#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 0.89 3.44 -5.12 0.00 -1.26 -5.03 105.19 98.11 2kw6 n GLY 52 Ca 0.00 -0.66 -0.44 0.00 0.00 0.00 0.00 46.02 44.92 2kw6 n GLY 52 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2kw6 s HIS 53 N -2.31 3.23 0.24 1.61 5.65 -1.26 -5.03 115.29 117.43 2kw6 s HIS 53 Ca 0.00 -1.54 -0.30 0.00 0.25 0.00 0.00 55.06 53.48 2kw6 s HIS 53 Cb 0.00 -4.23 -0.09 0.00 -1.18 0.00 0.00 32.58 27.08 2kw6 s HIS 53 CO 0.00 -1.42 0.99 -1.58 -0.65 0.00 0.00 174.74 172.08 2kw6 s HIS 54 N 2.29 3.85 -0.05 3.88 5.04 -1.26 -5.07 115.29 123.97 2kw6 s HIS 54 Ca 0.32 1.84 0.01 0.00 -1.54 0.00 0.00 55.06 55.69 2kw6 s HIS 54 Cb -0.05 -3.08 0.02 0.00 0.04 0.00 0.00 32.58 29.51 2kw6 s HIS 54 CO -0.09 0.13 -0.03 -3.38 -2.34 0.00 0.00 174.74 169.03 2kw6 s HIS 55 N -1.06 0.70 -0.31 3.88 0.00 -1.26 -5.10 115.29 112.15 2kw6 s HIS 55 Ca 0.43 -0.19 0.04 0.00 -3.00 0.00 0.00 55.06 52.34 2kw6 s HIS 55 Cb -0.28 -0.66 0.17 0.00 -4.00 0.00 0.00 32.58 27.81 2kw6 s HIS 55 CO 0.34 -0.21 0.48 -1.58 -1.00 0.00 0.00 174.74 172.78 2kw6 s HIS 56 N 1.07 -1.28 -0.16 0.38 5.04 -1.26 -5.07 115.29 114.00 2kw6 s HIS 56 Ca -0.09 0.44 -0.13 0.00 -1.54 0.00 0.00 55.06 53.74 2kw6 s HIS 56 Cb -0.14 0.01 -0.06 0.00 0.04 0.00 0.00 32.58 32.44 2kw6 s HIS 56 CO -0.01 -1.04 -0.21 0.72 -2.34 0.00 0.00 174.74 171.86 2kw6 n HIS 57 N 5.18 0.60 -3.44 3.88 8.25 -1.26 -5.01 115.22 123.42 2kw6 n HIS 57 Ca 0.04 0.26 -0.19 0.00 -0.26 0.00 0.00 57.72 57.57 2kw6 n HIS 57 Cb 0.51 -0.72 -0.01 0.00 1.12 0.00 0.00 29.99 30.89 2kw6 n HIS 57 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2kw6 s HIS 58 N -2.48 3.01 -0.41 4.41 0.09 -1.26 -5.11 115.29 113.54 2kw6 s HIS 58 Ca -0.22 -0.28 0.02 0.00 -0.00 0.00 0.00 55.06 54.59 2kw6 s HIS 58 Cb 0.04 -2.04 0.12 0.00 -0.00 0.00 0.00 32.58 30.69 2kw6 s HIS 58 CO 0.33 -0.06 0.18 0.45 -0.00 0.00 0.00 174.74 175.63 2kw6 s SER 59 N -4.18 4.11 -0.15 1.40 0.15 -1.26 -4.89 113.70 108.89 2kw6 s SER 59 Ca 0.46 -2.43 -0.04 0.00 0.70 0.00 0.00 55.95 54.64 2kw6 s SER 59 Cb -0.09 -1.27 -0.08 0.00 -1.71 0.00 0.00 66.02 62.88 2kw6 s SER 59 CO 0.31 -0.31 -0.16 1.41 1.20 0.00 0.00 173.24 175.69 2kw6 n HIS 60 N 3.83 0.00 -2.27 3.44 8.25 -1.26 -4.80 115.22 122.42 2kw6 n HIS 60 Ca 0.05 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.17 2kw6 n HIS 60 Cb 0.37 -0.54 -0.04 0.00 1.12 0.00 0.00 29.99 30.90 2kw6 n HIS 60 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2kw6 s SER 61 N -5.90 5.74 -0.01 0.41 0.01 -1.26 -4.80 113.70 107.89 2kw6 s SER 61 Ca -0.20 -1.80 -0.20 0.00 1.31 0.00 0.00 55.95 55.06 2kw6 s SER 61 Cb 0.07 -2.58 -0.25 0.00 0.21 0.00 0.00 66.02 63.46 2kw6 s SER 61 CO 0.29 -2.31 1.06 0.50 0.41 0.00 0.00 173.24 173.18 2kw6 h LYS 62 N 9.20 0.38 -0.42 12.44 1.63 -1.99 0.23 116.57 138.04 2kw6 h LYS 62 Ca 0.28 -0.45 -0.08 0.00 -0.85 0.00 0.00 60.65 59.55 2kw6 h LYS 62 Cb 0.93 0.14 -0.02 0.00 -0.60 0.00 0.00 32.23 32.68 2kw6 h LYS 62 CO 1.31 1.13 -0.07 1.88 -3.45 0.00 0.00 179.45 180.26 2kw6 h TYR 63 N -0.17 0.77 0.00 1.91 0.05 -1.96 -2.68 116.97 114.89 2kw6 h TYR 63 Ca -0.09 -0.12 -0.10 0.00 0.05 0.00 0.00 58.73 58.47 2kw6 h TYR 63 Cb 1.38 -0.20 -0.01 0.00 1.01 0.00 0.00 36.73 38.90 2kw6 h TYR 63 CO 0.16 0.76 -0.48 0.00 -1.05 0.00 0.00 178.16 177.54 2kw6 h ALA 64 N 1.27 1.06 -0.64 3.88 0.00 -1.95 -3.08 119.26 119.81 2kw6 h ALA 64 Ca 0.12 -0.44 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 2kw6 h ALA 64 Cb 0.51 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 2kw6 h ALA 64 CO 0.03 0.60 0.36 1.49 0.00 0.00 0.00 179.25 181.73 2kw6 h GLU 65 N 0.00 0.88 0.26 0.00 4.57 -0.61 -1.57 114.58 118.11 2kw6 h GLU 65 Ca -0.00 -0.09 -0.01 0.00 -1.18 0.00 0.00 59.36 58.07 2kw6 h GLU 65 Cb 0.93 -0.18 -0.00 0.00 -0.16 0.00 0.00 28.75 29.34 2kw6 h GLU 65 CO 0.06 0.65 -0.15 1.25 -1.18 0.00 0.00 179.01 179.64 2kw6 h LEU 66 N 0.86 -0.37 -0.80 1.64 5.85 -1.44 -1.31 115.31 119.75 2kw6 h LEU 66 Ca 0.23 0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.97 2kw6 h LEU 66 Cb 0.02 0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.11 2kw6 h LEU 66 CO -0.04 -0.25 0.52 0.25 -0.34 0.00 0.00 178.44 178.58 2kw6 h LEU 67 N -0.39 0.92 -0.89 2.25 5.85 -1.50 -2.60 115.31 118.96 2kw6 h LEU 67 Ca -0.03 -0.03 -0.09 0.00 0.84 0.00 0.00 57.88 58.57 2kw6 h LEU 67 Cb 0.32 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 2kw6 h LEU 67 CO 0.03 0.68 -0.17 0.00 -0.34 0.00 0.00 178.44 178.65 2kw6 h ALA 68 N 1.28 1.06 0.02 1.25 0.00 -1.06 -2.17 119.26 119.64 2kw6 h ALA 68 Ca 0.29 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2kw6 h ALA 68 Cb -0.11 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.53 2kw6 h ALA 68 CO -0.06 0.57 -0.01 0.82 0.00 0.00 0.00 179.25 180.57 2kw6 h ILE 69 N 0.57 1.33 -0.42 0.00 2.04 -1.11 -3.02 117.51 116.90 2kw6 h ILE 69 Ca 0.09 -1.09 -0.00 0.00 1.00 0.00 0.00 64.86 64.86 2kw6 h ILE 69 Cb 0.61 2.07 -0.02 0.00 -0.74 0.00 0.00 36.82 38.74 2kw6 h ILE 69 CO 0.04 0.28 0.26 0.40 0.00 0.00 0.00 178.15 179.14 2kw6 h ILE 70 N -0.50 1.13 0.00 -0.67 2.04 -1.33 -1.03 117.51 117.15 2kw6 h ILE 70 Ca -0.00 -0.27 -0.02 0.00 1.00 0.00 0.00 64.86 65.57 2kw6 h ILE 70 Cb 0.48 0.55 -0.00 0.00 -0.74 0.00 0.00 36.82 37.10 2kw6 h ILE 70 CO 0.00 0.13 -0.07 1.05 0.00 0.00 0.00 178.15 179.26 2kw6 h GLU 71 N 0.57 0.00 0.03 2.37 4.11 -1.51 -2.50 114.58 117.64 2kw6 h GLU 71 Ca 0.15 0.00 -0.15 0.00 0.07 0.00 0.00 59.36 59.43 2kw6 h GLU 71 Cb -0.02 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.24 2kw6 h GLU 71 CO -0.03 0.07 -0.62 1.49 0.07 0.00 0.00 179.01 179.99 2kw6 h GLU 72 N 0.00 0.37 -0.08 1.06 4.57 -1.18 -3.31 114.58 116.01 2kw6 h GLU 72 Ca -0.00 -0.44 0.02 0.00 -1.18 0.00 0.00 59.36 57.77 2kw6 h GLU 72 Cb 0.37 0.13 -0.00 0.00 -0.16 0.00 0.00 28.75 29.09 2kw6 h GLU 72 CO 0.01 1.12 0.06 -0.07 -1.18 0.00 0.00 179.01 178.96 2kw6 h LEU 73 N -0.20 0.00 -1.43 1.64 3.38 -0.78 -2.01 115.31 115.90 2kw6 h LEU 73 Ca -0.09 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.84 2kw6 h LEU 73 Cb 1.36 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.11 2kw6 h LEU 73 CO 0.12 0.00 -0.20 1.23 0.09 0.00 0.00 178.44 179.68 2kw6 h GLY 74 N 0.00 0.00 0.90 0.83 0.00 -1.59 -2.69 103.07 100.52 2kw6 h GLY 74 Ca 0.04 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.21 2kw6 h GLY 74 CO -0.00 0.00 -0.59 0.50 0.00 0.00 0.00 176.54 176.45 2kw6 h LYS 75 N 0.00 0.53 0.00 4.80 1.79 -1.51 -3.34 116.57 118.84 2kw6 h LYS 75 Ca -0.00 -0.47 0.00 0.00 -2.18 0.00 0.00 60.65 58.00 2kw6 h LYS 75 Cb 0.59 0.11 0.00 0.00 -1.58 0.00 0.00 32.23 31.35 2kw6 h LYS 75 CO 0.03 1.10 0.00 0.39 -1.08 0.00 0.00 179.45 179.89 2kw6 n GLU 76 N -4.18 0.01 -0.02 3.15 -0.58 -1.02 -3.43 120.64 114.57 2kw6 n GLU 76 Ca -0.09 0.20 -0.13 0.00 -0.42 0.00 0.00 57.16 56.72 2kw6 n GLU 76 Cb 0.65 -1.50 -0.08 0.00 -0.57 0.00 0.00 31.44 29.94 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 0.00 1.32 -0.21 -3.67 2.04 -1.66 -2.58 117.51 112.75 2kw6 h ILE 77 Ca 0.00 -1.00 0.03 0.00 1.00 0.00 0.00 64.86 64.88 2kw6 h ILE 77 Cb 0.30 1.87 -0.03 0.00 -0.74 0.00 0.00 36.82 38.22 2kw6 h ILE 77 CO 0.00 0.27 0.03 0.03 0.00 0.00 0.00 178.15 178.48 2kw6 h ARG 78 N -0.26 0.10 -0.35 2.37 3.08 -1.80 -0.27 114.38 117.26 2kw6 h ARG 78 Ca 0.01 -0.01 -0.11 0.00 0.07 0.00 0.00 59.98 59.95 2kw6 h ARG 78 Cb 0.45 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.46 2kw6 h ARG 78 CO 0.01 0.07 -0.23 -1.00 -1.07 0.00 0.00 179.97 177.74 2kw6 h PRO 79 N 0.11 0.69 -0.38 0.04 0.13 -1.78 -2.48 132.00 128.33 2kw6 h PRO 79 Ca 0.09 -0.28 0.05 0.00 -0.87 0.00 0.00 66.00 65.00 2kw6 h PRO 79 Cb 0.10 -0.03 -0.05 0.00 0.13 0.00 0.00 31.00 31.15 2kw6 h PRO 79 CO -0.13 0.87 0.11 1.15 -0.23 0.00 0.00 178.00 179.76 2kw6 h THR 80 N 0.61 0.86 -0.17 1.56 2.02 -1.00 -0.25 112.91 116.53 2kw6 h THR 80 Ca 0.09 -0.09 -0.04 0.00 0.77 0.00 0.00 66.41 67.14 2kw6 h THR 80 Cb 0.72 0.58 -0.01 0.00 -1.74 0.00 0.00 68.15 67.69 2kw6 h THR 80 CO 0.06 0.05 -0.07 0.22 0.37 0.00 0.00 175.52 176.14 2kw6 h TYR 81 N 0.26 0.26 -0.14 3.16 3.20 -1.10 -2.14 116.97 120.46 2kw6 h TYR 81 Ca 0.18 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.03 2kw6 h TYR 81 Cb 0.18 -0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.37 2kw6 h TYR 81 CO -0.16 0.34 0.00 0.00 -1.64 0.00 0.00 178.16 176.69 2kw6 n ALA 82 N -2.49 2.50 -1.20 1.82 0.00 -0.50 -4.90 120.51 115.74 2kw6 n ALA 82 Ca -0.00 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.13 2kw6 n ALA 82 Cb 0.23 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.63 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 0.83 1.03 3.53 0.00 0.00 -0.70 -5.03 105.19 104.85 2kw6 n GLY 83 Ca 0.09 -0.53 -0.42 0.00 0.00 0.00 0.00 46.02 45.16 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 -2.60 6.30 0.43 1.61 0.01 -0.22 -4.95 113.70 114.29 2kw6 s SER 84 Ca 0.00 -0.23 0.14 0.00 1.31 0.00 0.00 55.95 57.18 2kw6 s SER 84 Cb 0.00 -2.28 0.95 0.00 0.21 0.00 0.00 66.02 64.90 2kw6 s SER 84 CO 0.00 -0.60 1.95 0.50 0.41 0.00 0.00 173.24 175.51 2kw6 h LYS 85 N 8.64 0.00 -0.26 12.44 3.64 -1.91 -2.96 116.57 136.16 2kw6 h LYS 85 Ca -0.27 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 58.98 2kw6 h LYS 85 Cb 1.11 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.92 2kw6 h LYS 85 CO 0.82 0.23 -0.40 0.66 -2.27 0.00 0.00 179.45 178.49 2kw6 h SER 86 N 0.00 0.64 -0.16 4.20 4.64 -1.97 -2.81 113.55 118.09 2kw6 h SER 86 Ca -0.00 -0.29 -0.20 0.00 -0.47 0.00 0.00 61.79 60.83 2kw6 h SER 86 Cb 0.41 -0.18 0.01 0.00 -0.31 0.00 0.00 62.40 62.32 2kw6 h SER 86 CO 0.03 0.97 -0.68 0.00 -0.87 0.00 0.00 176.83 176.28 2kw6 h ALA 87 N 1.06 0.30 -0.03 5.18 0.00 -1.86 -3.13 119.26 120.79 2kw6 h ALA 87 Ca 0.04 -0.56 -0.09 0.00 0.00 0.00 0.00 54.91 54.30 2kw6 h ALA 87 Cb 0.91 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 2kw6 h ALA 87 CO 0.08 0.61 -0.42 0.00 0.00 0.00 0.00 179.25 179.51 2kw6 h MET 88 N 0.46 0.06 -0.30 0.00 -0.00 -1.49 -0.36 114.93 113.31 2kw6 h MET 88 Ca -0.04 -0.03 -0.01 0.00 -0.00 0.00 0.00 59.70 59.63 2kw6 h MET 88 Cb 1.31 -0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.89 2kw6 h MET 88 CO 0.14 0.48 0.17 0.93 -0.00 0.00 0.00 176.91 178.63 2kw6 h GLU 89 N 0.05 0.42 -0.52 -0.10 5.08 -1.53 -0.86 114.58 117.12 2kw6 h GLU 89 Ca 0.00 -0.05 -0.09 0.00 -1.00 0.00 0.00 59.36 58.23 2kw6 h GLU 89 Cb 0.77 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.92 2kw6 h GLU 89 CO 0.06 0.35 -0.01 0.00 -1.00 0.00 0.00 179.01 178.40 2kw6 h ARG 90 N 0.37 0.93 0.22 2.33 2.47 -1.44 -2.37 114.38 116.90 2kw6 h ARG 90 Ca 0.11 -0.30 -0.01 0.00 -1.26 0.00 0.00 59.98 58.51 2kw6 h ARG 90 Cb 0.05 -0.08 0.00 0.00 -1.65 0.00 0.00 29.97 28.30 2kw6 h ARG 90 CO -0.02 0.96 -0.11 1.25 0.56 0.00 0.00 179.97 182.61 2kw6 h LEU 91 N 0.80 -0.26 0.29 3.04 5.85 -1.01 -2.14 115.31 121.89 2kw6 h LEU 91 Ca 0.15 -0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 2kw6 h LEU 91 Cb 0.55 0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.65 2kw6 h LEU 91 CO 0.03 -0.13 -0.14 0.50 -0.34 0.00 0.00 178.44 178.36 2kw6 h LYS 92 N -0.37 -0.38 -0.97 1.25 3.64 -1.19 -1.89 116.57 116.66 2kw6 h LYS 92 Ca -0.03 0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.39 2kw6 h LYS 92 Cb 0.28 0.09 -0.05 0.00 -0.41 0.00 0.00 32.23 32.14 2kw6 h LYS 92 CO 0.05 -0.08 0.64 -0.09 -2.27 0.00 0.00 179.45 177.70 2kw6 h ARG 93 N -0.68 1.26 -0.24 1.90 2.43 -1.51 -1.72 114.38 115.82 2kw6 h ARG 93 Ca -0.04 -0.08 -0.17 0.00 -0.81 0.00 0.00 59.98 58.88 2kw6 h ARG 93 Cb 0.47 -0.28 -0.00 0.00 -0.42 0.00 0.00 29.97 29.74 2kw6 h ARG 93 CO 0.07 0.83 -0.54 0.78 -1.51 0.00 0.00 179.97 179.60 2kw6 h GLY 94 N 1.30 0.80 0.88 2.80 0.00 -1.39 -1.94 103.07 105.51 2kw6 h GLY 94 Ca 0.36 -0.93 -0.01 0.00 0.00 0.00 0.00 47.33 46.75 2kw6 h GLY 94 CO -0.09 0.83 -0.10 -2.22 0.00 0.00 0.00 176.54 174.97 2kw6 h ILE 95 N 0.56 0.84 -0.91 2.60 2.04 -0.90 0.16 117.51 121.90 2kw6 h ILE 95 Ca 0.01 -0.26 0.01 0.00 1.00 0.00 0.00 64.86 65.62 2kw6 h ILE 95 Cb 1.12 1.00 -0.04 0.00 -0.74 0.00 0.00 36.82 38.16 2kw6 h ILE 95 CO 0.11 0.06 0.60 0.40 0.00 0.00 0.00 178.15 179.32 2kw6 h ILE 96 N -0.41 1.24 -0.51 -0.67 2.04 -1.38 -1.97 117.51 115.85 2kw6 h ILE 96 Ca -0.03 -0.44 -0.11 0.00 1.00 0.00 0.00 64.86 65.28 2kw6 h ILE 96 Cb 0.31 -0.10 -0.02 0.00 -0.74 0.00 0.00 36.82 36.28 2kw6 h ILE 96 CO 0.05 0.23 -0.12 -0.74 0.00 0.00 0.00 178.15 177.57 2kw6 h HIS 97 N 1.24 1.06 -0.69 1.37 2.76 -1.29 -2.82 115.15 116.77 2kw6 h HIS 97 Ca 0.33 -0.21 -0.05 0.00 -2.20 0.00 0.00 60.37 58.24 2kw6 h HIS 97 Cb -0.13 -0.26 -0.03 0.00 1.55 0.00 0.00 27.41 28.54 2kw6 h HIS 97 CO -0.01 1.00 0.23 0.00 -1.30 0.00 0.00 177.93 177.85 2kw6 h ALA 98 N 1.01 0.91 0.00 5.26 0.00 -0.07 -1.33 119.26 125.03 2kw6 h ALA 98 Ca 0.13 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 2kw6 h ALA 98 Cb 0.66 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2kw6 h ALA 98 CO 0.05 0.57 -0.32 -0.09 0.00 0.00 0.00 179.25 179.46 2kw6 h ARG 99 N 1.01 0.00 0.00 0.00 2.43 -1.38 -1.58 114.38 114.86 2kw6 h ARG 99 Ca 0.22 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.35 2kw6 h ARG 99 Cb 0.28 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.83 2kw6 h ARG 99 CO -0.01 0.32 -0.21 0.78 -1.51 0.00 0.00 179.97 179.34 2kw6 h GLY 100 N 1.11 0.00 1.35 2.80 0.00 -1.00 -0.39 103.07 106.95 2kw6 h GLY 100 Ca -0.00 0.00 -0.27 0.00 0.00 0.00 0.00 47.33 47.06 2kw6 h GLY 100 CO 0.04 0.00 -1.45 1.41 0.00 0.00 0.00 176.54 176.54 2kw6 h LEU 101 N 0.00 0.09 -1.06 3.11 3.38 -0.77 -3.10 115.31 116.95 2kw6 h LEU 101 Ca -0.00 -0.13 -0.09 0.00 0.09 0.00 0.00 57.88 57.75 2kw6 h LEU 101 Cb 0.62 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 2kw6 h LEU 101 CO 0.03 1.11 -0.26 0.58 0.09 0.00 0.00 178.44 179.99 2kw6 h VAL 102 N 0.01 1.26 -0.75 1.22 2.07 -1.08 -1.83 116.25 117.15 2kw6 h VAL 102 Ca -0.19 -1.20 -0.00 0.00 0.82 0.00 0.00 66.70 66.12 2kw6 h VAL 102 Cb 1.93 1.39 -0.04 0.00 -1.52 0.00 0.00 31.29 33.06 2kw6 h VAL 102 CO 0.11 0.37 0.46 0.03 0.02 0.00 0.00 177.57 178.57 2kw6 h ARG 103 N 0.32 1.01 -0.17 1.57 2.47 -1.10 0.26 114.38 118.74 2kw6 h ARG 103 Ca 0.05 -0.08 -0.16 0.00 -1.26 0.00 0.00 59.98 58.53 2kw6 h ARG 103 Cb 0.62 -0.22 -0.01 0.00 -1.65 0.00 0.00 29.97 28.72 2kw6 h ARG 103 CO 0.04 0.70 -0.54 0.93 0.56 0.00 0.00 179.97 181.66 2kw6 h GLU 104 N 1.03 0.51 0.00 0.04 4.39 -1.39 -0.51 114.58 118.65 2kw6 h GLU 104 Ca 0.27 -0.32 -0.13 0.00 0.34 0.00 0.00 59.36 59.53 2kw6 h GLU 104 Cb -0.06 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.61 2kw6 h GLU 104 CO -0.05 0.92 -0.65 0.00 -1.16 0.00 0.00 179.01 178.06 2kw6 h LEU 106 N 0.00 0.60 -0.99 0.00 3.38 -0.45 -2.47 115.31 115.39 2kw6 h LEU 106 Ca -0.02 -0.54 0.06 0.00 0.09 0.00 0.00 57.88 57.47 2kw6 h LEU 106 Cb 1.47 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 41.96 2kw6 h LEU 106 CO 0.07 1.36 0.64 0.00 0.09 0.00 0.00 178.44 180.61 2kw6 h ALA 107 N 0.58 1.36 0.94 1.53 0.00 -1.09 0.23 119.26 122.82 2kw6 h ALA 107 Ca -0.12 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 2kw6 h ALA 107 Cb 1.76 -0.32 0.01 0.00 0.00 0.00 0.00 17.79 19.24 2kw6 h ALA 107 CO 0.19 0.46 -0.48 1.49 0.00 0.00 0.00 179.25 180.92 2kw6 h GLU 108 N 1.19 -1.25 0.00 0.00 4.57 -1.43 -2.88 114.58 114.77 2kw6 h GLU 108 Ca 0.42 0.09 -0.02 0.00 -1.18 0.00 0.00 59.36 58.67 2kw6 h GLU 108 Cb 0.12 0.28 -0.00 0.00 -0.16 0.00 0.00 28.75 28.99 2kw6 h GLU 108 CO -0.16 -0.83 -0.08 1.15 -1.18 0.00 0.00 179.01 177.91 2kw6 h THR 109 N -1.30 0.61 -0.30 0.32 2.02 -1.27 -2.83 112.91 110.17 2kw6 h THR 109 Ca -0.13 -0.33 -0.12 0.00 0.77 0.00 0.00 66.41 66.61 2kw6 h THR 109 Cb 1.00 1.20 -0.01 0.00 -1.74 0.00 0.00 68.15 68.61 2kw6 h THR 109 CO 0.20 0.08 -0.27 -0.08 0.37 0.00 0.00 175.52 175.82 2kw6 h GLU 110 N 0.00 0.71 0.00 6.66 4.57 -0.45 0.27 114.58 126.35 2kw6 h GLU 110 Ca -0.00 -0.36 -0.06 0.00 -1.18 0.00 0.00 59.36 57.76 2kw6 h GLU 110 Cb 0.20 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.79 2kw6 h GLU 110 CO 0.01 0.98 -0.28 0.00 -1.18 0.00 0.00 179.01 178.54 2kw6 h ARG 111 N 0.46 0.00 -0.01 1.92 2.47 -1.29 -2.15 114.38 115.78 2kw6 h ARG 111 Ca 0.05 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.77 2kw6 h ARG 111 Cb 0.83 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.15 2kw6 h ARG 111 CO 0.07 0.28 -0.33 -1.71 0.56 0.00 0.00 179.97 178.84 2kw6 n ASN 112 N -4.04 0.86 -4.76 7.04 5.15 -1.01 -4.92 115.26 113.58 2kw6 n ASN 112 Ca -0.02 -0.70 -0.39 0.00 -0.60 0.00 0.00 54.58 52.87 2kw6 n ASN 112 Cb 0.34 0.17 -0.05 0.00 -0.53 0.00 0.00 39.78 39.70 2kw6 n ASN 112 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2kw6 s ALA 113 N -2.65 3.45 0.00 5.20 0.00 0.93 -4.94 121.76 123.75 2kw6 s ALA 113 Ca 0.20 0.08 0.00 0.00 0.00 0.00 0.00 51.96 52.25 2kw6 s ALA 113 Cb 0.19 -2.80 0.00 0.00 0.00 0.00 0.00 23.12 20.50 2kw6 s ALA 113 CO 0.57 0.12 0.00 0.54 0.00 0.00 0.00 175.76 177.00 2kw6 n ARG 114 N 2.83 2.54 0.00 0.00 5.12 -1.26 -4.96 116.66 120.93 2kw6 n ARG 114 Ca -0.06 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.86 2kw6 n ARG 114 Cb 0.51 -0.77 0.00 0.00 -1.16 0.00 0.00 32.46 31.04 2kw6 n ARG 114 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57