#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kw6 n GLY 52 N 0.00 1.37 3.49 3.17 0.00 -1.26 -4.42 105.19 107.54 2kw6 n GLY 52 Ca 0.00 0.20 -0.37 0.00 0.00 0.00 0.00 46.02 45.85 2kw6 n GLY 52 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2kw6 s HIS 53 N 0.00 3.14 -0.09 1.61 0.09 -1.26 -5.09 115.29 113.69 2kw6 s HIS 53 Ca 0.00 -0.28 -0.21 0.00 -0.00 0.00 0.00 55.06 54.57 2kw6 s HIS 53 Cb 0.00 -2.30 -0.04 0.00 -0.00 0.00 0.00 32.58 30.24 2kw6 s HIS 53 CO 0.00 -0.31 0.59 -1.58 -0.00 0.00 0.00 174.74 173.44 2kw6 s HIS 54 N 1.66 3.55 -0.14 1.40 5.65 -1.26 -5.02 115.29 121.13 2kw6 s HIS 54 Ca 0.06 1.08 -0.29 0.00 0.25 0.00 0.00 55.06 56.16 2kw6 s HIS 54 Cb -0.16 -2.68 -0.05 0.00 -1.18 0.00 0.00 32.58 28.51 2kw6 s HIS 54 CO 0.06 0.14 1.92 -1.58 -0.65 0.00 0.00 174.74 174.63 2kw6 s HIS 55 N 0.68 1.54 0.48 3.88 5.65 -1.26 -5.00 115.29 121.26 2kw6 s HIS 55 Ca 0.32 0.22 -0.03 0.00 0.25 0.00 0.00 55.06 55.82 2kw6 s HIS 55 Cb -0.17 -4.05 -0.01 0.00 -1.18 0.00 0.00 32.58 27.17 2kw6 s HIS 55 CO 0.14 -4.15 0.75 -1.01 -0.65 0.00 0.00 174.74 169.83 2kw6 s HIS 56 N 5.95 3.37 -0.71 3.88 4.02 -1.26 -5.05 115.29 125.49 2kw6 s HIS 56 Ca 0.86 0.53 -0.19 0.00 1.02 0.00 0.00 55.06 57.28 2kw6 s HIS 56 Cb -0.33 -2.37 0.11 0.00 -1.02 0.00 0.00 32.58 28.97 2kw6 s HIS 56 CO 0.35 -0.40 0.87 -3.38 1.02 0.00 0.00 174.74 173.20 2kw6 s HIS 57 N -2.70 3.03 -1.27 1.40 0.00 -1.26 -4.98 115.29 109.51 2kw6 s HIS 57 Ca 0.48 -1.08 -0.17 0.00 -3.00 0.00 0.00 55.06 51.29 2kw6 s HIS 57 Cb -0.10 -4.12 0.01 0.00 -4.00 0.00 0.00 32.58 24.36 2kw6 s HIS 57 CO 0.42 -1.39 1.99 -2.39 -1.00 0.00 0.00 174.74 172.37 2kw6 n HIS 58 N 6.45 3.58 -2.44 0.38 -0.00 -1.26 -4.62 115.22 117.31 2kw6 n HIS 58 Ca 0.02 -2.59 -0.16 0.00 -0.00 0.00 0.00 57.72 54.98 2kw6 n HIS 58 Cb 0.45 -2.47 0.02 0.00 -0.00 0.00 0.00 29.99 28.00 2kw6 n HIS 58 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 2kw6 n SER 59 N 7.97 3.47 -4.38 4.39 2.88 -1.26 -4.98 113.62 121.71 2kw6 n SER 59 Ca 0.50 -3.15 -0.42 0.00 -1.33 0.00 0.00 58.87 54.46 2kw6 n SER 59 Cb 0.42 -0.44 -0.00 0.00 -0.75 0.00 0.00 64.21 63.45 2kw6 n SER 59 CO 0.00 0.00 0.00 1.57 -1.23 0.00 0.00 175.04 175.38 2kw6 n HIS 60 N -0.51 4.33 -1.87 0.66 -0.00 -1.26 -4.83 115.22 111.74 2kw6 n HIS 60 Ca 0.28 -2.82 -0.29 0.00 0.46 0.00 0.00 57.72 55.35 2kw6 n HIS 60 Cb 0.83 -2.61 0.09 0.00 -0.12 0.00 0.00 29.99 28.18 2kw6 n HIS 60 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 2kw6 s SER 61 N 4.06 4.40 0.36 0.26 0.15 -1.26 -4.88 113.70 116.79 2kw6 s SER 61 Ca 0.53 0.79 0.06 0.00 0.70 0.00 0.00 55.95 58.03 2kw6 s SER 61 Cb 0.06 -1.29 0.67 0.00 -1.71 0.00 0.00 66.02 63.76 2kw6 s SER 61 CO 0.04 -1.98 1.90 0.07 1.20 0.00 0.00 173.24 174.48 2kw6 h LYS 62 N -1.10 0.46 -0.01 5.44 2.10 -1.98 -0.48 116.57 120.99 2kw6 h LYS 62 Ca -0.46 -0.09 -0.07 0.00 -2.00 0.00 0.00 60.65 58.02 2kw6 h LYS 62 Cb 1.33 -0.07 0.01 0.00 -0.90 0.00 0.00 32.23 32.60 2kw6 h LYS 62 CO 0.65 0.49 -0.28 1.88 -2.00 0.00 0.00 179.45 180.20 2kw6 h TYR 63 N 0.44 0.30 -0.46 0.07 0.05 -1.97 -1.11 116.97 114.28 2kw6 h TYR 63 Ca 0.10 -0.16 -0.01 0.00 0.05 0.00 0.00 58.73 58.71 2kw6 h TYR 63 Cb 0.30 -0.04 -0.02 0.00 1.01 0.00 0.00 36.73 37.99 2kw6 h TYR 63 CO 0.01 0.95 0.26 0.00 -1.05 0.00 0.00 178.16 178.33 2kw6 h ALA 64 N 0.28 1.59 -0.05 3.88 0.00 -1.86 -1.43 119.26 121.66 2kw6 h ALA 64 Ca -0.03 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 2kw6 h ALA 64 Cb 1.02 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2kw6 h ALA 64 CO 0.06 0.35 -0.24 1.49 0.00 0.00 0.00 179.25 180.90 2kw6 h GLU 65 N 0.64 0.26 -0.28 0.00 4.81 -1.12 -2.70 114.58 116.19 2kw6 h GLU 65 Ca 0.17 -0.21 0.03 0.00 -0.13 0.00 0.00 59.36 59.22 2kw6 h GLU 65 Cb 0.01 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.40 2kw6 h GLU 65 CO -0.03 0.85 0.12 1.25 -0.73 0.00 0.00 179.01 180.47 2kw6 h LEU 66 N -0.27 0.15 0.24 1.64 5.85 -0.97 -0.30 115.31 121.65 2kw6 h LEU 66 Ca -0.02 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.73 2kw6 h LEU 66 Cb 0.89 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.90 2kw6 h LEU 66 CO 0.05 0.12 -0.27 0.25 -0.34 0.00 0.00 178.44 178.26 2kw6 h LEU 67 N 0.26 -0.73 -1.66 2.25 5.85 -1.38 -2.81 115.31 117.09 2kw6 h LEU 67 Ca 0.12 0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.89 2kw6 h LEU 67 Cb 0.07 0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.34 2kw6 h LEU 67 CO -0.11 -0.38 0.02 0.00 -0.34 0.00 0.00 178.44 177.63 2kw6 h ALA 68 N 0.09 1.73 0.26 1.25 0.00 -1.10 -2.57 119.26 118.92 2kw6 h ALA 68 Ca -0.00 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2kw6 h ALA 68 Cb 0.52 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2kw6 h ALA 68 CO -0.07 0.21 -0.13 0.82 0.00 0.00 0.00 179.25 180.08 2kw6 h ILE 69 N 0.23 0.76 -0.56 0.00 2.04 -1.01 -3.01 117.51 115.96 2kw6 h ILE 69 Ca 0.06 -0.69 -0.01 0.00 1.00 0.00 0.00 64.86 65.22 2kw6 h ILE 69 Cb 0.13 1.13 -0.03 0.00 -0.74 0.00 0.00 36.82 37.31 2kw6 h ILE 69 CO -0.00 0.14 0.32 0.40 0.00 0.00 0.00 178.15 179.01 2kw6 h ILE 70 N -0.74 1.18 0.00 -0.67 2.04 -1.21 -0.89 117.51 117.22 2kw6 h ILE 70 Ca -0.04 -0.44 0.00 0.00 1.00 0.00 0.00 64.86 65.39 2kw6 h ILE 70 Cb 0.49 0.45 0.00 0.00 -0.74 0.00 0.00 36.82 37.02 2kw6 h ILE 70 CO 0.06 0.19 0.00 1.05 0.00 0.00 0.00 178.15 179.45 2kw6 h GLU 71 N 0.76 0.00 0.23 2.37 4.11 -1.61 -2.68 114.58 117.77 2kw6 h GLU 71 Ca 0.20 0.00 -0.33 0.00 0.07 0.00 0.00 59.36 59.30 2kw6 h GLU 71 Cb 0.02 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.30 2kw6 h GLU 71 CO -0.03 0.00 -1.52 1.49 0.07 0.00 0.00 179.01 179.02 2kw6 h GLU 72 N 0.00 0.50 -0.22 1.06 4.81 -1.10 -3.28 114.58 116.35 2kw6 h GLU 72 Ca 0.00 -0.85 0.06 0.00 -0.13 0.00 0.00 59.36 58.44 2kw6 h GLU 72 Cb 0.47 0.32 -0.01 0.00 0.63 0.00 0.00 28.75 30.15 2kw6 h GLU 72 CO 0.00 1.41 0.16 -0.07 -0.73 0.00 0.00 179.01 179.78 2kw6 h LEU 73 N 0.10 0.00 -1.10 1.64 3.38 -0.89 -1.65 115.31 116.79 2kw6 h LEU 73 Ca -0.27 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.60 2kw6 h LEU 73 Cb 2.13 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.86 2kw6 h LEU 73 CO 0.25 0.00 -0.42 1.23 0.09 0.00 0.00 178.44 179.58 2kw6 h GLY 74 N 0.00 0.05 1.84 0.83 0.00 -1.56 -2.55 103.07 101.69 2kw6 h GLY 74 Ca 0.10 -0.05 -0.12 0.00 0.00 0.00 0.00 47.33 47.27 2kw6 h GLY 74 CO -0.00 0.05 -0.48 0.50 0.00 0.00 0.00 176.54 176.60 2kw6 h LYS 75 N 0.04 0.17 -0.00 4.80 1.79 -1.40 -3.23 116.57 118.74 2kw6 h LYS 75 Ca 0.00 -0.09 0.00 0.00 -2.18 0.00 0.00 60.65 58.38 2kw6 h LYS 75 Cb 0.77 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.42 2kw6 h LYS 75 CO 0.06 0.62 -0.20 0.39 -1.08 0.00 0.00 179.45 179.23 2kw6 n GLU 76 N -3.96 0.21 0.01 3.15 -0.58 -0.97 -3.85 120.64 114.64 2kw6 n GLU 76 Ca -0.02 -0.07 -0.11 0.00 -0.42 0.00 0.00 57.16 56.53 2kw6 n GLU 76 Cb 0.52 -1.50 -0.06 0.00 -0.57 0.00 0.00 31.44 29.83 2kw6 n GLU 76 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 2kw6 h ILE 77 N 0.18 1.06 0.07 -3.67 2.04 -1.54 -2.28 117.51 113.37 2kw6 h ILE 77 Ca 0.00 -0.16 0.02 0.00 1.00 0.00 0.00 64.86 65.73 2kw6 h ILE 77 Cb 0.46 1.04 -0.05 0.00 -0.74 0.00 0.00 36.82 37.53 2kw6 h ILE 77 CO 0.00 0.05 -0.38 0.03 0.00 0.00 0.00 178.15 177.85 2kw6 h ARG 78 N 0.04 -0.56 0.00 2.37 2.47 -1.79 -0.76 114.38 116.16 2kw6 h ARG 78 Ca 0.02 0.04 -0.16 0.00 -1.26 0.00 0.00 59.98 58.62 2kw6 h ARG 78 Cb 0.05 0.13 -0.02 0.00 -1.65 0.00 0.00 29.97 28.47 2kw6 h ARG 78 CO -0.00 -0.37 -0.76 -1.00 0.56 0.00 0.00 179.97 178.40 2kw6 h PRO 79 N -0.58 0.00 -0.13 0.04 0.13 -1.79 -2.71 132.00 126.95 2kw6 h PRO 79 Ca 0.04 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 65.17 2kw6 h PRO 79 Cb 0.63 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.75 2kw6 h PRO 79 CO -0.25 0.76 0.07 1.15 -0.23 0.00 0.00 178.00 179.49 2kw6 h THR 80 N 0.00 1.00 0.00 1.56 2.02 -1.27 -1.75 112.91 114.47 2kw6 h THR 80 Ca -0.01 -0.05 -0.00 0.00 0.77 0.00 0.00 66.41 67.12 2kw6 h THR 80 Cb 1.35 0.84 -0.00 0.00 -1.74 0.00 0.00 68.15 68.60 2kw6 h THR 80 CO 0.10 0.03 -0.02 0.22 0.37 0.00 0.00 175.52 176.21 2kw6 h TYR 81 N 0.15 0.00 0.00 3.16 3.20 -1.18 -1.61 116.97 120.68 2kw6 h TYR 81 Ca 0.05 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.92 2kw6 h TYR 81 Cb 0.00 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.27 2kw6 h TYR 81 CO -0.09 0.02 0.00 0.00 -1.64 0.00 0.00 178.16 176.46 2kw6 n ALA 82 N -2.53 2.51 -2.78 1.82 0.00 -0.82 -4.89 120.51 113.82 2kw6 n ALA 82 Ca -0.03 -0.12 -0.08 0.00 0.00 0.00 0.00 53.44 53.22 2kw6 n ALA 82 Cb 0.11 -1.30 0.03 0.00 0.00 0.00 0.00 19.45 18.29 2kw6 n ALA 82 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kw6 n GLY 83 N 0.66 0.35 3.52 0.00 0.00 -0.61 -5.05 105.19 104.07 2kw6 n GLY 83 Ca 0.14 -0.33 -0.39 0.00 0.00 0.00 0.00 46.02 45.43 2kw6 n GLY 83 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2kw6 s SER 84 N -3.21 5.94 0.60 1.61 0.01 -0.72 -4.97 113.70 112.95 2kw6 s SER 84 Ca 0.15 -0.36 0.38 0.00 1.31 0.00 0.00 55.95 57.43 2kw6 s SER 84 Cb -0.07 -2.10 1.85 0.00 0.21 0.00 0.00 66.02 65.91 2kw6 s SER 84 CO 0.26 -0.19 2.17 0.50 0.41 0.00 0.00 173.24 176.38 2kw6 h LYS 85 N 8.44 0.00 0.47 12.44 3.64 -1.93 -2.88 116.57 136.76 2kw6 h LYS 85 Ca -0.32 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.03 2kw6 h LYS 85 Cb 1.16 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 2kw6 h LYS 85 CO 0.61 0.01 -0.23 0.66 -2.27 0.00 0.00 179.45 178.24 2kw6 h SER 86 N 0.00 -0.54 -0.37 4.20 4.64 -1.95 -3.30 113.55 116.23 2kw6 h SER 86 Ca -0.00 -0.08 -0.10 0.00 -0.47 0.00 0.00 61.79 61.13 2kw6 h SER 86 Cb 0.27 0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 62.48 2kw6 h SER 86 CO 0.00 -0.16 -0.14 0.00 -0.87 0.00 0.00 176.83 175.65 2kw6 h ALA 87 N -0.69 0.91 -0.12 5.18 0.00 -1.84 -2.59 119.26 120.10 2kw6 h ALA 87 Ca -0.07 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 2kw6 h ALA 87 Cb 0.59 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2kw6 h ALA 87 CO 0.11 0.63 0.01 0.00 0.00 0.00 0.00 179.25 180.00 2kw6 h MET 88 N 0.75 0.17 0.06 0.00 3.00 -1.67 -0.42 114.93 116.82 2kw6 h MET 88 Ca 0.12 -0.02 -0.24 0.00 0.00 0.00 0.00 59.70 59.56 2kw6 h MET 88 Cb 0.65 -0.03 0.00 0.00 0.00 0.00 0.00 31.60 32.22 2kw6 h MET 88 CO 0.05 0.17 -1.08 0.93 0.00 0.00 0.00 176.91 176.99 2kw6 h GLU 89 N 0.17 0.31 -0.42 -0.10 4.39 -1.54 -0.57 114.58 116.81 2kw6 h GLU 89 Ca 0.04 -0.41 -0.03 0.00 0.34 0.00 0.00 59.36 59.31 2kw6 h GLU 89 Cb 0.10 0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 28.86 2kw6 h GLU 89 CO -0.00 1.14 0.16 0.00 -1.16 0.00 0.00 179.01 179.15 2kw6 h ARG 90 N 0.13 0.63 -0.35 2.33 2.47 -1.15 -1.61 114.38 116.83 2kw6 h ARG 90 Ca -0.10 -0.12 -0.05 0.00 -1.26 0.00 0.00 59.98 58.45 2kw6 h ARG 90 Cb 1.76 -0.10 -0.01 0.00 -1.65 0.00 0.00 29.97 29.96 2kw6 h ARG 90 CO 0.18 0.59 0.02 1.25 0.56 0.00 0.00 179.97 182.56 2kw6 h LEU 91 N 0.53 0.60 0.09 3.04 5.85 -1.12 -2.55 115.31 121.75 2kw6 h LEU 91 Ca 0.14 -0.29 -0.00 0.00 0.84 0.00 0.00 57.88 58.56 2kw6 h LEU 91 Cb 0.20 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.07 2kw6 h LEU 91 CO -0.01 0.74 -0.04 0.50 -0.34 0.00 0.00 178.44 179.29 2kw6 h LYS 92 N 0.43 -0.12 -0.51 1.25 1.63 -1.07 -2.52 116.57 115.67 2kw6 h LYS 92 Ca 0.10 0.01 -0.04 0.00 -0.85 0.00 0.00 60.65 59.87 2kw6 h LYS 92 Cb 0.43 0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 32.06 2kw6 h LYS 92 CO 0.01 0.11 0.16 -0.09 -3.45 0.00 0.00 179.45 176.20 2kw6 h ARG 93 N -0.33 0.79 -0.65 1.90 9.65 -1.32 -2.21 114.38 122.20 2kw6 h ARG 93 Ca -0.01 -0.17 -0.05 0.00 -1.10 0.00 0.00 59.98 58.65 2kw6 h ARG 93 Cb 0.28 -0.11 -0.03 0.00 -1.39 0.00 0.00 29.97 28.72 2kw6 h ARG 93 CO 0.02 0.73 0.21 0.78 2.80 0.00 0.00 179.97 184.51 2kw6 h GLY 94 N 0.69 1.07 0.97 2.80 0.00 -1.51 -1.82 103.07 105.27 2kw6 h GLY 94 Ca 0.16 -0.63 -0.00 0.00 0.00 0.00 0.00 47.33 46.87 2kw6 h GLY 94 CO -0.01 0.59 0.13 -2.22 0.00 0.00 0.00 176.54 175.03 2kw6 h ILE 95 N 0.93 1.09 -0.59 2.60 2.04 -1.16 0.62 117.51 123.04 2kw6 h ILE 95 Ca 0.21 -0.22 -0.00 0.00 1.00 0.00 0.00 64.86 65.84 2kw6 h ILE 95 Cb 0.28 0.84 -0.03 0.00 -0.74 0.00 0.00 36.82 37.17 2kw6 h ILE 95 CO -0.01 0.09 0.35 0.40 0.00 0.00 0.00 178.15 178.98 2kw6 h ILE 96 N 0.27 1.18 -0.34 -0.67 2.04 -1.36 -1.59 117.51 117.05 2kw6 h ILE 96 Ca 0.08 -0.41 -0.00 0.00 1.00 0.00 0.00 64.86 65.52 2kw6 h ILE 96 Cb 0.03 0.38 -0.02 0.00 -0.74 0.00 0.00 36.82 36.47 2kw6 h ILE 96 CO -0.01 0.19 0.20 -0.74 0.00 0.00 0.00 178.15 177.78 2kw6 h HIS 97 N 0.80 0.45 -0.34 1.37 2.76 -1.12 -2.48 115.15 116.60 2kw6 h HIS 97 Ca 0.21 -0.00 -0.09 0.00 -2.20 0.00 0.00 60.37 58.28 2kw6 h HIS 97 Cb -0.01 -0.15 -0.02 0.00 1.55 0.00 0.00 27.41 28.79 2kw6 h HIS 97 CO -0.02 0.34 -0.18 0.00 -1.30 0.00 0.00 177.93 176.76 2kw6 h ALA 98 N 1.07 1.05 -0.34 5.26 0.00 -0.70 -2.79 119.26 122.82 2kw6 h ALA 98 Ca 0.12 -0.33 -0.09 0.00 0.00 0.00 0.00 54.91 54.61 2kw6 h ALA 98 Cb 0.02 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 2kw6 h ALA 98 CO -0.02 0.58 -0.18 -0.09 0.00 0.00 0.00 179.25 179.54 2kw6 h ARG 99 N 0.56 0.62 -0.25 0.00 2.43 -1.17 -2.62 114.38 113.95 2kw6 h ARG 99 Ca 0.09 -0.21 -0.06 0.00 -0.81 0.00 0.00 59.98 58.98 2kw6 h ARG 99 Cb 0.63 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.12 2kw6 h ARG 99 CO 0.04 0.76 -0.11 0.78 -1.51 0.00 0.00 179.97 179.93 2kw6 h GLY 100 N 0.98 0.43 1.20 2.80 0.00 -1.17 -0.96 103.07 106.35 2kw6 h GLY 100 Ca 0.09 -0.28 -0.17 0.00 0.00 0.00 0.00 47.33 46.97 2kw6 h GLY 100 CO 0.04 0.26 -0.46 1.41 0.00 0.00 0.00 176.54 177.80 2kw6 h LEU 101 N 0.38 0.93 -0.81 3.11 3.38 -1.36 -2.33 115.31 118.61 2kw6 h LEU 101 Ca 0.07 -0.46 -0.12 0.00 0.09 0.00 0.00 57.88 57.46 2kw6 h LEU 101 Cb 0.43 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 2kw6 h LEU 101 CO 0.02 1.24 -0.46 0.58 0.09 0.00 0.00 178.44 179.92 2kw6 h VAL 102 N 0.68 1.32 -0.50 1.22 2.07 -1.15 -1.06 116.25 118.84 2kw6 h VAL 102 Ca 0.04 -1.64 -0.09 0.00 0.82 0.00 0.00 66.70 65.83 2kw6 h VAL 102 Cb 1.05 1.73 -0.02 0.00 -1.52 0.00 0.00 31.29 32.53 2kw6 h VAL 102 CO 0.10 0.49 -0.04 0.03 0.02 0.00 0.00 177.57 178.18 2kw6 h ARG 103 N 0.25 0.88 -0.07 1.57 2.47 -1.10 -0.59 114.38 117.79 2kw6 h ARG 103 Ca 0.02 -0.27 -0.14 0.00 -1.26 0.00 0.00 59.98 58.33 2kw6 h ARG 103 Cb 0.90 -0.09 -0.01 0.00 -1.65 0.00 0.00 29.97 29.13 2kw6 h ARG 103 CO 0.07 0.90 -0.60 1.49 0.56 0.00 0.00 179.97 182.39 2kw6 h GLU 104 N 0.80 0.24 -0.34 0.04 4.81 -1.21 -0.39 114.58 118.53 2kw6 h GLU 104 Ca 0.15 -0.16 -0.14 0.00 -0.13 0.00 0.00 59.36 59.07 2kw6 h GLU 104 Cb 0.53 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.93 2kw6 h GLU 104 CO 0.03 0.76 -0.36 0.00 -0.73 0.00 0.00 179.01 178.71 2kw6 h LEU 106 N 0.65 0.23 -1.22 0.00 3.38 -1.05 -1.95 115.31 115.34 2kw6 h LEU 106 Ca 0.06 -0.24 -0.04 0.00 0.09 0.00 0.00 57.88 57.75 2kw6 h LEU 106 Cb 0.91 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.56 2kw6 h LEU 106 CO 0.08 1.16 0.11 0.00 0.09 0.00 0.00 178.44 179.88 2kw6 h ALA 107 N 0.81 1.38 0.01 1.53 0.00 -1.06 0.36 119.26 122.27 2kw6 h ALA 107 Ca -0.07 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.56 2kw6 h ALA 107 Cb 1.81 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 19.43 2kw6 h ALA 107 CO 0.16 0.45 -0.42 1.49 0.00 0.00 0.00 179.25 180.93 2kw6 h GLU 108 N 0.63 0.28 0.00 0.00 4.57 -1.39 -3.04 114.58 115.63 2kw6 h GLU 108 Ca 0.15 -0.30 -0.00 0.00 -1.18 0.00 0.00 59.36 58.02 2kw6 h GLU 108 Cb 0.23 0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 28.91 2kw6 h GLU 108 CO -0.00 1.02 -0.01 1.15 -1.18 0.00 0.00 179.01 179.99 2kw6 h THR 109 N -0.34 0.04 -0.22 0.32 2.02 -1.29 -1.19 112.91 112.25 2kw6 h THR 109 Ca -0.05 -0.14 -0.10 0.00 0.77 0.00 0.00 66.41 66.88 2kw6 h THR 109 Cb 1.17 1.13 -0.00 0.00 -1.74 0.00 0.00 68.15 68.71 2kw6 h THR 109 CO 0.08 0.01 -0.25 -0.08 0.37 0.00 0.00 175.52 175.65 2kw6 h GLU 110 N 0.00 0.56 -0.01 6.66 4.57 -0.87 -0.98 114.58 124.51 2kw6 h GLU 110 Ca -0.00 -0.31 -0.15 0.00 -1.18 0.00 0.00 59.36 57.73 2kw6 h GLU 110 Cb 0.13 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.72 2kw6 h GLU 110 CO 0.00 0.90 -0.68 0.00 -1.18 0.00 0.00 179.01 178.05 2kw6 h ARG 111 N 0.25 0.03 -0.11 1.92 3.08 -1.20 -3.33 114.38 115.01 2kw6 h ARG 111 Ca 0.03 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.06 2kw6 h ARG 111 Cb 0.81 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.87 2kw6 h ARG 111 CO 0.06 0.70 0.00 -1.71 -1.07 0.00 0.00 179.97 177.95 2kw6 n ASN 112 N -3.74 2.13 -3.05 7.04 2.85 -0.54 -5.05 115.26 114.90 2kw6 n ASN 112 Ca -0.01 -1.77 -0.05 0.00 -0.11 0.00 0.00 54.58 52.64 2kw6 n ASN 112 Cb 0.67 -0.07 0.02 0.00 1.24 0.00 0.00 39.78 41.64 2kw6 n ASN 112 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2kw6 n ALA 113 N 0.05 -2.29 -2.63 5.20 0.00 -0.37 -4.99 120.51 115.49 2kw6 n ALA 113 Ca 0.05 -1.08 -0.12 0.00 0.00 0.00 0.00 53.44 52.28 2kw6 n ALA 113 Cb 0.27 0.71 0.02 0.00 0.00 0.00 0.00 19.45 20.45 2kw6 n ALA 113 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2kw6 n ARG 114 N -0.64 1.60 0.00 0.00 3.00 -1.26 -4.50 116.66 114.86 2kw6 n ARG 114 Ca -0.04 -3.50 0.04 0.00 -0.00 0.00 0.00 57.85 54.35 2kw6 n ARG 114 Cb 0.57 -1.44 0.26 0.00 0.00 0.00 0.00 32.46 31.85 2kw6 n ARG 114 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08