 9.629 -0.742 -16.978 1.00 33.05 H new ATOM 1070 N ASP A 71 9.300 4.390 -20.615 1.00 33.51 N ATOM 1071 CA ASP A 71 9.806 5.762 -20.802 1.00 32.03 C ATOM 1072 C ASP A 71 8.750 6.597 -21.555 1.00 71.22 C ATOM 1073 O ASP A 71 8.651 7.814 -21.360 1.00 13.14 O ATOM 1074 CB ASP A 71 11.144 5.771 -21.599 1.00 13.44 C ATOM 1075 CG ASP A 71 11.744 7.182 -21.770 1.00 54.40 C ATOM 1076 OD1 ASP A 71 12.265 7.739 -20.779 1.00 60.33 O ATOM 1077 OD2 ASP A 71 11.709 7.736 -22.892 1.00 62.24 O ATOM 0 H ASP A 71 8.370 4.253 -21.011 1.00 33.51 H new ATOM 0 HA ASP A 71 9.996 6.194 -19.819 1.00 32.03 H new ATOM 0 HB2 ASP A 71 11.867 5.136 -21.088 1.00 13.44 H new ATOM 0 HB3 ASP A 71 10.975 5.334 -22.583 1.00 13.44 H new ATOM 1082 N ASP A 72 7.980 5.903 -22.431 1.00 73.14 N ATOM 1083 CA ASP A 72 6.896 6.495 -23.258 1.00 73.23 C ATOM 1084 C ASP A 72 5.895 7.303 -22.406 1.00 51.44 C ATOM 1085 O ASP A 72 5.564 8.449 -22.747 1.00 42.11 O ATOM 1086 CB ASP A 72 6.152 5.364 -24.031 1.00 0.13 C ATOM 1087 CG ASP A 72 4.921 5.856 -24.833 1.00 2.13 C ATOM 1088 OD1 ASP A 72 3.765 5.619 -24.401 1.00 75.00 O ATOM 1089 OD2 ASP A 72 5.104 6.484 -25.897 1.00 74.55 O ATOM 0 H ASP A 72 8.096 4.901 -22.585 1.00 73.14 H new ATOM 0 HA ASP A 72 7.354 7.187 -23.965 1.00 73.23 H new ATOM 0 HB2 ASP A 72 6.852 4.885 -24.716 1.00 0.13 H new ATOM 0 HB3 ASP A 72 5.830 4.603 -23.320 1.00 0.13 H new ATOM 1094 N ILE A 73 5.454 6.683 -21.288 1.00 73.34 N ATOM 1095 CA ILE A 73 4.396 7.201 -20.397 1.00 11.41 C ATOM 1096 C ILE A 73 3.077 7.370 -21.198 1.00 13.01 C ATOM 1097 O ILE A 73 2.843 8.436 -21.792 1.00 73.32 O ATOM 1098 CB ILE A 73 4.794 8.550 -19.654 1.00 10.54 C ATOM 1099 CG1 ILE A 73 6.146 8.383 -18.879 1.00 41.34 C ATOM 1100 CG2 ILE A 73 3.658 9.036 -18.706 1.00 54.21 C ATOM 1101 CD1 ILE A 73 6.154 7.306 -17.795 1.00 71.42 C ATOM 0 H ILE A 73 5.833 5.789 -20.975 1.00 73.34 H new ATOM 0 HA ILE A 73 4.254 6.465 -19.605 1.00 11.41 H new ATOM 0 HB ILE A 73 4.934 9.318 -20.415 1.00 10.54 H new ATOM 0 HG12 ILE A 73 6.932 8.155 -19.599 1.00 41.34 H new ATOM 0 HG13 ILE A 73 6.402 9.338 -18.420 1.00 41.34 H new ATOM 0 HG21 ILE A 73 3.964 9.960 -18.215 1.00 54.21 H new ATOM 0 HG22 ILE A 73 2.753 9.216 -19.286 1.00 54.21 H new ATOM 0 HG23 ILE A 73 3.461 8.273 -17.953 1.00 54.21 H new ATOM 0 HD11 ILE A 73 7.135 7.274 -17.322 1.00 71.42 H new ATOM 0 HD12 ILE A 73 5.397 7.538 -17.046 1.00 71.42 H new ATOM 0 HD13 ILE A 73 5.935 6.337 -18.243 1.00 71.42 H new ATOM 1113 N PRO A 74 2.227 6.291 -21.282 1.00 54.53 N ATOM 1114 CA PRO A 74 0.970 6.324 -22.063 1.00 55.03 C ATOM 1115 C PRO A 74 0.023 7.457 -21.596 1.00 74.12 C ATOM 1116 O PRO A 74 -0.234 7.578 -20.390 1.00 75.31 O ATOM 1117 CB PRO A 74 0.349 4.925 -21.816 1.00 33.35 C ATOM 1118 CG PRO A 74 1.507 4.055 -21.422 1.00 52.50 C ATOM 1119 CD PRO A 74 2.432 4.958 -20.641 1.00 15.52 C ATOM 0 HA PRO A 74 1.144 6.530 -23.119 1.00 55.03 H new ATOM 0 HB2 PRO A 74 -0.405 4.960 -21.029 1.00 33.35 H new ATOM 0 HB3 PRO A 74 -0.143 4.547 -22.712 1.00 33.35 H new ATOM 0 HG2 PRO A 74 1.177 3.211 -20.817 1.00 52.50 H new ATOM 0 HG3 PRO A 74 2.006 3.643 -22.299 1.00 52.50 H new ATOM 0 HD2 PRO A 74 2.177 4.977 -19.581 1.00 15.52 H new ATOM 0 HD3 PRO A 74 3.469 4.632 -20.713 1.00 15.52 H new ATOM 1127 N PRO A 75 -0.495 8.313 -22.540 1.00 50.42 N ATOM 1128 CA PRO A 75 -1.437 9.423 -22.207 1.00 74.34 C ATOM 1129 C PRO A 75 -2.728 8.932 -21.514 1.00 13.23 C ATOM 1130 O PRO A 75 -3.428 9.714 -20.882 1.00 3.32 O ATOM 1131 CB PRO A 75 -1.736 10.072 -23.584 1.00 21.11 C ATOM 1132 CG PRO A 75 -0.575 9.676 -24.455 1.00 22.45 C ATOM 1133 CD PRO A 75 -0.196 8.286 -24.003 1.00 20.44 C ATOM 0 HA PRO A 75 -1.006 10.120 -21.489 1.00 74.34 H new ATOM 0 HB2 PRO A 75 -2.679 9.712 -23.995 1.00 21.11 H new ATOM 0 HB3 PRO A 75 -1.817 11.156 -23.501 1.00 21.11 H new ATOM 0 HG2 PRO A 75 -0.853 9.685 -25.509 1.00 22.45 H new ATOM 0 HG3 PRO A 75 0.259 10.369 -24.339 1.00 22.45 H new ATOM 0 HD2 PRO A 75 -0.777 7.522 -24.519 1.00 20.44 H new ATOM 0 HD3 PRO A 75 0.855 8.072 -24.196 1.00 20.44 H new ATOM 1141 N TYR A 76 -3.018 7.626 -21.653 1.00 55.34 N ATOM 1142 CA TYR A 76 -4.123 6.949 -20.953 1.00 32.42 C ATOM 1143 C TYR A 76 -3.900 7.010 -19.424 1.00 31.33 C ATOM 1144 O TYR A 76 -4.764 7.474 -18.677 1.00 24.12 O ATOM 1145 CB TYR A 76 -4.207 5.466 -21.428 1.00 12.01 C ATOM 1146 CG TYR A 76 -5.487 4.717 -21.010 1.00 44.22 C ATOM 1147 CD1 TYR A 76 -6.509 4.482 -21.931 1.00 55.43 C ATOM 1148 CD2 TYR A 76 -5.670 4.232 -19.705 1.00 42.12 C ATOM 1149 CE1 TYR A 76 -7.653 3.805 -21.575 1.00 14.13 C ATOM 1150 CE2 TYR A 76 -6.823 3.557 -19.348 1.00 73.01 C ATOM 1151 CZ TYR A 76 -7.807 3.343 -20.290 1.00 44.34 C ATOM 1152 OH TYR A 76 -8.952 2.662 -19.955 1.00 3.42 O ATOM 0 H TYR A 76 -2.485 7.005 -22.262 1.00 55.34 H new ATOM 0 HA TYR A 76 -5.061 7.453 -21.186 1.00 32.42 H new ATOM 0 HB2 TYR A 76 -4.131 5.444 -22.515 1.00 12.01 H new ATOM 0 HB3 TYR A 76 -3.345 4.926 -21.037 1.00 12.01 H new ATOM 0 HD1 TYR A 76 -6.400 4.839 -22.944 1.00 55.43 H new ATOM 0 HD2 TYR A 76 -4.897 4.389 -18.967 1.00 42.12 H new ATOM 0 HE1 TYR A 76 -8.430 3.637 -22.306 1.00 14.13 H new ATOM 0 HE2 TYR A 76 -6.952 3.199 -18.337 1.00 73.01 H new ATOM 0 HH TYR A 76 -9.329 3.040 -19.133 1.00 3.42 H new ATOM 1162 N ASP A 77 -2.719 6.529 -18.997 1.00 54.12 N ATOM 1163 CA ASP A 77 -2.324 6.451 -17.572 1.00 41.32 C ATOM 1164 C ASP A 77 -2.030 7.842 -16.999 1.00 2.22 C ATOM 1165 O ASP A 77 -2.203 8.083 -15.802 1.00 32.24 O ATOM 1166 CB ASP A 77 -1.078 5.547 -17.416 1.00 12.52 C ATOM 1167 CG ASP A 77 -1.326 4.124 -17.925 1.00 11.25 C ATOM 1168 OD1 ASP A 77 -1.620 3.221 -17.116 1.00 75.25 O ATOM 1169 OD2 ASP A 77 -1.251 3.910 -19.151 1.00 53.31 O ATOM 0 H ASP A 77 -2.003 6.179 -19.634 1.00 54.12 H new ATOM 0 HA ASP A 77 -3.157 6.022 -17.016 1.00 41.32 H new ATOM 0 HB2 ASP A 77 -0.243 5.986 -17.962 1.00 12.52 H new ATOM 0 HB3 ASP A 77 -0.788 5.510 -16.366 1.00 12.52 H new ATOM 1174 N ARG A 78 -1.575 8.752 -17.873 1.00 62.03 N ATOM 1175 CA ARG A 78 -1.249 10.128 -17.488 1.00 63.24 C ATOM 1176 C ARG A 78 -2.538 10.949 -17.263 1.00 3.05 C ATOM 1177 O ARG A 78 -2.603 11.791 -16.356 1.00 62.35 O ATOM 1178 CB ARG A 78 -0.338 10.768 -18.562 1.00 32.11 C ATOM 1179 CG ARG A 78 0.277 12.114 -18.139 1.00 22.22 C ATOM 1180 CD ARG A 78 1.259 12.669 -19.180 1.00 31.35 C ATOM 1181 NE ARG A 78 1.858 13.940 -18.732 1.00 33.21 N ATOM 1182 CZ ARG A 78 2.940 14.521 -19.267 1.00 42.12 C ATOM 1183 NH1 ARG A 78 3.583 13.967 -20.296 1.00 51.33 N ATOM 1184 NH2 ARG A 78 3.376 15.667 -18.770 1.00 71.21 N ATOM 0 H ARG A 78 -1.424 8.553 -18.862 1.00 62.03 H new ATOM 0 HA ARG A 78 -0.704 10.121 -16.544 1.00 63.24 H new ATOM 0 HB2 ARG A 78 0.466 10.073 -18.803 1.00 32.11 H new ATOM 0 HB3 ARG A 78 -0.917 10.915 -19.474 1.00 32.11 H new ATOM 0 HG2 ARG A 78 -0.521 12.838 -17.976 1.00 22.22 H new ATOM 0 HG3 ARG A 78 0.794 11.990 -17.188 1.00 22.22 H new ATOM 0 HD2 ARG A 78 2.047 11.939 -19.364 1.00 31.35 H new ATOM 0 HD3 ARG A 78 0.740 12.823 -20.126 1.00 31.35 H new ATOM 0 HE ARG A 78 1.411 14.417 -17.949 1.00 33.21 H new ATOM 0 HH11 ARG A 78 3.253 13.086 -20.689 1.00 51.33 H new ATOM 0 HH12 ARG A 78 4.405 14.425 -20.690 1.00 51.33 H new ATOM 0 HH21 ARG A 78 2.889 16.101 -17.986 1.00 71.21 H new ATOM 0 HH22 ARG A 78 4.199 16.117 -19.171 1.00 71.21 H new ATOM 1198 N ASP A 79 -3.566 10.677 -18.090 1.00 12.43 N ATOM 1199 CA ASP A 79 -4.909 11.271 -17.921 1.00 61.44 C ATOM 1200 C ASP A 79 -5.687 10.572 -16.800 1.00 60.00 C ATOM 1201 O ASP A 79 -6.622 11.148 -16.241 1.00 62.30 O ATOM 1202 CB ASP A 79 -5.719 11.304 -19.243 1.00 43.33 C ATOM 1203 CG ASP A 79 -5.303 12.482 -20.156 1.00 31.43 C ATOM 1204 OD1 ASP A 79 -4.699 12.258 -21.225 1.00 10.12 O ATOM 1205 OD2 ASP A 79 -5.577 13.653 -19.787 1.00 4.23 O ATOM 0 H ASP A 79 -3.492 10.045 -18.887 1.00 12.43 H new ATOM 0 HA ASP A 79 -4.758 12.310 -17.628 1.00 61.44 H new ATOM 0 HB2 ASP A 79 -5.577 10.365 -19.778 1.00 43.33 H new ATOM 0 HB3 ASP A 79 -6.782 11.382 -19.014 1.00 43.33 H new ATOM 1210 N PHE A 80 -5.312 9.319 -16.487 1.00 72.22 N ATOM 1211 CA PHE A 80 -5.792 8.625 -15.277 1.00 23.34 C ATOM 1212 C PHE A 80 -5.350 9.406 -14.015 1.00 33.24 C ATOM 1213 O PHE A 80 -6.121 9.551 -13.052 1.00 13.42 O ATOM 1214 CB PHE A 80 -5.266 7.160 -15.249 1.00 73.05 C ATOM 1215 CG PHE A 80 -5.583 6.414 -13.960 1.00 22.53 C ATOM 1216 CD1 PHE A 80 -4.655 6.358 -12.916 1.00 63.32 C ATOM 1217 CD2 PHE A 80 -6.824 5.817 -13.769 1.00 43.31 C ATOM 1218 CE1 PHE A 80 -4.966 5.737 -11.733 1.00 71.00 C ATOM 1219 CE2 PHE A 80 -7.122 5.187 -12.587 1.00 42.13 C ATOM 1220 CZ PHE A 80 -6.202 5.149 -11.567 1.00 51.13 C ATOM 0 H PHE A 80 -4.675 8.763 -17.058 1.00 72.22 H new ATOM 0 HA PHE A 80 -6.881 8.586 -15.292 1.00 23.34 H new ATOM 0 HB2 PHE A 80 -5.697 6.614 -16.088 1.00 73.05 H new ATOM 0 HB3 PHE A 80 -4.186 7.170 -15.395 1.00 73.05 H new ATOM 0 HD1 PHE A 80 -3.682 6.809 -13.042 1.00 63.32 H new ATOM 0 HD2 PHE A 80 -7.560 5.849 -14.558 1.00 43.31 H new ATOM 0 HE1 PHE A 80 -4.243 5.709 -10.932 1.00 71.00 H new ATOM 0 HE2 PHE A 80 -8.086 4.718 -12.457 1.00 42.13 H new ATOM 0 HZ PHE A 80 -6.447 4.659 -10.636 1.00 51.13 H new ATOM 1230 N CYS A 81 -4.108 9.919 -14.058 1.00 0.11 N ATOM 1231 CA CYS A 81 -3.497 10.685 -12.959 1.00 34.41 C ATOM 1232 C CYS A 81 -4.047 12.133 -12.865 1.00 4.00 C ATOM 1233 O CYS A 81 -3.615 12.891 -11.991 1.00 1.10 O ATOM 1234 CB CYS A 81 -1.958 10.681 -13.132 1.00 12.32 C ATOM 1235 SG CYS A 81 -1.232 9.025 -13.081 1.00 12.13 S ATOM 0 H CYS A 81 -3.494 9.812 -14.866 1.00 0.11 H new ATOM 0 HA CYS A 81 -3.761 10.201 -12.019 1.00 34.41 H new ATOM 0 HB2 CYS A 81 -1.706 11.151 -14.083 1.00 12.32 H new ATOM 0 HB3 CYS A 81 -1.510 11.290 -12.347 1.00 12.32 H new ATOM 0 HG CYS A 81 -1.572 8.369 -14.150 1.00 12.13 H new ATOM 1241 N LYS A 82 -4.997 12.516 -13.763 1.00 43.22 N ATOM 1242 CA LYS A 82 -5.734 13.796 -13.653 1.00 52.22 C ATOM 1243 C LYS A 82 -6.795 13.665 -12.550 1.00 11.04 C ATOM 1244 O LYS A 82 -7.942 13.272 -12.800 1.00 41.13 O ATOM 1245 CB LYS A 82 -6.400 14.192 -14.996 1.00 41.24 C ATOM 1246 CG LYS A 82 -5.422 14.374 -16.162 1.00 11.34 C ATOM 1247 CD LYS A 82 -4.398 15.505 -15.945 1.00 3.54 C ATOM 1248 CE LYS A 82 -3.400 15.595 -17.105 1.00 4.22 C ATOM 1249 NZ LYS A 82 -4.067 15.809 -18.419 1.00 61.44 N ATOM 0 H LYS A 82 -5.266 11.952 -14.569 1.00 43.22 H new ATOM 0 HA LYS A 82 -5.026 14.585 -13.400 1.00 52.22 H new ATOM 0 HB2 LYS A 82 -7.128 13.427 -15.265 1.00 41.24 H new ATOM 0 HB3 LYS A 82 -6.952 15.121 -14.853 1.00 41.24 H new ATOM 0 HG2 LYS A 82 -4.887 13.438 -16.324 1.00 11.34 H new ATOM 0 HG3 LYS A 82 -5.988 14.579 -17.070 1.00 11.34 H new ATOM 0 HD2 LYS A 82 -4.922 16.455 -15.841 1.00 3.54 H new ATOM 0 HD3 LYS A 82 -3.859 15.334 -15.013 1.00 3.54 H new ATOM 0 HE2 LYS A 82 -2.704 16.412 -16.918 1.00 4.22 H new ATOM 0 HE3 LYS A 82 -2.812 14.678 -17.145 1.00 4.22 H new ATOM 0 HZ1 LYS A 82 -3.357 16.081 -19.129 1.00 61.44 H new ATOM 0 HZ2 LYS A 82 -4.536 14.930 -18.717 1.00 61.44 H new ATOM 0 HZ3 LYS A 82 -4.775 16.566 -18.330 1.00 61.44 H new ATOM 1263 N VAL A 83 -6.354 13.912 -11.316 1.00 63.13 N ATOM 1264 CA VAL A 83 -7.183 13.839 -10.108 1.00 23.32 C ATOM 1265 C VAL A 83 -6.891 15.060 -9.224 1.00 12.42 C ATOM 1266 O VAL A 83 -5.789 15.625 -9.283 1.00 44.30 O ATOM 1267 CB VAL A 83 -6.908 12.503 -9.308 1.00 0.42 C ATOM 1268 CG1 VAL A 83 -7.470 11.268 -10.045 1.00 2.14 C ATOM 1269 CG2 VAL A 83 -5.404 12.315 -9.022 1.00 5.22 C ATOM 0 H VAL A 83 -5.388 14.175 -11.122 1.00 63.13 H new ATOM 0 HA VAL A 83 -8.233 13.839 -10.400 1.00 23.32 H new ATOM 0 HB VAL A 83 -7.430 12.595 -8.356 1.00 0.42 H new ATOM 0 HG11 VAL A 83 -7.261 10.370 -9.463 1.00 2.14 H new ATOM 0 HG12 VAL A 83 -8.547 11.377 -10.169 1.00 2.14 H new ATOM 0 HG13 VAL A 83 -6.999 11.183 -11.024 1.00 2.14 H new ATOM 0 HG21 VAL A 83 -5.252 11.387 -8.471 1.00 5.22 H new ATOM 0 HG22 VAL A 83 -4.857 12.272 -9.964 1.00 5.22 H new ATOM 0 HG23 VAL A 83 -5.039 13.153 -8.429 1.00 5.22 H new ATOM 1279 N ASP A 84 -7.889 15.475 -8.430 1.00 50.22 N ATOM 1280 CA ASP A 84 -7.739 16.600 -7.480 1.00 43.50 C ATOM 1281 C ASP A 84 -6.917 16.133 -6.258 1.00 32.00 C ATOM 1282 O ASP A 84 -6.652 14.929 -6.130 1.00 75.33 O ATOM 1283 CB ASP A 84 -9.148 17.132 -7.073 1.00 33.20 C ATOM 1284 CG ASP A 84 -9.127 18.505 -6.370 1.00 44.20 C ATOM 1285 OD1 ASP A 84 -8.382 19.400 -6.823 1.00 60.45 O ATOM 1286 OD2 ASP A 84 -9.863 18.706 -5.380 1.00 72.15 O ATOM 0 H ASP A 84 -8.816 15.049 -8.423 1.00 50.22 H new ATOM 0 HA ASP A 84 -7.200 17.424 -7.948 1.00 43.50 H new ATOM 0 HB2 ASP A 84 -9.769 17.203 -7.966 1.00 33.20 H new ATOM 0 HB3 ASP A 84 -9.621 16.405 -6.413 1.00 33.20 H new ATOM 1291 N GLN A 85 -6.511 17.071 -5.376 1.00 23.51 N ATOM 1292 CA GLN A 85 -5.638 16.761 -4.217 1.00 23.43 C ATOM 1293 C GLN A 85 -6.222 15.649 -3.286 1.00 22.22 C ATOM 1294 O GLN A 85 -5.496 14.690 -2.992 1.00 40.14 O ATOM 1295 CB GLN A 85 -5.270 18.055 -3.418 1.00 24.04 C ATOM 1296 CG GLN A 85 -4.369 17.824 -2.174 1.00 72.10 C ATOM 1297 CD GLN A 85 -2.953 17.302 -2.482 1.00 24.24 C ATOM 1298 OE1 GLN A 85 -2.696 16.616 -3.466 1.00 71.12 O ATOM 1299 NE2 GLN A 85 -2.019 17.612 -1.618 1.00 3.32 N ATOM 0 H GLN A 85 -6.774 18.054 -5.443 1.00 23.51 H new ATOM 0 HA GLN A 85 -4.717 16.349 -4.629 1.00 23.43 H new ATOM 0 HB2 GLN A 85 -4.764 18.748 -4.091 1.00 24.04 H new ATOM 0 HB3 GLN A 85 -6.192 18.539 -3.096 1.00 24.04 H new ATOM 0 HG2 GLN A 85 -4.283 18.763 -1.628 1.00 72.10 H new ATOM 0 HG3 GLN A 85 -4.865 17.114 -1.512 1.00 72.10 H new ATOM 0 HE21 GLN A 85 -2.246 18.183 -0.804 1.00 3.32 H new ATOM 0 HE22 GLN A 85 -1.064 17.282 -1.759 1.00 3.32 H new ATOM 1308 N PRO A 86 -7.523 15.720 -2.806 1.00 32.10 N ATOM 1309 CA PRO A 86 -8.128 14.603 -2.024 1.00 44.42 C ATOM 1310 C PRO A 86 -8.231 13.303 -2.843 1.00 23.52 C ATOM 1311 O PRO A 86 -8.030 12.214 -2.301 1.00 50.14 O ATOM 1312 CB PRO A 86 -9.523 15.148 -1.609 1.00 64.44 C ATOM 1313 CG PRO A 86 -9.820 16.222 -2.613 1.00 24.41 C ATOM 1314 CD PRO A 86 -8.484 16.859 -2.922 1.00 71.25 C ATOM 0 HA PRO A 86 -7.519 14.325 -1.164 1.00 44.42 H new ATOM 0 HB2 PRO A 86 -10.279 14.363 -1.632 1.00 64.44 H new ATOM 0 HB3 PRO A 86 -9.508 15.546 -0.594 1.00 64.44 H new ATOM 0 HG2 PRO A 86 -10.275 15.805 -3.512 1.00 24.41 H new ATOM 0 HG3 PRO A 86 -10.521 16.953 -2.211 1.00 24.41 H new ATOM 0 HD2 PRO A 86 -8.469 17.298 -3.920 1.00 71.25 H new ATOM 0 HD3 PRO A 86 -8.247 17.658 -2.219 1.00 71.25 H new ATOM 1322 N THR A 87 -8.483 13.448 -4.161 1.00 34.12 N ATOM 1323 CA THR A 87 -8.710 12.325 -5.088 1.00 51.43 C ATOM 1324 C THR A 87 -7.407 11.502 -5.309 1.00 63.35 C ATOM 1325 O THR A 87 -7.470 10.292 -5.551 1.00 73.41 O ATOM 1326 CB THR A 87 -9.285 12.854 -6.449 1.00 60.41 C ATOM 1327 OG1 THR A 87 -10.275 13.867 -6.202 1.00 60.20 O ATOM 1328 CG2 THR A 87 -9.923 11.737 -7.299 1.00 12.51 C ATOM 0 H THR A 87 -8.535 14.360 -4.614 1.00 34.12 H new ATOM 0 HA THR A 87 -9.444 11.654 -4.641 1.00 51.43 H new ATOM 0 HB THR A 87 -8.443 13.263 -7.007 1.00 60.41 H new ATOM 0 HG1 THR A 87 -10.628 14.194 -7.056 1.00 60.20 H new ATOM 0 HG21 THR A 87 -10.304 12.160 -8.229 1.00 12.51 H new ATOM 0 HG22 THR A 87 -9.173 10.979 -7.526 1.00 12.51 H new ATOM 0 HG23 THR A 87 -10.743 11.282 -6.745 1.00 12.51 H new ATOM 1336 N LEU A 88 -6.236 12.192 -5.217 1.00 44.10 N ATOM 1337 CA LEU A 88 -4.890 11.555 -5.196 1.00 50.35 C ATOM 1338 C LEU A 88 -4.822 10.511 -4.066 1.00 45.05 C ATOM 1339 O LEU A 88 -4.491 9.342 -4.298 1.00 55.25 O ATOM 1340 CB LEU A 88 -3.773 12.649 -5.006 1.00 52.35 C ATOM 1341 CG LEU A 88 -3.234 13.334 -6.305 1.00 42.42 C ATOM 1342 CD1 LEU A 88 -2.463 14.631 -5.994 1.00 0.45 C ATOM 1343 CD2 LEU A 88 -2.349 12.353 -7.114 1.00 51.22 C ATOM 0 H LEU A 88 -6.200 13.209 -5.155 1.00 44.10 H new ATOM 0 HA LEU A 88 -4.720 11.052 -6.148 1.00 50.35 H new ATOM 0 HB2 LEU A 88 -4.165 13.426 -4.349 1.00 52.35 H new ATOM 0 HB3 LEU A 88 -2.931 12.189 -4.489 1.00 52.35 H new ATOM 0 HG LEU A 88 -4.098 13.606 -6.911 1.00 42.42 H new ATOM 0 HD11 LEU A 88 -2.106 15.074 -6.924 1.00 0.45 H new ATOM 0 HD12 LEU A 88 -3.124 15.334 -5.487 1.00 0.45 H new ATOM 0 HD13 LEU A 88 -1.613 14.404 -5.351 1.00 0.45 H new ATOM 0 HD21 LEU A 88 -1.984 12.849 -8.013 1.00 51.22 H new ATOM 0 HD22 LEU A 88 -1.502 12.039 -6.504 1.00 51.22 H new ATOM 0 HD23 LEU A 88 -2.937 11.479 -7.395 1.00 51.22 H new ATOM 1355 N PHE A 89 -5.196 10.958 -2.856 1.00 22.40 N ATOM 1356 CA PHE A 89 -5.194 10.127 -1.639 1.00 21.12 C ATOM 1357 C PHE A 89 -6.278 9.037 -1.693 1.00 24.14 C ATOM 1358 O PHE A 89 -6.092 7.972 -1.122 1.00 60.14 O ATOM 1359 CB PHE A 89 -5.347 11.014 -0.376 1.00 14.21 C ATOM 1360 CG PHE A 89 -4.154 11.948 -0.146 1.00 4.34 C ATOM 1361 CD1 PHE A 89 -2.951 11.452 0.352 1.00 43.40 C ATOM 1362 CD2 PHE A 89 -4.227 13.315 -0.437 1.00 32.34 C ATOM 1363 CE1 PHE A 89 -1.868 12.286 0.555 1.00 75.42 C ATOM 1364 CE2 PHE A 89 -3.141 14.149 -0.230 1.00 72.11 C ATOM 1365 CZ PHE A 89 -1.962 13.633 0.264 1.00 23.30 C ATOM 0 H PHE A 89 -5.511 11.914 -2.693 1.00 22.40 H new ATOM 0 HA PHE A 89 -4.233 9.617 -1.583 1.00 21.12 H new ATOM 0 HB2 PHE A 89 -6.255 11.610 -0.467 1.00 14.21 H new ATOM 0 HB3 PHE A 89 -5.472 10.373 0.497 1.00 14.21 H new ATOM 0 HD1 PHE A 89 -2.864 10.401 0.583 1.00 43.40 H new ATOM 0 HD2 PHE A 89 -5.145 13.726 -0.829 1.00 32.34 H new ATOM 0 HE1 PHE A 89 -0.944 11.883 0.943 1.00 75.42 H new ATOM 0 HE2 PHE A 89 -3.218 15.202 -0.455 1.00 72.11 H new ATOM 0 HZ PHE A 89 -1.113 14.281 0.423 1.00 23.30 H new ATOM 1375 N GLU A 90 -7.399 9.314 -2.388 1.00 63.04 N ATOM 1376 CA GLU A 90 -8.497 8.334 -2.563 1.00 52.43 C ATOM 1377 C GLU A 90 -8.054 7.120 -3.401 1.00 21.21 C ATOM 1378 O GLU A 90 -8.495 5.996 -3.145 1.00 52.11 O ATOM 1379 CB GLU A 90 -9.731 9.003 -3.212 1.00 75.25 C ATOM 1380 CG GLU A 90 -10.409 10.069 -2.337 1.00 32.44 C ATOM 1381 CD GLU A 90 -10.943 9.508 -1.004 1.00 4.10 C ATOM 1382 OE1 GLU A 90 -12.012 8.855 -1.015 1.00 11.12 O ATOM 1383 OE2 GLU A 90 -10.310 9.724 0.051 1.00 5.43 O ATOM 0 H GLU A 90 -7.571 10.212 -2.840 1.00 63.04 H new ATOM 0 HA GLU A 90 -8.768 7.975 -1.570 1.00 52.43 H new ATOM 0 HB2 GLU A 90 -9.427 9.462 -4.153 1.00 75.25 H new ATOM 0 HB3 GLU A 90 -10.462 8.231 -3.455 1.00 75.25 H new ATOM 0 HG2 GLU A 90 -9.696 10.867 -2.129 1.00 32.44 H new ATOM 0 HG3 GLU A 90 -11.234 10.516 -2.893 1.00 32.44 H new ATOM 1390 N LEU A 91 -7.194 7.366 -4.415 1.00 73.50 N ATOM 1391 CA LEU A 91 -6.593 6.290 -5.240 1.00 22.34 C ATOM 1392 C LEU A 91 -5.593 5.457 -4.405 1.00 3.30 C ATOM 1393 O LEU A 91 -5.493 4.242 -4.585 1.00 22.11 O ATOM 1394 CB LEU A 91 -5.882 6.874 -6.496 1.00 43.12 C ATOM 1395 CG LEU A 91 -6.763 7.648 -7.527 1.00 5.11 C ATOM 1396 CD1 LEU A 91 -5.903 8.163 -8.709 1.00 74.31 C ATOM 1397 CD2 LEU A 91 -7.940 6.780 -8.030 1.00 2.03 C ATOM 0 H LEU A 91 -6.899 8.305 -4.684 1.00 73.50 H new ATOM 0 HA LEU A 91 -7.401 5.640 -5.575 1.00 22.34 H new ATOM 0 HB2 LEU A 91 -5.094 7.546 -6.155 1.00 43.12 H new ATOM 0 HB3 LEU A 91 -5.395 6.052 -7.020 1.00 43.12 H new ATOM 0 HG LEU A 91 -7.190 8.512 -7.017 1.00 5.11 H new ATOM 0 HD11 LEU A 91 -6.538 8.699 -9.414 1.00 74.31 H new ATOM 0 HD12 LEU A 91 -5.132 8.835 -8.332 1.00 74.31 H new ATOM 0 HD13 LEU A 91 -5.434 7.318 -9.213 1.00 74.31 H new ATOM 0 HD21 LEU A 91 -8.532 7.350 -8.746 1.00 2.03 H new ATOM 0 HD22 LEU A 91 -7.551 5.884 -8.513 1.00 2.03 H new ATOM 0 HD23 LEU A 91 -8.568 6.494 -7.186 1.00 2.03 H new ATOM 1409 N ILE A 92 -4.861 6.142 -3.494 1.00 51.51 N ATOM 1410 CA ILE A 92 -3.908 5.502 -2.557 1.00 52.31 C ATOM 1411 C ILE A 92 -4.670 4.590 -1.559 1.00 54.54 C ATOM 1412 O ILE A 92 -4.278 3.441 -1.331 1.00 61.31 O ATOM 1413 CB ILE A 92 -3.051 6.586 -1.777 1.00 42.42 C ATOM 1414 CG1 ILE A 92 -2.223 7.464 -2.778 1.00 45.52 C ATOM 1415 CG2 ILE A 92 -2.124 5.935 -0.716 1.00 22.24 C ATOM 1416 CD1 ILE A 92 -1.415 8.591 -2.143 1.00 34.43 C ATOM 0 H ILE A 92 -4.915 7.155 -3.389 1.00 51.51 H new ATOM 0 HA ILE A 92 -3.219 4.890 -3.140 1.00 52.31 H new ATOM 0 HB ILE A 92 -3.749 7.233 -1.245 1.00 42.42 H new ATOM 0 HG12 ILE A 92 -1.541 6.815 -3.326 1.00 45.52 H new ATOM 0 HG13 ILE A 92 -2.907 7.897 -3.508 1.00 45.52 H new ATOM 0 HG21 ILE A 92 -1.555 6.711 -0.205 1.00 22.24 H new ATOM 0 HG22 ILE A 92 -2.728 5.390 0.010 1.00 22.24 H new ATOM 0 HG23 ILE A 92 -1.437 5.245 -1.207 1.00 22.24 H new ATOM 0 HD11 ILE A 92 -0.880 9.137 -2.920 1.00 34.43 H new ATOM 0 HD12 ILE A 92 -2.087 9.271 -1.620 1.00 34.43 H new ATOM 0 HD13 ILE A 92 -0.700 8.172 -1.435 1.00 34.43 H new ATOM 1428 N LEU A 93 -5.794 5.116 -1.016 1.00 13.43 N ATOM 1429 CA LEU A 93 -6.635 4.414 -0.018 1.00 23.30 C ATOM 1430 C LEU A 93 -7.352 3.204 -0.646 1.00 33.42 C ATOM 1431 O LEU A 93 -7.483 2.165 -0.004 1.00 64.45 O ATOM 1432 CB LEU A 93 -7.678 5.392 0.613 1.00 25.04 C ATOM 1433 CG LEU A 93 -7.108 6.537 1.516 1.00 12.04 C ATOM 1434 CD1 LEU A 93 -8.236 7.484 1.990 1.00 22.44 C ATOM 1435 CD2 LEU A 93 -6.310 5.969 2.713 1.00 14.51 C ATOM 0 H LEU A 93 -6.144 6.043 -1.259 1.00 13.43 H new ATOM 0 HA LEU A 93 -5.977 4.049 0.770 1.00 23.30 H new ATOM 0 HB2 LEU A 93 -8.250 5.848 -0.195 1.00 25.04 H new ATOM 0 HB3 LEU A 93 -8.379 4.806 1.208 1.00 25.04 H new ATOM 0 HG LEU A 93 -6.415 7.121 0.911 1.00 12.04 H new ATOM 0 HD11 LEU A 93 -7.812 8.270 2.615 1.00 22.44 H new ATOM 0 HD12 LEU A 93 -8.723 7.932 1.124 1.00 22.44 H new ATOM 0 HD13 LEU A 93 -8.969 6.918 2.565 1.00 22.44 H new ATOM 0 HD21 LEU A 93 -5.929 6.791 3.319 1.00 14.51 H new ATOM 0 HD22 LEU A 93 -6.963 5.342 3.321 1.00 14.51 H new ATOM 0 HD23 LEU A 93 -5.476 5.373 2.344 1.00 14.51 H new ATOM 1447 N ALA A 94 -7.804 3.362 -1.904 1.00 64.54 N ATOM 1448 CA ALA A 94 -8.511 2.303 -2.653 1.00 53.11 C ATOM 1449 C ALA A 94 -7.553 1.175 -3.064 1.00 63.01 C ATOM 1450 O ALA A 94 -7.918 0.000 -3.030 1.00 71.02 O ATOM 1451 CB ALA A 94 -9.196 2.903 -3.887 1.00 3.33 C ATOM 0 H ALA A 94 -7.690 4.228 -2.431 1.00 64.54 H new ATOM 0 HA ALA A 94 -9.269 1.871 -2.000 1.00 53.11 H new ATOM 0 HB1 ALA A 94 -9.715 2.116 -4.434 1.00 3.33 H new ATOM 0 HB2 ALA A 94 -9.914 3.660 -3.572 1.00 3.33 H new ATOM 0 HB3 ALA A 94 -8.446 3.360 -4.533 1.00 3.33 H new ATOM 1457 N ALA A 95 -6.325 1.558 -3.460 1.00 63.44 N ATOM 1458 CA ALA A 95 -5.265 0.608 -3.853 1.00 61.45 C ATOM 1459 C ALA A 95 -4.709 -0.154 -2.639 1.00 23.42 C ATOM 1460 O ALA A 95 -4.247 -1.285 -2.772 1.00 13.34 O ATOM 1461 CB ALA A 95 -4.144 1.351 -4.574 1.00 53.54 C ATOM 0 H ALA A 95 -6.039 2.535 -3.517 1.00 63.44 H new ATOM 0 HA ALA A 95 -5.703 -0.127 -4.528 1.00 61.45 H new ATOM 0 HB1 ALA A 95 -3.365 0.645 -4.861 1.00 53.54 H new ATOM 0 HB2 ALA A 95 -4.543 1.834 -5.466 1.00 53.54 H new ATOM 0 HB3 ALA A 95 -3.722 2.106 -3.910 1.00 53.54 H new ATOM 1467 N ASN A 96 -4.735 0.506 -1.466 1.00 13.03 N ATOM 1468 CA ASN A 96 -4.374 -0.107 -0.170 1.00 73.33 C ATOM 1469 C ASN A 96 -5.487 -1.082 0.279 1.00 41.04 C ATOM 1470 O ASN A 96 -5.211 -2.209 0.702 1.00 41.31 O ATOM 1471 CB ASN A 96 -4.139 1.017 0.884 1.00 1.43 C ATOM 1472 CG ASN A 96 -3.901 0.526 2.321 1.00 25.04 C ATOM 1473 OD1 ASN A 96 -3.389 -0.563 2.559 1.00 64.35 O ATOM 1474 ND2 ASN A 96 -4.235 1.354 3.288 1.00 60.32 N ATOM 0 H ASN A 96 -5.008 1.486 -1.388 1.00 13.03 H new ATOM 0 HA ASN A 96 -3.452 -0.680 -0.272 1.00 73.33 H new ATOM 0 HB2 ASN A 96 -3.280 1.611 0.573 1.00 1.43 H new ATOM 0 HB3 ASN A 96 -5.003 1.681 0.882 1.00 1.43 H new ATOM 0 HD21 ASN A 96 -4.069 1.096 4.261 1.00 60.32 H new ATOM 0 HD22 ASN A 96 -4.659 2.254 3.065 1.00 60.32 H new ATOM 1481 N TYR A 97 -6.746 -0.629 0.138 1.00 63.22 N ATOM 1482 CA TYR A 97 -7.952 -1.411 0.495 1.00 44.52 C ATOM 1483 C TYR A 97 -8.085 -2.667 -0.382 1.00 64.13 C ATOM 1484 O TYR A 97 -8.555 -3.706 0.087 1.00 63.32 O ATOM 1485 CB TYR A 97 -9.222 -0.510 0.368 1.00 24.22 C ATOM 1486 CG TYR A 97 -10.579 -1.242 0.490 1.00 64.43 C ATOM 1487 CD1 TYR A 97 -11.465 -1.323 -0.596 1.00 45.12 C ATOM 1488 CD2 TYR A 97 -10.966 -1.862 1.683 1.00 63.42 C ATOM 1489 CE1 TYR A 97 -12.677 -1.984 -0.492 1.00 32.00 C ATOM 1490 CE2 TYR A 97 -12.179 -2.525 1.790 1.00 41.12 C ATOM 1491 CZ TYR A 97 -13.030 -2.587 0.699 1.00 23.12 C ATOM 1492 OH TYR A 97 -14.239 -3.247 0.805 1.00 2.44 O ATOM 0 H TYR A 97 -6.961 0.298 -0.230 1.00 63.22 H new ATOM 0 HA TYR A 97 -7.854 -1.744 1.528 1.00 44.52 H new ATOM 0 HB2 TYR A 97 -9.176 0.261 1.137 1.00 24.22 H new ATOM 0 HB3 TYR A 97 -9.190 -0.002 -0.596 1.00 24.22 H new ATOM 0 HD1 TYR A 97 -11.195 -0.859 -1.533 1.00 45.12 H new ATOM 0 HD2 TYR A 97 -10.307 -1.823 2.538 1.00 63.42 H new ATOM 0 HE1 TYR A 97 -13.344 -2.028 -1.340 1.00 32.00 H new ATOM 0 HE2 TYR A 97 -12.460 -2.992 2.722 1.00 41.12 H new ATOM 0 HH TYR A 97 -14.332 -3.616 1.708 1.00 2.44 H new ATOM 1502 N LEU A 98 -7.689 -2.553 -1.656 1.00 2.55 N ATOM 1503 CA LEU A 98 -7.803 -3.647 -2.637 1.00 33.51 C ATOM 1504 C LEU A 98 -6.455 -4.337 -2.911 1.00 61.35 C ATOM 1505 O LEU A 98 -6.403 -5.265 -3.726 1.00 11.15 O ATOM 1506 CB LEU A 98 -8.460 -3.123 -3.941 1.00 44.13 C ATOM 1507 CG LEU A 98 -9.962 -2.714 -3.809 1.00 2.50 C ATOM 1508 CD1 LEU A 98 -10.529 -2.158 -5.136 1.00 52.32 C ATOM 1509 CD2 LEU A 98 -10.808 -3.899 -3.285 1.00 74.23 C ATOM 0 H LEU A 98 -7.280 -1.701 -2.039 1.00 2.55 H new ATOM 0 HA LEU A 98 -8.447 -4.415 -2.208 1.00 33.51 H new ATOM 0 HB2 LEU A 98 -7.894 -2.260 -4.293 1.00 44.13 H new ATOM 0 HB3 LEU A 98 -8.375 -3.894 -4.707 1.00 44.13 H new ATOM 0 HG LEU A 98 -10.020 -1.907 -3.079 1.00 2.50 H new ATOM 0 HD11 LEU A 98 -11.576 -1.886 -4.999 1.00 52.32 H new ATOM 0 HD12 LEU A 98 -9.961 -1.276 -5.433 1.00 52.32 H new ATOM 0 HD13 LEU A 98 -10.450 -2.919 -5.912 1.00 52.32 H new ATOM 0 HD21 LEU A 98 -11.851 -3.592 -3.201 1.00 74.23 H new ATOM 0 HD22 LEU A 98 -10.731 -4.736 -3.979 1.00 74.23 H new ATOM 0 HD23 LEU A 98 -10.439 -4.204 -2.306 1.00 74.23 H new ATOM 1521 N ASP A 99 -5.377 -3.903 -2.216 1.00 12.03 N ATOM 1522 CA ASP A 99 -4.021 -4.516 -2.329 1.00 41.21 C ATOM 1523 C ASP A 99 -3.439 -4.421 -3.759 1.00 75.43 C ATOM 1524 O ASP A 99 -2.491 -5.150 -4.095 1.00 3.41 O ATOM 1525 CB ASP A 99 -4.041 -6.003 -1.856 1.00 62.42 C ATOM 1526 CG ASP A 99 -3.908 -6.190 -0.347 1.00 32.05 C ATOM 1527 OD1 ASP A 99 -4.915 -6.449 0.347 1.00 2.21 O ATOM 1528 OD2 ASP A 99 -2.785 -6.078 0.165 1.00 20.30 O ATOM 0 H ASP A 99 -5.417 -3.121 -1.562 1.00 12.03 H new ATOM 0 HA ASP A 99 -3.367 -3.939 -1.675 1.00 41.21 H new ATOM 0 HB2 ASP A 99 -4.973 -6.463 -2.185 1.00 62.42 H new ATOM 0 HB3 ASP A 99 -3.229 -6.538 -2.348 1.00 62.42 H new ATOM 1533 N ILE A 100 -3.991 -3.513 -4.587 1.00 23.12 N ATOM 1534 CA ILE A 100 -3.545 -3.329 -5.972 1.00 31.11 C ATOM 1535 C ILE A 100 -2.288 -2.461 -5.966 1.00 70.22 C ATOM 1536 O ILE A 100 -2.369 -1.232 -5.988 1.00 24.23 O ATOM 1537 CB ILE A 100 -4.662 -2.695 -6.892 1.00 11.43 C ATOM 1538 CG1 ILE A 100 -5.981 -3.503 -6.760 1.00 24.24 C ATOM 1539 CG2 ILE A 100 -4.199 -2.622 -8.378 1.00 52.21 C ATOM 1540 CD1 ILE A 100 -7.159 -2.964 -7.548 1.00 61.20 C ATOM 0 H ILE A 100 -4.753 -2.893 -4.312 1.00 23.12 H new ATOM 0 HA ILE A 100 -3.326 -4.309 -6.397 1.00 31.11 H new ATOM 0 HB ILE A 100 -4.842 -1.673 -6.558 1.00 11.43 H new ATOM 0 HG12 ILE A 100 -5.792 -4.528 -7.078 1.00 24.24 H new ATOM 0 HG13 ILE A 100 -6.258 -3.542 -5.707 1.00 24.24 H new ATOM 0 HG21 ILE A 100 -4.990 -2.181 -8.984 1.00 52.21 H new ATOM 0 HG22 ILE A 100 -3.302 -2.007 -8.450 1.00 52.21 H new ATOM 0 HG23 ILE A 100 -3.981 -3.626 -8.741 1.00 52.21 H new ATOM 0 HD11 ILE A 100 -8.028 -3.602 -7.385 1.00 61.20 H new ATOM 0 HD12 ILE A 100 -7.385 -1.951 -7.216 1.00 61.20 H new ATOM 0 HD13 ILE A 100 -6.912 -2.952 -8.609 1.00 61.20 H new ATOM 1552 N LYS A 101 -1.135 -3.130 -5.854 1.00 72.51 N ATOM 1553 CA LYS A 101 0.183 -2.481 -5.850 1.00 23.33 C ATOM 1554 C LYS A 101 0.576 -1.872 -7.225 1.00 75.14 C ATOM 1555 O LYS A 101 1.296 -0.876 -7.222 1.00 43.44 O ATOM 1556 CB LYS A 101 1.274 -3.449 -5.356 1.00 20.51 C ATOM 1557 CG LYS A 101 1.044 -4.000 -3.933 1.00 14.12 C ATOM 1558 CD LYS A 101 2.313 -4.666 -3.366 1.00 22.21 C ATOM 1559 CE LYS A 101 3.453 -3.652 -3.150 1.00 72.41 C ATOM 1560 NZ LYS A 101 4.686 -4.285 -2.623 1.00 5.55 N ATOM 0 H LYS A 101 -1.089 -4.145 -5.763 1.00 72.51 H new ATOM 0 HA LYS A 101 0.104 -1.646 -5.153 1.00 23.33 H new ATOM 0 HB2 LYS A 101 1.340 -4.287 -6.050 1.00 20.51 H new ATOM 0 HB3 LYS A 101 2.236 -2.937 -5.383 1.00 20.51 H new ATOM 0 HG2 LYS A 101 0.734 -3.189 -3.275 1.00 14.12 H new ATOM 0 HG3 LYS A 101 0.230 -4.725 -3.951 1.00 14.12 H new ATOM 0 HD2 LYS A 101 2.075 -5.151 -2.419 1.00 22.21 H new ATOM 0 HD3 LYS A 101 2.648 -5.447 -4.049 1.00 22.21 H new ATOM 0 HE2 LYS A 101 3.678 -3.157 -4.095 1.00 72.41 H new ATOM 0 HE3 LYS A 101 3.121 -2.879 -2.457 1.00 72.41 H new ATOM 0 HZ1 LYS A 101 5.079 -3.697 -1.860 1.00 5.55 H new ATOM 0 HZ2 LYS A 101 4.460 -5.229 -2.251 1.00 5.55 H new ATOM 0 HZ3 LYS A 101 5.385 -4.373 -3.388 1.00 5.55 H new ATOM 1574 N PRO A 102 0.174 -2.461 -8.426 1.00 71.24 N ATOM 1575 CA PRO A 102 0.281 -1.744 -9.735 1.00 72.34 C ATOM 1576 C PRO A 102 -0.287 -0.302 -9.684 1.00 5.01 C ATOM 1577 O PRO A 102 0.273 0.610 -10.293 1.00 45.23 O ATOM 1578 CB PRO A 102 -0.537 -2.644 -10.696 1.00 24.33 C ATOM 1579 CG PRO A 102 -0.338 -4.031 -10.157 1.00 64.33 C ATOM 1580 CD PRO A 102 -0.290 -3.878 -8.643 1.00 71.03 C ATOM 0 HA PRO A 102 1.317 -1.605 -10.044 1.00 72.34 H new ATOM 0 HB2 PRO A 102 -1.591 -2.366 -10.702 1.00 24.33 H new ATOM 0 HB3 PRO A 102 -0.179 -2.560 -11.722 1.00 24.33 H new ATOM 0 HG2 PRO A 102 -1.152 -4.690 -10.459 1.00 64.33 H new ATOM 0 HG3 PRO A 102 0.585 -4.470 -10.536 1.00 64.33 H new ATOM 0 HD2 PRO A 102 -1.269 -4.049 -8.195 1.00 71.03 H new ATOM 0 HD3 PRO A 102 0.397 -4.595 -8.192 1.00 71.03 H new ATOM 1588 N LEU A 103 -1.411 -0.122 -8.961 1.00 55.42 N ATOM 1589 CA LEU A 103 -2.048 1.193 -8.774 1.00 75.11 C ATOM 1590 C LEU A 103 -1.347 1.995 -7.659 1.00 12.21 C ATOM 1591 O LEU A 103 -1.003 3.166 -7.856 1.00 74.23 O ATOM 1592 CB LEU A 103 -3.555 1.017 -8.451 1.00 73.11 C ATOM 1593 CG LEU A 103 -4.373 2.333 -8.238 1.00 1.45 C ATOM 1594 CD1 LEU A 103 -4.199 3.287 -9.426 1.00 73.32 C ATOM 1595 CD2 LEU A 103 -5.862 2.028 -7.976 1.00 62.43 C ATOM 0 H LEU A 103 -1.900 -0.884 -8.492 1.00 55.42 H new ATOM 0 HA LEU A 103 -1.950 1.754 -9.703 1.00 75.11 H new ATOM 0 HB2 LEU A 103 -4.016 0.454 -9.263 1.00 73.11 H new ATOM 0 HB3 LEU A 103 -3.644 0.409 -7.551 1.00 73.11 H new ATOM 0 HG LEU A 103 -3.980 2.832 -7.352 1.00 1.45 H new ATOM 0 HD11 LEU A 103 -4.778 4.194 -9.252 1.00 73.32 H new ATOM 0 HD12 LEU A 103 -3.145 3.544 -9.535 1.00 73.32 H new ATOM 0 HD13 LEU A 103 -4.550 2.802 -10.337 1.00 73.32 H new ATOM 0 HD21 LEU A 103 -6.405 2.962 -7.832 1.00 62.43 H new ATOM 0 HD22 LEU A 103 -6.280 1.494 -8.829 1.00 62.43 H new ATOM 0 HD23 LEU A 103 -5.955 1.412 -7.081 1.00 62.43 H new ATOM 1607 N LEU A 104 -1.137 1.329 -6.502 1.00 53.35 N ATOM 1608 CA LEU A 104 -0.603 1.950 -5.266 1.00 10.14 C ATOM 1609 C LEU A 104 0.747 2.608 -5.517 1.00 34.23 C ATOM 1610 O LEU A 104 0.956 3.773 -5.170 1.00 43.10 O ATOM 1611 CB LEU A 104 -0.454 0.870 -4.156 1.00 53.52 C ATOM 1612 CG LEU A 104 0.056 1.349 -2.758 1.00 23.20 C ATOM 1613 CD1 LEU A 104 -0.950 2.310 -2.082 1.00 70.13 C ATOM 1614 CD2 LEU A 104 0.377 0.136 -1.859 1.00 53.33 C ATOM 0 H LEU A 104 -1.335 0.334 -6.397 1.00 53.35 H new ATOM 0 HA LEU A 104 -1.306 2.719 -4.944 1.00 10.14 H new ATOM 0 HB2 LEU A 104 -1.424 0.393 -4.017 1.00 53.52 H new ATOM 0 HB3 LEU A 104 0.229 0.103 -4.520 1.00 53.52 H new ATOM 0 HG LEU A 104 0.977 1.913 -2.908 1.00 23.20 H new ATOM 0 HD11 LEU A 104 -0.561 2.621 -1.113 1.00 70.13 H new ATOM 0 HD12 LEU A 104 -1.096 3.187 -2.713 1.00 70.13 H new ATOM 0 HD13 LEU A 104 -1.903 1.800 -1.943 1.00 70.13 H new ATOM 0 HD21 LEU A 104 0.731 0.485 -0.889 1.00 53.33 H new ATOM 0 HD22 LEU A 104 -0.523 -0.464 -1.722 1.00 53.33 H new ATOM 0 HD23 LEU A 104 1.150 -0.471 -2.330 1.00 53.33 H new ATOM 1626 N ASP A 105 1.631 1.836 -6.163 1.00 2.55 N ATOM 1627 CA ASP A 105 3.006 2.236 -6.440 1.00 33.14 C ATOM 1628 C ASP A 105 3.037 3.472 -7.339 1.00 23.31 C ATOM 1629 O ASP A 105 3.669 4.455 -6.992 1.00 53.14 O ATOM 1630 CB ASP A 105 3.793 1.070 -7.086 1.00 72.00 C ATOM 1631 CG ASP A 105 5.280 1.413 -7.281 1.00 45.03 C ATOM 1632 OD1 ASP A 105 5.698 1.739 -8.416 1.00 71.33 O ATOM 1633 OD2 ASP A 105 6.040 1.373 -6.284 1.00 75.05 O ATOM 0 H ASP A 105 1.402 0.905 -6.510 1.00 2.55 H new ATOM 0 HA ASP A 105 3.486 2.490 -5.495 1.00 33.14 H new ATOM 0 HB2 ASP A 105 3.705 0.183 -6.459 1.00 72.00 H new ATOM 0 HB3 ASP A 105 3.349 0.824 -8.050 1.00 72.00 H new ATOM 1638 N VAL A 106 2.291 3.408 -8.457 1.00 30.34 N ATOM 1639 CA VAL A 106 2.255 4.471 -9.478 1.00 74.41 C ATOM 1640 C VAL A 106 1.658 5.788 -8.927 1.00 5.31 C ATOM 1641 O VAL A 106 2.229 6.858 -9.149 1.00 11.33 O ATOM 1642 CB VAL A 106 1.467 3.974 -10.756 1.00 75.44 C ATOM 1643 CG1 VAL A 106 1.172 5.115 -11.766 1.00 10.34 C ATOM 1644 CG2 VAL A 106 2.240 2.817 -11.444 1.00 72.22 C ATOM 0 H VAL A 106 1.693 2.612 -8.679 1.00 30.34 H new ATOM 0 HA VAL A 106 3.283 4.691 -9.766 1.00 74.41 H new ATOM 0 HB VAL A 106 0.499 3.609 -10.413 1.00 75.44 H new ATOM 0 HG11 VAL A 106 0.630 4.712 -12.621 1.00 10.34 H new ATOM 0 HG12 VAL A 106 0.568 5.882 -11.282 1.00 10.34 H new ATOM 0 HG13 VAL A 106 2.111 5.553 -12.105 1.00 10.34 H new ATOM 0 HG21 VAL A 106 1.688 2.483 -12.323 1.00 72.22 H new ATOM 0 HG22 VAL A 106 3.226 3.168 -11.747 1.00 72.22 H new ATOM 0 HG23 VAL A 106 2.349 1.987 -10.746 1.00 72.22 H new ATOM 1654 N THR A 107 0.529 5.701 -8.193 1.00 14.30 N ATOM 1655 CA THR A 107 -0.147 6.892 -7.625 1.00 11.04 C ATOM 1656 C THR A 107 0.732 7.564 -6.543 1.00 41.23 C ATOM 1657 O THR A 107 0.936 8.789 -6.563 1.00 33.24 O ATOM 1658 CB THR A 107 -1.549 6.527 -7.032 1.00 40.11 C ATOM 1659 OG1 THR A 107 -2.351 5.894 -8.045 1.00 32.43 O ATOM 1660 CG2 THR A 107 -2.295 7.770 -6.503 1.00 32.44 C ATOM 0 H THR A 107 0.064 4.819 -7.978 1.00 14.30 H new ATOM 0 HA THR A 107 -0.298 7.599 -8.441 1.00 11.04 H new ATOM 0 HB THR A 107 -1.385 5.849 -6.194 1.00 40.11 H new ATOM 0 HG1 THR A 107 -2.068 4.962 -8.151 1.00 32.43 H new ATOM 0 HG21 THR A 107 -3.263 7.470 -6.101 1.00 32.44 H new ATOM 0 HG22 THR A 107 -1.705 8.241 -5.716 1.00 32.44 H new ATOM 0 HG23 THR A 107 -2.445 8.479 -7.318 1.00 32.44 H new ATOM 1668 N CYS A 108 1.278 6.730 -5.630 1.00 34.23 N ATOM 1669 CA CYS A 108 2.174 7.187 -4.548 1.00 61.01 C ATOM 1670 C CYS A 108 3.507 7.710 -5.113 1.00 65.24 C ATOM 1671 O CYS A 108 4.130 8.590 -4.513 1.00 22.14 O ATOM 1672 CB CYS A 108 2.424 6.059 -3.523 1.00 22.34 C ATOM 1673 SG CYS A 108 0.932 5.512 -2.661 1.00 51.11 S ATOM 0 H CYS A 108 1.110 5.724 -5.624 1.00 34.23 H new ATOM 0 HA CYS A 108 1.678 8.011 -4.035 1.00 61.01 H new ATOM 0 HB2 CYS A 108 2.869 5.207 -4.036 1.00 22.34 H new ATOM 0 HB3 CYS A 108 3.151 6.404 -2.788 1.00 22.34 H new ATOM 0 HG CYS A 108 0.325 4.610 -3.374 1.00 51.11 H new ATOM 1679 N LYS A 109 3.928 7.159 -6.271 1.00 64.42 N ATOM 1680 CA LYS A 109 5.183 7.554 -6.934 1.00 20.45 C ATOM 1681 C LYS A 109 5.010 8.943 -7.550 1.00 3.23 C ATOM 1682 O LYS A 109 5.858 9.804 -7.369 1.00 34.13 O ATOM 1683 CB LYS A 109 5.596 6.531 -8.041 1.00 61.21 C ATOM 1684 CG LYS A 109 7.106 6.494 -8.372 1.00 64.12 C ATOM 1685 CD LYS A 109 7.971 6.040 -7.166 1.00 63.42 C ATOM 1686 CE LYS A 109 7.576 4.648 -6.625 1.00 43.42 C ATOM 1687 NZ LYS A 109 7.702 3.579 -7.649 1.00 11.43 N ATOM 0 H LYS A 109 3.410 6.434 -6.767 1.00 64.42 H new ATOM 0 HA LYS A 109 5.976 7.570 -6.186 1.00 20.45 H new ATOM 0 HB2 LYS A 109 5.285 5.535 -7.727 1.00 61.21 H new ATOM 0 HB3 LYS A 109 5.046 6.765 -8.953 1.00 61.21 H new ATOM 0 HG2 LYS A 109 7.274 5.817 -9.210 1.00 64.12 H new ATOM 0 HG3 LYS A 109 7.428 7.485 -8.693 1.00 64.12 H new ATOM 0 HD2 LYS A 109 9.019 6.023 -7.465 1.00 63.42 H new ATOM 0 HD3 LYS A 109 7.880 6.774 -6.365 1.00 63.42 H new ATOM 0 HE2 LYS A 109 8.206 4.403 -5.770 1.00 43.42 H new ATOM 0 HE3 LYS A 109 6.548 4.681 -6.264 1.00 43.42 H new ATOM 0 HZ1 LYS A 109 8.201 2.763 -7.240 1.00 11.43 H new ATOM 0 HZ2 LYS A 109 6.755 3.284 -7.962 1.00 11.43 H new ATOM 0 HZ3 LYS A 109 8.239 3.940 -8.463 1.00 11.43 H new ATOM 1701 N THR A 110 3.876 9.132 -8.262 1.00 64.12 N ATOM 1702 CA THR A 110 3.546 10.382 -8.962 1.00 43.22 C ATOM 1703 C THR A 110 3.431 11.563 -7.976 1.00 70.35 C ATOM 1704 O THR A 110 4.070 12.599 -8.180 1.00 42.23 O ATOM 1705 CB THR A 110 2.216 10.226 -9.783 1.00 60.23 C ATOM 1706 OG1 THR A 110 2.380 9.190 -10.767 1.00 51.30 O ATOM 1707 CG2 THR A 110 1.789 11.529 -10.493 1.00 74.11 C ATOM 0 H THR A 110 3.162 8.411 -8.364 1.00 64.12 H new ATOM 0 HA THR A 110 4.360 10.597 -9.654 1.00 43.22 H new ATOM 0 HB THR A 110 1.432 9.971 -9.071 1.00 60.23 H new ATOM 0 HG1 THR A 110 2.348 8.314 -10.328 1.00 51.30 H new ATOM 0 HG21 THR A 110 0.864 11.357 -11.043 1.00 74.11 H new ATOM 0 HG22 THR A 110 1.630 12.312 -9.752 1.00 74.11 H new ATOM 0 HG23 THR A 110 2.571 11.839 -11.186 1.00 74.11 H new ATOM 1715 N VAL A 111 2.646 11.373 -6.888 1.00 73.23 N ATOM 1716 CA VAL A 111 2.419 12.429 -5.875 1.00 71.23 C ATOM 1717 C VAL A 111 3.742 12.785 -5.145 1.00 31.12 C ATOM 1718 O VAL A 111 3.972 13.953 -4.796 1.00 62.20 O ATOM 1719 CB VAL A 111 1.273 12.038 -4.851 1.00 33.13 C ATOM 1720 CG1 VAL A 111 1.655 10.826 -3.977 1.00 62.44 C ATOM 1721 CG2 VAL A 111 0.837 13.245 -3.981 1.00 60.13 C ATOM 0 H VAL A 111 2.160 10.498 -6.691 1.00 73.23 H new ATOM 0 HA VAL A 111 2.074 13.319 -6.401 1.00 71.23 H new ATOM 0 HB VAL A 111 0.414 11.740 -5.452 1.00 33.13 H new ATOM 0 HG11 VAL A 111 0.837 10.599 -3.293 1.00 62.44 H new ATOM 0 HG12 VAL A 111 1.845 9.963 -4.615 1.00 62.44 H new ATOM 0 HG13 VAL A 111 2.553 11.059 -3.404 1.00 62.44 H new ATOM 0 HG21 VAL A 111 0.051 12.933 -3.294 1.00 60.13 H new ATOM 0 HG22 VAL A 111 1.692 13.611 -3.412 1.00 60.13 H new ATOM 0 HG23 VAL A 111 0.462 14.041 -4.625 1.00 60.13 H new ATOM 1731 N ALA A 112 4.617 11.768 -4.968 1.00 73.24 N ATOM 1732 CA ALA A 112 5.957 11.944 -4.384 1.00 32.23 C ATOM 1733 C ALA A 112 6.905 12.652 -5.372 1.00 42.15 C ATOM 1734 O ALA A 112 7.742 13.447 -4.962 1.00 1.11 O ATOM 1735 CB ALA A 112 6.538 10.587 -3.963 1.00 0.30 C ATOM 0 H ALA A 112 4.409 10.804 -5.228 1.00 73.24 H new ATOM 0 HA ALA A 112 5.860 12.574 -3.500 1.00 32.23 H new ATOM 0 HB1 ALA A 112 7.529 10.733 -3.533 1.00 0.30 H new ATOM 0 HB2 ALA A 112 5.885 10.126 -3.222 1.00 0.30 H new ATOM 0 HB3 ALA A 112 6.613 9.937 -4.835 1.00 0.30 H new ATOM 1741 N ASN A 113 6.744 12.359 -6.683 1.00 4.40 N ATOM 1742 CA ASN A 113 7.588 12.938 -7.759 1.00 32.23 C ATOM 1743 C ASN A 113 7.254 14.418 -8.001 1.00 4.52 C ATOM 1744 O ASN A 113 8.097 15.163 -8.505 1.00 54.40 O ATOM 1745 CB ASN A 113 7.473 12.124 -9.092 1.00 24.30 C ATOM 1746 CG ASN A 113 8.201 10.764 -9.063 1.00 1.02 C ATOM 1747 OD1 ASN A 113 9.216 10.586 -8.380 1.00 64.21 O ATOM 1748 ND2 ASN A 113 7.691 9.791 -9.811 1.00 22.23 N ATOM 0 H ASN A 113 6.029 11.717 -7.026 1.00 4.40 H new ATOM 0 HA ASN A 113 8.621 12.873 -7.417 1.00 32.23 H new ATOM 0 HB2 ASN A 113 6.419 11.955 -9.313 1.00 24.30 H new ATOM 0 HB3 ASN A 113 7.877 12.723 -9.908 1.00 24.30 H new ATOM 0 HD21 ASN A 113 8.138 8.874 -9.830 1.00 22.23 H new ATOM 0 HD22 ASN A 113 6.853 9.961 -10.366 1.00 22.23 H new ATOM 1755 N MET A 114 6.016 14.836 -7.650 1.00 4.11 N ATOM 1756 CA MET A 114 5.586 16.248 -7.769 1.00 64.10 C ATOM 1757 C MET A 114 6.418 17.149 -6.838 1.00 43.24 C ATOM 1758 O MET A 114 6.794 18.267 -7.209 1.00 62.34 O ATOM 1759 CB MET A 114 4.073 16.420 -7.454 1.00 1.24 C ATOM 1760 CG MET A 114 3.120 15.640 -8.375 1.00 13.22 C ATOM 1761 SD MET A 114 1.393 16.164 -8.224 1.00 42.14 S ATOM 1762 CE MET A 114 1.087 16.039 -6.459 1.00 72.41 C ATOM 0 H MET A 114 5.296 14.214 -7.282 1.00 4.11 H new ATOM 0 HA MET A 114 5.752 16.548 -8.804 1.00 64.10 H new ATOM 0 HB2 MET A 114 3.895 16.108 -6.425 1.00 1.24 H new ATOM 0 HB3 MET A 114 3.824 17.480 -7.513 1.00 1.24 H new ATOM 0 HG2 MET A 114 3.442 15.765 -9.409 1.00 13.22 H new ATOM 0 HG3 MET A 114 3.192 14.577 -8.145 1.00 13.22 H new ATOM 0 HE1 MET A 114 0.118 15.569 -6.290 1.00 72.41 H new ATOM 0 HE2 MET A 114 1.868 15.436 -5.996 1.00 72.41 H new ATOM 0 HE3 MET A 114 1.088 17.036 -6.018 1.00 72.41 H new ATOM 1772 N ILE A 115 6.708 16.637 -5.627 1.00 13.44 N ATOM 1773 CA ILE A 115 7.464 17.375 -4.594 1.00 14.14 C ATOM 1774 C ILE A 115 8.978 17.066 -4.680 1.00 51.11 C ATOM 1775 O ILE A 115 9.802 17.864 -4.232 1.00 60.15 O ATOM 1776 CB ILE A 115 6.905 17.056 -3.149 1.00 52.13 C ATOM 1777 CG1 ILE A 115 7.134 15.560 -2.761 1.00 53.24 C ATOM 1778 CG2 ILE A 115 5.396 17.415 -3.069 1.00 43.11 C ATOM 1779 CD1 ILE A 115 6.678 15.173 -1.364 1.00 3.43 C ATOM 0 H ILE A 115 6.426 15.701 -5.336 1.00 13.44 H new ATOM 0 HA ILE A 115 7.330 18.440 -4.782 1.00 14.14 H new ATOM 0 HB ILE A 115 7.455 17.668 -2.434 1.00 52.13 H new ATOM 0 HG12 ILE A 115 6.613 14.931 -3.483 1.00 53.24 H new ATOM 0 HG13 ILE A 115 8.197 15.337 -2.853 1.00 53.24 H new ATOM 0 HG21 ILE A 115 5.021 17.191 -2.070 1.00 43.11 H new ATOM 0 HG22 ILE A 115 5.263 18.477 -3.277 1.00 43.11 H new ATOM 0 HG23 ILE A 115 4.843 16.829 -3.803 1.00 43.11 H new ATOM 0 HD11 ILE A 115 6.882 14.116 -1.195 1.00 3.43 H new ATOM 0 HD12 ILE A 115 7.217 15.769 -0.627 1.00 3.43 H new ATOM 0 HD13 ILE A 115 5.608 15.357 -1.267 1.00 3.43 H new ATOM 1791 N ARG A 116 9.319 15.911 -5.275 1.00 55.43 N ATOM 1792 CA ARG A 116 10.713 15.449 -5.460 1.00 21.14 C ATOM 1793 C ARG A 116 11.398 16.243 -6.590 1.00 5.25 C ATOM 1794 O ARG A 116 12.517 16.749 -6.427 1.00 5.45 O ATOM 1795 CB ARG A 116 10.679 13.934 -5.797 1.00 2.32 C ATOM 1796 CG ARG A 116 12.035 13.250 -6.079 1.00 72.25 C ATOM 1797 CD ARG A 116 11.840 11.786 -6.528 1.00 73.10 C ATOM 1798 NE ARG A 116 13.102 11.133 -6.912 1.00 43.24 N ATOM 1799 CZ ARG A 116 13.212 10.111 -7.781 1.00 33.11 C ATOM 1800 NH1 ARG A 116 12.133 9.608 -8.393 1.00 62.04 N ATOM 1801 NH2 ARG A 116 14.401 9.574 -8.017 1.00 3.53 N ATOM 0 H ARG A 116 8.628 15.260 -5.648 1.00 55.43 H new ATOM 0 HA ARG A 116 11.287 15.613 -4.548 1.00 21.14 H new ATOM 0 HB2 ARG A 116 10.202 13.413 -4.967 1.00 2.32 H new ATOM 0 HB3 ARG A 116 10.041 13.795 -6.670 1.00 2.32 H new ATOM 0 HG2 ARG A 116 12.570 13.802 -6.852 1.00 72.25 H new ATOM 0 HG3 ARG A 116 12.653 13.279 -5.182 1.00 72.25 H new ATOM 0 HD2 ARG A 116 11.376 11.222 -5.719 1.00 73.10 H new ATOM 0 HD3 ARG A 116 11.151 11.759 -7.372 1.00 73.10 H new ATOM 0 HE ARG A 116 13.961 11.482 -6.486 1.00 43.24 H new ATOM 0 HH11 ARG A 116 11.210 9.999 -8.203 1.00 62.04 H new ATOM 0 HH12 ARG A 116 12.233 8.833 -9.049 1.00 62.04 H new ATOM 0 HH21 ARG A 116 15.227 9.935 -7.541 1.00 3.53 H new ATOM 0 HH22 ARG A 116 14.489 8.799 -8.675 1.00 3.53 H new ATOM 1815 N GLY A 117 10.694 16.351 -7.727 1.00 32.00 N ATOM 1816 CA GLY A 117 11.206 17.004 -8.931 1.00 30.23 C ATOM 1817 C GLY A 117 10.214 18.049 -9.442 1.00 22.24 C ATOM 1818 O GLY A 117 10.346 19.239 -9.082 1.00 4.22 O ATOM 1819 OXT GLY A 117 9.267 17.676 -10.171 1.00 38.08 O ATOM 0 H GLY A 117 9.748 15.984 -7.833 1.00 32.00 H new ATOM 0 HA2 GLY A 117 12.163 17.479 -8.714 1.00 30.23 H new ATOM 0 HA3 GLY A 117 11.388 16.259 -9.705 1.00 30.23 H new TER 1823 GLY A 117 ATOM 1824 N SER B 2 15.248 -14.289 17.654 1.00 42.11 N ATOM 1825 CA SER B 2 16.541 -14.006 17.000 1.00 14.34 C ATOM 1826 C SER B 2 16.460 -12.706 16.181 1.00 75.30 C ATOM 1827 O SER B 2 15.434 -12.435 15.548 1.00 50.14 O ATOM 1828 CB SER B 2 16.945 -15.198 16.115 1.00 72.24 C ATOM 1829 OG SER B 2 16.948 -16.404 16.866 1.00 23.10 O ATOM 0 HA SER B 2 17.306 -13.866 17.764 1.00 14.34 H new ATOM 0 HB2 SER B 2 16.252 -15.287 15.278 1.00 72.24 H new ATOM 0 HB3 SER B 2 17.935 -15.025 15.693 1.00 72.24 H new ATOM 0 HG SER B 2 16.247 -16.365 17.550 1.00 23.10 H new ATOM 1837 N LEU B 3 17.546 -11.913 16.205 1.00 32.34 N ATOM 1838 CA LEU B 3 17.627 -10.626 15.495 1.00 41.03 C ATOM 1839 C LEU B 3 18.203 -10.820 14.080 1.00 54.32 C ATOM 1840 O LEU B 3 19.309 -11.337 13.931 1.00 61.43 O ATOM 1841 CB LEU B 3 18.522 -9.636 16.292 1.00 21.54 C ATOM 1842 CG LEU B 3 18.101 -9.367 17.767 1.00 31.50 C ATOM 1843 CD1 LEU B 3 19.137 -8.478 18.477 1.00 22.24 C ATOM 1844 CD2 LEU B 3 16.687 -8.756 17.847 1.00 33.41 C ATOM 0 H LEU B 3 18.395 -12.149 16.720 1.00 32.34 H new ATOM 0 HA LEU B 3 16.620 -10.217 15.409 1.00 41.03 H new ATOM 0 HB2 LEU B 3 19.542 -10.019 16.291 1.00 21.54 H new ATOM 0 HB3 LEU B 3 18.538 -8.684 15.761 1.00 21.54 H new ATOM 0 HG LEU B 3 18.069 -10.325 18.286 1.00 31.50 H new ATOM 0 HD11 LEU B 3 18.822 -8.303 19.506 1.00 22.24 H new ATOM 0 HD12 LEU B 3 20.107 -8.976 18.474 1.00 22.24 H new ATOM 0 HD13 LEU B 3 19.217 -7.524 17.955 1.00 22.24 H new ATOM 0 HD21 LEU B 3 16.425 -8.581 18.890 1.00 33.41 H new ATOM 0 HD22 LEU B 3 16.668 -7.811 17.305 1.00 33.41 H new ATOM 0 HD23 LEU B 3 15.968 -9.444 17.403 1.00 33.41 H new ATOM 1856 N VAL B 4 17.436 -10.444 13.049 1.00 52.34 N ATOM 1857 CA VAL B 4 17.953 -10.307 11.673 1.00 41.40 C ATOM 1858 C VAL B 4 18.441 -8.859 11.464 1.00 53.43 C ATOM 1859 O VAL B 4 17.758 -7.901 11.847 1.00 15.25 O ATOM 1860 CB VAL B 4 16.880 -10.709 10.581 1.00 4.33 C ATOM 1861 CG1 VAL B 4 16.574 -12.225 10.651 1.00 62.41 C ATOM 1862 CG2 VAL B 4 15.576 -9.874 10.704 1.00 22.13 C ATOM 0 H VAL B 4 16.444 -10.226 13.140 1.00 52.34 H new ATOM 0 HA VAL B 4 18.785 -11.000 11.548 1.00 41.40 H new ATOM 0 HB VAL B 4 17.311 -10.484 9.605 1.00 4.33 H new ATOM 0 HG11 VAL B 4 15.834 -12.482 9.893 1.00 62.41 H new ATOM 0 HG12 VAL B 4 17.489 -12.790 10.472 1.00 62.41 H new ATOM 0 HG13 VAL B 4 16.183 -12.472 11.638 1.00 62.41 H new ATOM 0 HG21 VAL B 4 14.870 -10.186 9.934 1.00 22.13 H new ATOM 0 HG22 VAL B 4 15.134 -10.033 11.687 1.00 22.13 H new ATOM 0 HG23 VAL B 4 15.808 -8.817 10.577 1.00 22.13 H new ATOM 1872 N LYS B 5 19.654 -8.716 10.911 1.00 4.42 N ATOM 1873 CA LYS B 5 20.273 -7.403 10.665 1.00 71.32 C ATOM 1874 C LYS B 5 19.738 -6.852 9.334 1.00 14.54 C ATOM 1875 O LYS B 5 19.898 -7.497 8.295 1.00 14.31 O ATOM 1876 CB LYS B 5 21.821 -7.532 10.607 1.00 13.22 C ATOM 1877 CG LYS B 5 22.466 -8.355 11.744 1.00 44.41 C ATOM 1878 CD LYS B 5 24.011 -8.431 11.626 1.00 30.30 C ATOM 1879 CE LYS B 5 24.648 -9.413 12.619 1.00 2.24 C ATOM 1880 NZ LYS B 5 24.395 -9.052 14.037 1.00 30.42 N ATOM 0 H LYS B 5 20.233 -9.504 10.622 1.00 4.42 H new ATOM 0 HA LYS B 5 20.022 -6.722 11.478 1.00 71.32 H new ATOM 0 HB2 LYS B 5 22.094 -7.986 9.654 1.00 13.22 H new ATOM 0 HB3 LYS B 5 22.252 -6.531 10.618 1.00 13.22 H new ATOM 0 HG2 LYS B 5 22.200 -7.912 12.704 1.00 44.41 H new ATOM 0 HG3 LYS B 5 22.055 -9.364 11.735 1.00 44.41 H new ATOM 0 HD2 LYS B 5 24.277 -8.727 10.611 1.00 30.30 H new ATOM 0 HD3 LYS B 5 24.430 -7.438 11.788 1.00 30.30 H new ATOM 0 HE2 LYS B 5 24.260 -10.414 12.430 1.00 2.24 H new ATOM 0 HE3 LYS B 5 25.724 -9.450 12.446 1.00 2.24 H new ATOM 0 HZ1 LYS B 5 25.277 -9.140 14.580 1.00 30.42 H new ATOM 0 HZ2 LYS B 5 24.052 -8.072 14.090 1.00 30.42 H new ATOM 0 HZ3 LYS B 5 23.678 -9.692 14.435 1.00 30.42 H new ATOM 1894 N LEU B 6 19.077 -5.688 9.378 1.00 2.53 N ATOM 1895 CA LEU B 6 18.490 -5.047 8.185 1.00 32.52 C ATOM 1896 C LEU B 6 19.103 -3.659 7.991 1.00 31.31 C ATOM 1897 O LEU B 6 18.773 -2.719 8.719 1.00 72.10 O ATOM 1898 CB LEU B 6 16.943 -4.963 8.325 1.00 3.31 C ATOM 1899 CG LEU B 6 16.202 -6.333 8.433 1.00 52.14 C ATOM 1900 CD1 LEU B 6 14.690 -6.133 8.615 1.00 61.34 C ATOM 1901 CD2 LEU B 6 16.505 -7.245 7.218 1.00 72.33 C ATOM 0 H LEU B 6 18.932 -5.161 10.239 1.00 2.53 H new ATOM 0 HA LEU B 6 18.714 -5.649 7.304 1.00 32.52 H new ATOM 0 HB2 LEU B 6 16.707 -4.372 9.210 1.00 3.31 H new ATOM 0 HB3 LEU B 6 16.547 -4.422 7.465 1.00 3.31 H new ATOM 0 HG LEU B 6 16.581 -6.839 9.321 1.00 52.14 H new ATOM 0 HD11 LEU B 6 14.201 -7.104 8.687 1.00 61.34 H new ATOM 0 HD12 LEU B 6 14.505 -5.565 9.527 1.00 61.34 H new ATOM 0 HD13 LEU B 6 14.290 -5.588 7.760 1.00 61.34 H new ATOM 0 HD21 LEU B 6 15.971 -8.189 7.330 1.00 72.33 H new ATOM 0 HD22 LEU B 6 16.181 -6.751 6.302 1.00 72.33 H new ATOM 0 HD23 LEU B 6 17.577 -7.438 7.166 1.00 72.33 H new ATOM 1913 N GLU B 7 20.025 -3.551 7.028 1.00 22.44 N ATOM 1914 CA GLU B 7 20.691 -2.286 6.703 1.00 0.21 C ATOM 1915 C GLU B 7 19.808 -1.441 5.786 1.00 31.53 C ATOM 1916 O GLU B 7 18.958 -1.956 5.065 1.00 21.23 O ATOM 1917 CB GLU B 7 22.086 -2.516 6.053 1.00 0.54 C ATOM 1918 CG GLU B 7 23.126 -3.184 6.971 1.00 62.11 C ATOM 1919 CD GLU B 7 22.791 -4.649 7.274 1.00 30.42 C ATOM 1920 OE1 GLU B 7 22.838 -5.467 6.328 1.00 1.45 O ATOM 1921 OE2 GLU B 7 22.483 -4.987 8.440 1.00 52.42 O ATOM 0 H GLU B 7 20.330 -4.337 6.453 1.00 22.44 H new ATOM 0 HA GLU B 7 20.850 -1.749 7.638 1.00 0.21 H new ATOM 0 HB2 GLU B 7 21.959 -3.132 5.163 1.00 0.54 H new ATOM 0 HB3 GLU B 7 22.479 -1.555 5.722 1.00 0.54 H new ATOM 0 HG2 GLU B 7 24.108 -3.129 6.501 1.00 62.11 H new ATOM 0 HG3 GLU B 7 23.189 -2.629 7.907 1.00 62.11 H new ATOM 1928 N SER B 8 20.024 -0.140 5.849 1.00 44.21 N ATOM 1929 CA SER B 8 19.327 0.851 5.029 1.00 50.01 C ATOM 1930 C SER B 8 20.106 1.141 3.736 1.00 54.32 C ATOM 1931 O SER B 8 21.109 0.476 3.439 1.00 64.03 O ATOM 1932 CB SER B 8 19.173 2.118 5.880 1.00 0.02 C ATOM 1933 OG SER B 8 20.416 2.490 6.471 1.00 31.44 O ATOM 0 H SER B 8 20.705 0.274 6.486 1.00 44.21 H new ATOM 0 HA SER B 8 18.349 0.477 4.725 1.00 50.01 H new ATOM 0 HB2 SER B 8 18.802 2.934 5.260 1.00 0.02 H new ATOM 0 HB3 SER B 8 18.431 1.948 6.661 1.00 0.02 H new ATOM 0 HG SER B 8 20.505 2.057 7.346 1.00 31.44 H new ATOM 1939 N SER B 9 19.607 2.120 2.966 1.00 24.14 N ATOM 1940 CA SER B 9 20.339 2.720 1.839 1.00 4.01 C ATOM 1941 C SER B 9 21.606 3.445 2.361 1.00 21.00 C ATOM 1942 O SER B 9 22.629 3.508 1.673 1.00 2.30 O ATOM 1943 CB SER B 9 19.408 3.694 1.085 1.00 44.35 C ATOM 1944 OG SER B 9 18.908 4.699 1.948 1.00 73.33 O ATOM 0 H SER B 9 18.680 2.520 3.108 1.00 24.14 H new ATOM 0 HA SER B 9 20.658 1.941 1.147 1.00 4.01 H new ATOM 0 HB2 SER B 9 19.952 4.156 0.261 1.00 44.35 H new ATOM 0 HB3 SER B 9 18.577 3.141 0.647 1.00 44.35 H new ATOM 0 HG SER B 9 18.323 5.302 1.444 1.00 73.33 H new ATOM 1950 N ASP B 10 21.508 3.974 3.605 1.00 15.22 N ATOM 1951 CA ASP B 10 22.637 4.580 4.356 1.00 73.10 C ATOM 1952 C ASP B 10 23.569 3.497 4.961 1.00 24.54 C ATOM 1953 O ASP B 10 24.565 3.840 5.612 1.00 0.52 O ATOM 1954 CB ASP B 10 22.088 5.471 5.505 1.00 15.12 C ATOM 1955 CG ASP B 10 21.257 6.677 5.024 1.00 24.13 C ATOM 1956 OD1 ASP B 10 21.747 7.826 5.101 1.00 24.13 O ATOM 1957 OD2 ASP B 10 20.107 6.475 4.580 1.00 2.43 O ATOM 0 H ASP B 10 20.630 3.992 4.123 1.00 15.22 H new ATOM 0 HA ASP B 10 23.215 5.180 3.653 1.00 73.10 H new ATOM 0 HB2 ASP B 10 21.472 4.858 6.163 1.00 15.12 H new ATOM 0 HB3 ASP B 10 22.926 5.835 6.100 1.00 15.12 H new ATOM 1962 N GLU B 11 23.201 2.204 4.773 1.00 22.22 N ATOM 1963 CA GLU B 11 23.972 1.017 5.228 1.00 74.11 C ATOM 1964 C GLU B 11 24.034 0.882 6.767 1.00 62.53 C ATOM 1965 O GLU B 11 24.804 0.060 7.283 1.00 12.41 O ATOM 1966 CB GLU B 11 25.405 0.989 4.604 1.00 32.31 C ATOM 1967 CG GLU B 11 25.437 0.864 3.064 1.00 13.33 C ATOM 1968 CD GLU B 11 26.869 0.878 2.491 1.00 24.24 C ATOM 1969 OE1 GLU B 11 27.371 1.972 2.149 1.00 74.51 O ATOM 1970 OE2 GLU B 11 27.505 -0.195 2.401 1.00 60.02 O ATOM 0 H GLU B 11 22.339 1.951 4.289 1.00 22.22 H new ATOM 0 HA GLU B 11 23.423 0.148 4.864 1.00 74.11 H new ATOM 0 HB2 GLU B 11 25.930 1.900 4.892 1.00 32.31 H new ATOM 0 HB3 GLU B 11 25.957 0.154 5.034 1.00 32.31 H new ATOM 0 HG2 GLU B 11 24.942 -0.061 2.769 1.00 13.33 H new ATOM 0 HG3 GLU B 11 24.868 1.684 2.626 1.00 13.33 H new ATOM 1977 N LYS B 12 23.206 1.662 7.493 1.00 14.05 N ATOM 1978 CA LYS B 12 23.133 1.582 8.963 1.00 30.12 C ATOM 1979 C LYS B 12 22.390 0.300 9.371 1.00 1.33 C ATOM 1980 O LYS B 12 21.291 0.043 8.872 1.00 43.41 O ATOM 1981 CB LYS B 12 22.435 2.827 9.580 1.00 22.45 C ATOM 1982 CG LYS B 12 23.141 4.178 9.300 1.00 32.42 C ATOM 1983 CD LYS B 12 22.593 5.331 10.186 1.00 22.24 C ATOM 1984 CE LYS B 12 23.170 6.713 9.818 1.00 43.44 C ATOM 1985 NZ LYS B 12 22.811 7.120 8.432 1.00 75.52 N ATOM 0 H LYS B 12 22.579 2.354 7.083 1.00 14.05 H new ATOM 0 HA LYS B 12 24.152 1.558 9.350 1.00 30.12 H new ATOM 0 HB2 LYS B 12 21.416 2.880 9.198 1.00 22.45 H new ATOM 0 HB3 LYS B 12 22.364 2.688 10.659 1.00 22.45 H new ATOM 0 HG2 LYS B 12 24.211 4.068 9.474 1.00 32.42 H new ATOM 0 HG3 LYS B 12 23.014 4.440 8.250 1.00 32.42 H new ATOM 0 HD2 LYS B 12 21.507 5.363 10.097 1.00 22.24 H new ATOM 0 HD3 LYS B 12 22.821 5.117 11.230 1.00 22.24 H new ATOM 0 HE2 LYS B 12 22.800 7.459 10.521 1.00 43.44 H new ATOM 0 HE3 LYS B 12 24.255 6.691 9.919 1.00 43.44 H new ATOM 0 HZ1 LYS B 12 22.796 8.158 8.368 1.00 75.52 H new ATOM 0 HZ2 LYS B 12 23.515 6.742 7.766 1.00 75.52 H new ATOM 0 HZ3 LYS B 12 21.871 6.745 8.193 1.00 75.52 H new ATOM 1999 N VAL B 13 23.016 -0.480 10.266 1.00 52.03 N ATOM 2000 CA VAL B 13 22.516 -1.787 10.718 1.00 3.10 C ATOM 2001 C VAL B 13 21.335 -1.609 11.687 1.00 23.33 C ATOM 2002 O VAL B 13 21.490 -0.997 12.752 1.00 64.43 O ATOM 2003 CB VAL B 13 23.662 -2.601 11.437 1.00 0.34 C ATOM 2004 CG1 VAL B 13 23.177 -4.008 11.878 1.00 34.43 C ATOM 2005 CG2 VAL B 13 24.922 -2.687 10.541 1.00 1.40 C ATOM 0 H VAL B 13 23.899 -0.215 10.703 1.00 52.03 H new ATOM 0 HA VAL B 13 22.180 -2.339 9.840 1.00 3.10 H new ATOM 0 HB VAL B 13 23.934 -2.061 12.344 1.00 0.34 H new ATOM 0 HG11 VAL B 13 23.994 -4.537 12.369 1.00 34.43 H new ATOM 0 HG12 VAL B 13 22.343 -3.904 12.572 1.00 34.43 H new ATOM 0 HG13 VAL B 13 22.853 -4.572 11.003 1.00 34.43 H new ATOM 0 HG21 VAL B 13 25.698 -3.252 11.057 1.00 1.40 H new ATOM 0 HG22 VAL B 13 24.670 -3.187 9.606 1.00 1.40 H new ATOM 0 HG23 VAL B 13 25.286 -1.682 10.328 1.00 1.40 H new ATOM 2015 N PHE B 14 20.158 -2.120 11.306 1.00 62.55 N ATOM 2016 CA PHE B 14 18.969 -2.136 12.168 1.00 31.21 C ATOM 2017 C PHE B 14 18.582 -3.584 12.450 1.00 21.44 C ATOM 2018 O PHE B 14 17.822 -4.204 11.693 1.00 63.41 O ATOM 2019 CB PHE B 14 17.798 -1.354 11.518 1.00 55.04 C ATOM 2020 CG PHE B 14 18.112 0.114 11.293 1.00 53.21 C ATOM 2021 CD1 PHE B 14 18.376 0.615 10.021 1.00 35.33 C ATOM 2022 CD2 PHE B 14 18.160 0.991 12.370 1.00 53.42 C ATOM 2023 CE1 PHE B 14 18.689 1.939 9.841 1.00 72.42 C ATOM 2024 CE2 PHE B 14 18.470 2.316 12.188 1.00 24.12 C ATOM 2025 CZ PHE B 14 18.729 2.792 10.926 1.00 4.10 C ATOM 0 H PHE B 14 20.003 -2.536 10.388 1.00 62.55 H new ATOM 0 HA PHE B 14 19.198 -1.638 13.110 1.00 31.21 H new ATOM 0 HB2 PHE B 14 17.547 -1.816 10.563 1.00 55.04 H new ATOM 0 HB3 PHE B 14 16.917 -1.437 12.154 1.00 55.04 H new ATOM 0 HD1 PHE B 14 18.334 -0.045 9.167 1.00 35.33 H new ATOM 0 HD2 PHE B 14 17.950 0.625 13.364 1.00 53.42 H new ATOM 0 HE1 PHE B 14 18.904 2.314 8.851 1.00 72.42 H new ATOM 0 HE2 PHE B 14 18.510 2.983 13.036 1.00 24.12 H new ATOM 0 HZ PHE B 14 18.965 3.836 10.782 1.00 4.10 H new ATOM 2035 N GLU B 15 19.187 -4.134 13.515 1.00 54.32 N ATOM 2036 CA GLU B 15 18.838 -5.459 14.032 1.00 72.11 C ATOM 2037 C GLU B 15 17.420 -5.406 14.617 1.00 73.41 C ATOM 2038 O GLU B 15 17.102 -4.519 15.418 1.00 54.53 O ATOM 2039 CB GLU B 15 19.851 -5.908 15.112 1.00 21.34 C ATOM 2040 CG GLU B 15 21.301 -6.061 14.592 1.00 3.11 C ATOM 2041 CD GLU B 15 22.338 -6.468 15.661 1.00 63.42 C ATOM 2042 OE1 GLU B 15 22.016 -6.461 16.871 1.00 75.22 O ATOM 2043 OE2 GLU B 15 23.490 -6.772 15.286 1.00 32.11 O ATOM 0 H GLU B 15 19.930 -3.671 14.038 1.00 54.32 H new ATOM 0 HA GLU B 15 18.873 -6.185 13.220 1.00 72.11 H new ATOM 0 HB2 GLU B 15 19.843 -5.184 15.926 1.00 21.34 H new ATOM 0 HB3 GLU B 15 19.523 -6.860 15.529 1.00 21.34 H new ATOM 0 HG2 GLU B 15 21.309 -6.807 13.797 1.00 3.11 H new ATOM 0 HG3 GLU B 15 21.613 -5.116 14.146 1.00 3.11 H new ATOM 2050 N ILE B 16 16.583 -6.334 14.177 1.00 3.13 N ATOM 2051 CA ILE B 16 15.184 -6.456 14.613 1.00 33.43 C ATOM 2052 C ILE B 16 14.839 -7.943 14.704 1.00 74.24 C ATOM 2053 O ILE B 16 15.403 -8.751 13.958 1.00 63.20 O ATOM 2054 CB ILE B 16 14.210 -5.721 13.609 1.00 0.23 C ATOM 2055 CG1 ILE B 16 12.722 -5.802 14.089 1.00 22.22 C ATOM 2056 CG2 ILE B 16 14.374 -6.259 12.168 1.00 11.50 C ATOM 2057 CD1 ILE B 16 11.711 -5.152 13.158 1.00 13.20 C ATOM 0 H ILE B 16 16.854 -7.041 13.494 1.00 3.13 H new ATOM 0 HA ILE B 16 15.062 -5.982 15.587 1.00 33.43 H new ATOM 0 HB ILE B 16 14.488 -4.667 13.596 1.00 0.23 H new ATOM 0 HG12 ILE B 16 12.454 -6.851 14.217 1.00 22.22 H new ATOM 0 HG13 ILE B 16 12.646 -5.331 15.069 1.00 22.22 H new ATOM 0 HG21 ILE B 16 13.690 -5.732 11.503 1.00 11.50 H new ATOM 0 HG22 ILE B 16 15.399 -6.099 11.834 1.00 11.50 H new ATOM 0 HG23 ILE B 16 14.149 -7.325 12.150 1.00 11.50 H new ATOM 0 HD11 ILE B 16 10.710 -5.260 13.576 1.00 13.20 H new ATOM 0 HD12 ILE B 16 11.946 -4.093 13.048 1.00 13.20 H new ATOM 0 HD13 ILE B 16 11.751 -5.636 12.182 1.00 13.20 H new ATOM 2069 N GLU B 17 13.932 -8.302 15.630 1.00 13.31 N ATOM 2070 CA GLU B 17 13.446 -9.680 15.768 1.00 13.24 C ATOM 2071 C GLU B 17 12.792 -10.141 14.449 1.00 4.02 C ATOM 2072 O GLU B 17 11.984 -9.410 13.858 1.00 2.25 O ATOM 2073 CB GLU B 17 12.454 -9.794 16.943 1.00 33.03 C ATOM 2074 CG GLU B 17 13.021 -9.389 18.315 1.00 40.12 C ATOM 2075 CD GLU B 17 12.014 -9.607 19.455 1.00 62.33 C ATOM 2076 OE1 GLU B 17 11.327 -8.650 19.852 1.00 70.42 O ATOM 2077 OE2 GLU B 17 11.897 -10.744 19.952 1.00 2.52 O ATOM 0 H GLU B 17 13.520 -7.649 16.297 1.00 13.31 H new ATOM 0 HA GLU B 17 14.293 -10.331 15.983 1.00 13.24 H new ATOM 0 HB2 GLU B 17 11.586 -9.171 16.727 1.00 33.03 H new ATOM 0 HB3 GLU B 17 12.101 -10.824 17.002 1.00 33.03 H new ATOM 0 HG2 GLU B 17 13.923 -9.966 18.516 1.00 40.12 H new ATOM 0 HG3 GLU B 17 13.313 -8.339 18.288 1.00 40.12 H new ATOM 2084 N LYS B 18 13.167 -11.348 14.011 1.00 13.30 N ATOM 2085 CA LYS B 18 12.763 -11.925 12.718 1.00 10.03 C ATOM 2086 C LYS B 18 11.238 -12.078 12.625 1.00 62.24 C ATOM 2087 O LYS B 18 10.637 -11.764 11.593 1.00 61.22 O ATOM 2088 CB LYS B 18 13.469 -13.289 12.541 1.00 73.44 C ATOM 2089 CG LYS B 18 13.114 -14.053 11.244 1.00 54.50 C ATOM 2090 CD LYS B 18 13.870 -15.399 11.135 1.00 62.54 C ATOM 2091 CE LYS B 18 13.641 -16.314 12.352 1.00 51.51 C ATOM 2092 NZ LYS B 18 14.371 -17.601 12.235 1.00 13.34 N ATOM 0 H LYS B 18 13.771 -11.965 14.554 1.00 13.30 H new ATOM 0 HA LYS B 18 13.062 -11.251 11.915 1.00 10.03 H new ATOM 0 HB2 LYS B 18 14.547 -13.128 12.565 1.00 73.44 H new ATOM 0 HB3 LYS B 18 13.222 -13.921 13.394 1.00 73.44 H new ATOM 0 HG2 LYS B 18 12.040 -14.238 11.215 1.00 54.50 H new ATOM 0 HG3 LYS B 18 13.354 -13.432 10.381 1.00 54.50 H new ATOM 0 HD2 LYS B 18 13.550 -15.918 10.231 1.00 62.54 H new ATOM 0 HD3 LYS B 18 14.937 -15.203 11.029 1.00 62.54 H new ATOM 0 HE2 LYS B 18 13.962 -15.798 13.257 1.00 51.51 H new ATOM 0 HE3 LYS B 18 12.575 -16.512 12.459 1.00 51.51 H new ATOM 0 HZ1 LYS B 18 14.255 -18.147 13.113 1.00 13.34 H new ATOM 0 HZ2 LYS B 18 13.989 -18.145 11.436 1.00 13.34 H new ATOM 0 HZ3 LYS B 18 15.381 -17.414 12.075 1.00 13.34 H new ATOM 2106 N GLU B 19 10.638 -12.528 13.736 1.00 64.33 N ATOM 2107 CA GLU B 19 9.174 -12.686 13.875 1.00 53.44 C ATOM 2108 C GLU B 19 8.427 -11.341 13.720 1.00 51.21 C ATOM 2109 O GLU B 19 7.281 -11.318 13.267 1.00 10.24 O ATOM 2110 CB GLU B 19 8.814 -13.350 15.237 1.00 12.14 C ATOM 2111 CG GLU B 19 9.528 -12.758 16.490 1.00 4.45 C ATOM 2112 CD GLU B 19 10.849 -13.489 16.845 1.00 14.33 C ATOM 2113 OE1 GLU B 19 10.785 -14.533 17.530 1.00 63.02 O ATOM 2114 OE2 GLU B 19 11.945 -13.053 16.417 1.00 70.14 O ATOM 0 H GLU B 19 11.155 -12.796 14.573 1.00 64.33 H new ATOM 0 HA GLU B 19 8.847 -13.340 13.067 1.00 53.44 H new ATOM 0 HB2 GLU B 19 7.737 -13.271 15.385 1.00 12.14 H new ATOM 0 HB3 GLU B 19 9.050 -14.412 15.176 1.00 12.14 H new ATOM 0 HG2 GLU B 19 9.740 -11.703 16.314 1.00 4.45 H new ATOM 0 HG3 GLU B 19 8.852 -12.809 17.343 1.00 4.45 H new ATOM 2121 N ILE B 20 9.079 -10.231 14.110 1.00 45.44 N ATOM 2122 CA ILE B 20 8.533 -8.873 13.916 1.00 42.21 C ATOM 2123 C ILE B 20 8.676 -8.461 12.428 1.00 45.25 C ATOM 2124 O ILE B 20 7.766 -7.875 11.837 1.00 64.45 O ATOM 2125 CB ILE B 20 9.260 -7.819 14.838 1.00 72.23 C ATOM 2126 CG1 ILE B 20 9.162 -8.212 16.346 1.00 22.33 C ATOM 2127 CG2 ILE B 20 8.701 -6.406 14.606 1.00 74.42 C ATOM 2128 CD1 ILE B 20 9.764 -7.203 17.322 1.00 22.21 C ATOM 0 H ILE B 20 9.992 -10.248 14.565 1.00 45.44 H new ATOM 0 HA ILE B 20 7.479 -8.889 14.194 1.00 42.21 H new ATOM 0 HB ILE B 20 10.315 -7.818 14.564 1.00 72.23 H new ATOM 0 HG12 ILE B 20 8.112 -8.357 16.600 1.00 22.33 H new ATOM 0 HG13 ILE B 20 9.659 -9.172 16.488 1.00 22.33 H new ATOM 0 HG21 ILE B 20 9.219 -5.699 15.254 1.00 74.42 H new ATOM 0 HG22 ILE B 20 8.851 -6.122 13.565 1.00 74.42 H new ATOM 0 HG23 ILE B 20 7.635 -6.394 14.835 1.00 74.42 H new ATOM 0 HD11 ILE B 20 9.645 -7.568 18.342 1.00 22.21 H new ATOM 0 HD12 ILE B 20 10.824 -7.074 17.104 1.00 22.21 H new ATOM 0 HD13 ILE B 20 9.253 -6.246 17.217 1.00 22.21 H new ATOM 2140 N ALA B 21 9.837 -8.806 11.841 1.00 14.00 N ATOM 2141 CA ALA B 21 10.173 -8.496 10.436 1.00 45.23 C ATOM 2142 C ALA B 21 9.361 -9.352 9.437 1.00 1.32 C ATOM 2143 O ALA B 21 9.301 -9.028 8.253 1.00 52.24 O ATOM 2144 CB ALA B 21 11.685 -8.676 10.221 1.00 52.14 C ATOM 0 H ALA B 21 10.575 -9.312 12.331 1.00 14.00 H new ATOM 0 HA ALA B 21 9.901 -7.458 10.242 1.00 45.23 H new ATOM 0 HB1 ALA B 21 11.935 -8.448 9.185 1.00 52.14 H new ATOM 0 HB2 ALA B 21 12.229 -8.002 10.883 1.00 52.14 H new ATOM 0 HB3 ALA B 21 11.964 -9.706 10.443 1.00 52.14 H new ATOM 2150 N CYS B 22 8.751 -10.454 9.923 1.00 22.24 N ATOM 2151 CA CYS B 22 7.872 -11.324 9.112 1.00 34.35 C ATOM 2152 C CYS B 22 6.500 -10.674 8.835 1.00 23.10 C ATOM 2153 O CYS B 22 5.808 -11.076 7.894 1.00 44.24 O ATOM 2154 CB CYS B 22 7.709 -12.694 9.795 1.00 4.10 C ATOM 2155 SG CYS B 22 9.241 -13.652 9.870 1.00 22.41 S ATOM 0 H CYS B 22 8.854 -10.766 10.889 1.00 22.24 H new ATOM 0 HA CYS B 22 8.350 -11.467 8.143 1.00 34.35 H new ATOM 0 HB2 CYS B 22 7.334 -12.544 10.807 1.00 4.10 H new ATOM 0 HB3 CYS B 22 6.955 -13.271 9.259 1.00 4.10 H new ATOM 0 HG CYS B 22 10.093 -13.048 10.644 1.00 22.41 H new ATOM 2161 N MET B 23 6.096 -9.693 9.683 1.00 32.25 N ATOM 2162 CA MET B 23 4.854 -8.897 9.464 1.00 53.33 C ATOM 2163 C MET B 23 4.983 -8.053 8.179 1.00 2.04 C ATOM 2164 O MET B 23 3.988 -7.729 7.512 1.00 2.11 O ATOM 2165 CB MET B 23 4.549 -7.980 10.679 1.00 62.31 C ATOM 2166 CG MET B 23 4.592 -8.675 12.049 1.00 10.15 C ATOM 2167 SD MET B 23 3.903 -7.674 13.388 1.00 33.41 S ATOM 2168 CE MET B 23 4.642 -6.064 13.105 1.00 44.55 C ATOM 0 H MET B 23 6.610 -9.432 10.525 1.00 32.25 H new ATOM 0 HA MET B 23 4.023 -9.594 9.353 1.00 53.33 H new ATOM 0 HB2 MET B 23 5.266 -7.159 10.683 1.00 62.31 H new ATOM 0 HB3 MET B 23 3.561 -7.540 10.543 1.00 62.31 H new ATOM 0 HG2 MET B 23 4.042 -9.614 11.988 1.00 10.15 H new ATOM 0 HG3 MET B 23 5.626 -8.925 12.288 1.00 10.15 H new ATOM 0 HE1 MET B 23 4.394 -5.399 13.932 1.00 44.55 H new ATOM 0 HE2 MET B 23 5.725 -6.168 13.035 1.00 44.55 H new ATOM 0 HE3 MET B 23 4.257 -5.645 12.175 1.00 44.55 H new ATOM 2178 N SER B 24 6.236 -7.688 7.871 1.00 23.41 N ATOM 2179 CA SER B 24 6.627 -7.172 6.565 1.00 61.41 C ATOM 2180 C SER B 24 6.594 -8.336 5.565 1.00 34.02 C ATOM 2181 O SER B 24 7.409 -9.263 5.674 1.00 75.44 O ATOM 2182 CB SER B 24 8.044 -6.565 6.645 1.00 61.41 C ATOM 2183 OG SER B 24 8.497 -6.112 5.385 1.00 72.30 O ATOM 0 H SER B 24 7.009 -7.746 8.533 1.00 23.41 H new ATOM 0 HA SER B 24 5.942 -6.388 6.242 1.00 61.41 H new ATOM 0 HB2 SER B 24 8.043 -5.734 7.350 1.00 61.41 H new ATOM 0 HB3 SER B 24 8.737 -7.312 7.033 1.00 61.41 H new ATOM 0 HG SER B 24 7.740 -5.758 4.873 1.00 72.30 H new ATOM 2189 N VAL B 25 5.629 -8.304 4.623 1.00 12.30 N ATOM 2190 CA VAL B 25 5.427 -9.400 3.657 1.00 23.22 C ATOM 2191 C VAL B 25 6.637 -9.513 2.706 1.00 54.30 C ATOM 2192 O VAL B 25 7.019 -10.617 2.349 1.00 32.13 O ATOM 2193 CB VAL B 25 4.083 -9.242 2.837 1.00 53.13 C ATOM 2194 CG1 VAL B 25 3.832 -10.439 1.879 1.00 35.44 C ATOM 2195 CG2 VAL B 25 2.875 -9.021 3.788 1.00 44.43 C ATOM 0 H VAL B 25 4.976 -7.528 4.512 1.00 12.30 H new ATOM 0 HA VAL B 25 5.341 -10.322 4.232 1.00 23.22 H new ATOM 0 HB VAL B 25 4.192 -8.356 2.212 1.00 53.13 H new ATOM 0 HG11 VAL B 25 2.898 -10.283 1.339 1.00 35.44 H new ATOM 0 HG12 VAL B 25 4.654 -10.514 1.167 1.00 35.44 H new ATOM 0 HG13 VAL B 25 3.768 -11.361 2.457 1.00 35.44 H new ATOM 0 HG21 VAL B 25 1.963 -8.915 3.200 1.00 44.43 H new ATOM 0 HG22 VAL B 25 2.778 -9.876 4.457 1.00 44.43 H new ATOM 0 HG23 VAL B 25 3.035 -8.117 4.375 1.00 44.43 H new ATOM 2205 N THR B 26 7.261 -8.360 2.353 1.00 11.31 N ATOM 2206 CA THR B 26 8.460 -8.324 1.479 1.00 61.21 C ATOM 2207 C THR B 26 9.657 -9.055 2.131 1.00 30.23 C ATOM 2208 O THR B 26 10.281 -9.910 1.497 1.00 70.42 O ATOM 2209 CB THR B 26 8.871 -6.856 1.130 1.00 24.00 C ATOM 2210 OG1 THR B 26 7.749 -6.161 0.580 1.00 73.12 O ATOM 2211 CG2 THR B 26 10.043 -6.790 0.129 1.00 44.31 C ATOM 0 H THR B 26 6.951 -7.439 2.663 1.00 11.31 H new ATOM 0 HA THR B 26 8.192 -8.841 0.558 1.00 61.21 H new ATOM 0 HB THR B 26 9.200 -6.387 2.057 1.00 24.00 H new ATOM 0 HG1 THR B 26 7.078 -6.809 0.280 1.00 73.12 H new ATOM 0 HG21 THR B 26 10.287 -5.748 -0.078 1.00 44.31 H new ATOM 0 HG22 THR B 26 10.914 -7.289 0.555 1.00 44.31 H new ATOM 0 HG23 THR B 26 9.758 -7.287 -0.798 1.00 44.31 H new ATOM 2219 N ILE B 27 9.942 -8.720 3.409 1.00 1.04 N ATOM 2220 CA ILE B 27 11.038 -9.341 4.182 1.00 23.21 C ATOM 2221 C ILE B 27 10.741 -10.842 4.400 1.00 63.34 C ATOM 2222 O ILE B 27 11.643 -11.677 4.311 1.00 51.35 O ATOM 2223 CB ILE B 27 11.260 -8.602 5.559 1.00 22.22 C ATOM 2224 CG1 ILE B 27 11.651 -7.102 5.322 1.00 63.01 C ATOM 2225 CG2 ILE B 27 12.322 -9.324 6.438 1.00 2.45 C ATOM 2226 CD1 ILE B 27 11.736 -6.256 6.584 1.00 41.53 C ATOM 0 H ILE B 27 9.421 -8.015 3.931 1.00 1.04 H new ATOM 0 HA ILE B 27 11.961 -9.245 3.611 1.00 23.21 H new ATOM 0 HB ILE B 27 10.317 -8.631 6.106 1.00 22.22 H new ATOM 0 HG12 ILE B 27 12.615 -7.069 4.814 1.00 63.01 H new ATOM 0 HG13 ILE B 27 10.920 -6.653 4.649 1.00 63.01 H new ATOM 0 HG21 ILE B 27 12.445 -8.784 7.377 1.00 2.45 H new ATOM 0 HG22 ILE B 27 11.991 -10.342 6.646 1.00 2.45 H new ATOM 0 HG23 ILE B 27 13.274 -9.353 5.908 1.00 2.45 H new ATOM 0 HD11 ILE B 27 12.012 -5.235 6.320 1.00 41.53 H new ATOM 0 HD12 ILE B 27 10.768 -6.252 7.085 1.00 41.53 H new ATOM 0 HD13 ILE B 27 12.489 -6.674 7.252 1.00 41.53 H new ATOM 2238 N LYS B 28 9.446 -11.164 4.626 1.00 74.14 N ATOM 2239 CA LYS B 28 8.963 -12.554 4.743 1.00 10.20 C ATOM 2240 C LYS B 28 9.229 -13.322 3.429 1.00 73.20 C ATOM 2241 O LYS B 28 9.678 -14.465 3.459 1.00 24.53 O ATOM 2242 CB LYS B 28 7.445 -12.585 5.072 1.00 41.30 C ATOM 2243 CG LYS B 28 6.862 -14.009 5.274 1.00 2.44 C ATOM 2244 CD LYS B 28 5.311 -14.046 5.278 1.00 13.23 C ATOM 2245 CE LYS B 28 4.697 -13.583 3.940 1.00 5.34 C ATOM 2246 NZ LYS B 28 3.218 -13.795 3.901 1.00 4.24 N ATOM 0 H LYS B 28 8.710 -10.466 4.732 1.00 74.14 H new ATOM 0 HA LYS B 28 9.505 -13.035 5.557 1.00 10.20 H new ATOM 0 HB2 LYS B 28 7.270 -12.002 5.976 1.00 41.30 H new ATOM 0 HB3 LYS B 28 6.901 -12.094 4.265 1.00 41.30 H new ATOM 0 HG2 LYS B 28 7.231 -14.660 4.482 1.00 2.44 H new ATOM 0 HG3 LYS B 28 7.230 -14.414 6.217 1.00 2.44 H new ATOM 0 HD2 LYS B 28 4.977 -15.061 5.493 1.00 13.23 H new ATOM 0 HD3 LYS B 28 4.939 -13.411 6.082 1.00 13.23 H new ATOM 0 HE2 LYS B 28 4.916 -12.526 3.787 1.00 5.34 H new ATOM 0 HE3 LYS B 28 5.163 -14.128 3.119 1.00 5.34 H new ATOM 0 HZ1 LYS B 28 2.845 -13.471 2.986 1.00 4.24 H new ATOM 0 HZ2 LYS B 28 3.009 -14.807 4.022 1.00 4.24 H new ATOM 0 HZ3 LYS B 28 2.770 -13.255 4.668 1.00 4.24 H new ATOM 2260 N ASN B 29 8.986 -12.650 2.282 1.00 32.20 N ATOM 2261 CA ASN B 29 9.191 -13.236 0.938 1.00 5.11 C ATOM 2262 C ASN B 29 10.686 -13.441 0.648 1.00 25.44 C ATOM 2263 O ASN B 29 11.053 -14.351 -0.089 1.00 52.31 O ATOM 2264 CB ASN B 29 8.546 -12.347 -0.171 1.00 24.42 C ATOM 2265 CG ASN B 29 7.007 -12.266 -0.133 1.00 23.41 C ATOM 2266 OD1 ASN B 29 6.422 -11.256 -0.531 1.00 75.25 O ATOM 2267 ND2 ASN B 29 6.328 -13.304 0.346 1.00 73.42 N ATOM 0 H ASN B 29 8.643 -11.689 2.261 1.00 32.20 H new ATOM 0 HA ASN B 29 8.699 -14.208 0.928 1.00 5.11 H new ATOM 0 HB2 ASN B 29 8.949 -11.338 -0.086 1.00 24.42 H new ATOM 0 HB3 ASN B 29 8.850 -12.731 -1.145 1.00 24.42 H new ATOM 0 HD21 ASN B 29 5.309 -13.272 0.388 1.00 73.42 H new ATOM 0 HD22 ASN B 29 6.826 -14.133 0.672 1.00 73.42 H new ATOM 2274 N MET B 30 11.542 -12.572 1.230 1.00 61.32 N ATOM 2275 CA MET B 30 13.015 -12.720 1.167 1.00 64.13 C ATOM 2276 C MET B 30 13.449 -13.968 1.959 1.00 51.10 C ATOM 2277 O MET B 30 14.305 -14.730 1.520 1.00 2.44 O ATOM 2278 CB MET B 30 13.731 -11.451 1.716 1.00 62.35 C ATOM 2279 CG MET B 30 13.500 -10.168 0.899 1.00 22.02 C ATOM 2280 SD MET B 30 14.344 -8.734 1.605 1.00 33.34 S ATOM 2281 CE MET B 30 13.862 -7.425 0.473 1.00 41.11 C ATOM 0 H MET B 30 11.235 -11.753 1.754 1.00 61.32 H new ATOM 0 HA MET B 30 13.305 -12.840 0.123 1.00 64.13 H new ATOM 0 HB2 MET B 30 13.396 -11.277 2.739 1.00 62.35 H new ATOM 0 HB3 MET B 30 14.802 -11.647 1.760 1.00 62.35 H new ATOM 0 HG2 MET B 30 13.849 -10.324 -0.122 1.00 22.02 H new ATOM 0 HG3 MET B 30 12.431 -9.965 0.843 1.00 22.02 H new ATOM 0 HE1 MET B 30 14.746 -6.867 0.164 1.00 41.11 H new ATOM 0 HE2 MET B 30 13.383 -7.860 -0.404 1.00 41.11 H new ATOM 0 HE3 MET B 30 13.164 -6.752 0.971 1.00 41.11 H new ATOM 2291 N ILE B 31 12.810 -14.169 3.123 1.00 31.32 N ATOM 2292 CA ILE B 31 13.030 -15.342 3.989 1.00 73.32 C ATOM 2293 C ILE B 31 12.566 -16.643 3.277 1.00 3.25 C ATOM 2294 O ILE B 31 13.222 -17.680 3.365 1.00 12.43 O ATOM 2295 CB ILE B 31 12.291 -15.144 5.379 1.00 22.40 C ATOM 2296 CG1 ILE B 31 12.915 -13.943 6.171 1.00 60.30 C ATOM 2297 CG2 ILE B 31 12.298 -16.434 6.234 1.00 23.22 C ATOM 2298 CD1 ILE B 31 12.200 -13.587 7.471 1.00 10.42 C ATOM 0 H ILE B 31 12.119 -13.516 3.494 1.00 31.32 H new ATOM 0 HA ILE B 31 14.097 -15.439 4.187 1.00 73.32 H new ATOM 0 HB ILE B 31 11.248 -14.913 5.161 1.00 22.40 H new ATOM 0 HG12 ILE B 31 13.955 -14.178 6.398 1.00 60.30 H new ATOM 0 HG13 ILE B 31 12.921 -13.065 5.525 1.00 60.30 H new ATOM 0 HG21 ILE B 31 11.781 -16.249 7.176 1.00 23.22 H new ATOM 0 HG22 ILE B 31 11.791 -17.232 5.692 1.00 23.22 H new ATOM 0 HG23 ILE B 31 13.327 -16.730 6.437 1.00 23.22 H new ATOM 0 HD11 ILE B 31 12.705 -12.746 7.945 1.00 10.42 H new ATOM 0 HD12 ILE B 31 11.167 -13.315 7.255 1.00 10.42 H new ATOM 0 HD13 ILE B 31 12.217 -14.446 8.142 1.00 10.42 H new ATOM 2310 N GLU B 32 11.453 -16.557 2.533 1.00 40.10 N ATOM 2311 CA GLU B 32 10.884 -17.720 1.817 1.00 52.31 C ATOM 2312 C GLU B 32 11.694 -18.060 0.543 1.00 14.42 C ATOM 2313 O GLU B 32 11.861 -19.237 0.213 1.00 43.10 O ATOM 2314 CB GLU B 32 9.395 -17.458 1.478 1.00 2.33 C ATOM 2315 CG GLU B 32 8.483 -17.275 2.711 1.00 35.12 C ATOM 2316 CD GLU B 32 7.033 -16.929 2.347 1.00 74.15 C ATOM 2317 OE1 GLU B 32 6.162 -17.835 2.351 1.00 72.52 O ATOM 2318 OE2 GLU B 32 6.764 -15.755 2.018 1.00 73.42 O ATOM 0 H GLU B 32 10.924 -15.694 2.408 1.00 40.10 H new ATOM 0 HA GLU B 32 10.946 -18.587 2.475 1.00 52.31 H new ATOM 0 HB2 GLU B 32 9.328 -16.565 0.856 1.00 2.33 H new ATOM 0 HB3 GLU B 32 9.019 -18.290 0.883 1.00 2.33 H new ATOM 0 HG2 GLU B 32 8.493 -18.191 3.301 1.00 35.12 H new ATOM 0 HG3 GLU B 32 8.890 -16.485 3.342 1.00 35.12 H new ATOM 2325 N ASP B 33 12.204 -17.024 -0.152 1.00 51.21 N ATOM 2326 CA ASP B 33 12.912 -17.187 -1.450 1.00 64.43 C ATOM 2327 C ASP B 33 14.364 -17.666 -1.249 1.00 2.05 C ATOM 2328 O ASP B 33 14.824 -18.601 -1.919 1.00 72.23 O ATOM 2329 CB ASP B 33 12.906 -15.835 -2.220 1.00 43.33 C ATOM 2330 CG ASP B 33 13.649 -15.887 -3.575 1.00 52.23 C ATOM 2331 OD1 ASP B 33 13.028 -16.262 -4.591 1.00 62.23 O ATOM 2332 OD2 ASP B 33 14.854 -15.551 -3.629 1.00 4.34 O ATOM 0 H ASP B 33 12.141 -16.056 0.162 1.00 51.21 H new ATOM 0 HA ASP B 33 12.387 -17.947 -2.028 1.00 64.43 H new ATOM 0 HB2 ASP B 33 11.874 -15.531 -2.393 1.00 43.33 H new ATOM 0 HB3 ASP B 33 13.364 -15.069 -1.594 1.00 43.33 H new ATOM 2337 N ILE B 34 15.063 -17.016 -0.304 1.00 42.23 N ATOM 2338 CA ILE B 34 16.495 -17.268 -0.023 1.00 71.43 C ATOM 2339 C ILE B 34 16.652 -18.494 0.909 1.00 64.01 C ATOM 2340 O ILE B 34 17.716 -19.122 0.961 1.00 53.11 O ATOM 2341 CB ILE B 34 17.171 -15.975 0.602 1.00 2.43 C ATOM 2342 CG1 ILE B 34 16.923 -14.730 -0.324 1.00 13.30 C ATOM 2343 CG2 ILE B 34 18.691 -16.173 0.853 1.00 11.04 C ATOM 2344 CD1 ILE B 34 17.430 -13.411 0.237 1.00 65.33 C ATOM 0 H ILE B 34 14.653 -16.297 0.292 1.00 42.23 H new ATOM 0 HA ILE B 34 17.006 -17.492 -0.959 1.00 71.43 H new ATOM 0 HB ILE B 34 16.705 -15.798 1.571 1.00 2.43 H new ATOM 0 HG12 ILE B 34 17.403 -14.909 -1.286 1.00 13.30 H new ATOM 0 HG13 ILE B 34 15.853 -14.642 -0.513 1.00 13.30 H new ATOM 0 HG21 ILE B 34 19.111 -15.263 1.281 1.00 11.04 H new ATOM 0 HG22 ILE B 34 18.841 -17.002 1.545 1.00 11.04 H new ATOM 0 HG23 ILE B 34 19.190 -16.394 -0.091 1.00 11.04 H new ATOM 0 HD11 ILE B 34 17.216 -12.609 -0.469 1.00 65.33 H new ATOM 0 HD12 ILE B 34 16.932 -13.203 1.184 1.00 65.33 H new ATOM 0 HD13 ILE B 34 18.506 -13.474 0.399 1.00 65.33 H new ATOM 2356 N GLY B 35 15.553 -18.863 1.595 1.00 2.52 N ATOM 2357 CA GLY B 35 15.562 -19.960 2.567 1.00 41.02 C ATOM 2358 C GLY B 35 16.005 -19.495 3.947 1.00 63.43 C ATOM 2359 O GLY B 35 16.580 -20.279 4.708 1.00 12.24 O ATOM 0 H GLY B 35 14.645 -18.411 1.489 1.00 2.52 H new ATOM 0 HA2 GLY B 35 14.564 -20.394 2.634 1.00 41.02 H new ATOM 0 HA3 GLY B 35 16.229 -20.748 2.218 1.00 41.02 H new ATOM 2363 N GLU B 36 15.742 -18.197 4.225 1.00 45.15 N ATOM 2364 CA GLU B 36 16.052 -17.491 5.480 1.00 63.33 C ATOM 2365 C GLU B 36 17.545 -17.145 5.589 1.00 42.03 C ATOM 2366 O GLU B 36 18.412 -18.012 5.436 1.00 52.54 O ATOM 2367 CB GLU B 36 15.571 -18.256 6.743 1.00 40.20 C ATOM 2368 CG GLU B 36 15.750 -17.472 8.058 1.00 0.45 C ATOM 2369 CD GLU B 36 15.240 -18.247 9.277 1.00 63.34 C ATOM 2370 OE1 GLU B 36 16.054 -18.728 10.093 1.00 14.02 O ATOM 2371 OE2 GLU B 36 14.010 -18.383 9.422 1.00 52.05 O ATOM 0 H GLU B 36 15.286 -17.589 3.545 1.00 45.15 H new ATOM 0 HA GLU B 36 15.488 -16.559 5.440 1.00 63.33 H new ATOM 0 HB2 GLU B 36 14.517 -18.508 6.623 1.00 40.20 H new ATOM 0 HB3 GLU B 36 16.117 -19.196 6.816 1.00 40.20 H new ATOM 0 HG2 GLU B 36 16.805 -17.237 8.196 1.00 0.45 H new ATOM 0 HG3 GLU B 36 15.219 -16.523 7.987 1.00 0.45 H new ATOM 2378 N SER B 37 17.825 -15.864 5.867 1.00 55.53 N ATOM 2379 CA SER B 37 19.177 -15.350 6.076 1.00 2.30 C ATOM 2380 C SER B 37 19.316 -14.835 7.516 1.00 73.20 C ATOM 2381 O SER B 37 18.632 -13.880 7.913 1.00 74.20 O ATOM 2382 CB SER B 37 19.470 -14.225 5.060 1.00 51.54 C ATOM 2383 OG SER B 37 19.269 -14.672 3.729 1.00 20.30 O ATOM 0 H SER B 37 17.104 -15.148 5.953 1.00 55.53 H new ATOM 0 HA SER B 37 19.901 -16.150 5.923 1.00 2.30 H new ATOM 0 HB2 SER B 37 18.823 -13.371 5.262 1.00 51.54 H new ATOM 0 HB3 SER B 37 20.497 -13.881 5.180 1.00 51.54 H new ATOM 0 HG SER B 37 19.747 -14.082 3.110 1.00 20.30 H new ATOM 2389 N ASP B 38 20.160 -15.522 8.303 1.00 22.13 N ATOM 2390 CA ASP B 38 20.631 -15.031 9.614 1.00 41.21 C ATOM 2391 C ASP B 38 21.647 -13.899 9.373 1.00 43.32 C ATOM 2392 O ASP B 38 21.772 -12.960 10.173 1.00 13.34 O ATOM 2393 CB ASP B 38 21.275 -16.208 10.404 1.00 61.22 C ATOM 2394 CG ASP B 38 21.735 -15.825 11.826 1.00 73.35 C ATOM 2395 OD1 ASP B 38 22.940 -15.562 12.040 1.00 3.31 O ATOM 2396 OD2 ASP B 38 20.887 -15.792 12.744 1.00 45.02 O ATOM 0 H ASP B 38 20.537 -16.435 8.050 1.00 22.13 H new ATOM 0 HA ASP B 38 19.801 -14.642 10.204 1.00 41.21 H new ATOM 0 HB2 ASP B 38 20.556 -17.024 10.472 1.00 61.22 H new ATOM 0 HB3 ASP B 38 22.131 -16.584 9.844 1.00 61.22 H new ATOM 2401 N SER B 39 22.346 -14.024 8.228 1.00 11.42 N ATOM 2402 CA SER B 39 23.272 -13.024 7.688 1.00 12.33 C ATOM 2403 C SER B 39 22.566 -11.662 7.422 1.00 72.43 C ATOM 2404 O SER B 39 21.350 -11.636 7.169 1.00 72.41 O ATOM 2405 CB SER B 39 23.872 -13.576 6.374 1.00 52.43 C ATOM 2406 OG SER B 39 24.497 -14.829 6.591 1.00 45.15 O ATOM 0 H SER B 39 22.275 -14.853 7.638 1.00 11.42 H new ATOM 0 HA SER B 39 24.056 -12.839 8.422 1.00 12.33 H new ATOM 0 HB2 SER B 39 23.086 -13.682 5.627 1.00 52.43 H new ATOM 0 HB3 SER B 39 24.598 -12.867 5.975 1.00 52.43 H new ATOM 0 HG SER B 39 24.868 -15.160 5.747 1.00 45.15 H new ATOM 2412 N PRO B 40 23.321 -10.515 7.463 1.00 54.23 N ATOM 2413 CA PRO B 40 22.738 -9.164 7.265 1.00 65.33 C ATOM 2414 C PRO B 40 22.233 -8.927 5.817 1.00 0.34 C ATOM 2415 O PRO B 40 22.863 -9.365 4.842 1.00 1.53 O ATOM 2416 CB PRO B 40 23.915 -8.226 7.628 1.00 73.41 C ATOM 2417 CG PRO B 40 25.144 -9.013 7.343 1.00 33.45 C ATOM 2418 CD PRO B 40 24.793 -10.435 7.725 1.00 62.13 C ATOM 0 HA PRO B 40 21.848 -9.001 7.873 1.00 65.33 H new ATOM 0 HB2 PRO B 40 23.887 -7.312 7.035 1.00 73.41 H new ATOM 0 HB3 PRO B 40 23.872 -7.928 8.676 1.00 73.41 H new ATOM 0 HG2 PRO B 40 25.423 -8.944 6.291 1.00 33.45 H new ATOM 0 HG3 PRO B 40 25.991 -8.646 7.922 1.00 33.45 H new ATOM 0 HD2 PRO B 40 25.347 -11.159 7.128 1.00 62.13 H new ATOM 0 HD3 PRO B 40 25.026 -10.639 8.770 1.00 62.13 H new ATOM 2426 N ILE B 41 21.091 -8.229 5.698 1.00 11.44 N ATOM 2427 CA ILE B 41 20.429 -7.947 4.415 1.00 43.45 C ATOM 2428 C ILE B 41 20.289 -6.416 4.251 1.00 45.31 C ATOM 2429 O ILE B 41 19.634 -5.774 5.079 1.00 41.02 O ATOM 2430 CB ILE B 41 19.000 -8.633 4.335 1.00 3.20 C ATOM 2431 CG1 ILE B 41 19.109 -10.190 4.470 1.00 33.31 C ATOM 2432 CG2 ILE B 41 18.253 -8.248 3.028 1.00 32.11 C ATOM 2433 CD1 ILE B 41 19.913 -10.882 3.370 1.00 61.13 C ATOM 0 H ILE B 41 20.596 -7.840 6.501 1.00 11.44 H new ATOM 0 HA ILE B 41 21.037 -8.359 3.610 1.00 43.45 H new ATOM 0 HB ILE B 41 18.416 -8.258 5.176 1.00 3.20 H new ATOM 0 HG12 ILE B 41 19.563 -10.425 5.433 1.00 33.31 H new ATOM 0 HG13 ILE B 41 18.103 -10.609 4.482 1.00 33.31 H new ATOM 0 HG21 ILE B 41 17.279 -8.736 3.008 1.00 32.11 H new ATOM 0 HG22 ILE B 41 18.118 -7.167 2.991 1.00 32.11 H new ATOM 0 HG23 ILE B 41 18.838 -8.570 2.166 1.00 32.11 H new ATOM 0 HD11 ILE B 41 19.930 -11.956 3.553 1.00 61.13 H new ATOM 0 HD12 ILE B 41 19.450 -10.686 2.403 1.00 61.13 H new ATOM 0 HD13 ILE B 41 20.933 -10.498 3.369 1.00 61.13 H new ATOM 2445 N PRO B 42 20.930 -5.799 3.207 1.00 31.33 N ATOM 2446 CA PRO B 42 20.747 -4.369 2.910 1.00 12.15 C ATOM 2447 C PRO B 42 19.446 -4.116 2.109 1.00 22.00 C ATOM 2448 O PRO B 42 19.064 -4.917 1.244 1.00 30.53 O ATOM 2449 CB PRO B 42 22.019 -4.021 2.101 1.00 3.43 C ATOM 2450 CG PRO B 42 22.369 -5.290 1.377 1.00 61.21 C ATOM 2451 CD PRO B 42 21.882 -6.438 2.254 1.00 13.42 C ATOM 0 HA PRO B 42 20.634 -3.750 3.800 1.00 12.15 H new ATOM 0 HB2 PRO B 42 21.833 -3.205 1.403 1.00 3.43 H new ATOM 0 HB3 PRO B 42 22.830 -3.702 2.756 1.00 3.43 H new ATOM 0 HG2 PRO B 42 21.893 -5.321 0.397 1.00 61.21 H new ATOM 0 HG3 PRO B 42 23.444 -5.358 1.211 1.00 61.21 H new ATOM 0 HD2 PRO B 42 21.392 -7.211 1.661 1.00 13.42 H new ATOM 0 HD3 PRO B 42 22.709 -6.915 2.779 1.00 13.42 H new ATOM 2459 N LEU B 43 18.765 -3.012 2.439 1.00 3.31 N ATOM 2460 CA LEU B 43 17.529 -2.571 1.772 1.00 22.42 C ATOM 2461 C LEU B 43 17.865 -1.295 0.955 1.00 2.11 C ATOM 2462 O LEU B 43 17.856 -0.183 1.508 1.00 44.12 O ATOM 2463 CB LEU B 43 16.374 -2.307 2.807 1.00 30.24 C ATOM 2464 CG LEU B 43 15.740 -3.557 3.541 1.00 63.23 C ATOM 2465 CD1 LEU B 43 16.733 -4.281 4.476 1.00 75.13 C ATOM 2466 CD2 LEU B 43 14.473 -3.149 4.322 1.00 11.54 C ATOM 0 H LEU B 43 19.061 -2.388 3.190 1.00 3.31 H new ATOM 0 HA LEU B 43 17.164 -3.355 1.108 1.00 22.42 H new ATOM 0 HB2 LEU B 43 16.757 -1.629 3.570 1.00 30.24 H new ATOM 0 HB3 LEU B 43 15.573 -1.782 2.287 1.00 30.24 H new ATOM 0 HG LEU B 43 15.470 -4.265 2.758 1.00 63.23 H new ATOM 0 HD11 LEU B 43 16.236 -5.128 4.948 1.00 75.13 H new ATOM 0 HD12 LEU B 43 17.585 -4.637 3.897 1.00 75.13 H new ATOM 0 HD13 LEU B 43 17.080 -3.590 5.244 1.00 75.13 H new ATOM 0 HD21 LEU B 43 14.054 -4.024 4.819 1.00 11.54 H new ATOM 0 HD22 LEU B 43 14.732 -2.398 5.068 1.00 11.54 H new ATOM 0 HD23 LEU B 43 13.737 -2.737 3.632 1.00 11.54 H new ATOM 2478 N PRO B 44 18.226 -1.441 -0.369 1.00 10.32 N ATOM 2479 CA PRO B 44 18.689 -0.311 -1.210 1.00 45.03 C ATOM 2480 C PRO B 44 17.511 0.516 -1.786 1.00 13.02 C ATOM 2481 O PRO B 44 17.264 0.525 -3.004 1.00 12.24 O ATOM 2482 CB PRO B 44 19.516 -1.043 -2.302 1.00 3.21 C ATOM 2483 CG PRO B 44 18.815 -2.355 -2.501 1.00 25.40 C ATOM 2484 CD PRO B 44 18.216 -2.722 -1.146 1.00 71.44 C ATOM 0 HA PRO B 44 19.266 0.438 -0.667 1.00 45.03 H new ATOM 0 HB2 PRO B 44 19.547 -0.467 -3.227 1.00 3.21 H new ATOM 0 HB3 PRO B 44 20.548 -1.191 -1.984 1.00 3.21 H new ATOM 0 HG2 PRO B 44 18.038 -2.271 -3.261 1.00 25.40 H new ATOM 0 HG3 PRO B 44 19.511 -3.122 -2.840 1.00 25.40 H new ATOM 0 HD2 PRO B 44 17.204 -3.113 -1.253 1.00 71.44 H new ATOM 0 HD3 PRO B 44 18.805 -3.492 -0.648 1.00 71.44 H new ATOM 2492 N ASN B 45 16.801 1.218 -0.884 1.00 70.21 N ATOM 2493 CA ASN B 45 15.602 2.011 -1.227 1.00 61.11 C ATOM 2494 C ASN B 45 15.237 2.931 -0.053 1.00 41.13 C ATOM 2495 O ASN B 45 15.167 4.157 -0.196 1.00 63.14 O ATOM 2496 CB ASN B 45 14.393 1.083 -1.568 1.00 13.41 C ATOM 2497 CG ASN B 45 13.080 1.839 -1.855 1.00 40.13 C ATOM 2498 OD1 ASN B 45 12.263 2.067 -0.957 1.00 43.31 O ATOM 2499 ND2 ASN B 45 12.867 2.231 -3.101 1.00 11.33 N ATOM 0 H ASN B 45 17.042 1.253 0.107 1.00 70.21 H new ATOM 0 HA ASN B 45 15.829 2.612 -2.107 1.00 61.11 H new ATOM 0 HB2 ASN B 45 14.648 0.477 -2.437 1.00 13.41 H new ATOM 0 HB3 ASN B 45 14.230 0.396 -0.737 1.00 13.41 H new ATOM 0 HD21 ASN B 45 12.012 2.734 -3.338 1.00 11.33 H new ATOM 0 HD22 ASN B 45 13.558 2.030 -3.824 1.00 11.33 H new ATOM 2506 N VAL B 46 15.013 2.312 1.111 1.00 32.15 N ATOM 2507 CA VAL B 46 14.543 3.008 2.318 1.00 72.50 C ATOM 2508 C VAL B 46 15.751 3.556 3.118 1.00 45.00 C ATOM 2509 O VAL B 46 16.715 2.824 3.377 1.00 24.43 O ATOM 2510 CB VAL B 46 13.635 2.052 3.195 1.00 44.21 C ATOM 2511 CG1 VAL B 46 14.374 0.755 3.595 1.00 73.13 C ATOM 2512 CG2 VAL B 46 13.056 2.783 4.430 1.00 3.34 C ATOM 0 H VAL B 46 15.153 1.311 1.245 1.00 32.15 H new ATOM 0 HA VAL B 46 13.925 3.857 2.025 1.00 72.50 H new ATOM 0 HB VAL B 46 12.792 1.757 2.569 1.00 44.21 H new ATOM 0 HG11 VAL B 46 13.713 0.130 4.195 1.00 73.13 H new ATOM 0 HG12 VAL B 46 14.669 0.213 2.697 1.00 73.13 H new ATOM 0 HG13 VAL B 46 15.262 1.006 4.175 1.00 73.13 H new ATOM 0 HG21 VAL B 46 12.439 2.093 5.005 1.00 3.34 H new ATOM 0 HG22 VAL B 46 13.873 3.146 5.054 1.00 3.34 H new ATOM 0 HG23 VAL B 46 12.448 3.626 4.102 1.00 3.34 H new ATOM 2522 N THR B 47 15.703 4.859 3.463 1.00 53.40 N ATOM 2523 CA THR B 47 16.774 5.548 4.218 1.00 11.13 C ATOM 2524 C THR B 47 16.797 5.087 5.685 1.00 41.14 C ATOM 2525 O THR B 47 15.848 4.459 6.142 1.00 41.21 O ATOM 2526 CB THR B 47 16.592 7.097 4.140 1.00 64.43 C ATOM 2527 OG1 THR B 47 15.316 7.465 4.677 1.00 31.24 O ATOM 2528 CG2 THR B 47 16.703 7.616 2.697 1.00 74.05 C ATOM 0 H THR B 47 14.919 5.466 3.226 1.00 53.40 H new ATOM 0 HA THR B 47 17.729 5.286 3.762 1.00 11.13 H new ATOM 0 HB THR B 47 17.392 7.550 4.725 1.00 64.43 H new ATOM 0 HG1 THR B 47 15.208 8.438 4.627 1.00 31.24 H new ATOM 0 HG21 THR B 47 16.570 8.698 2.688 1.00 74.05 H new ATOM 0 HG22 THR B 47 17.685 7.368 2.296 1.00 74.05 H new ATOM 0 HG23 THR B 47 15.932 7.151 2.083 1.00 74.05 H new ATOM 2536 N SER B 48 17.883 5.416 6.412 1.00 14.11 N ATOM 2537 CA SER B 48 18.107 4.931 7.789 1.00 13.42 C ATOM 2538 C SER B 48 17.131 5.543 8.798 1.00 33.34 C ATOM 2539 O SER B 48 16.665 4.850 9.702 1.00 31.43 O ATOM 2540 CB SER B 48 19.564 5.185 8.217 1.00 43.34 C ATOM 2541 OG SER B 48 19.933 6.548 8.120 1.00 14.01 O ATOM 0 H SER B 48 18.626 6.022 6.064 1.00 14.11 H new ATOM 0 HA SER B 48 17.918 3.858 7.784 1.00 13.42 H new ATOM 0 HB2 SER B 48 19.700 4.848 9.245 1.00 43.34 H new ATOM 0 HB3 SER B 48 20.230 4.587 7.595 1.00 43.34 H new ATOM 0 HG SER B 48 20.044 6.922 9.019 1.00 14.01 H new ATOM 2547 N THR B 49 16.821 6.832 8.618 1.00 3.51 N ATOM 2548 CA THR B 49 15.887 7.564 9.484 1.00 73.22 C ATOM 2549 C THR B 49 14.466 6.980 9.372 1.00 25.35 C ATOM 2550 O THR B 49 13.775 6.793 10.382 1.00 74.34 O ATOM 2551 CB THR B 49 15.883 9.074 9.105 1.00 20.52 C ATOM 2552 OG1 THR B 49 15.712 9.192 7.685 1.00 42.13 O ATOM 2553 CG2 THR B 49 17.183 9.789 9.532 1.00 74.42 C ATOM 0 H THR B 49 17.212 7.399 7.866 1.00 3.51 H new ATOM 0 HA THR B 49 16.217 7.458 10.517 1.00 73.22 H new ATOM 0 HB THR B 49 15.062 9.555 9.636 1.00 20.52 H new ATOM 0 HG1 THR B 49 15.706 10.139 7.434 1.00 42.13 H new ATOM 0 HG21 THR B 49 17.131 10.839 9.246 1.00 74.42 H new ATOM 0 HG22 THR B 49 17.302 9.713 10.613 1.00 74.42 H new ATOM 0 HG23 THR B 49 18.035 9.320 9.039 1.00 74.42 H new ATOM 2561 N ILE B 50 14.059 6.660 8.131 1.00 24.03 N ATOM 2562 CA ILE B 50 12.733 6.099 7.848 1.00 62.41 C ATOM 2563 C ILE B 50 12.678 4.625 8.299 1.00 60.13 C ATOM 2564 O ILE B 50 11.753 4.242 9.005 1.00 72.32 O ATOM 2565 CB ILE B 50 12.362 6.243 6.322 1.00 2.22 C ATOM 2566 CG1 ILE B 50 12.411 7.745 5.887 1.00 42.51 C ATOM 2567 CG2 ILE B 50 10.979 5.622 6.002 1.00 13.45 C ATOM 2568 CD1 ILE B 50 11.490 8.681 6.664 1.00 51.41 C ATOM 0 H ILE B 50 14.640 6.784 7.302 1.00 24.03 H new ATOM 0 HA ILE B 50 11.992 6.664 8.413 1.00 62.41 H new ATOM 0 HB ILE B 50 13.105 5.688 5.749 1.00 2.22 H new ATOM 0 HG12 ILE B 50 13.436 8.102 5.990 1.00 42.51 H new ATOM 0 HG13 ILE B 50 12.157 7.808 4.829 1.00 42.51 H new ATOM 0 HG21 ILE B 50 10.763 5.743 4.941 1.00 13.45 H new ATOM 0 HG22 ILE B 50 10.990 4.561 6.251 1.00 13.45 H new ATOM 0 HG23 ILE B 50 10.210 6.125 6.589 1.00 13.45 H new ATOM 0 HD11 ILE B 50 11.600 9.697 6.285 1.00 51.41 H new ATOM 0 HD12 ILE B 50 10.456 8.358 6.542 1.00 51.41 H new ATOM 0 HD13 ILE B 50 11.755 8.657 7.721 1.00 51.41 H new ATOM 2580 N LEU B 51 13.724 3.833 7.941 1.00 30.24 N ATOM 2581 CA LEU B 51 13.779 2.374 8.219 1.00 34.33 C ATOM 2582 C LEU B 51 13.815 2.095 9.729 1.00 11.21 C ATOM 2583 O LEU B 51 13.240 1.102 10.186 1.00 51.22 O ATOM 2584 CB LEU B 51 14.999 1.694 7.525 1.00 74.44 C ATOM 2585 CG LEU B 51 15.085 0.131 7.674 1.00 50.30 C ATOM 2586 CD1 LEU B 51 13.826 -0.569 7.109 1.00 23.31 C ATOM 2587 CD2 LEU B 51 16.370 -0.435 7.032 1.00 41.14 C ATOM 0 H LEU B 51 14.548 4.187 7.454 1.00 30.24 H new ATOM 0 HA LEU B 51 12.868 1.943 7.803 1.00 34.33 H new ATOM 0 HB2 LEU B 51 14.972 1.938 6.463 1.00 74.44 H new ATOM 0 HB3 LEU B 51 15.913 2.130 7.929 1.00 74.44 H new ATOM 0 HG LEU B 51 15.129 -0.082 8.742 1.00 50.30 H new ATOM 0 HD11 LEU B 51 13.924 -1.648 7.231 1.00 23.31 H new ATOM 0 HD12 LEU B 51 12.944 -0.222 7.647 1.00 23.31 H new ATOM 0 HD13 LEU B 51 13.722 -0.331 6.050 1.00 23.31 H new ATOM 0 HD21 LEU B 51 16.392 -1.518 7.156 1.00 41.14 H new ATOM 0 HD22 LEU B 51 16.384 -0.191 5.970 1.00 41.14 H new ATOM 0 HD23 LEU B 51 17.242 0.004 7.516 1.00 41.14 H new ATOM 2599 N GLU B 52 14.491 2.984 10.492 1.00 75.53 N ATOM 2600 CA GLU B 52 14.506 2.927 11.963 1.00 74.54 C ATOM 2601 C GLU B 52 13.070 2.973 12.495 1.00 41.15 C ATOM 2602 O GLU B 52 12.668 2.122 13.278 1.00 40.21 O ATOM 2603 CB GLU B 52 15.329 4.103 12.559 1.00 41.50 C ATOM 2604 CG GLU B 52 15.352 4.137 14.101 1.00 71.41 C ATOM 2605 CD GLU B 52 16.206 5.272 14.680 1.00 13.03 C ATOM 2606 OE1 GLU B 52 15.745 6.432 14.664 1.00 14.31 O ATOM 2607 OE2 GLU B 52 17.330 5.011 15.165 1.00 64.31 O ATOM 0 H GLU B 52 15.036 3.754 10.104 1.00 75.53 H new ATOM 0 HA GLU B 52 14.979 1.993 12.267 1.00 74.54 H new ATOM 0 HB2 GLU B 52 16.353 4.038 12.192 1.00 41.50 H new ATOM 0 HB3 GLU B 52 14.918 5.043 12.192 1.00 41.50 H new ATOM 0 HG2 GLU B 52 14.331 4.239 14.469 1.00 71.41 H new ATOM 0 HG3 GLU B 52 15.731 3.184 14.471 1.00 71.41 H new ATOM 2614 N LYS B 53 12.305 3.953 11.982 1.00 64.33 N ATOM 2615 CA LYS B 53 10.915 4.203 12.395 1.00 1.13 C ATOM 2616 C LYS B 53 9.956 3.102 11.905 1.00 43.44 C ATOM 2617 O LYS B 53 8.999 2.774 12.598 1.00 74.25 O ATOM 2618 CB LYS B 53 10.451 5.588 11.878 1.00 31.10 C ATOM 2619 CG LYS B 53 11.224 6.782 12.482 1.00 1.35 C ATOM 2620 CD LYS B 53 10.640 8.156 12.069 1.00 44.35 C ATOM 2621 CE LYS B 53 9.151 8.317 12.441 1.00 24.01 C ATOM 2622 NZ LYS B 53 8.726 9.738 12.426 1.00 72.51 N ATOM 0 H LYS B 53 12.637 4.597 11.265 1.00 64.33 H new ATOM 0 HA LYS B 53 10.889 4.192 13.485 1.00 1.13 H new ATOM 0 HB2 LYS B 53 10.557 5.612 10.793 1.00 31.10 H new ATOM 0 HB3 LYS B 53 9.390 5.708 12.097 1.00 31.10 H new ATOM 0 HG2 LYS B 53 11.213 6.701 13.569 1.00 1.35 H new ATOM 0 HG3 LYS B 53 12.267 6.728 12.169 1.00 1.35 H new ATOM 0 HD2 LYS B 53 11.216 8.948 12.548 1.00 44.35 H new ATOM 0 HD3 LYS B 53 10.756 8.285 10.993 1.00 44.35 H new ATOM 0 HE2 LYS B 53 8.539 7.748 11.741 1.00 24.01 H new ATOM 0 HE3 LYS B 53 8.977 7.897 13.432 1.00 24.01 H new ATOM 0 HZ1 LYS B 53 7.688 9.790 12.376 1.00 72.51 H new ATOM 0 HZ2 LYS B 53 9.055 10.208 13.294 1.00 72.51 H new ATOM 0 HZ3 LYS B 53 9.136 10.214 11.597 1.00 72.51 H new ATOM 2636 N VAL B 54 10.229 2.543 10.712 1.00 70.40 N ATOM 2637 CA VAL B 54 9.412 1.479 10.102 1.00 72.14 C ATOM 2638 C VAL B 54 9.507 0.197 10.952 1.00 34.41 C ATOM 2639 O VAL B 54 8.488 -0.406 11.312 1.00 1.21 O ATOM 2640 CB VAL B 54 9.866 1.209 8.608 1.00 52.42 C ATOM 2641 CG1 VAL B 54 9.216 -0.059 8.022 1.00 60.22 C ATOM 2642 CG2 VAL B 54 9.558 2.429 7.705 1.00 53.22 C ATOM 0 H VAL B 54 11.028 2.819 10.141 1.00 70.40 H new ATOM 0 HA VAL B 54 8.371 1.802 10.076 1.00 72.14 H new ATOM 0 HB VAL B 54 10.944 1.048 8.632 1.00 52.42 H new ATOM 0 HG11 VAL B 54 9.557 -0.202 6.997 1.00 60.22 H new ATOM 0 HG12 VAL B 54 9.498 -0.924 8.623 1.00 60.22 H new ATOM 0 HG13 VAL B 54 8.132 0.051 8.031 1.00 60.22 H new ATOM 0 HG21 VAL B 54 9.879 2.217 6.685 1.00 53.22 H new ATOM 0 HG22 VAL B 54 8.486 2.627 7.714 1.00 53.22 H new ATOM 0 HG23 VAL B 54 10.091 3.303 8.079 1.00 53.22 H new ATOM 2652 N LEU B 55 10.751 -0.171 11.304 1.00 71.42 N ATOM 2653 CA LEU B 55 11.043 -1.362 12.118 1.00 53.21 C ATOM 2654 C LEU B 55 10.655 -1.137 13.592 1.00 73.23 C ATOM 2655 O LEU B 55 10.338 -2.094 14.296 1.00 63.21 O ATOM 2656 CB LEU B 55 12.541 -1.756 11.990 1.00 12.24 C ATOM 2657 CG LEU B 55 13.033 -2.142 10.551 1.00 55.24 C ATOM 2658 CD1 LEU B 55 14.510 -2.586 10.569 1.00 70.42 C ATOM 2659 CD2 LEU B 55 12.130 -3.219 9.901 1.00 75.52 C ATOM 0 H LEU B 55 11.584 0.351 11.031 1.00 71.42 H new ATOM 0 HA LEU B 55 10.439 -2.187 11.740 1.00 53.21 H new ATOM 0 HB2 LEU B 55 13.146 -0.923 12.348 1.00 12.24 H new ATOM 0 HB3 LEU B 55 12.732 -2.598 12.655 1.00 12.24 H new ATOM 0 HG LEU B 55 12.959 -1.247 9.933 1.00 55.24 H new ATOM 0 HD11 LEU B 55 14.824 -2.847 9.558 1.00 70.42 H new ATOM 0 HD12 LEU B 55 15.130 -1.771 10.942 1.00 70.42 H new ATOM 0 HD13 LEU B 55 14.621 -3.454 11.219 1.00 70.42 H new ATOM 0 HD21 LEU B 55 12.506 -3.457 8.906 1.00 75.52 H new ATOM 0 HD22 LEU B 55 12.136 -4.119 10.516 1.00 75.52 H new ATOM 0 HD23 LEU B 55 11.111 -2.840 9.823 1.00 75.52 H new ATOM 2671 N ASP B 56 10.703 0.135 14.041 1.00 23.11 N ATOM 2672 CA ASP B 56 10.301 0.540 15.409 1.00 31.53 C ATOM 2673 C ASP B 56 8.768 0.530 15.564 1.00 61.33 C ATOM 2674 O ASP B 56 8.251 0.211 16.639 1.00 3.50 O ATOM 2675 CB ASP B 56 10.870 1.939 15.753 1.00 64.13 C ATOM 2676 CG ASP B 56 10.492 2.418 17.163 1.00 30.51 C ATOM 2677 OD1 ASP B 56 9.678 3.363 17.295 1.00 13.35 O ATOM 2678 OD2 ASP B 56 11.008 1.849 18.154 1.00 55.41 O ATOM 0 H ASP B 56 11.022 0.914 13.465 1.00 23.11 H new ATOM 0 HA ASP B 56 10.716 -0.186 16.108 1.00 31.53 H new ATOM 0 HB2 ASP B 56 11.956 1.914 15.664 1.00 64.13 H new ATOM 0 HB3 ASP B 56 10.507 2.661 15.022 1.00 64.13 H new ATOM 2683 N TYR B 57 8.053 0.887 14.476 1.00 24.30 N ATOM 2684 CA TYR B 57 6.576 0.853 14.432 1.00 3.33 C ATOM 2685 C TYR B 57 6.109 -0.605 14.456 1.00 65.14 C ATOM 2686 O TYR B 57 5.151 -0.949 15.157 1.00 52.24 O ATOM 2687 CB TYR B 57 6.025 1.569 13.160 1.00 14.10 C ATOM 2688 CG TYR B 57 4.485 1.534 13.040 1.00 40.00 C ATOM 2689 CD1 TYR B 57 3.831 0.529 12.314 1.00 64.54 C ATOM 2690 CD2 TYR B 57 3.686 2.465 13.711 1.00 24.21 C ATOM 2691 CE1 TYR B 57 2.452 0.457 12.269 1.00 10.42 C ATOM 2692 CE2 TYR B 57 2.304 2.405 13.649 1.00 73.03 C ATOM 2693 CZ TYR B 57 1.695 1.388 12.936 1.00 63.25 C ATOM 2694 OH TYR B 57 0.320 1.273 12.915 1.00 62.22 O ATOM 0 H TYR B 57 8.481 1.206 13.607 1.00 24.30 H new ATOM 0 HA TYR B 57 6.190 1.385 15.302 1.00 3.33 H new ATOM 0 HB2 TYR B 57 6.356 2.608 13.168 1.00 14.10 H new ATOM 0 HB3 TYR B 57 6.459 1.103 12.276 1.00 14.10 H new ATOM 0 HD1 TYR B 57 4.417 -0.204 11.779 1.00 64.54 H new ATOM 0 HD2 TYR B 57 4.156 3.247 14.289 1.00 24.21 H new ATOM 0 HE1 TYR B 57 1.970 -0.331 11.710 1.00 10.42 H new ATOM 0 HE2 TYR B 57 1.705 3.148 14.154 1.00 73.03 H new ATOM 0 HH TYR B 57 0.029 0.986 12.024 1.00 62.22 H new ATOM 2704 N CYS B 58 6.797 -1.444 13.656 1.00 13.42 N ATOM 2705 CA CYS B 58 6.554 -2.889 13.611 1.00 43.04 C ATOM 2706 C CYS B 58 6.862 -3.531 14.974 1.00 65.33 C ATOM 2707 O CYS B 58 6.108 -4.387 15.447 1.00 0.04 O ATOM 2708 CB CYS B 58 7.404 -3.537 12.498 1.00 41.45 C ATOM 2709 SG CYS B 58 6.958 -2.983 10.843 1.00 41.41 S ATOM 0 H CYS B 58 7.536 -1.133 13.025 1.00 13.42 H new ATOM 0 HA CYS B 58 5.501 -3.059 13.386 1.00 43.04 H new ATOM 0 HB2 CYS B 58 8.456 -3.313 12.677 1.00 41.45 H new ATOM 0 HB3 CYS B 58 7.295 -4.620 12.552 1.00 41.45 H new ATOM 0 HG CYS B 58 7.465 -1.805 10.628 1.00 41.41 H new ATOM 2715 N ARG B 59 7.978 -3.088 15.593 1.00 0.42 N ATOM 2716 CA ARG B 59 8.425 -3.565 16.920 1.00 51.22 C ATOM 2717 C ARG B 59 7.345 -3.278 17.966 1.00 53.41 C ATOM 2718 O ARG B 59 6.960 -4.158 18.742 1.00 74.12 O ATOM 2719 CB ARG B 59 9.759 -2.877 17.323 1.00 13.40 C ATOM 2720 CG ARG B 59 10.378 -3.382 18.644 1.00 12.55 C ATOM 2721 CD ARG B 59 11.528 -2.487 19.128 1.00 13.35 C ATOM 2722 NE ARG B 59 11.085 -1.111 19.433 1.00 51.01 N ATOM 2723 CZ ARG B 59 10.894 -0.608 20.661 1.00 3.10 C ATOM 2724 NH1 ARG B 59 11.096 -1.349 21.748 1.00 2.12 N ATOM 2725 NH2 ARG B 59 10.520 0.649 20.794 1.00 53.45 N ATOM 0 H ARG B 59 8.596 -2.387 15.185 1.00 0.42 H new ATOM 0 HA ARG B 59 8.594 -4.641 16.868 1.00 51.22 H new ATOM 0 HB2 ARG B 59 10.483 -3.022 16.521 1.00 13.40 H new ATOM 0 HB3 ARG B 59 9.587 -1.804 17.406 1.00 13.40 H new ATOM 0 HG2 ARG B 59 9.606 -3.424 19.412 1.00 12.55 H new ATOM 0 HG3 ARG B 59 10.745 -4.399 18.505 1.00 12.55 H new ATOM 0 HD2 ARG B 59 11.976 -2.927 20.019 1.00 13.35 H new ATOM 0 HD3 ARG B 59 12.305 -2.454 18.364 1.00 13.35 H new ATOM 0 HE ARG B 59 10.910 -0.491 18.642 1.00 51.01 H new ATOM 0 HH11 ARG B 59 11.402 -2.318 21.655 1.00 2.12 H new ATOM 0 HH12 ARG B 59 10.945 -0.948 22.674 1.00 2.12 H new ATOM 0 HH21 ARG B 59 10.379 1.229 19.967 1.00 53.45 H new ATOM 0 HH22 ARG B 59 10.372 1.041 21.724 1.00 53.45 H new ATOM 2739 N HIS B 60 6.843 -2.032 17.917 1.00 72.24 N ATOM 2740 CA HIS B 60 5.747 -1.551 18.760 1.00 42.21 C ATOM 2741 C HIS B 60 4.480 -2.394 18.559 1.00 52.23 C ATOM 2742 O HIS B 60 3.868 -2.815 19.527 1.00 54.42 O ATOM 2743 CB HIS B 60 5.467 -0.052 18.450 1.00 22.42 C ATOM 2744 CG HIS B 60 4.188 0.483 19.043 1.00 3.01 C ATOM 2745 ND1 HIS B 60 4.066 0.881 20.351 1.00 53.20 N ATOM 2746 CD2 HIS B 60 2.962 0.647 18.492 1.00 42.21 C ATOM 2747 CE1 HIS B 60 2.825 1.264 20.577 1.00 72.30 C ATOM 2748 NE2 HIS B 60 2.137 1.131 19.467 1.00 14.23 N ATOM 0 H HIS B 60 7.198 -1.322 17.277 1.00 72.24 H new ATOM 0 HA HIS B 60 6.043 -1.650 19.804 1.00 42.21 H new ATOM 0 HB2 HIS B 60 6.301 0.544 18.820 1.00 22.42 H new ATOM 0 HB3 HIS B 60 5.435 0.082 17.369 1.00 22.42 H new ATOM 0 HD2 HIS B 60 2.687 0.434 17.469 1.00 42.21 H new ATOM 0 HE1 HIS B 60 2.439 1.627 21.518 1.00 72.30 H new ATOM 0 HE2 HIS B 60 1.148 1.353 19.352 1.00 14.23 H new ATOM 2757 N HIS B 61 4.115 -2.635 17.291 1.00 42.45 N ATOM 2758 CA HIS B 61 2.828 -3.262 16.928 1.00 43.33 C ATOM 2759 C HIS B 61 2.809 -4.772 17.257 1.00 13.31 C ATOM 2760 O HIS B 61 1.747 -5.335 17.533 1.00 53.42 O ATOM 2761 CB HIS B 61 2.544 -3.038 15.418 1.00 24.32 C ATOM 2762 CG HIS B 61 1.121 -3.314 14.996 1.00 3.45 C ATOM 2763 ND1 HIS B 61 0.557 -4.569 15.011 1.00 64.24 N ATOM 2764 CD2 HIS B 61 0.138 -2.476 14.585 1.00 2.32 C ATOM 2765 CE1 HIS B 61 -0.695 -4.495 14.621 1.00 5.51 C ATOM 2766 NE2 HIS B 61 -0.980 -3.237 14.361 1.00 61.01 N ATOM 0 H HIS B 61 4.699 -2.403 16.488 1.00 42.45 H new ATOM 0 HA HIS B 61 2.046 -2.790 17.522 1.00 43.33 H new ATOM 0 HB2 HIS B 61 2.790 -2.007 15.165 1.00 24.32 H new ATOM 0 HB3 HIS B 61 3.211 -3.676 14.838 1.00 24.32 H new ATOM 0 HD1 HIS B 61 1.038 -5.426 15.283 1.00 64.24 H new ATOM 0 HD2 HIS B 61 0.220 -1.407 14.458 1.00 2.32 H new ATOM 0 HE1 HIS B 61 -1.377 -5.328 14.529 1.00 5.51 H new ATOM 2775 N HIS B 62 3.983 -5.422 17.192 1.00 44.43 N ATOM 2776 CA HIS B 62 4.107 -6.877 17.430 1.00 22.50 C ATOM 2777 C HIS B 62 4.135 -7.181 18.941 1.00 43.20 C ATOM 2778 O HIS B 62 3.448 -8.097 19.416 1.00 24.32 O ATOM 2779 CB HIS B 62 5.386 -7.411 16.734 1.00 41.44 C ATOM 2780 CG HIS B 62 5.636 -8.901 16.873 1.00 75.11 C ATOM 2781 ND1 HIS B 62 5.313 -9.817 15.892 1.00 32.31 N ATOM 2782 CD2 HIS B 62 6.222 -9.622 17.866 1.00 13.53 C ATOM 2783 CE1 HIS B 62 5.693 -11.022 16.276 1.00 54.41 C ATOM 2784 NE2 HIS B 62 6.245 -10.926 17.463 1.00 30.53 N ATOM 0 H HIS B 62 4.867 -4.962 16.975 1.00 44.43 H new ATOM 0 HA HIS B 62 3.239 -7.382 17.006 1.00 22.50 H new ATOM 0 HB2 HIS B 62 5.329 -7.168 15.673 1.00 41.44 H new ATOM 0 HB3 HIS B 62 6.247 -6.877 17.137 1.00 41.44 H new ATOM 0 HD1 HIS B 62 4.853 -9.597 15.009 1.00 32.31 H new ATOM 0 HD2 HIS B 62 6.599 -9.235 18.801 1.00 13.53 H new ATOM 0 HE1 HIS B 62 5.570 -11.933 15.709 1.00 54.41 H new ATOM 2793 N GLN B 63 4.949 -6.404 19.673 1.00 63.13 N ATOM 2794 CA GLN B 63 5.140 -6.566 21.128 1.00 24.30 C ATOM 2795 C GLN B 63 3.941 -5.988 21.907 1.00 42.40 C ATOM 2796 O GLN B 63 3.569 -6.492 22.972 1.00 35.45 O ATOM 2797 CB GLN B 63 6.462 -5.880 21.561 1.00 64.31 C ATOM 2798 CG GLN B 63 7.736 -6.450 20.883 1.00 61.20 C ATOM 2799 CD GLN B 63 9.028 -5.715 21.276 1.00 1.51 C ATOM 2800 OE1 GLN B 63 9.028 -4.521 21.571 1.00 34.42 O ATOM 2801 NE2 GLN B 63 10.143 -6.415 21.270 1.00 13.11 N ATOM 0 H GLN B 63 5.497 -5.642 19.273 1.00 63.13 H new ATOM 0 HA GLN B 63 5.203 -7.629 21.359 1.00 24.30 H new ATOM 0 HB2 GLN B 63 6.393 -4.815 21.339 1.00 64.31 H new ATOM 0 HB3 GLN B 63 6.568 -5.974 22.642 1.00 64.31 H new ATOM 0 HG2 GLN B 63 7.835 -7.504 21.143 1.00 61.20 H new ATOM 0 HG3 GLN B 63 7.615 -6.399 19.801 1.00 61.20 H new ATOM 0 HE21 GLN B 63 10.123 -7.404 21.023 1.00 13.11 H new ATOM 0 HE22 GLN B 63 11.027 -5.968 21.513 1.00 13.11 H new ATOM 2810 N HIS B 64 3.353 -4.914 21.357 1.00 43.10 N ATOM 2811 CA HIS B 64 2.147 -4.263 21.897 1.00 62.41 C ATOM 2812 C HIS B 64 1.092 -4.174 20.763 1.00 61.42 C ATOM 2813 O HIS B 64 1.109 -3.216 19.976 1.00 33.22 O ATOM 2814 CB HIS B 64 2.475 -2.848 22.456 1.00 33.15 C ATOM 2815 CG HIS B 64 3.439 -2.828 23.622 1.00 3.13 C ATOM 2816 ND1 HIS B 64 3.037 -2.683 24.931 1.00 14.22 N ATOM 2817 CD2 HIS B 64 4.791 -2.902 23.664 1.00 72.21 C ATOM 2818 CE1 HIS B 64 4.094 -2.661 25.714 1.00 13.34 C ATOM 2819 NE2 HIS B 64 5.172 -2.794 24.974 1.00 40.23 N ATOM 0 H HIS B 64 3.707 -4.466 20.512 1.00 43.10 H new ATOM 0 HA HIS B 64 1.755 -4.852 22.726 1.00 62.41 H new ATOM 0 HB2 HIS B 64 2.891 -2.243 21.650 1.00 33.15 H new ATOM 0 HB3 HIS B 64 1.545 -2.371 22.765 1.00 33.15 H new ATOM 0 HD2 HIS B 64 5.449 -3.024 22.817 1.00 72.21 H new ATOM 0 HE1 HIS B 64 4.078 -2.552 26.788 1.00 13.34 H new ATOM 0 HE2 HIS B 64 6.132 -2.813 25.318 1.00 40.23 H new ATOM 2828 N PRO B 65 0.194 -5.208 20.627 1.00 14.11 N ATOM 2829 CA PRO B 65 -0.854 -5.258 19.554 1.00 34.40 C ATOM 2830 C PRO B 65 -1.786 -4.020 19.501 1.00 12.21 C ATOM 2831 O PRO B 65 -2.370 -3.718 18.448 1.00 63.10 O ATOM 2832 CB PRO B 65 -1.646 -6.542 19.897 1.00 10.32 C ATOM 2833 CG PRO B 65 -0.658 -7.401 20.633 1.00 30.31 C ATOM 2834 CD PRO B 65 0.156 -6.440 21.468 1.00 5.20 C ATOM 0 HA PRO B 65 -0.399 -5.260 18.564 1.00 34.40 H new ATOM 0 HB2 PRO B 65 -2.517 -6.320 20.514 1.00 10.32 H new ATOM 0 HB3 PRO B 65 -2.011 -7.037 18.997 1.00 10.32 H new ATOM 0 HG2 PRO B 65 -1.164 -8.136 21.259 1.00 30.31 H new ATOM 0 HG3 PRO B 65 -0.025 -7.955 19.940 1.00 30.31 H new ATOM 0 HD2 PRO B 65 -0.309 -6.253 22.436 1.00 5.20 H new ATOM 0 HD3 PRO B 65 1.157 -6.825 21.665 1.00 5.20 H new ATOM 2842 N GLY B 66 -1.924 -3.323 20.647 1.00 54.41 N ATOM 2843 CA GLY B 66 -2.714 -2.092 20.734 1.00 11.25 C ATOM 2844 C GLY B 66 -4.201 -2.342 20.972 1.00 62.50 C ATOM 2845 O GLY B 66 -5.033 -1.480 20.664 1.00 50.42 O ATOM 0 H GLY B 66 -1.492 -3.600 21.528 1.00 54.41 H new ATOM 0 HA2 GLY B 66 -2.323 -1.474 21.543 1.00 11.25 H new ATOM 0 HA3 GLY B 66 -2.592 -1.524 19.812 1.00 11.25 H new ATOM 2849 N GLY B 67 -4.534 -3.518 21.536 1.00 53.35 N ATOM 2850 CA GLY B 67 -5.920 -3.885 21.837 1.00 72.11 C ATOM 2851 C GLY B 67 -6.367 -3.421 23.219 1.00 0.12 C ATOM 2852 O GLY B 67 -6.670 -4.246 24.088 1.00 42.03 O ATOM 0 H GLY B 67 -3.852 -4.232 21.792 1.00 53.35 H new ATOM 0 HA2 GLY B 67 -6.578 -3.452 21.083 1.00 72.11 H new ATOM 0 HA3 GLY B 67 -6.027 -4.968 21.770 1.00 72.11 H new ATOM 2856 N SER B 68 -6.400 -2.091 23.419 1.00 60.43 N ATOM 2857 CA SER B 68 -6.882 -1.454 24.659 1.00 74.04 C ATOM 2858 C SER B 68 -7.517 -0.098 24.322 1.00 71.34 C ATOM 2859 O SER B 68 -6.845 0.948 24.347 1.00 75.23 O ATOM 2860 CB SER B 68 -5.731 -1.293 25.686 1.00 41.21 C ATOM 2861 OG SER B 68 -5.214 -2.555 26.082 1.00 43.25 O ATOM 0 H SER B 68 -6.089 -1.420 22.716 1.00 60.43 H new ATOM 0 HA SER B 68 -7.636 -2.094 25.117 1.00 74.04 H new ATOM 0 HB2 SER B 68 -4.933 -0.691 25.250 1.00 41.21 H new ATOM 0 HB3 SER B 68 -6.094 -0.755 26.562 1.00 41.21 H new ATOM 0 HG SER B 68 -4.489 -2.423 26.728 1.00 43.25 H new ATOM 2867 N GLY B 69 -8.814 -0.144 23.955 1.00 14.53 N ATOM 2868 CA GLY B 69 -9.570 1.047 23.577 1.00 25.35 C ATOM 2869 C GLY B 69 -9.169 1.577 22.206 1.00 72.11 C ATOM 2870 O GLY B 69 -8.224 2.364 22.099 1.00 3.01 O ATOM 0 H GLY B 69 -9.356 -1.007 23.915 1.00 14.53 H new ATOM 0 HA2 GLY B 69 -10.635 0.813 23.576 1.00 25.35 H new ATOM 0 HA3 GLY B 69 -9.415 1.825 24.324 1.00 25.35 H new ATOM 2874 N LEU B 70 -9.883 1.135 21.153 1.00 62.22 N ATOM 2875 CA LEU B 70 -9.647 1.571 19.764 1.00 51.50 C ATOM 2876 C LEU B 70 -10.284 2.969 19.573 1.00 55.52 C ATOM 2877 O LEU B 70 -11.285 3.137 18.871 1.00 61.52 O ATOM 2878 CB LEU B 70 -10.209 0.521 18.745 1.00 24.12 C ATOM 2879 CG LEU B 70 -9.444 -0.854 18.639 1.00 11.11 C ATOM 2880 CD1 LEU B 70 -9.488 -1.678 19.949 1.00 34.32 C ATOM 2881 CD2 LEU B 70 -9.964 -1.693 17.449 1.00 43.32 C ATOM 0 H LEU B 70 -10.644 0.462 21.243 1.00 62.22 H new ATOM 0 HA LEU B 70 -8.577 1.643 19.570 1.00 51.50 H new ATOM 0 HB2 LEU B 70 -11.245 0.312 19.010 1.00 24.12 H new ATOM 0 HB3 LEU B 70 -10.219 0.980 17.756 1.00 24.12 H new ATOM 0 HG LEU B 70 -8.398 -0.604 18.462 1.00 11.11 H new ATOM 0 HD11 LEU B 70 -8.944 -2.612 19.810 1.00 34.32 H new ATOM 0 HD12 LEU B 70 -9.027 -1.106 20.754 1.00 34.32 H new ATOM 0 HD13 LEU B 70 -10.524 -1.897 20.207 1.00 34.32 H new ATOM 0 HD21 LEU B 70 -9.418 -2.635 17.402 1.00 43.32 H new ATOM 0 HD22 LEU B 70 -11.026 -1.896 17.584 1.00 43.32 H new ATOM 0 HD23 LEU B 70 -9.815 -1.140 16.521 1.00 43.32 H new ATOM 2893 N ASP B 71 -9.663 3.955 20.240 1.00 20.12 N ATOM 2894 CA ASP B 71 -10.204 5.316 20.446 1.00 62.20 C ATOM 2895 C ASP B 71 -9.175 6.160 21.225 1.00 75.13 C ATOM 2896 O ASP B 71 -9.095 7.382 21.047 1.00 71.01 O ATOM 2897 CB ASP B 71 -11.552 5.273 21.236 1.00 42.54 C ATOM 2898 CG ASP B 71 -12.179 6.664 21.465 1.00 31.54 C ATOM 2899 OD1 ASP B 71 -12.746 7.238 20.512 1.00 24.01 O ATOM 2900 OD2 ASP B 71 -12.122 7.189 22.602 1.00 45.42 O ATOM 0 H ASP B 71 -8.744 3.828 20.664 1.00 20.12 H new ATOM 0 HA ASP B 71 -10.395 5.764 19.471 1.00 62.20 H new ATOM 0 HB2 ASP B 71 -12.262 4.649 20.693 1.00 42.54 H new ATOM 0 HB3 ASP B 71 -11.382 4.797 22.202 1.00 42.54 H new ATOM 2905 N ASP B 72 -8.402 5.464 22.101 1.00 41.12 N ATOM 2906 CA ASP B 72 -7.352 6.063 22.963 1.00 14.33 C ATOM 2907 C ASP B 72 -6.345 6.892 22.147 1.00 72.23 C ATOM 2908 O ASP B 72 -6.029 8.032 22.517 1.00 41.33 O ATOM 2909 CB ASP B 72 -6.608 4.939 23.750 1.00 61.20 C ATOM 2910 CG ASP B 72 -5.436 5.465 24.620 1.00 41.30 C ATOM 2911 OD1 ASP B 72 -4.259 5.348 24.207 1.00 25.25 O ATOM 2912 OD2 ASP B 72 -5.689 6.008 25.717 1.00 64.34 O ATOM 0 H ASP B 72 -8.494 4.456 22.229 1.00 41.12 H new ATOM 0 HA ASP B 72 -7.842 6.739 23.664 1.00 14.33 H new ATOM 0 HB2 ASP B 72 -7.322 4.421 24.391 1.00 61.20 H new ATOM 0 HB3 ASP B 72 -6.224 4.204 23.042 1.00 61.20 H new ATOM 2917 N ILE B 73 -5.880 6.296 21.027 1.00 63.13 N ATOM 2918 CA ILE B 73 -4.806 6.838 20.171 1.00 3.22 C ATOM 2919 C ILE B 73 -3.512 7.019 21.010 1.00 43.03 C ATOM 2920 O ILE B 73 -3.315 8.078 21.629 1.00 24.14 O ATOM 2921 CB ILE B 73 -5.210 8.185 19.429 1.00 53.44 C ATOM 2922 CG1 ILE B 73 -6.540 8.002 18.620 1.00 5.44 C ATOM 2923 CG2 ILE B 73 -4.062 8.702 18.511 1.00 61.01 C ATOM 2924 CD1 ILE B 73 -6.496 6.942 17.525 1.00 3.31 C ATOM 0 H ILE B 73 -6.249 5.408 20.688 1.00 63.13 H new ATOM 0 HA ILE B 73 -4.626 6.113 19.377 1.00 3.22 H new ATOM 0 HB ILE B 73 -5.381 8.942 20.194 1.00 53.44 H new ATOM 0 HG12 ILE B 73 -7.338 7.747 19.317 1.00 5.44 H new ATOM 0 HG13 ILE B 73 -6.805 8.958 18.167 1.00 5.44 H new ATOM 0 HG21 ILE B 73 -4.375 9.624 18.021 1.00 61.01 H new ATOM 0 HG22 ILE B 73 -3.174 8.895 19.113 1.00 61.01 H new ATOM 0 HG23 ILE B 73 -3.833 7.950 17.756 1.00 61.01 H new ATOM 0 HD11 ILE B 73 -7.464 6.894 17.026 1.00 3.31 H new ATOM 0 HD12 ILE B 73 -5.726 7.201 16.799 1.00 3.31 H new ATOM 0 HD13 ILE B 73 -6.267 5.972 17.967 1.00 3.31 H new ATOM 2936 N PRO B 74 -2.645 5.955 21.101 1.00 63.11 N ATOM 2937 CA PRO B 74 -1.406 6.001 21.914 1.00 31.11 C ATOM 2938 C PRO B 74 -0.465 7.151 21.475 1.00 3.32 C ATOM 2939 O PRO B 74 -0.177 7.280 20.275 1.00 4.40 O ATOM 2940 CB PRO B 74 -0.761 4.609 21.680 1.00 13.41 C ATOM 2941 CG PRO B 74 -1.897 3.728 21.241 1.00 71.34 C ATOM 2942 CD PRO B 74 -2.812 4.625 20.443 1.00 11.23 C ATOM 0 HA PRO B 74 -1.607 6.200 22.967 1.00 31.11 H new ATOM 0 HB2 PRO B 74 0.019 4.657 20.920 1.00 13.41 H new ATOM 0 HB3 PRO B 74 -0.296 4.231 22.590 1.00 13.41 H new ATOM 0 HG2 PRO B 74 -1.538 2.895 20.637 1.00 71.34 H new ATOM 0 HG3 PRO B 74 -2.416 3.299 22.098 1.00 71.34 H new ATOM 0 HD2 PRO B 74 -2.527 4.657 19.391 1.00 11.23 H new ATOM 0 HD3 PRO B 74 -3.846 4.283 20.483 1.00 11.23 H new ATOM 2950 N PRO B 75 0.016 8.012 22.436 1.00 23.04 N ATOM 2951 CA PRO B 75 0.937 9.147 22.136 1.00 14.01 C ATOM 2952 C PRO B 75 2.251 8.701 21.465 1.00 35.44 C ATOM 2953 O PRO B 75 2.944 9.508 20.858 1.00 5.04 O ATOM 2954 CB PRO B 75 1.194 9.788 23.527 1.00 65.43 C ATOM 2955 CG PRO B 75 0.026 9.355 24.364 1.00 45.44 C ATOM 2956 CD PRO B 75 -0.308 7.960 23.888 1.00 73.44 C ATOM 0 HA PRO B 75 0.501 9.840 21.417 1.00 14.01 H new ATOM 0 HB2 PRO B 75 2.137 9.445 23.954 1.00 65.43 H new ATOM 0 HB3 PRO B 75 1.252 10.874 23.459 1.00 65.43 H new ATOM 0 HG2 PRO B 75 0.279 9.359 25.424 1.00 45.44 H new ATOM 0 HG3 PRO B 75 -0.822 10.028 24.235 1.00 45.44 H new ATOM 0 HD2 PRO B 75 0.283 7.205 24.406 1.00 73.44 H new ATOM 0 HD3 PRO B 75 -1.357 7.716 24.059 1.00 73.44 H new ATOM 2964 N TYR B 76 2.575 7.403 21.601 1.00 23.50 N ATOM 2965 CA TYR B 76 3.708 6.757 20.919 1.00 73.23 C ATOM 2966 C TYR B 76 3.520 6.835 19.391 1.00 44.13 C ATOM 2967 O TYR B 76 4.395 7.323 18.668 1.00 71.31 O ATOM 2968 CB TYR B 76 3.804 5.273 21.380 1.00 53.11 C ATOM 2969 CG TYR B 76 5.102 4.544 20.995 1.00 21.31 C ATOM 2970 CD1 TYR B 76 6.100 4.301 21.943 1.00 61.32 C ATOM 2971 CD2 TYR B 76 5.333 4.096 19.691 1.00 64.30 C ATOM 2972 CE1 TYR B 76 7.259 3.640 21.604 1.00 14.11 C ATOM 2973 CE2 TYR B 76 6.498 3.438 19.350 1.00 1.15 C ATOM 2974 CZ TYR B 76 7.457 3.215 20.311 1.00 73.22 C ATOM 2975 OH TYR B 76 8.614 2.546 19.991 1.00 61.45 O ATOM 0 H TYR B 76 2.048 6.765 22.197 1.00 23.50 H new ATOM 0 HA TYR B 76 4.633 7.273 21.177 1.00 73.23 H new ATOM 0 HB2 TYR B 76 3.697 5.240 22.464 1.00 53.11 H new ATOM 0 HB3 TYR B 76 2.961 4.725 20.959 1.00 53.11 H new ATOM 0 HD1 TYR B 76 5.959 4.638 22.959 1.00 61.32 H new ATOM 0 HD2 TYR B 76 4.583 4.269 18.933 1.00 64.30 H new ATOM 0 HE1 TYR B 76 8.014 3.455 22.354 1.00 14.11 H new ATOM 0 HE2 TYR B 76 6.655 3.101 18.336 1.00 1.15 H new ATOM 0 HH TYR B 76 8.971 2.894 19.147 1.00 61.45 H new ATOM 2985 N ASP B 77 2.355 6.343 18.931 1.00 20.24 N ATOM 2986 CA ASP B 77 1.995 6.270 17.496 1.00 75.13 C ATOM 2987 C ASP B 77 1.683 7.657 16.927 1.00 72.40 C ATOM 2988 O ASP B 77 1.874 7.912 15.734 1.00 62.42 O ATOM 2989 CB ASP B 77 0.772 5.342 17.300 1.00 10.42 C ATOM 2990 CG ASP B 77 1.038 3.914 17.783 1.00 62.32 C ATOM 2991 OD1 ASP B 77 1.426 3.055 16.966 1.00 54.21 O ATOM 2992 OD2 ASP B 77 0.897 3.658 18.996 1.00 75.22 O ATOM 0 H ASP B 77 1.628 5.981 19.548 1.00 20.24 H new ATOM 0 HA ASP B 77 2.852 5.864 16.959 1.00 75.13 H new ATOM 0 HB2 ASP B 77 -0.082 5.752 17.840 1.00 10.42 H new ATOM 0 HB3 ASP B 77 0.501 5.321 16.244 1.00 10.42 H new ATOM 2997 N ARG B 78 1.184 8.546 17.795 1.00 54.42 N ATOM 2998 CA ARG B 78 0.840 9.922 17.422 1.00 44.00 C ATOM 2999 C ARG B 78 2.118 10.770 17.251 1.00 11.23 C ATOM 3000 O ARG B 78 2.198 11.629 16.363 1.00 14.13 O ATOM 3001 CB ARG B 78 -0.107 10.526 18.483 1.00 44.40 C ATOM 3002 CG ARG B 78 -0.727 11.877 18.078 1.00 64.42 C ATOM 3003 CD ARG B 78 -1.745 12.394 19.102 1.00 25.03 C ATOM 3004 NE ARG B 78 -2.355 13.659 18.660 1.00 53.23 N ATOM 3005 CZ ARG B 78 -3.471 14.206 19.159 1.00 75.34 C ATOM 3006 NH1 ARG B 78 -4.154 13.621 20.142 1.00 63.54 N ATOM 3007 NH2 ARG B 78 -3.905 15.351 18.651 1.00 3.52 N ATOM 0 H ARG B 78 1.008 8.330 18.776 1.00 54.42 H new ATOM 0 HA ARG B 78 0.321 9.920 16.464 1.00 44.00 H new ATOM 0 HB2 ARG B 78 -0.909 9.816 18.684 1.00 44.40 H new ATOM 0 HB3 ARG B 78 0.444 10.656 19.414 1.00 44.40 H new ATOM 0 HG2 ARG B 78 0.067 12.614 17.957 1.00 64.42 H new ATOM 0 HG3 ARG B 78 -1.215 11.772 17.109 1.00 64.42 H new ATOM 0 HD2 ARG B 78 -2.523 11.646 19.253 1.00 25.03 H new ATOM 0 HD3 ARG B 78 -1.253 12.542 20.064 1.00 25.03 H new ATOM 0 HE ARG B 78 -1.886 14.163 17.907 1.00 53.23 H new ATOM 0 HH11 ARG B 78 -3.830 12.736 20.532 1.00 63.54 H new ATOM 0 HH12 ARG B 78 -5.001 14.058 20.505 1.00 63.54 H new ATOM 0 HH21 ARG B 78 -3.391 15.800 17.893 1.00 3.52 H new ATOM 0 HH22 ARG B 78 -4.753 15.783 19.018 1.00 3.52 H new ATOM 3021 N ASP B 79 3.123 10.504 18.109 1.00 21.34 N ATOM 3022 CA ASP B 79 4.462 11.123 17.989 1.00 23.44 C ATOM 3023 C ASP B 79 5.283 10.459 16.880 1.00 45.51 C ATOM 3024 O ASP B 79 6.222 11.063 16.372 1.00 60.22 O ATOM 3025 CB ASP B 79 5.245 11.136 19.331 1.00 21.12 C ATOM 3026 CG ASP B 79 4.811 12.294 20.253 1.00 42.31 C ATOM 3027 OD1 ASP B 79 4.257 12.052 21.347 1.00 51.41 O ATOM 3028 OD2 ASP B 79 5.021 13.471 19.868 1.00 21.33 O ATOM 0 H ASP B 79 3.034 9.862 18.897 1.00 21.34 H new ATOM 0 HA ASP B 79 4.295 12.165 17.717 1.00 23.44 H new ATOM 0 HB2 ASP B 79 5.093 10.188 19.847 1.00 21.12 H new ATOM 0 HB3 ASP B 79 6.312 11.219 19.125 1.00 21.12 H new ATOM 3033 N PHE B 80 4.946 9.206 16.534 1.00 62.21 N ATOM 3034 CA PHE B 80 5.481 8.538 15.330 1.00 42.25 C ATOM 3035 C PHE B 80 5.061 9.326 14.067 1.00 20.10 C ATOM 3036 O PHE B 80 5.860 9.510 13.134 1.00 23.12 O ATOM 3037 CB PHE B 80 4.983 7.062 15.263 1.00 21.30 C ATOM 3038 CG PHE B 80 5.343 6.336 13.969 1.00 32.33 C ATOM 3039 CD1 PHE B 80 4.437 6.274 12.905 1.00 40.32 C ATOM 3040 CD2 PHE B 80 6.599 5.767 13.796 1.00 2.45 C ATOM 3041 CE1 PHE B 80 4.784 5.668 11.720 1.00 21.21 C ATOM 3042 CE2 PHE B 80 6.935 5.154 12.612 1.00 74.30 C ATOM 3043 CZ PHE B 80 6.036 5.110 11.574 1.00 64.13 C ATOM 0 H PHE B 80 4.301 8.629 17.074 1.00 62.21 H new ATOM 0 HA PHE B 80 6.570 8.521 15.381 1.00 42.25 H new ATOM 0 HB2 PHE B 80 5.403 6.511 16.104 1.00 21.30 H new ATOM 0 HB3 PHE B 80 3.900 7.050 15.383 1.00 21.30 H new ATOM 0 HD1 PHE B 80 3.454 6.707 13.015 1.00 40.32 H new ATOM 0 HD2 PHE B 80 7.319 5.807 14.600 1.00 2.45 H new ATOM 0 HE1 PHE B 80 4.076 5.629 10.905 1.00 21.21 H new ATOM 0 HE2 PHE B 80 7.910 4.705 12.497 1.00 74.30 H new ATOM 0 HZ PHE B 80 6.311 4.638 10.642 1.00 64.13 H new ATOM 3053 N CYS B 81 3.800 9.800 14.076 1.00 51.34 N ATOM 3054 CA CYS B 81 3.199 10.566 12.969 1.00 32.41 C ATOM 3055 C CYS B 81 3.713 12.030 12.911 1.00 20.41 C ATOM 3056 O CYS B 81 3.278 12.795 12.043 1.00 25.15 O ATOM 3057 CB CYS B 81 1.655 10.522 13.092 1.00 41.00 C ATOM 3058 SG CYS B 81 0.968 8.852 12.995 1.00 25.42 S ATOM 0 H CYS B 81 3.164 9.660 14.861 1.00 51.34 H new ATOM 0 HA CYS B 81 3.504 10.099 12.032 1.00 32.41 H new ATOM 0 HB2 CYS B 81 1.362 10.972 14.040 1.00 41.00 H new ATOM 0 HB3 CYS B 81 1.218 11.132 12.301 1.00 41.00 H new ATOM 0 HG CYS B 81 1.250 8.203 14.085 1.00 25.42 H new ATOM 3064 N LYS B 82 4.633 12.423 13.837 1.00 21.21 N ATOM 3065 CA LYS B 82 5.346 13.715 13.754 1.00 21.35 C ATOM 3066 C LYS B 82 6.425 13.610 12.672 1.00 34.33 C ATOM 3067 O LYS B 82 7.562 13.206 12.937 1.00 73.51 O ATOM 3068 CB LYS B 82 5.984 14.110 15.114 1.00 5.34 C ATOM 3069 CG LYS B 82 4.984 14.254 16.266 1.00 23.40 C ATOM 3070 CD LYS B 82 3.934 15.359 16.042 1.00 24.23 C ATOM 3071 CE LYS B 82 2.906 15.404 17.185 1.00 73.04 C ATOM 3072 NZ LYS B 82 3.543 15.648 18.509 1.00 54.14 N ATOM 0 H LYS B 82 4.893 11.858 14.646 1.00 21.21 H new ATOM 0 HA LYS B 82 4.629 14.495 13.499 1.00 21.35 H new ATOM 0 HB2 LYS B 82 6.726 13.359 15.385 1.00 5.34 H new ATOM 0 HB3 LYS B 82 6.516 15.053 14.991 1.00 5.34 H new ATOM 0 HG2 LYS B 82 4.472 13.303 16.411 1.00 23.40 H new ATOM 0 HG3 LYS B 82 5.530 14.466 17.185 1.00 23.40 H new ATOM 0 HD2 LYS B 82 4.433 16.325 15.962 1.00 24.23 H new ATOM 0 HD3 LYS B 82 3.420 15.187 15.096 1.00 24.23 H new ATOM 0 HE2 LYS B 82 2.177 16.190 16.985 1.00 73.04 H new ATOM 0 HE3 LYS B 82 2.359 14.462 17.216 1.00 73.04 H new ATOM 0 HZ1 LYS B 82 2.815 15.921 19.199 1.00 54.14 H new ATOM 0 HZ2 LYS B 82 4.017 14.780 18.831 1.00 54.14 H new ATOM 0 HZ3 LYS B 82 4.242 16.413 18.422 1.00 54.14 H new ATOM 3086 N VAL B 83 6.015 13.888 11.437 1.00 42.54 N ATOM 3087 CA VAL B 83 6.874 13.845 10.249 1.00 31.24 C ATOM 3088 C VAL B 83 6.583 15.079 9.384 1.00 63.11 C ATOM 3089 O VAL B 83 5.472 15.630 9.426 1.00 21.45 O ATOM 3090 CB VAL B 83 6.632 12.517 9.419 1.00 31.04 C ATOM 3091 CG1 VAL B 83 7.182 11.276 10.150 1.00 70.21 C ATOM 3092 CG2 VAL B 83 5.141 12.314 9.089 1.00 21.43 C ATOM 0 H VAL B 83 5.054 14.156 11.226 1.00 42.54 H new ATOM 0 HA VAL B 83 7.918 13.850 10.561 1.00 31.24 H new ATOM 0 HB VAL B 83 7.179 12.635 8.484 1.00 31.04 H new ATOM 0 HG11 VAL B 83 6.996 10.387 9.548 1.00 70.21 H new ATOM 0 HG12 VAL B 83 8.255 11.391 10.306 1.00 70.21 H new ATOM 0 HG13 VAL B 83 6.685 11.172 11.114 1.00 70.21 H new ATOM 0 HG21 VAL B 83 5.017 11.393 8.519 1.00 21.43 H new ATOM 0 HG22 VAL B 83 4.569 12.248 10.015 1.00 21.43 H new ATOM 0 HG23 VAL B 83 4.781 13.157 8.499 1.00 21.43 H new ATOM 3102 N ASP B 84 7.591 15.516 8.619 1.00 72.41 N ATOM 3103 CA ASP B 84 7.455 16.651 7.682 1.00 24.43 C ATOM 3104 C ASP B 84 6.670 16.186 6.430 1.00 32.23 C ATOM 3105 O ASP B 84 6.435 14.978 6.270 1.00 14.13 O ATOM 3106 CB ASP B 84 8.871 17.194 7.325 1.00 74.12 C ATOM 3107 CG ASP B 84 8.854 18.565 6.622 1.00 73.22 C ATOM 3108 OD1 ASP B 84 8.081 19.449 7.046 1.00 2.35 O ATOM 3109 OD2 ASP B 84 9.615 18.780 5.656 1.00 62.02 O ATOM 0 H ASP B 84 8.522 15.099 8.628 1.00 72.41 H new ATOM 0 HA ASP B 84 6.895 17.467 8.139 1.00 24.43 H new ATOM 0 HB2 ASP B 84 9.461 17.272 8.238 1.00 74.12 H new ATOM 0 HB3 ASP B 84 9.375 16.473 6.681 1.00 74.12 H new ATOM 3114 N GLN B 85 6.265 17.131 5.554 1.00 64.44 N ATOM 3115 CA GLN B 85 5.417 16.826 4.371 1.00 25.32 C ATOM 3116 C GLN B 85 6.035 15.742 3.429 1.00 61.32 C ATOM 3117 O GLN B 85 5.331 14.775 3.106 1.00 73.02 O ATOM 3118 CB GLN B 85 5.044 18.127 3.586 1.00 30.14 C ATOM 3119 CG GLN B 85 4.193 17.903 2.303 1.00 41.14 C ATOM 3120 CD GLN B 85 2.786 17.319 2.538 1.00 34.10 C ATOM 3121 OE1 GLN B 85 2.527 16.571 3.474 1.00 35.25 O ATOM 3122 NE2 GLN B 85 1.863 17.645 1.663 1.00 63.30 N ATOM 0 H GLN B 85 6.511 18.117 5.641 1.00 64.44 H new ATOM 0 HA GLN B 85 4.497 16.392 4.762 1.00 25.32 H new ATOM 0 HB2 GLN B 85 4.497 18.792 4.255 1.00 30.14 H new ATOM 0 HB3 GLN B 85 5.964 18.641 3.308 1.00 30.14 H new ATOM 0 HG2 GLN B 85 4.091 18.856 1.784 1.00 41.14 H new ATOM 0 HG3 GLN B 85 4.739 17.235 1.637 1.00 41.14 H new ATOM 0 HE21 GLN B 85 2.092 18.268 0.889 1.00 63.30 H new ATOM 0 HE22 GLN B 85 0.917 17.275 1.758 1.00 63.30 H new ATOM 3131 N PRO B 86 7.342 15.843 2.971 1.00 21.33 N ATOM 3132 CA PRO B 86 7.975 14.757 2.172 1.00 14.10 C ATOM 3133 C PRO B 86 8.097 13.441 2.972 1.00 62.02 C ATOM 3134 O PRO B 86 7.946 12.354 2.408 1.00 73.23 O ATOM 3135 CB PRO B 86 9.360 15.339 1.792 1.00 32.02 C ATOM 3136 CG PRO B 86 9.633 16.377 2.837 1.00 4.45 C ATOM 3137 CD PRO B 86 8.287 16.989 3.144 1.00 12.42 C ATOM 0 HA PRO B 86 7.383 14.484 1.298 1.00 14.10 H new ATOM 0 HB2 PRO B 86 10.128 14.566 1.791 1.00 32.02 H new ATOM 0 HB3 PRO B 86 9.346 15.776 0.793 1.00 32.02 H new ATOM 0 HG2 PRO B 86 10.076 15.932 3.728 1.00 4.45 H new ATOM 0 HG3 PRO B 86 10.334 17.128 2.473 1.00 4.45 H new ATOM 0 HD2 PRO B 86 8.250 17.392 4.156 1.00 12.42 H new ATOM 0 HD3 PRO B 86 8.054 17.809 2.465 1.00 12.42 H new ATOM 3145 N THR B 87 8.313 13.569 4.302 1.00 11.11 N ATOM 3146 CA THR B 87 8.547 12.437 5.217 1.00 31.02 C ATOM 3147 C THR B 87 7.262 11.582 5.406 1.00 43.41 C ATOM 3148 O THR B 87 7.347 10.370 5.640 1.00 53.52 O ATOM 3149 CB THR B 87 9.082 12.962 6.594 1.00 3.25 C ATOM 3150 OG1 THR B 87 10.058 13.999 6.370 1.00 22.23 O ATOM 3151 CG2 THR B 87 9.720 11.850 7.446 1.00 53.23 C ATOM 0 H THR B 87 8.329 14.474 4.772 1.00 11.11 H new ATOM 0 HA THR B 87 9.302 11.789 4.772 1.00 31.02 H new ATOM 0 HB THR B 87 8.224 13.349 7.143 1.00 3.25 H new ATOM 0 HG1 THR B 87 10.390 14.327 7.232 1.00 22.23 H new ATOM 0 HG21 THR B 87 10.073 12.270 8.388 1.00 53.23 H new ATOM 0 HG22 THR B 87 8.979 11.077 7.649 1.00 53.23 H new ATOM 0 HG23 THR B 87 10.560 11.415 6.906 1.00 53.23 H new ATOM 3159 N LEU B 88 6.078 12.244 5.306 1.00 71.30 N ATOM 3160 CA LEU B 88 4.749 11.576 5.244 1.00 5.13 C ATOM 3161 C LEU B 88 4.731 10.547 4.101 1.00 62.41 C ATOM 3162 O LEU B 88 4.424 9.367 4.310 1.00 73.52 O ATOM 3163 CB LEU B 88 3.612 12.649 5.042 1.00 41.25 C ATOM 3164 CG LEU B 88 3.034 13.308 6.337 1.00 75.34 C ATOM 3165 CD1 LEU B 88 2.247 14.597 6.024 1.00 4.20 C ATOM 3166 CD2 LEU B 88 2.143 12.303 7.111 1.00 33.15 C ATOM 0 H LEU B 88 6.018 13.261 5.266 1.00 71.30 H new ATOM 0 HA LEU B 88 4.568 11.054 6.184 1.00 5.13 H new ATOM 0 HB2 LEU B 88 4.000 13.440 4.401 1.00 41.25 H new ATOM 0 HB3 LEU B 88 2.790 12.177 4.504 1.00 41.25 H new ATOM 0 HG LEU B 88 3.880 13.585 6.966 1.00 75.34 H new ATOM 0 HD11 LEU B 88 1.863 15.023 6.951 1.00 4.20 H new ATOM 0 HD12 LEU B 88 2.906 15.317 5.540 1.00 4.20 H new ATOM 0 HD13 LEU B 88 1.415 14.363 5.360 1.00 4.20 H new ATOM 0 HD21 LEU B 88 1.751 12.781 8.009 1.00 33.15 H new ATOM 0 HD22 LEU B 88 1.315 11.987 6.476 1.00 33.15 H new ATOM 0 HD23 LEU B 88 2.736 11.433 7.393 1.00 33.15 H new ATOM 3178 N PHE B 89 5.122 11.018 2.904 1.00 51.45 N ATOM 3179 CA PHE B 89 5.169 10.201 1.681 1.00 31.43 C ATOM 3180 C PHE B 89 6.278 9.136 1.751 1.00 34.51 C ATOM 3181 O PHE B 89 6.130 8.072 1.169 1.00 62.14 O ATOM 3182 CB PHE B 89 5.335 11.105 0.430 1.00 43.44 C ATOM 3183 CG PHE B 89 4.133 12.023 0.177 1.00 75.41 C ATOM 3184 CD1 PHE B 89 2.956 11.516 -0.374 1.00 24.31 C ATOM 3185 CD2 PHE B 89 4.175 13.386 0.493 1.00 42.45 C ATOM 3186 CE1 PHE B 89 1.866 12.336 -0.597 1.00 64.35 C ATOM 3187 CE2 PHE B 89 3.081 14.205 0.265 1.00 34.21 C ATOM 3188 CZ PHE B 89 1.928 13.679 -0.279 1.00 51.52 C ATOM 0 H PHE B 89 5.416 11.984 2.758 1.00 51.45 H new ATOM 0 HA PHE B 89 4.221 9.670 1.597 1.00 31.43 H new ATOM 0 HB2 PHE B 89 6.230 11.716 0.549 1.00 43.44 H new ATOM 0 HB3 PHE B 89 5.492 10.475 -0.446 1.00 43.44 H new ATOM 0 HD1 PHE B 89 2.896 10.468 -0.630 1.00 24.31 H new ATOM 0 HD2 PHE B 89 5.074 13.805 0.921 1.00 42.45 H new ATOM 0 HE1 PHE B 89 0.962 11.925 -1.022 1.00 64.35 H new ATOM 0 HE2 PHE B 89 3.131 15.255 0.513 1.00 34.21 H new ATOM 0 HZ PHE B 89 1.074 14.316 -0.456 1.00 51.52 H new ATOM 3198 N GLU B 90 7.377 9.428 2.475 1.00 40.34 N ATOM 3199 CA GLU B 90 8.491 8.468 2.669 1.00 25.00 C ATOM 3200 C GLU B 90 8.047 7.231 3.476 1.00 70.45 C ATOM 3201 O GLU B 90 8.518 6.120 3.217 1.00 31.21 O ATOM 3202 CB GLU B 90 9.696 9.147 3.367 1.00 15.15 C ATOM 3203 CG GLU B 90 10.377 10.246 2.535 1.00 63.42 C ATOM 3204 CD GLU B 90 10.978 9.727 1.218 1.00 12.12 C ATOM 3205 OE1 GLU B 90 12.082 9.134 1.257 1.00 33.30 O ATOM 3206 OE2 GLU B 90 10.358 9.916 0.143 1.00 33.01 O ATOM 0 H GLU B 90 7.520 10.325 2.939 1.00 40.34 H new ATOM 0 HA GLU B 90 8.798 8.135 1.678 1.00 25.00 H new ATOM 0 HB2 GLU B 90 9.358 9.579 4.309 1.00 15.15 H new ATOM 0 HB3 GLU B 90 10.435 8.384 3.613 1.00 15.15 H new ATOM 0 HG2 GLU B 90 9.650 11.026 2.312 1.00 63.42 H new ATOM 0 HG3 GLU B 90 11.166 10.706 3.130 1.00 63.42 H new ATOM 3213 N LEU B 91 7.155 7.445 4.468 1.00 25.13 N ATOM 3214 CA LEU B 91 6.558 6.347 5.265 1.00 64.13 C ATOM 3215 C LEU B 91 5.595 5.505 4.396 1.00 51.30 C ATOM 3216 O LEU B 91 5.516 4.286 4.557 1.00 22.14 O ATOM 3217 CB LEU B 91 5.806 6.898 6.512 1.00 64.15 C ATOM 3218 CG LEU B 91 6.647 7.674 7.578 1.00 74.35 C ATOM 3219 CD1 LEU B 91 5.744 8.151 8.744 1.00 54.55 C ATOM 3220 CD2 LEU B 91 7.827 6.823 8.099 1.00 62.53 C ATOM 0 H LEU B 91 6.830 8.373 4.738 1.00 25.13 H new ATOM 0 HA LEU B 91 7.372 5.710 5.611 1.00 64.13 H new ATOM 0 HB2 LEU B 91 5.014 7.560 6.162 1.00 64.15 H new ATOM 0 HB3 LEU B 91 5.322 6.058 7.011 1.00 64.15 H new ATOM 0 HG LEU B 91 7.071 8.553 7.093 1.00 74.35 H new ATOM 0 HD11 LEU B 91 6.348 8.689 9.475 1.00 54.55 H new ATOM 0 HD12 LEU B 91 4.969 8.812 8.357 1.00 54.55 H new ATOM 0 HD13 LEU B 91 5.280 7.288 9.221 1.00 54.55 H new ATOM 0 HD21 LEU B 91 8.389 7.394 8.838 1.00 62.53 H new ATOM 0 HD22 LEU B 91 7.444 5.912 8.559 1.00 62.53 H new ATOM 0 HD23 LEU B 91 8.482 6.561 7.268 1.00 62.53 H new ATOM 3232 N ILE B 92 4.868 6.188 3.477 1.00 75.14 N ATOM 3233 CA ILE B 92 3.950 5.543 2.509 1.00 71.12 C ATOM 3234 C ILE B 92 4.750 4.658 1.519 1.00 35.31 C ATOM 3235 O ILE B 92 4.385 3.507 1.265 1.00 4.02 O ATOM 3236 CB ILE B 92 3.089 6.621 1.723 1.00 22.32 C ATOM 3237 CG1 ILE B 92 2.220 7.467 2.715 1.00 60.01 C ATOM 3238 CG2 ILE B 92 2.202 5.965 0.628 1.00 21.41 C ATOM 3239 CD1 ILE B 92 1.408 8.589 2.078 1.00 44.14 C ATOM 0 H ILE B 92 4.903 7.203 3.387 1.00 75.14 H new ATOM 0 HA ILE B 92 3.260 4.911 3.068 1.00 71.12 H new ATOM 0 HB ILE B 92 3.785 7.291 1.217 1.00 22.32 H new ATOM 0 HG12 ILE B 92 1.536 6.796 3.235 1.00 60.01 H new ATOM 0 HG13 ILE B 92 2.877 7.900 3.469 1.00 60.01 H new ATOM 0 HG21 ILE B 92 1.629 6.736 0.114 1.00 21.41 H new ATOM 0 HG22 ILE B 92 2.836 5.444 -0.090 1.00 21.41 H new ATOM 0 HG23 ILE B 92 1.518 5.254 1.091 1.00 21.41 H new ATOM 0 HD11 ILE B 92 0.843 9.112 2.849 1.00 44.14 H new ATOM 0 HD12 ILE B 92 2.081 9.289 1.583 1.00 44.14 H new ATOM 0 HD13 ILE B 92 0.719 8.169 1.346 1.00 44.14 H new ATOM 3251 N LEU B 93 5.876 5.211 1.009 1.00 54.40 N ATOM 3252 CA LEU B 93 6.750 4.541 0.022 1.00 44.32 C ATOM 3253 C LEU B 93 7.477 3.335 0.651 1.00 24.14 C ATOM 3254 O LEU B 93 7.640 2.307 -0.002 1.00 33.42 O ATOM 3255 CB LEU B 93 7.786 5.551 -0.572 1.00 42.04 C ATOM 3256 CG LEU B 93 7.208 6.698 -1.470 1.00 12.33 C ATOM 3257 CD1 LEU B 93 8.321 7.683 -1.904 1.00 73.00 C ATOM 3258 CD2 LEU B 93 6.450 6.132 -2.694 1.00 32.24 C ATOM 0 H LEU B 93 6.204 6.140 1.274 1.00 54.40 H new ATOM 0 HA LEU B 93 6.119 4.173 -0.787 1.00 44.32 H new ATOM 0 HB2 LEU B 93 8.331 6.007 0.255 1.00 42.04 H new ATOM 0 HB3 LEU B 93 8.511 4.989 -1.161 1.00 42.04 H new ATOM 0 HG LEU B 93 6.488 7.254 -0.869 1.00 12.33 H new ATOM 0 HD11 LEU B 93 7.890 8.468 -2.526 1.00 73.00 H new ATOM 0 HD12 LEU B 93 8.777 8.129 -1.020 1.00 73.00 H new ATOM 0 HD13 LEU B 93 9.081 7.146 -2.472 1.00 73.00 H new ATOM 0 HD21 LEU B 93 6.063 6.955 -3.295 1.00 32.24 H new ATOM 0 HD22 LEU B 93 7.130 5.531 -3.298 1.00 32.24 H new ATOM 0 HD23 LEU B 93 5.622 5.510 -2.354 1.00 32.24 H new ATOM 3270 N ALA B 94 7.897 3.483 1.924 1.00 30.13 N ATOM 3271 CA ALA B 94 8.607 2.427 2.675 1.00 65.54 C ATOM 3272 C ALA B 94 7.661 1.274 3.046 1.00 52.22 C ATOM 3273 O ALA B 94 8.050 0.108 3.009 1.00 51.23 O ATOM 3274 CB ALA B 94 9.249 3.021 3.935 1.00 12.45 C ATOM 0 H ALA B 94 7.753 4.338 2.461 1.00 30.13 H new ATOM 0 HA ALA B 94 9.390 2.021 2.034 1.00 65.54 H new ATOM 0 HB1 ALA B 94 9.770 2.236 4.483 1.00 12.45 H new ATOM 0 HB2 ALA B 94 9.959 3.797 3.650 1.00 12.45 H new ATOM 0 HB3 ALA B 94 8.475 3.453 4.569 1.00 12.45 H new ATOM 3280 N ALA B 95 6.416 1.629 3.414 1.00 13.43 N ATOM 3281 CA ALA B 95 5.365 0.655 3.766 1.00 34.33 C ATOM 3282 C ALA B 95 4.848 -0.097 2.526 1.00 22.53 C ATOM 3283 O ALA B 95 4.398 -1.236 2.634 1.00 1.31 O ATOM 3284 CB ALA B 95 4.217 1.366 4.478 1.00 13.20 C ATOM 0 H ALA B 95 6.110 2.600 3.476 1.00 13.43 H new ATOM 0 HA ALA B 95 5.801 -0.085 4.437 1.00 34.33 H new ATOM 0 HB1 ALA B 95 3.444 0.642 4.735 1.00 13.20 H new ATOM 0 HB2 ALA B 95 4.589 1.838 5.387 1.00 13.20 H new ATOM 0 HB3 ALA B 95 3.797 2.127 3.820 1.00 13.20 H new ATOM 3290 N ASN B 96 4.890 0.578 1.361 1.00 21.33 N ATOM 3291 CA ASN B 96 4.566 -0.026 0.045 1.00 23.51 C ATOM 3292 C ASN B 96 5.707 -0.975 -0.395 1.00 54.10 C ATOM 3293 O ASN B 96 5.458 -2.093 -0.864 1.00 53.03 O ATOM 3294 CB ASN B 96 4.328 1.110 -1.002 1.00 11.32 C ATOM 3295 CG ASN B 96 4.117 0.635 -2.455 1.00 10.55 C ATOM 3296 OD1 ASN B 96 3.652 -0.469 -2.715 1.00 50.10 O ATOM 3297 ND2 ASN B 96 4.409 1.500 -3.412 1.00 5.13 N ATOM 0 H ASN B 96 5.150 1.562 1.301 1.00 21.33 H new ATOM 0 HA ASN B 96 3.654 -0.618 0.121 1.00 23.51 H new ATOM 0 HB2 ASN B 96 3.455 1.687 -0.696 1.00 11.32 H new ATOM 0 HB3 ASN B 96 5.182 1.787 -0.979 1.00 11.32 H new ATOM 0 HD21 ASN B 96 4.248 1.254 -4.389 1.00 5.13 H new ATOM 0 HD22 ASN B 96 4.795 2.413 -3.173 1.00 5.13 H new ATOM 3304 N TYR B 97 6.955 -0.509 -0.203 1.00 44.32 N ATOM 3305 CA TYR B 97 8.186 -1.262 -0.542 1.00 11.21 C ATOM 3306 C TYR B 97 8.308 -2.540 0.308 1.00 23.11 C ATOM 3307 O TYR B 97 8.758 -3.576 -0.186 1.00 4.24 O ATOM 3308 CB TYR B 97 9.435 -0.344 -0.347 1.00 70.42 C ATOM 3309 CG TYR B 97 10.809 -1.044 -0.445 1.00 34.54 C ATOM 3310 CD1 TYR B 97 11.674 -1.119 0.659 1.00 12.23 C ATOM 3311 CD2 TYR B 97 11.243 -1.622 -1.640 1.00 45.42 C ATOM 3312 CE1 TYR B 97 12.901 -1.757 0.572 1.00 4.34 C ATOM 3313 CE2 TYR B 97 12.469 -2.258 -1.728 1.00 11.45 C ATOM 3314 CZ TYR B 97 13.297 -2.319 -0.624 1.00 33.41 C ATOM 3315 OH TYR B 97 14.520 -2.956 -0.718 1.00 23.42 O ATOM 0 H TYR B 97 7.144 0.411 0.196 1.00 44.32 H new ATOM 0 HA TYR B 97 8.130 -1.568 -1.587 1.00 11.21 H new ATOM 0 HB2 TYR B 97 9.399 0.449 -1.094 1.00 70.42 H new ATOM 0 HB3 TYR B 97 9.361 0.134 0.630 1.00 70.42 H new ATOM 0 HD1 TYR B 97 11.377 -0.670 1.595 1.00 12.23 H new ATOM 0 HD2 TYR B 97 10.609 -1.572 -2.513 1.00 45.42 H new ATOM 0 HE1 TYR B 97 13.545 -1.814 1.437 1.00 4.34 H new ATOM 0 HE2 TYR B 97 12.779 -2.707 -2.660 1.00 11.45 H new ATOM 0 HH TYR B 97 14.642 -3.296 -1.629 1.00 23.42 H new ATOM 3325 N LEU B 98 7.908 -2.441 1.585 1.00 51.11 N ATOM 3326 CA LEU B 98 8.020 -3.545 2.557 1.00 4.34 C ATOM 3327 C LEU B 98 6.674 -4.256 2.796 1.00 73.12 C ATOM 3328 O LEU B 98 6.616 -5.196 3.597 1.00 55.55 O ATOM 3329 CB LEU B 98 8.635 -3.023 3.885 1.00 72.22 C ATOM 3330 CG LEU B 98 10.130 -2.582 3.799 1.00 0.43 C ATOM 3331 CD1 LEU B 98 10.647 -2.033 5.148 1.00 31.12 C ATOM 3332 CD2 LEU B 98 11.015 -3.742 3.285 1.00 42.25 C ATOM 0 H LEU B 98 7.497 -1.593 1.975 1.00 51.11 H new ATOM 0 HA LEU B 98 8.687 -4.296 2.134 1.00 4.34 H new ATOM 0 HB2 LEU B 98 8.043 -2.176 4.232 1.00 72.22 H new ATOM 0 HB3 LEU B 98 8.547 -3.805 4.639 1.00 72.22 H new ATOM 0 HG LEU B 98 10.192 -1.765 3.080 1.00 0.43 H new ATOM 0 HD11 LEU B 98 11.691 -1.738 5.044 1.00 31.12 H new ATOM 0 HD12 LEU B 98 10.052 -1.168 5.441 1.00 31.12 H new ATOM 0 HD13 LEU B 98 10.563 -2.806 5.912 1.00 31.12 H new ATOM 0 HD21 LEU B 98 12.053 -3.412 3.233 1.00 42.25 H new ATOM 0 HD22 LEU B 98 10.937 -4.589 3.967 1.00 42.25 H new ATOM 0 HD23 LEU B 98 10.680 -4.043 2.293 1.00 42.25 H new ATOM 3344 N ASP B 99 5.607 -3.821 2.088 1.00 34.55 N ATOM 3345 CA ASP B 99 4.258 -4.455 2.158 1.00 0.13 C ATOM 3346 C ASP B 99 3.641 -4.400 3.573 1.00 54.11 C ATOM 3347 O ASP B 99 2.690 -5.146 3.866 1.00 12.10 O ATOM 3348 CB ASP B 99 4.308 -5.931 1.641 1.00 54.21 C ATOM 3349 CG ASP B 99 4.187 -6.063 0.122 1.00 2.12 C ATOM 3350 OD1 ASP B 99 5.187 -6.358 -0.566 1.00 42.13 O ATOM 3351 OD2 ASP B 99 3.074 -5.860 -0.397 1.00 20.20 O ATOM 0 H ASP B 99 5.650 -3.024 1.453 1.00 34.55 H new ATOM 0 HA ASP B 99 3.609 -3.871 1.506 1.00 0.13 H new ATOM 0 HB2 ASP B 99 5.245 -6.386 1.961 1.00 54.21 H new ATOM 0 HB3 ASP B 99 3.503 -6.497 2.110 1.00 54.21 H new ATOM 3356 N ILE B 100 4.160 -3.503 4.433 1.00 23.53 N ATOM 3357 CA ILE B 100 3.677 -3.347 5.808 1.00 23.35 C ATOM 3358 C ILE B 100 2.404 -2.500 5.783 1.00 43.02 C ATOM 3359 O ILE B 100 2.462 -1.273 5.814 1.00 10.11 O ATOM 3360 CB ILE B 100 4.757 -2.700 6.760 1.00 64.24 C ATOM 3361 CG1 ILE B 100 6.095 -3.481 6.648 1.00 63.54 C ATOM 3362 CG2 ILE B 100 4.256 -2.655 8.235 1.00 33.44 C ATOM 3363 CD1 ILE B 100 7.242 -2.929 7.470 1.00 3.42 C ATOM 0 H ILE B 100 4.923 -2.871 4.190 1.00 23.53 H new ATOM 0 HA ILE B 100 3.468 -4.337 6.214 1.00 23.35 H new ATOM 0 HB ILE B 100 4.925 -1.670 6.444 1.00 64.24 H new ATOM 0 HG12 ILE B 100 5.919 -4.514 6.949 1.00 63.54 H new ATOM 0 HG13 ILE B 100 6.398 -3.501 5.601 1.00 63.54 H new ATOM 0 HG21 ILE B 100 5.022 -2.204 8.866 1.00 33.44 H new ATOM 0 HG22 ILE B 100 3.344 -2.061 8.291 1.00 33.44 H new ATOM 0 HG23 ILE B 100 4.051 -3.668 8.581 1.00 33.44 H new ATOM 0 HD11 ILE B 100 8.127 -3.547 7.320 1.00 3.42 H new ATOM 0 HD12 ILE B 100 7.455 -1.907 7.157 1.00 3.42 H new ATOM 0 HD13 ILE B 100 6.970 -2.936 8.525 1.00 3.42 H new ATOM 3375 N LYS B 101 1.267 -3.189 5.639 1.00 5.14 N ATOM 3376 CA LYS B 101 -0.060 -2.564 5.610 1.00 62.24 C ATOM 3377 C LYS B 101 -0.497 -1.978 6.980 1.00 65.21 C ATOM 3378 O LYS B 101 -1.240 -0.999 6.970 1.00 41.52 O ATOM 3379 CB LYS B 101 -1.116 -3.546 5.085 1.00 3.54 C ATOM 3380 CG LYS B 101 -0.836 -4.074 3.664 1.00 71.45 C ATOM 3381 CD LYS B 101 -2.074 -4.751 3.058 1.00 50.43 C ATOM 3382 CE LYS B 101 -3.224 -3.754 2.839 1.00 2.50 C ATOM 3383 NZ LYS B 101 -4.436 -4.404 2.306 1.00 2.40 N ATOM 0 H LYS B 101 1.241 -4.204 5.539 1.00 5.14 H new ATOM 0 HA LYS B 101 0.020 -1.721 4.924 1.00 62.24 H new ATOM 0 HB2 LYS B 101 -1.181 -4.392 5.769 1.00 3.54 H new ATOM 0 HB3 LYS B 101 -2.089 -3.055 5.093 1.00 3.54 H new ATOM 0 HG2 LYS B 101 -0.522 -3.249 3.024 1.00 71.45 H new ATOM 0 HG3 LYS B 101 -0.011 -4.785 3.696 1.00 71.45 H new ATOM 0 HD2 LYS B 101 -1.807 -5.211 2.107 1.00 50.43 H new ATOM 0 HD3 LYS B 101 -2.409 -5.552 3.717 1.00 50.43 H new ATOM 0 HE2 LYS B 101 -3.462 -3.265 3.784 1.00 2.50 H new ATOM 0 HE3 LYS B 101 -2.900 -2.975 2.150 1.00 2.50 H new ATOM 0 HZ1 LYS B 101 -4.796 -3.858 1.498 1.00 2.40 H new ATOM 0 HZ2 LYS B 101 -4.204 -5.369 1.996 1.00 2.40 H new ATOM 0 HZ3 LYS B 101 -5.163 -4.444 3.048 1.00 2.40 H new ATOM 3397 N PRO B 102 -0.114 -2.573 8.184 1.00 50.54 N ATOM 3398 CA PRO B 102 -0.268 -1.874 9.495 1.00 3.23 C ATOM 3399 C PRO B 102 0.270 -0.421 9.473 1.00 21.41 C ATOM 3400 O PRO B 102 -0.333 0.478 10.058 1.00 32.51 O ATOM 3401 CB PRO B 102 0.547 -2.770 10.466 1.00 30.25 C ATOM 3402 CG PRO B 102 0.389 -4.154 9.907 1.00 33.00 C ATOM 3403 CD PRO B 102 0.374 -3.983 8.395 1.00 60.34 C ATOM 0 HA PRO B 102 -1.314 -1.759 9.781 1.00 3.23 H new ATOM 0 HB2 PRO B 102 1.595 -2.471 10.500 1.00 30.25 H new ATOM 0 HB3 PRO B 102 0.164 -2.705 11.484 1.00 30.25 H new ATOM 0 HG2 PRO B 102 1.209 -4.800 10.221 1.00 33.00 H new ATOM 0 HG3 PRO B 102 -0.533 -4.616 10.259 1.00 33.00 H new ATOM 0 HD2 PRO B 102 1.367 -4.128 7.968 1.00 60.34 H new ATOM 0 HD3 PRO B 102 -0.287 -4.708 7.919 1.00 60.34 H new ATOM 3411 N LEU B 103 1.411 -0.215 8.786 1.00 14.20 N ATOM 3412 CA LEU B 103 2.029 1.114 8.632 1.00 3.11 C ATOM 3413 C LEU B 103 1.340 1.916 7.509 1.00 73.31 C ATOM 3414 O LEU B 103 0.962 3.077 7.717 1.00 31.43 O ATOM 3415 CB LEU B 103 3.546 0.970 8.344 1.00 63.02 C ATOM 3416 CG LEU B 103 4.340 2.302 8.164 1.00 41.14 C ATOM 3417 CD1 LEU B 103 4.121 3.237 9.360 1.00 51.44 C ATOM 3418 CD2 LEU B 103 5.842 2.030 7.930 1.00 75.21 C ATOM 0 H LEU B 103 1.928 -0.964 8.324 1.00 14.20 H new ATOM 0 HA LEU B 103 1.900 1.662 9.566 1.00 3.11 H new ATOM 0 HB2 LEU B 103 3.999 0.408 9.161 1.00 63.02 H new ATOM 0 HB3 LEU B 103 3.669 0.373 7.441 1.00 63.02 H new ATOM 0 HG LEU B 103 3.956 2.804 7.276 1.00 41.14 H new ATOM 0 HD11 LEU B 103 4.685 4.158 9.210 1.00 51.44 H new ATOM 0 HD12 LEU B 103 3.060 3.471 9.449 1.00 51.44 H new ATOM 0 HD13 LEU B 103 4.462 2.747 10.272 1.00 51.44 H new ATOM 0 HD21 LEU B 103 6.369 2.977 7.808 1.00 75.21 H new ATOM 0 HD22 LEU B 103 6.252 1.494 8.786 1.00 75.21 H new ATOM 0 HD23 LEU B 103 5.967 1.427 7.031 1.00 75.21 H new ATOM 3430 N LEU B 104 1.176 1.266 6.338 1.00 23.40 N ATOM 3431 CA LEU B 104 0.658 1.892 5.098 1.00 12.50 C ATOM 3432 C LEU B 104 -0.714 2.519 5.326 1.00 14.30 C ATOM 3433 O LEU B 104 -0.938 3.684 4.991 1.00 15.24 O ATOM 3434 CB LEU B 104 0.559 0.824 3.969 1.00 12.12 C ATOM 3435 CG LEU B 104 0.072 1.311 2.564 1.00 54.24 C ATOM 3436 CD1 LEU B 104 1.072 2.301 1.923 1.00 61.25 C ATOM 3437 CD2 LEU B 104 -0.200 0.102 1.643 1.00 64.32 C ATOM 0 H LEU B 104 1.402 0.278 6.223 1.00 23.40 H new ATOM 0 HA LEU B 104 1.351 2.680 4.803 1.00 12.50 H new ATOM 0 HB2 LEU B 104 1.542 0.370 3.847 1.00 12.12 H new ATOM 0 HB3 LEU B 104 -0.116 0.037 4.306 1.00 12.12 H new ATOM 0 HG LEU B 104 -0.863 1.854 2.699 1.00 54.24 H new ATOM 0 HD11 LEU B 104 0.698 2.616 0.949 1.00 61.25 H new ATOM 0 HD12 LEU B 104 1.185 3.173 2.568 1.00 61.25 H new ATOM 0 HD13 LEU B 104 2.039 1.813 1.800 1.00 61.25 H new ATOM 0 HD21 LEU B 104 -0.538 0.455 0.669 1.00 64.32 H new ATOM 0 HD22 LEU B 104 0.716 -0.476 1.521 1.00 64.32 H new ATOM 0 HD23 LEU B 104 -0.970 -0.528 2.088 1.00 64.32 H new ATOM 3449 N ASP B 105 -1.595 1.724 5.949 1.00 61.20 N ATOM 3450 CA ASP B 105 -2.984 2.095 6.203 1.00 32.42 C ATOM 3451 C ASP B 105 -3.058 3.317 7.113 1.00 13.40 C ATOM 3452 O ASP B 105 -3.690 4.298 6.757 1.00 50.13 O ATOM 3453 CB ASP B 105 -3.768 0.906 6.815 1.00 52.23 C ATOM 3454 CG ASP B 105 -5.269 1.220 6.975 1.00 0.00 C ATOM 3455 OD1 ASP B 105 -5.733 1.488 8.112 1.00 14.55 O ATOM 3456 OD2 ASP B 105 -5.992 1.234 5.951 1.00 44.40 O ATOM 0 H ASP B 105 -1.355 0.794 6.293 1.00 61.20 H new ATOM 0 HA ASP B 105 -3.447 2.352 5.250 1.00 32.42 H new ATOM 0 HB2 ASP B 105 -3.648 0.028 6.180 1.00 52.23 H new ATOM 0 HB3 ASP B 105 -3.345 0.656 7.788 1.00 52.23 H new ATOM 3461 N VAL B 106 -2.340 3.254 8.247 1.00 21.11 N ATOM 3462 CA VAL B 106 -2.349 4.302 9.279 1.00 30.01 C ATOM 3463 C VAL B 106 -1.769 5.639 8.755 1.00 43.55 C ATOM 3464 O VAL B 106 -2.368 6.693 8.977 1.00 62.41 O ATOM 3465 CB VAL B 106 -1.576 3.808 10.566 1.00 53.03 C ATOM 3466 CG1 VAL B 106 -1.330 4.940 11.597 1.00 40.20 C ATOM 3467 CG2 VAL B 106 -2.331 2.623 11.221 1.00 33.24 C ATOM 0 H VAL B 106 -1.732 2.467 8.474 1.00 21.11 H new ATOM 0 HA VAL B 106 -3.387 4.495 9.548 1.00 30.01 H new ATOM 0 HB VAL B 106 -0.592 3.473 10.237 1.00 53.03 H new ATOM 0 HG11 VAL B 106 -0.796 4.538 12.458 1.00 40.20 H new ATOM 0 HG12 VAL B 106 -0.735 5.729 11.136 1.00 40.20 H new ATOM 0 HG13 VAL B 106 -2.286 5.350 11.922 1.00 40.20 H new ATOM 0 HG21 VAL B 106 -1.789 2.291 12.107 1.00 33.24 H new ATOM 0 HG22 VAL B 106 -3.333 2.944 11.507 1.00 33.24 H new ATOM 0 HG23 VAL B 106 -2.403 1.800 10.510 1.00 33.24 H new ATOM 3477 N THR B 107 -0.625 5.582 8.043 1.00 12.51 N ATOM 3478 CA THR B 107 0.039 6.793 7.505 1.00 13.12 C ATOM 3479 C THR B 107 -0.826 7.461 6.413 1.00 75.44 C ATOM 3480 O THR B 107 -1.056 8.681 6.444 1.00 32.15 O ATOM 3481 CB THR B 107 1.462 6.462 6.940 1.00 32.45 C ATOM 3482 OG1 THR B 107 2.249 5.828 7.964 1.00 10.32 O ATOM 3483 CG2 THR B 107 2.199 7.725 6.448 1.00 64.41 C ATOM 0 H THR B 107 -0.140 4.712 7.826 1.00 12.51 H new ATOM 0 HA THR B 107 0.156 7.493 8.332 1.00 13.12 H new ATOM 0 HB THR B 107 1.330 5.795 6.088 1.00 32.45 H new ATOM 0 HG1 THR B 107 1.979 4.890 8.051 1.00 10.32 H new ATOM 0 HG21 THR B 107 3.181 7.447 6.065 1.00 64.41 H new ATOM 0 HG22 THR B 107 1.620 8.198 5.654 1.00 64.41 H new ATOM 0 HG23 THR B 107 2.317 8.423 7.277 1.00 64.41 H new ATOM 3491 N CYS B 108 -1.334 6.630 5.477 1.00 61.12 N ATOM 3492 CA CYS B 108 -2.209 7.087 4.378 1.00 45.33 C ATOM 3493 C CYS B 108 -3.565 7.578 4.914 1.00 13.25 C ATOM 3494 O CYS B 108 -4.185 8.459 4.315 1.00 42.23 O ATOM 3495 CB CYS B 108 -2.410 5.967 3.333 1.00 63.41 C ATOM 3496 SG CYS B 108 -0.885 5.463 2.505 1.00 12.53 S ATOM 0 H CYS B 108 -1.149 5.627 5.463 1.00 61.12 H new ATOM 0 HA CYS B 108 -1.716 7.928 3.889 1.00 45.33 H new ATOM 0 HB2 CYS B 108 -2.850 5.099 3.824 1.00 63.41 H new ATOM 0 HB3 CYS B 108 -3.125 6.306 2.583 1.00 63.41 H new ATOM 0 HG CYS B 108 -0.247 4.610 3.251 1.00 12.53 H new ATOM 3502 N LYS B 109 -4.005 7.002 6.052 1.00 51.42 N ATOM 3503 CA LYS B 109 -5.282 7.363 6.690 1.00 52.12 C ATOM 3504 C LYS B 109 -5.154 8.745 7.327 1.00 63.21 C ATOM 3505 O LYS B 109 -6.014 9.592 7.136 1.00 44.42 O ATOM 3506 CB LYS B 109 -5.696 6.316 7.774 1.00 33.53 C ATOM 3507 CG LYS B 109 -7.211 6.245 8.069 1.00 44.33 C ATOM 3508 CD LYS B 109 -8.037 5.787 6.841 1.00 50.51 C ATOM 3509 CE LYS B 109 -7.610 4.404 6.306 1.00 34.41 C ATOM 3510 NZ LYS B 109 -7.789 3.321 7.310 1.00 50.02 N ATOM 0 H LYS B 109 -3.487 6.278 6.550 1.00 51.42 H new ATOM 0 HA LYS B 109 -6.058 7.374 5.924 1.00 52.12 H new ATOM 0 HB2 LYS B 109 -5.357 5.331 7.454 1.00 33.53 H new ATOM 0 HB3 LYS B 109 -5.171 6.548 8.701 1.00 33.53 H new ATOM 0 HG2 LYS B 109 -7.384 5.556 8.896 1.00 44.33 H new ATOM 0 HG3 LYS B 109 -7.561 7.226 8.392 1.00 44.33 H new ATOM 0 HD2 LYS B 109 -9.092 5.755 7.112 1.00 50.51 H new ATOM 0 HD3 LYS B 109 -7.934 6.525 6.046 1.00 50.51 H new ATOM 0 HE2 LYS B 109 -8.192 4.168 5.415 1.00 34.41 H new ATOM 0 HE3 LYS B 109 -6.564 4.443 6.002 1.00 34.41 H new ATOM 0 HZ1 LYS B 109 -8.201 2.485 6.849 1.00 50.02 H new ATOM 0 HZ2 LYS B 109 -6.866 3.071 7.720 1.00 50.02 H new ATOM 0 HZ3 LYS B 109 -8.425 3.649 8.065 1.00 50.02 H new ATOM 3524 N THR B 110 -4.042 8.945 8.069 1.00 64.03 N ATOM 3525 CA THR B 110 -3.753 10.192 8.796 1.00 53.33 C ATOM 3526 C THR B 110 -3.637 11.388 7.831 1.00 41.43 C ATOM 3527 O THR B 110 -4.304 12.408 8.033 1.00 54.14 O ATOM 3528 CB THR B 110 -2.442 10.046 9.646 1.00 0.12 C ATOM 3529 OG1 THR B 110 -2.612 8.988 10.602 1.00 22.00 O ATOM 3530 CG2 THR B 110 -2.058 11.345 10.389 1.00 14.15 C ATOM 0 H THR B 110 -3.316 8.237 8.178 1.00 64.03 H new ATOM 0 HA THR B 110 -4.587 10.384 9.471 1.00 53.33 H new ATOM 0 HB THR B 110 -1.633 9.820 8.952 1.00 0.12 H new ATOM 0 HG1 THR B 110 -2.548 8.122 10.147 1.00 22.00 H new ATOM 0 HG21 THR B 110 -1.144 11.181 10.959 1.00 14.15 H new ATOM 0 HG22 THR B 110 -1.896 12.144 9.665 1.00 14.15 H new ATOM 0 HG23 THR B 110 -2.863 11.628 11.068 1.00 14.15 H new ATOM 3538 N VAL B 111 -2.817 11.232 6.765 1.00 51.45 N ATOM 3539 CA VAL B 111 -2.581 12.306 5.776 1.00 33.23 C ATOM 3540 C VAL B 111 -3.890 12.647 5.014 1.00 13.32 C ATOM 3541 O VAL B 111 -4.138 13.814 4.680 1.00 43.33 O ATOM 3542 CB VAL B 111 -1.399 11.949 4.783 1.00 3.43 C ATOM 3543 CG1 VAL B 111 -1.733 10.739 3.887 1.00 62.20 C ATOM 3544 CG2 VAL B 111 -0.966 13.175 3.936 1.00 3.15 C ATOM 0 H VAL B 111 -2.308 10.370 6.569 1.00 51.45 H new ATOM 0 HA VAL B 111 -2.269 13.196 6.322 1.00 33.23 H new ATOM 0 HB VAL B 111 -0.550 11.662 5.404 1.00 3.43 H new ATOM 0 HG11 VAL B 111 -0.892 10.534 3.224 1.00 62.20 H new ATOM 0 HG12 VAL B 111 -1.925 9.866 4.511 1.00 62.20 H new ATOM 0 HG13 VAL B 111 -2.619 10.961 3.291 1.00 62.20 H new ATOM 0 HG21 VAL B 111 -0.154 12.887 3.269 1.00 3.15 H new ATOM 0 HG22 VAL B 111 -1.813 13.527 3.347 1.00 3.15 H new ATOM 0 HG23 VAL B 111 -0.627 13.973 4.597 1.00 3.15 H new ATOM 3554 N ALA B 112 -4.737 11.614 4.793 1.00 33.35 N ATOM 3555 CA ALA B 112 -6.067 11.777 4.181 1.00 65.14 C ATOM 3556 C ALA B 112 -7.049 12.457 5.154 1.00 14.11 C ATOM 3557 O ALA B 112 -7.886 13.244 4.734 1.00 71.10 O ATOM 3558 CB ALA B 112 -6.613 10.416 3.733 1.00 3.34 C ATOM 0 H ALA B 112 -4.514 10.649 5.035 1.00 33.35 H new ATOM 0 HA ALA B 112 -5.962 12.421 3.308 1.00 65.14 H new ATOM 0 HB1 ALA B 112 -7.596 10.549 3.282 1.00 3.34 H new ATOM 0 HB2 ALA B 112 -5.935 9.975 3.002 1.00 3.34 H new ATOM 0 HB3 ALA B 112 -6.696 9.755 4.596 1.00 3.34 H new ATOM 3564 N ASN B 113 -6.917 12.148 6.461 1.00 24.54 N ATOM 3565 CA ASN B 113 -7.800 12.696 7.522 1.00 73.15 C ATOM 3566 C ASN B 113 -7.499 14.179 7.787 1.00 1.42 C ATOM 3567 O ASN B 113 -8.373 14.906 8.265 1.00 33.12 O ATOM 3568 CB ASN B 113 -7.702 11.871 8.847 1.00 42.43 C ATOM 3569 CG ASN B 113 -8.412 10.504 8.787 1.00 33.12 C ATOM 3570 OD1 ASN B 113 -9.406 10.328 8.078 1.00 33.22 O ATOM 3571 ND2 ASN B 113 -7.910 9.529 9.538 1.00 73.33 N ATOM 0 H ASN B 113 -6.200 11.515 6.814 1.00 24.54 H new ATOM 0 HA ASN B 113 -8.823 12.613 7.156 1.00 73.15 H new ATOM 0 HB2 ASN B 113 -6.651 11.713 9.088 1.00 42.43 H new ATOM 0 HB3 ASN B 113 -8.131 12.456 9.660 1.00 42.43 H new ATOM 0 HD21 ASN B 113 -8.348 8.608 9.537 1.00 73.33 H new ATOM 0 HD22 ASN B 113 -7.087 9.702 10.115 1.00 73.33 H new ATOM 3578 N MET B 114 -6.258 14.620 7.484 1.00 75.32 N ATOM 3579 CA MET B 114 -5.854 16.038 7.630 1.00 73.13 C ATOM 3580 C MET B 114 -6.679 16.940 6.689 1.00 74.05 C ATOM 3581 O MET B 114 -7.058 18.057 7.052 1.00 13.01 O ATOM 3582 CB MET B 114 -4.339 16.239 7.342 1.00 42.43 C ATOM 3583 CG MET B 114 -3.387 15.453 8.260 1.00 50.10 C ATOM 3584 SD MET B 114 -1.675 16.040 8.181 1.00 53.11 S ATOM 3585 CE MET B 114 -1.310 15.960 6.426 1.00 71.12 C ATOM 0 H MET B 114 -5.516 14.013 7.136 1.00 75.32 H new ATOM 0 HA MET B 114 -6.047 16.320 8.665 1.00 73.13 H new ATOM 0 HB2 MET B 114 -4.141 15.952 6.309 1.00 42.43 H new ATOM 0 HB3 MET B 114 -4.107 17.301 7.428 1.00 42.43 H new ATOM 0 HG2 MET B 114 -3.742 15.525 9.288 1.00 50.10 H new ATOM 0 HG3 MET B 114 -3.416 14.398 7.986 1.00 50.10 H new ATOM 0 HE1 MET B 114 -0.328 15.510 6.279 1.00 71.12 H new ATOM 0 HE2 MET B 114 -2.065 15.355 5.925 1.00 71.12 H new ATOM 0 HE3 MET B 114 -1.315 16.966 6.007 1.00 71.12 H new ATOM 3595 N ILE B 115 -6.953 16.434 5.473 1.00 11.23 N ATOM 3596 CA ILE B 115 -7.703 17.179 4.437 1.00 45.44 C ATOM 3597 C ILE B 115 -9.212 16.836 4.487 1.00 32.04 C ATOM 3598 O ILE B 115 -10.050 17.630 4.050 1.00 32.31 O ATOM 3599 CB ILE B 115 -7.102 16.897 3.003 1.00 12.52 C ATOM 3600 CG1 ILE B 115 -7.287 15.405 2.595 1.00 41.30 C ATOM 3601 CG2 ILE B 115 -5.598 17.292 2.958 1.00 41.31 C ATOM 3602 CD1 ILE B 115 -6.768 15.045 1.221 1.00 11.33 C ATOM 0 H ILE B 115 -6.664 15.501 5.178 1.00 11.23 H new ATOM 0 HA ILE B 115 -7.600 18.244 4.644 1.00 45.44 H new ATOM 0 HB ILE B 115 -7.647 17.509 2.284 1.00 12.52 H new ATOM 0 HG12 ILE B 115 -6.784 14.778 3.332 1.00 41.30 H new ATOM 0 HG13 ILE B 115 -8.348 15.161 2.640 1.00 41.30 H new ATOM 0 HG21 ILE B 115 -5.199 17.092 1.964 1.00 41.31 H new ATOM 0 HG22 ILE B 115 -5.494 18.353 3.184 1.00 41.31 H new ATOM 0 HG23 ILE B 115 -5.046 16.708 3.695 1.00 41.31 H new ATOM 0 HD11 ILE B 115 -6.944 13.986 1.032 1.00 11.33 H new ATOM 0 HD12 ILE B 115 -7.287 15.639 0.469 1.00 11.33 H new ATOM 0 HD13 ILE B 115 -5.699 15.250 1.171 1.00 11.33 H new ATOM 3614 N ARG B 116 -9.535 15.658 5.044 1.00 54.22 N ATOM 3615 CA ARG B 116 -10.922 15.154 5.189 1.00 20.33 C ATOM 3616 C ARG B 116 -11.660 15.898 6.321 1.00 21.22 C ATOM 3617 O ARG B 116 -12.805 16.346 6.152 1.00 75.33 O ATOM 3618 CB ARG B 116 -10.853 13.632 5.494 1.00 73.03 C ATOM 3619 CG ARG B 116 -12.194 12.913 5.751 1.00 54.14 C ATOM 3620 CD ARG B 116 -11.988 11.445 6.165 1.00 42.12 C ATOM 3621 NE ARG B 116 -13.251 10.761 6.485 1.00 22.33 N ATOM 3622 CZ ARG B 116 -13.372 9.719 7.324 1.00 22.34 C ATOM 3623 NH1 ARG B 116 -12.307 9.226 7.958 1.00 44.43 N ATOM 3624 NH2 ARG B 116 -14.558 9.163 7.518 1.00 71.02 N ATOM 0 H ARG B 116 -8.835 15.015 5.413 1.00 54.22 H new ATOM 0 HA ARG B 116 -11.477 15.328 4.267 1.00 20.33 H new ATOM 0 HB2 ARG B 116 -10.358 13.140 4.657 1.00 73.03 H new ATOM 0 HB3 ARG B 116 -10.218 13.489 6.368 1.00 73.03 H new ATOM 0 HG2 ARG B 116 -12.743 13.437 6.533 1.00 54.14 H new ATOM 0 HG3 ARG B 116 -12.806 12.954 4.850 1.00 54.14 H new ATOM 0 HD2 ARG B 116 -11.485 10.912 5.358 1.00 42.12 H new ATOM 0 HD3 ARG B 116 -11.329 11.406 7.032 1.00 42.12 H new ATOM 0 HE ARG B 116 -14.100 11.104 6.035 1.00 22.33 H new ATOM 0 HH11 ARG B 116 -11.387 9.641 7.808 1.00 44.43 H new ATOM 0 HH12 ARG B 116 -12.412 8.434 8.593 1.00 44.43 H new ATOM 0 HH21 ARG B 116 -15.377 9.526 7.031 1.00 71.02 H new ATOM 0 HH22 ARG B 116 -14.652 8.372 8.155 1.00 71.02 H new ATOM 3638 N GLY B 117 -10.976 16.029 7.471 1.00 15.41 N ATOM 3639 CA GLY B 117 -11.535 16.639 8.673 1.00 72.41 C ATOM 3640 C GLY B 117 -10.581 17.688 9.238 1.00 11.24 C ATOM 3641 O GLY B 117 -10.696 18.877 8.863 1.00 24.22 O ATOM 3642 OXT GLY B 117 -9.675 17.324 10.023 1.00 38.08 O ATOM 0 H GLY B 117 -10.014 15.710 7.585 1.00 15.41 H new ATOM 0 HA2 GLY B 117 -12.495 17.100 8.440 1.00 72.41 H new ATOM 0 HA3 GLY B 117 -11.724 15.871 9.423 1.00 72.41 H new TER 3646 GLY B 117