#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 4.69 0.15 3.03 0.00 -1.26 -4.33 105.19 107.47 2kw6 n GLY 52 Ca 0.00 -1.78 0.09 0.00 0.00 0.00 0.00 46.02 44.33 2kw6 n GLY 52 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2kw6 n HIS 53 N 3.12 0.10 -0.09 1.61 -0.00 -1.26 -4.77 115.22 113.93 2kw6 n HIS 53 Ca 0.66 -0.93 -0.01 0.00 -0.00 0.00 0.00 57.72 57.44 2kw6 n HIS 53 Cb 0.26 -0.15 0.24 0.00 -0.00 0.00 0.00 29.99 30.34 2kw6 n HIS 53 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 2kw6 h HIS 54 N 0.21 0.75 -1.49 -1.40 -0.00 -2.10 -3.42 115.15 107.70 2kw6 h HIS 54 Ca 0.00 -0.06 -0.43 0.00 -0.00 0.00 0.00 60.37 59.88 2kw6 h HIS 54 Cb 0.99 -0.22 0.01 0.00 -0.00 0.00 0.00 27.41 28.18 2kw6 h HIS 54 CO 0.05 0.63 -0.29 -3.38 -0.00 0.00 0.00 177.93 174.95 2kw6 s HIS 55 N -5.20 2.83 -0.19 2.45 0.00 -1.26 -5.15 115.29 108.77 2kw6 s HIS 55 Ca -0.09 -0.39 -0.24 0.00 -3.00 0.00 0.00 55.06 51.33 2kw6 s HIS 55 Cb 0.16 -2.31 0.06 0.00 -4.00 0.00 0.00 32.58 26.49 2kw6 s HIS 55 CO 0.79 -0.33 0.64 -3.38 -1.00 0.00 0.00 174.74 171.46 2kw6 s HIS 56 N -2.35 -0.68 -0.86 0.38 -0.00 -1.26 -5.10 115.29 105.41 2kw6 s HIS 56 Ca 0.53 1.54 -0.25 0.00 -0.00 0.00 0.00 55.06 56.88 2kw6 s HIS 56 Cb -0.09 0.27 0.01 0.00 -0.00 0.00 0.00 32.58 32.78 2kw6 s HIS 56 CO 0.32 -0.41 1.59 -1.01 -0.00 0.00 0.00 174.74 175.23 2kw6 s HIS 57 N -0.08 2.17 -1.24 0.38 3.76 -1.26 -4.93 115.29 114.09 2kw6 s HIS 57 Ca -0.03 -0.06 -0.20 0.00 -0.15 0.00 0.00 55.06 54.61 2kw6 s HIS 57 Cb -0.04 -4.44 -0.01 0.00 1.11 0.00 0.00 32.58 29.21 2kw6 s HIS 57 CO 0.03 -1.98 1.84 1.58 -0.85 0.00 0.00 174.74 175.36 2kw6 n HIS 58 N 10.78 3.69 -3.80 1.40 -0.00 -1.26 -4.93 115.22 121.10 2kw6 n HIS 58 Ca 0.26 -2.16 -0.36 0.00 0.46 0.00 0.00 57.72 55.92 2kw6 n HIS 58 Cb 0.50 -2.63 -0.12 0.00 -0.12 0.00 0.00 29.99 27.62 2kw6 n HIS 58 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 2kw6 s SER 59 N 5.33 5.38 -0.84 0.26 0.15 -1.26 -5.04 113.70 117.68 2kw6 s SER 59 Ca 0.61 -0.11 -0.25 0.00 0.70 0.00 0.00 55.95 56.90 2kw6 s SER 59 Cb 0.02 -1.96 -0.06 0.00 -1.71 0.00 0.00 66.02 62.31 2kw6 s SER 59 CO 0.11 0.01 2.01 -1.38 1.20 0.00 0.00 173.24 175.19 2kw6 s HIS 60 N 1.34 1.68 -0.28 3.44 0.00 -1.26 -4.66 115.29 115.55 2kw6 s HIS 60 Ca 0.05 0.86 -0.22 0.00 -3.00 0.00 0.00 55.06 52.75 2kw6 s HIS 60 Cb -0.15 -3.96 0.11 0.00 -4.00 0.00 0.00 32.58 24.58 2kw6 s HIS 60 CO 0.04 -1.82 0.89 -1.54 -1.00 0.00 0.00 174.74 171.32 2kw6 s SER 61 N 8.52 -0.61 0.37 7.38 1.04 -1.26 -5.09 113.70 124.06 2kw6 s SER 61 Ca 0.73 1.11 0.19 0.00 0.48 0.00 0.00 55.95 58.46 2kw6 s SER 61 Cb -0.09 1.17 0.65 0.00 0.10 0.00 0.00 66.02 67.85 2kw6 s SER 61 CO 0.04 -0.19 1.71 0.11 0.98 0.00 0.00 173.24 175.90 2kw6 h LYS 62 N 5.17 0.00 -0.01 4.02 1.57 -1.98 -0.36 116.57 124.98 2kw6 h LYS 62 Ca -0.29 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.39 2kw6 h LYS 62 Cb 1.18 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.50 2kw6 h LYS 62 CO 0.12 0.37 -0.40 1.88 -0.57 0.00 0.00 179.45 180.84 2kw6 h TYR 63 N 0.00 0.43 -0.08 -1.35 -1.99 -1.97 -0.24 116.97 111.77 2kw6 h TYR 63 Ca -0.00 -0.22 -0.06 0.00 2.00 0.00 0.00 58.73 60.44 2kw6 h TYR 63 Cb 0.93 -0.05 -0.01 0.00 2.00 0.00 0.00 36.73 39.60 2kw6 h TYR 63 CO 0.00 1.02 -0.24 0.00 -0.00 0.00 0.00 178.16 178.94 2kw6 h ALA 64 N 0.31 1.45 -0.30 3.88 0.00 -1.86 -1.94 119.26 120.80 2kw6 h ALA 64 Ca -0.05 -0.26 -0.19 0.00 0.00 0.00 0.00 54.91 54.42 2kw6 h ALA 64 Cb 1.12 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2kw6 h ALA 64 CO 0.08 0.39 -0.54 1.49 0.00 0.00 0.00 179.25 180.67 2kw6 h GLU 65 N 0.13 0.89 -0.60 0.00 4.57 -1.08 -2.14 114.58 116.34 2kw6 h GLU 65 Ca 0.02 -0.56 -0.03 0.00 -1.18 0.00 0.00 59.36 57.61 2kw6 h GLU 65 Cb 0.50 0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 29.13 2kw6 h GLU 65 CO 0.03 1.20 0.24 1.25 -1.18 0.00 0.00 179.01 180.55 2kw6 h LEU 66 N 0.68 0.83 -0.41 1.64 5.85 -0.66 -0.51 115.31 122.73 2kw6 h LEU 66 Ca 0.02 -0.17 -0.00 0.00 0.84 0.00 0.00 57.88 58.56 2kw6 h LEU 66 Cb 1.15 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.95 2kw6 h LEU 66 CO 0.12 0.77 0.24 0.25 -0.34 0.00 0.00 178.44 179.48 2kw6 h LEU 67 N 0.83 0.50 -1.20 2.25 5.85 -1.40 -2.87 115.31 119.28 2kw6 h LEU 67 Ca 0.20 -0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 2kw6 h LEU 67 Cb 0.20 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.08 2kw6 h LEU 67 CO -0.02 0.43 0.35 0.00 -0.34 0.00 0.00 178.44 178.86 2kw6 h ALA 68 N 1.10 1.39 0.41 1.25 0.00 -0.74 -0.49 119.26 122.17 2kw6 h ALA 68 Ca 0.15 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2kw6 h ALA 68 Cb 0.03 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.55 2kw6 h ALA 68 CO -0.03 0.50 -0.19 0.82 0.00 0.00 0.00 179.25 180.35 2kw6 h ILE 69 N 0.91 0.60 -0.10 0.00 2.04 -1.06 -2.43 117.51 117.47 2kw6 h ILE 69 Ca 0.23 -0.16 -0.09 0.00 1.00 0.00 0.00 64.86 65.85 2kw6 h ILE 69 Cb 0.03 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 36.78 2kw6 h ILE 69 CO -0.04 0.03 -0.33 0.40 0.00 0.00 0.00 178.15 178.21 2kw6 h ILE 70 N -0.63 1.27 -0.84 -0.67 2.04 -1.25 0.46 117.51 117.89 2kw6 h ILE 70 Ca -0.06 -1.29 0.08 0.00 1.00 0.00 0.00 64.86 64.59 2kw6 h ILE 70 Cb 0.47 1.56 -0.07 0.00 -0.74 0.00 0.00 36.82 38.04 2kw6 h ILE 70 CO 0.09 0.39 0.50 -0.08 0.00 0.00 0.00 178.15 179.05 2kw6 h GLU 71 N 0.17 0.86 0.19 2.37 4.57 -1.11 -2.91 114.58 118.71 2kw6 h GLU 71 Ca 0.02 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.14 2kw6 h GLU 71 Cb 0.67 -0.19 0.00 0.00 -0.16 0.00 0.00 28.75 29.07 2kw6 h GLU 71 CO 0.05 0.57 -0.09 1.49 -1.18 0.00 0.00 179.01 179.85 2kw6 h GLU 72 N 0.88 -0.24 -1.05 1.92 4.57 -0.46 -3.29 114.58 116.90 2kw6 h GLU 72 Ca 0.38 0.02 0.29 0.00 -1.18 0.00 0.00 59.36 58.87 2kw6 h GLU 72 Cb 0.26 0.06 -0.12 0.00 -0.16 0.00 0.00 28.75 28.79 2kw6 h GLU 72 CO -0.21 0.16 0.65 -0.07 -1.18 0.00 0.00 179.01 178.37 2kw6 h LEU 73 N -0.80 0.51 -0.70 1.64 3.38 -1.09 0.42 115.31 118.66 2kw6 h LEU 73 Ca -0.03 0.12 -0.13 0.00 0.09 0.00 0.00 57.88 57.93 2kw6 h LEU 73 Cb 0.52 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 2kw6 h LEU 73 CO 0.04 0.03 -0.46 1.23 0.09 0.00 0.00 178.44 179.36 2kw6 h GLY 74 N 0.40 0.48 2.00 0.83 0.00 -1.60 -2.72 103.07 102.46 2kw6 h GLY 74 Ca 0.66 -0.50 -0.00 0.00 0.00 0.00 0.00 47.33 47.48 2kw6 h GLY 74 CO -0.42 0.45 -0.02 0.50 0.00 0.00 0.00 176.54 177.06 2kw6 h LYS 75 N 0.35 0.00 -0.00 4.80 1.57 -1.02 -3.19 116.57 119.08 2kw6 h LYS 75 Ca 0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 2kw6 h LYS 75 Cb 0.95 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.26 2kw6 h LYS 75 CO 0.08 0.02 -0.28 0.39 -0.57 0.00 0.00 179.45 179.09 2kw6 n GLU 76 N -3.11 0.06 0.05 3.15 -0.58 -0.64 -4.06 120.64 115.51 2kw6 n GLU 76 Ca 0.03 -0.03 -0.13 0.00 -0.42 0.00 0.00 57.16 56.62 2kw6 n GLU 76 Cb 0.50 -1.50 -0.08 0.00 -0.57 0.00 0.00 31.44 29.79 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 0.06 1.07 0.00 -3.67 2.04 -1.50 -2.59 117.51 112.93 2kw6 h ILE 77 Ca 0.00 -0.38 0.03 0.00 1.00 0.00 0.00 64.86 65.51 2kw6 h ILE 77 Cb 0.49 1.32 -0.05 0.00 -0.74 0.00 0.00 36.82 37.84 2kw6 h ILE 77 CO 0.00 0.10 -0.27 0.03 0.00 0.00 0.00 178.15 178.01 2kw6 h ARG 78 N -0.24 -0.39 -0.08 2.37 3.08 -1.77 -0.69 114.38 116.66 2kw6 h ARG 78 Ca -0.01 0.03 -0.12 0.00 0.07 0.00 0.00 59.98 59.95 2kw6 h ARG 78 Cb 0.21 0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.34 2kw6 h ARG 78 CO 0.01 -0.26 -0.49 -1.00 -1.07 0.00 0.00 179.97 177.16 2kw6 h PRO 79 N -0.41 0.20 -0.87 0.04 0.13 -1.79 -1.67 132.00 127.63 2kw6 h PRO 79 Ca 0.06 -0.11 0.01 0.00 -0.87 0.00 0.00 66.00 65.09 2kw6 h PRO 79 Cb 0.49 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 31.59 2kw6 h PRO 79 CO -0.23 0.65 0.57 1.15 -0.23 0.00 0.00 178.00 179.91 2kw6 h THR 80 N 0.16 1.22 -0.38 1.56 2.02 -1.12 -0.31 112.91 116.06 2kw6 h THR 80 Ca 0.01 -0.40 -0.06 0.00 0.77 0.00 0.00 66.41 66.72 2kw6 h THR 80 Cb 0.92 -0.05 -0.02 0.00 -1.74 0.00 0.00 68.15 67.26 2kw6 h THR 80 CO 0.07 0.21 -0.03 0.22 0.37 0.00 0.00 175.52 176.37 2kw6 h TYR 81 N 1.17 0.64 0.00 3.16 3.20 -1.05 -2.86 116.97 121.24 2kw6 h TYR 81 Ca 0.32 -0.08 0.00 0.00 3.14 0.00 0.00 58.73 62.11 2kw6 h TYR 81 Cb -0.13 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 37.97 2kw6 h TYR 81 CO -0.01 0.64 0.00 0.00 -1.64 0.00 0.00 178.16 177.15 2kw6 n ALA 82 N -2.48 2.19 -0.66 1.82 0.00 -0.54 -4.86 120.51 115.98 2kw6 n ALA 82 Ca 0.02 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2kw6 n ALA 82 Cb 0.28 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.39 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 0.39 0.72 3.50 0.00 0.00 -0.89 -5.04 105.19 103.87 2kw6 n GLY 83 Ca 0.13 -0.60 -0.43 0.00 0.00 0.00 0.00 46.02 45.12 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 -2.57 6.31 0.56 1.61 0.01 -0.24 -4.91 113.70 114.47 2kw6 s SER 84 Ca 0.00 -0.51 0.34 0.00 1.31 0.00 0.00 55.95 57.09 2kw6 s SER 84 Cb 0.00 -2.38 1.49 0.00 0.21 0.00 0.00 66.02 65.34 2kw6 s SER 84 CO 0.00 -1.06 2.03 0.50 0.41 0.00 0.00 173.24 175.12 2kw6 h LYS 85 N 9.15 0.00 -0.66 12.44 3.64 -1.91 -2.45 116.57 136.79 2kw6 h LYS 85 Ca -0.26 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.05 2kw6 h LYS 85 Cb 1.08 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.87 2kw6 h LYS 85 CO 1.02 0.03 0.17 1.03 -2.27 0.00 0.00 179.45 179.43 2kw6 h SER 86 N 0.00 0.97 -0.18 4.20 0.87 -1.96 -2.71 113.55 114.74 2kw6 h SER 86 Ca -0.00 -0.19 -0.20 0.00 -1.23 0.00 0.00 61.79 60.17 2kw6 h SER 86 Cb 0.45 -0.25 0.01 0.00 -0.44 0.00 0.00 62.40 62.16 2kw6 h SER 86 CO 0.00 0.93 -0.66 0.00 -0.53 0.00 0.00 176.83 176.57 2kw6 h ALA 87 N 1.19 0.33 0.00 6.23 0.00 -1.78 -2.39 119.26 122.83 2kw6 h ALA 87 Ca 0.21 -0.56 -0.06 0.00 0.00 0.00 0.00 54.91 54.50 2kw6 h ALA 87 Cb 0.34 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2kw6 h ALA 87 CO -0.00 0.62 -0.30 0.00 0.00 0.00 0.00 179.25 179.57 2kw6 h MET 88 N 0.50 0.00 0.08 0.00 3.00 -1.52 0.80 114.93 117.79 2kw6 h MET 88 Ca -0.03 0.00 -0.00 0.00 0.00 0.00 0.00 59.70 59.66 2kw6 h MET 88 Cb 1.29 0.00 0.00 0.00 0.00 0.00 0.00 31.60 32.89 2kw6 h MET 88 CO 0.14 0.30 -0.04 0.93 0.00 0.00 0.00 176.91 178.24 2kw6 h GLU 89 N 0.00 -0.11 -0.01 -0.10 5.08 -1.38 -1.07 114.58 116.99 2kw6 h GLU 89 Ca -0.00 0.01 -0.08 0.00 -1.00 0.00 0.00 59.36 58.29 2kw6 h GLU 89 Cb 0.54 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 2kw6 h GLU 89 CO 0.04 0.22 -0.37 0.00 -1.00 0.00 0.00 179.01 177.90 2kw6 h ARG 90 N -0.44 0.02 -0.09 2.33 2.47 -1.23 -0.18 114.38 117.26 2kw6 h ARG 90 Ca -0.01 -0.01 -0.01 0.00 -1.26 0.00 0.00 59.98 58.69 2kw6 h ARG 90 Cb 0.38 -0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.69 2kw6 h ARG 90 CO 0.02 0.39 0.01 1.25 0.56 0.00 0.00 179.97 182.20 2kw6 h LEU 91 N 0.02 0.15 -0.22 3.04 5.85 -0.87 -2.52 115.31 120.75 2kw6 h LEU 91 Ca -0.00 -0.27 -0.06 0.00 0.84 0.00 0.00 57.88 58.39 2kw6 h LEU 91 Cb 0.66 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.65 2kw6 h LEU 91 CO 0.05 0.38 -0.11 0.50 -0.34 0.00 0.00 178.44 178.92 2kw6 h LYS 92 N -0.09 0.47 -0.78 1.25 3.64 -0.73 -1.46 116.57 118.86 2kw6 h LYS 92 Ca 0.03 -0.20 -0.03 0.00 -1.27 0.00 0.00 60.65 59.17 2kw6 h LYS 92 Cb 0.30 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.07 2kw6 h LYS 92 CO 0.00 0.74 0.36 0.00 -2.27 0.00 0.00 179.45 178.28 2kw6 h ARG 93 N 0.17 1.13 -0.36 1.90 2.47 -1.12 -0.86 114.38 117.71 2kw6 h ARG 93 Ca 0.05 -0.18 -0.03 0.00 -1.26 0.00 0.00 59.98 58.57 2kw6 h ARG 93 Cb 0.60 -0.20 -0.02 0.00 -1.65 0.00 0.00 29.97 28.71 2kw6 h ARG 93 CO 0.03 0.89 0.12 0.78 0.56 0.00 0.00 179.97 182.35 2kw6 h GLY 94 N 1.10 0.60 1.00 0.04 0.00 -1.42 -2.18 103.07 102.22 2kw6 h GLY 94 Ca 0.26 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 47.25 2kw6 h GLY 94 CO -0.03 0.33 0.22 -2.22 0.00 0.00 0.00 176.54 174.84 2kw6 h ILE 95 N 0.43 1.09 -0.42 2.60 2.04 -0.71 0.16 117.51 122.71 2kw6 h ILE 95 Ca 0.12 -0.18 -0.10 0.00 1.00 0.00 0.00 64.86 65.70 2kw6 h ILE 95 Cb 0.24 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 2kw6 h ILE 95 CO -0.01 0.09 -0.12 0.40 0.00 0.00 0.00 178.15 178.51 2kw6 h ILE 96 N 0.46 1.28 -0.93 -0.67 2.04 -1.22 -1.43 117.51 117.03 2kw6 h ILE 96 Ca 0.12 -1.23 0.00 0.00 1.00 0.00 0.00 64.86 64.75 2kw6 h ILE 96 Cb -0.04 1.21 -0.05 0.00 -0.74 0.00 0.00 36.82 37.20 2kw6 h ILE 96 CO -0.03 0.41 0.59 -0.74 0.00 0.00 0.00 178.15 178.39 2kw6 h HIS 97 N 0.63 1.21 -0.63 1.37 2.76 -1.22 -1.53 115.15 117.73 2kw6 h HIS 97 Ca 0.10 0.01 -0.05 0.00 -2.20 0.00 0.00 60.37 58.24 2kw6 h HIS 97 Cb 0.66 -0.40 -0.03 0.00 1.55 0.00 0.00 27.41 29.19 2kw6 h HIS 97 CO 0.05 0.78 0.22 0.00 -1.30 0.00 0.00 177.93 177.68 2kw6 h ALA 98 N 1.32 0.83 -0.90 5.26 0.00 -0.41 -1.88 119.26 123.48 2kw6 h ALA 98 Ca 0.34 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 55.06 2kw6 h ALA 98 Cb -0.09 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.41 2kw6 h ALA 98 CO -0.07 0.49 0.58 -0.09 0.00 0.00 0.00 179.25 180.16 2kw6 h ARG 99 N 0.91 1.20 -0.38 0.00 2.43 -1.05 -1.92 114.38 115.57 2kw6 h ARG 99 Ca 0.21 -0.08 -0.05 0.00 -0.81 0.00 0.00 59.98 59.25 2kw6 h ARG 99 Cb 0.27 -0.26 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 2kw6 h ARG 99 CO -0.01 0.80 0.03 0.78 -1.51 0.00 0.00 179.97 180.06 2kw6 h GLY 100 N 1.23 0.62 1.26 2.80 0.00 -0.59 0.15 103.07 108.54 2kw6 h GLY 100 Ca 0.33 -0.36 -0.22 0.00 0.00 0.00 0.00 47.33 47.08 2kw6 h GLY 100 CO -0.07 0.34 -0.79 1.41 0.00 0.00 0.00 176.54 177.43 2kw6 h LEU 101 N 0.56 0.87 -1.02 3.11 3.38 -1.10 -3.14 115.31 117.97 2kw6 h LEU 101 Ca 0.12 -0.58 -0.08 0.00 0.09 0.00 0.00 57.88 57.44 2kw6 h LEU 101 Cb 0.32 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 2kw6 h LEU 101 CO 0.01 1.37 -0.37 0.58 0.09 0.00 0.00 178.44 180.12 2kw6 h VAL 102 N 0.49 0.91 -0.10 1.22 2.07 -0.86 -0.98 116.25 118.99 2kw6 h VAL 102 Ca -0.06 -1.45 -0.00 0.00 0.82 0.00 0.00 66.70 66.01 2kw6 h VAL 102 Cb 1.42 1.88 -0.00 0.00 -1.52 0.00 0.00 31.29 33.06 2kw6 h VAL 102 CO 0.16 0.36 0.06 0.03 0.02 0.00 0.00 177.57 178.19 2kw6 h ARG 103 N 0.00 0.14 -0.00 1.57 2.47 -0.69 0.69 114.38 118.55 2kw6 h ARG 103 Ca -0.00 -0.02 -0.15 0.00 -1.26 0.00 0.00 59.98 58.55 2kw6 h ARG 103 Cb 0.85 -0.03 -0.02 0.00 -1.65 0.00 0.00 29.97 29.12 2kw6 h ARG 103 CO 0.05 0.16 -0.70 0.93 0.56 0.00 0.00 179.97 180.97 2kw6 h GLU 104 N 0.07 0.00 -0.05 0.04 5.08 -1.48 -1.38 114.58 116.87 2kw6 h GLU 104 Ca 0.03 -0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.25 2kw6 h GLU 104 Cb 0.07 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 2kw6 h GLU 104 CO -0.01 0.70 -0.62 0.00 -1.00 0.00 0.00 179.01 178.09 2kw6 h LEU 106 N 0.13 0.71 -1.36 0.00 3.38 -0.73 -1.29 115.31 116.15 2kw6 h LEU 106 Ca -0.01 -0.57 0.02 0.00 0.09 0.00 0.00 57.88 57.41 2kw6 h LEU 106 Cb 1.12 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 41.63 2kw6 h LEU 106 CO 0.09 1.16 0.44 0.00 0.09 0.00 0.00 178.44 180.22 2kw6 h ALA 107 N 0.57 1.58 0.46 1.53 0.00 -1.15 -1.02 119.26 121.23 2kw6 h ALA 107 Ca -0.01 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2kw6 h ALA 107 Cb 1.06 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2kw6 h ALA 107 CO 0.10 0.37 -0.22 1.49 0.00 0.00 0.00 179.25 180.99 2kw6 h GLU 108 N 0.85 -0.59 -0.85 0.00 4.57 -1.07 -3.21 114.58 114.28 2kw6 h GLU 108 Ca 0.26 0.04 0.22 0.00 -1.18 0.00 0.00 59.36 58.70 2kw6 h GLU 108 Cb -0.01 0.13 -0.14 0.00 -0.16 0.00 0.00 28.75 28.57 2kw6 h GLU 108 CO -0.07 -0.36 0.13 1.15 -1.18 0.00 0.00 179.01 178.69 2kw6 h THR 109 N -1.13 0.28 0.00 0.32 2.02 -1.14 -1.32 112.91 111.94 2kw6 h THR 109 Ca -0.06 -0.05 -0.06 0.00 0.77 0.00 0.00 66.41 67.01 2kw6 h THR 109 Cb 0.51 0.12 -0.01 0.00 -1.74 0.00 0.00 68.15 67.04 2kw6 h THR 109 CO 0.10 0.03 -0.27 -0.08 0.37 0.00 0.00 175.52 175.67 2kw6 h GLU 110 N 0.14 0.00 0.01 6.66 4.81 -1.28 0.20 114.58 125.12 2kw6 h GLU 110 Ca 0.51 0.00 -0.20 0.00 -0.13 0.00 0.00 59.36 59.54 2kw6 h GLU 110 Cb 1.00 0.00 0.02 0.00 0.63 0.00 0.00 28.75 30.39 2kw6 h GLU 110 CO -0.70 0.27 -0.79 0.00 -0.73 0.00 0.00 179.01 177.07 2kw6 h ARG 111 N 0.00 0.52 -0.00 1.92 3.08 -1.26 -3.30 114.38 115.34 2kw6 h ARG 111 Ca -0.00 -0.57 0.00 0.00 0.07 0.00 0.00 59.98 59.48 2kw6 h ARG 111 Cb 0.70 0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.91 2kw6 h ARG 111 CO 0.04 1.20 -0.07 0.09 -1.07 0.00 0.00 179.97 180.15 2kw6 n ASN 112 N -4.07 0.25 -4.52 7.04 3.02 -0.81 -4.86 115.26 111.30 2kw6 n ASN 112 Ca -0.11 -0.33 -0.25 0.00 -0.03 0.00 0.00 54.58 53.86 2kw6 n ASN 112 Cb 0.76 -0.17 -0.10 0.00 -0.61 0.00 0.00 39.78 39.66 2kw6 n ASN 112 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2kw6 s ALA 113 N -2.56 2.89 -0.41 5.41 0.00 0.64 -5.07 121.76 122.67 2kw6 s ALA 113 Ca 0.27 -2.03 0.01 0.00 0.00 0.00 0.00 51.96 50.21 2kw6 s ALA 113 Cb 0.20 -0.10 0.11 0.00 0.00 0.00 0.00 23.12 23.33 2kw6 s ALA 113 CO 0.48 0.14 0.16 0.50 0.00 0.00 0.00 175.76 177.04 2kw6 s ARG 114 N -3.58 1.82 0.00 0.00 3.52 -1.26 -4.81 118.95 114.64 2kw6 s ARG 114 Ca 0.32 -2.00 0.00 0.00 -0.13 0.00 0.00 55.73 53.91 2kw6 s ARG 114 Cb 0.00 -3.40 0.00 0.00 -1.56 0.00 0.00 34.95 29.99 2kw6 s ARG 114 CO 0.16 -1.03 0.00 0.43 -0.81 0.00 0.00 175.30 174.05