#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k9q s GLU 2 N 0.00 1.17 0.14 2.12 2.02 -1.26 -4.88 118.70 118.01 2k9q s GLU 2 Ca 0.00 0.07 -0.16 0.00 0.02 0.00 0.00 54.97 54.90 2k9q s GLU 2 Cb 0.00 -1.86 0.01 0.00 0.10 0.00 0.00 34.13 32.37 2k9q s GLU 2 CO 0.00 -2.13 1.73 1.25 0.02 0.00 0.00 175.26 176.13 2k9q h LEU 3 N -1.44 0.54 -1.17 1.80 5.85 -1.97 -2.40 115.31 116.51 2k9q h LEU 3 Ca -0.47 -0.12 -0.06 0.00 0.84 0.00 0.00 57.88 58.07 2k9q h LEU 3 Cb 1.31 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 42.19 2k9q h LEU 3 CO 0.57 0.50 -0.11 -1.28 -0.34 0.00 0.00 178.44 177.78 2k9q h SER 4 N 0.53 0.42 -0.33 1.25 0.87 -1.93 -1.75 113.55 112.62 2k9q h SER 4 Ca 0.14 -0.10 0.01 0.00 -1.23 0.00 0.00 61.79 60.62 2k9q h SER 4 Cb 0.10 -0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 61.92 2k9q h SER 4 CO -0.02 0.57 0.20 -1.13 -0.53 0.00 0.00 176.83 175.92 2k9q h ASN 5 N 0.41 0.33 0.39 6.23 -1.24 -1.79 -0.27 115.58 119.64 2k9q h ASN 5 Ca 0.08 0.00 -0.12 0.00 0.71 0.00 0.00 56.30 56.97 2k9q h ASN 5 Cb 0.45 -0.07 -0.01 0.00 0.73 0.00 0.00 38.32 39.42 2k9q h ASN 5 CO 0.03 0.24 -0.53 -0.33 -1.29 0.00 0.00 177.43 175.55 2k9q h GLU 6 N 0.41 0.15 -0.60 6.67 5.08 -1.29 -2.79 114.58 122.21 2k9q h GLU 6 Ca 0.13 -0.09 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 2k9q h GLU 6 Cb -0.01 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 2k9q h GLU 6 CO -0.05 0.64 0.33 1.25 -1.00 0.00 0.00 179.01 180.18 2k9q h LEU 7 N 0.12 0.74 -0.88 1.33 5.85 -0.43 -1.36 115.31 120.68 2k9q h LEU 7 Ca 0.00 -0.09 -0.04 0.00 0.84 0.00 0.00 57.88 58.59 2k9q h LEU 7 Cb 0.97 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.77 2k9q h LEU 7 CO 0.08 0.62 0.36 0.11 -0.34 0.00 0.00 178.44 179.26 2k9q h LYS 8 N 0.81 1.17 -0.65 1.25 1.79 -0.91 -2.26 116.57 117.77 2k9q h LYS 8 Ca 0.21 -0.19 0.00 0.00 -2.18 0.00 0.00 60.65 58.50 2k9q h LYS 8 Cb 0.04 -0.20 -0.03 0.00 -1.58 0.00 0.00 32.23 30.45 2k9q h LYS 8 CO -0.03 0.92 0.42 0.28 -1.08 0.00 0.00 179.45 179.95 2k9q h VAL 9 N 1.15 1.17 -0.21 0.50 2.07 -1.11 -0.48 116.25 119.34 2k9q h VAL 9 Ca 0.27 -0.34 0.05 0.00 0.82 0.00 0.00 66.70 67.50 2k9q h VAL 9 Cb 0.16 0.24 -0.05 0.00 -1.52 0.00 0.00 31.29 30.12 2k9q h VAL 9 CO -0.03 0.17 -0.10 -0.08 0.02 0.00 0.00 177.57 177.56 2k9q h GLU 10 N 0.88 -0.07 -0.75 1.57 4.22 -0.68 0.59 114.58 120.35 2k9q h GLU 10 Ca 0.24 0.00 -0.01 0.00 0.08 0.00 0.00 59.36 59.67 2k9q h GLU 10 Cb -0.08 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.15 2k9q h GLU 10 CO -0.05 -0.04 0.41 -0.09 -2.18 0.00 0.00 179.01 177.06 2k9q h ARG 11 N -0.07 1.04 -0.47 1.92 2.43 -1.19 -0.47 114.38 117.56 2k9q h ARG 11 Ca 0.11 -0.12 -0.03 0.00 -0.81 0.00 0.00 59.98 59.13 2k9q h ARG 11 Cb 0.24 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 29.56 2k9q h ARG 11 CO -0.26 0.77 0.18 0.82 -1.51 0.00 0.00 179.97 179.97 2k9q h ILE 12 N 1.03 1.21 -0.49 1.20 2.04 -0.00 2.64 117.51 125.14 2k9q h ILE 12 Ca 0.26 -0.67 -0.01 0.00 1.00 0.00 0.00 64.86 65.44 2k9q h ILE 12 Cb 0.03 0.77 -0.02 0.00 -0.74 0.00 0.00 36.82 36.86 2k9q h ILE 12 CO -0.04 0.25 0.27 -0.09 0.00 0.00 0.00 178.15 178.54 2k9q h ARG 13 N 0.62 0.68 -0.02 2.37 2.43 0.62 -2.03 114.38 119.04 2k9q h ARG 13 Ca 0.16 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 2k9q h ARG 13 Cb 0.21 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 2k9q h ARG 13 CO -0.01 0.52 -0.04 1.28 -1.51 0.00 0.00 179.97 180.22 2k9q n LEU 14 N -4.67 1.77 -4.36 3.80 4.77 -0.23 -4.93 117.00 113.15 2k9q n LEU 14 Ca 0.02 -0.59 -0.34 0.00 -0.03 0.00 0.00 56.01 55.07 2k9q n LEU 14 Cb 0.08 -0.01 -0.09 0.00 -2.33 0.00 0.00 43.42 41.07 2k9q n LEU 14 CO 0.36 0.30 -0.36 -1.54 -1.33 0.00 0.00 177.39 174.82 2k9q n SER 15 N 0.33 -0.07 -4.85 -1.43 3.41 0.88 -4.88 113.62 107.01 2k9q n SER 15 Ca 0.17 -1.25 -0.32 0.00 -0.26 0.00 0.00 58.87 57.22 2k9q n SER 15 Cb 0.41 -1.72 -0.01 0.00 -0.26 0.00 0.00 64.21 62.63 2k9q n SER 15 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2k9q s LEU 16 N -7.32 3.44 -0.13 1.04 2.96 -0.89 -5.01 118.68 112.77 2k9q s LEU 16 Ca 0.27 1.50 -0.06 0.00 -0.22 0.00 0.00 54.13 55.62 2k9q s LEU 16 Cb -0.16 -4.49 -0.04 0.00 0.50 0.00 0.00 46.19 42.00 2k9q s LEU 16 CO 1.00 -0.72 0.10 0.42 -1.32 0.00 0.00 176.35 175.83 2k9q s THR 17 N -2.88 5.16 0.26 3.68 -4.23 -1.26 -4.94 115.64 111.43 2k9q s THR 17 Ca 0.57 0.08 -0.03 0.00 -1.18 0.00 0.00 61.69 61.14 2k9q s THR 17 Cb -0.10 -3.26 0.13 0.00 1.34 0.00 0.00 72.50 70.61 2k9q s THR 17 CO 0.42 0.58 1.78 0.00 -0.54 0.00 0.00 174.62 176.85 2k9q h ALA 18 N 5.44 1.12 -0.58 3.99 0.00 -2.00 -2.77 119.26 124.46 2k9q h ALA 18 Ca -0.50 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.16 2k9q h ALA 18 Cb 1.20 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.75 2k9q h ALA 18 CO 0.61 0.58 0.31 -0.22 0.00 0.00 0.00 179.25 180.53 2k9q h LYS 19 N 0.82 0.81 -0.45 0.00 3.64 -1.98 0.27 116.57 119.69 2k9q h LYS 19 Ca 0.17 -0.10 -0.00 0.00 -1.27 0.00 0.00 60.65 59.45 2k9q h LYS 19 Cb 0.38 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.02 2k9q h LYS 19 CO 0.01 0.62 0.28 0.66 -2.27 0.00 0.00 179.45 178.75 2k9q h SER 20 N 0.78 0.53 -0.37 4.20 4.64 -1.92 -2.15 113.55 119.25 2k9q h SER 20 Ca 0.20 -0.04 -0.06 0.00 -0.47 0.00 0.00 61.79 61.42 2k9q h SER 20 Cb 0.05 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 61.99 2k9q h SER 20 CO -0.03 0.41 -0.01 0.58 -0.87 0.00 0.00 176.83 176.91 2k9q h VAL 21 N 0.60 1.26 -0.24 0.95 2.07 -1.22 -1.35 116.25 118.32 2k9q h VAL 21 Ca 0.16 -1.01 0.04 0.00 0.82 0.00 0.00 66.70 66.71 2k9q h VAL 21 Cb -0.02 1.17 -0.04 0.00 -1.52 0.00 0.00 31.29 30.88 2k9q h VAL 21 CO -0.03 0.34 -0.03 0.00 0.02 0.00 0.00 177.57 177.87 2k9q h ALA 22 N 0.87 0.19 -0.15 1.67 0.00 -0.69 0.20 119.26 121.35 2k9q h ALA 22 Ca 0.10 0.08 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 2k9q h ALA 22 Cb 0.48 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 2k9q h ALA 22 CO 0.02 -0.44 -0.12 1.49 0.00 0.00 0.00 179.25 180.19 2k9q h GLU 23 N 0.04 0.35 -0.13 0.00 4.57 -1.36 0.64 114.58 118.69 2k9q h GLU 23 Ca 0.12 -0.17 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 2k9q h GLU 23 Cb 0.16 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.75 2k9q h GLU 23 CO -0.22 0.71 0.08 1.49 -1.18 0.00 0.00 179.01 179.90 2k9q h GLU 24 N -0.01 0.18 -0.72 1.92 4.57 -1.04 -2.47 114.58 117.01 2k9q h GLU 24 Ca 0.03 -0.01 -0.04 0.00 -1.18 0.00 0.00 59.36 58.16 2k9q h GLU 24 Cb 0.64 -0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 29.16 2k9q h GLU 24 CO 0.03 0.14 0.30 0.52 -1.18 0.00 0.00 179.01 178.82 2k9q h MET 25 N 0.17 1.05 0.00 1.92 2.86 -0.64 -3.46 114.93 116.82 2k9q h MET 25 Ca 0.05 -0.17 0.00 0.00 -2.06 0.00 0.00 59.70 57.52 2k9q h MET 25 Cb -0.00 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 31.48 2k9q h MET 25 CO -0.01 0.85 0.00 0.41 1.06 0.00 0.00 176.91 179.22 2k9q n GLY 26 N -0.97 1.40 3.44 8.32 0.00 -0.59 -5.01 105.19 111.77 2k9q n GLY 26 Ca 0.06 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.87 2k9q n GLY 26 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2k9q s ILE 27 N -2.00 1.92 0.73 -0.61 -4.36 0.12 -5.01 121.20 111.99 2k9q s ILE 27 Ca 0.00 -2.21 -0.12 0.00 -0.26 0.00 0.00 60.65 58.07 2k9q s ILE 27 Cb 0.00 -2.37 0.03 0.00 1.25 0.00 0.00 42.46 41.37 2k9q s ILE 27 CO 0.00 -0.36 1.11 -0.94 0.24 0.00 0.00 174.94 174.99 2k9q s SER 28 N -3.46 5.20 0.32 4.36 1.04 -1.26 -3.82 113.70 116.08 2k9q s SER 28 Ca 0.29 1.09 0.02 0.00 0.48 0.00 0.00 55.95 57.83 2k9q s SER 28 Cb 0.01 -1.83 0.55 0.00 0.10 0.00 0.00 66.02 64.85 2k9q s SER 28 CO 0.12 -1.50 1.88 0.03 0.98 0.00 0.00 173.24 174.76 2k9q h ARG 29 N -0.76 0.67 -0.73 4.02 3.08 -1.91 -2.32 114.38 116.43 2k9q h ARG 29 Ca -0.45 -0.12 -0.00 0.00 0.07 0.00 0.00 59.98 59.47 2k9q h ARG 29 Cb 1.27 -0.11 -0.04 0.00 0.08 0.00 0.00 29.97 31.17 2k9q h ARG 29 CO 0.64 0.61 0.45 0.37 -1.07 0.00 0.00 179.97 180.97 2k9q h GLN 30 N 0.65 0.99 -0.54 0.04 5.75 -1.99 0.31 115.11 120.33 2k9q h GLN 30 Ca 0.15 -0.08 -0.06 0.00 -0.15 0.00 0.00 58.65 58.51 2k9q h GLN 30 Cb 0.24 -0.21 -0.02 0.00 1.07 0.00 0.00 27.48 28.56 2k9q h GLN 30 CO -0.00 0.69 0.11 1.96 -2.65 0.00 0.00 178.83 178.94 2k9q h GLN 31 N 1.00 0.87 -0.70 1.69 4.20 -1.80 -2.17 115.11 118.21 2k9q h GLN 31 Ca 0.26 -0.22 -0.05 0.00 0.06 0.00 0.00 58.65 58.70 2k9q h GLN 31 Cb -0.05 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 27.59 2k9q h GLN 31 CO -0.05 0.84 0.25 1.25 -0.67 0.00 0.00 178.83 180.45 2k9q h LEU 32 N 0.76 0.99 -1.65 1.46 5.85 -1.00 -2.06 115.31 119.66 2k9q h LEU 32 Ca 0.17 -0.19 -0.00 0.00 0.84 0.00 0.00 57.88 58.69 2k9q h LEU 32 Cb 0.38 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.13 2k9q h LEU 32 CO 0.01 0.91 0.17 0.00 -0.34 0.00 0.00 178.44 179.19 2k9q h ASN 34 N 0.42 0.91 -0.41 0.00 -0.73 -0.73 -1.61 115.58 113.43 2k9q h ASN 34 Ca 0.11 -0.06 -0.04 0.00 1.87 0.00 0.00 56.30 58.18 2k9q h ASN 34 Cb 0.00 -0.23 -0.02 0.00 0.27 0.00 0.00 38.32 38.35 2k9q h ASN 34 CO -0.02 0.70 0.11 0.40 -0.37 0.00 0.00 177.43 178.25 2k9q h ILE 35 N 1.04 1.22 -0.03 2.57 2.04 -1.22 -1.33 117.51 121.81 2k9q h ILE 35 Ca 0.27 -0.76 0.01 0.00 1.00 0.00 0.00 64.86 65.39 2k9q h ILE 35 Cb -0.05 0.94 -0.00 0.00 -0.74 0.00 0.00 36.82 36.97 2k9q h ILE 35 CO -0.05 0.27 0.07 -0.08 0.00 0.00 0.00 178.15 178.35 2k9q h GLU 36 N 0.52 0.00 -0.60 2.37 4.81 -0.96 0.54 114.58 121.26 2k9q h GLU 36 Ca 0.13 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 2k9q h GLU 36 Cb 0.29 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.67 2k9q h GLU 36 CO -0.00 0.00 0.00 1.04 -0.73 0.00 0.00 179.01 179.32 2k9q n GLN 37 N -3.41 2.59 -1.77 1.92 6.02 -0.51 -4.94 117.38 117.28 2k9q n GLN 37 Ca -0.02 -1.61 -0.40 0.00 -0.01 0.00 0.00 57.00 54.95 2k9q n GLN 37 Cb 0.15 -1.64 0.01 0.00 1.02 0.00 0.00 30.24 29.78 2k9q n GLN 37 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2k9q n SER 38 N 0.51 3.58 0.08 1.08 2.88 0.19 -4.92 113.62 117.01 2k9q n SER 38 Ca 0.15 1.17 0.00 0.00 -1.33 0.00 0.00 58.87 58.85 2k9q n SER 38 Cb 0.57 -1.62 0.00 0.00 -0.75 0.00 0.00 64.21 62.41 2k9q n SER 38 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 2k9q n GLU 39 N 0.06 0.00 -4.72 -1.46 4.07 -1.26 -4.78 120.64 112.54 2k9q n GLU 39 Ca 0.03 0.00 -0.33 0.00 -0.06 0.00 0.00 57.16 56.81 2k9q n GLU 39 Cb 0.40 -0.34 -0.15 0.00 -0.06 0.00 0.00 31.44 31.29 2k9q n GLU 39 CO 0.00 0.00 0.00 0.99 -0.06 0.00 0.00 177.13 178.06 2k9q s THR 40 N -1.98 2.66 0.28 6.31 2.01 -1.26 -4.95 115.64 118.71 2k9q s THR 40 Ca 0.00 -0.79 -0.10 0.00 0.31 0.00 0.00 61.69 61.11 2k9q s THR 40 Cb 0.00 -2.10 -0.07 0.00 0.01 0.00 0.00 72.50 70.34 2k9q s THR 40 CO 0.00 0.53 0.62 0.00 -0.69 0.00 0.00 174.62 175.08 2k9q s ALA 41 N 0.60 3.49 0.57 7.40 0.00 -1.26 -5.07 121.76 127.50 2k9q s ALA 41 Ca -0.09 -0.24 -0.18 0.00 0.00 0.00 0.00 51.96 51.44 2k9q s ALA 41 Cb -0.16 -2.52 -0.05 0.00 0.00 0.00 0.00 23.12 20.40 2k9q s ALA 41 CO 0.03 0.36 1.11 -1.25 0.00 0.00 0.00 175.76 176.00 2k9q s PRO 42 N -3.12 3.27 0.02 0.00 0.04 -1.26 -4.90 135.00 129.05 2k9q s PRO 42 Ca 0.49 1.48 0.06 0.00 0.04 0.00 0.00 61.00 63.07 2k9q s PRO 42 Cb -0.11 -2.01 0.26 0.00 0.04 0.00 0.00 34.50 32.69 2k9q s PRO 42 CO 0.23 -0.89 1.19 1.33 0.04 0.00 0.00 177.00 178.90 2k9q n VAL 43 N -1.60 1.62 -0.23 -0.36 0.24 -1.26 -2.43 118.33 114.31 2k9q n VAL 43 Ca 0.11 0.43 -0.05 0.00 -2.04 0.00 0.00 64.34 62.78 2k9q n VAL 43 Cb 0.52 -1.35 0.05 0.00 -1.47 0.00 0.00 33.84 31.59 2k9q n VAL 43 CO 0.00 0.00 0.00 0.58 -2.14 0.00 0.00 176.83 175.27 2k9q h VAL 44 N 0.00 1.13 -0.46 3.34 2.07 -1.99 -0.67 116.25 119.67 2k9q h VAL 44 Ca 0.00 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.24 2k9q h VAL 44 Cb 0.09 0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 30.05 2k9q h VAL 44 CO 0.00 0.15 0.30 0.58 0.02 0.00 0.00 177.57 178.62 2k9q h VAL 45 N 0.84 1.12 -0.80 2.57 2.07 -1.87 -2.03 116.25 118.15 2k9q h VAL 45 Ca 0.25 -0.23 -0.03 0.00 0.82 0.00 0.00 66.70 67.50 2k9q h VAL 45 Cb -0.05 0.46 -0.04 0.00 -1.52 0.00 0.00 31.29 30.14 2k9q h VAL 45 CO -0.07 0.12 0.37 0.11 0.02 0.00 0.00 177.57 178.11 2k9q h LYS 46 N 0.62 1.17 -0.97 1.57 1.57 -1.60 -2.23 116.57 116.71 2k9q h LYS 46 Ca 0.17 -0.18 0.03 0.00 -1.87 0.00 0.00 60.65 58.79 2k9q h LYS 46 Cb -0.06 -0.20 -0.05 0.00 0.08 0.00 0.00 32.23 31.99 2k9q h LYS 46 CO -0.04 0.92 0.64 -0.92 -0.57 0.00 0.00 179.45 179.48 2k9q h TYR 47 N 1.15 1.19 -0.60 -1.35 3.20 -0.62 -1.16 116.97 118.78 2k9q h TYR 47 Ca 0.27 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 62.15 2k9q h TYR 47 Cb 0.15 -0.40 -0.03 0.00 1.54 0.00 0.00 36.73 37.99 2k9q h TYR 47 CO 0.01 0.71 0.30 0.82 -1.64 0.00 0.00 178.16 178.36 2k9q h ILE 48 N 1.25 1.21 -0.49 1.81 2.04 -0.80 -1.54 117.51 120.99 2k9q h ILE 48 Ca 0.38 -0.56 0.00 0.00 1.00 0.00 0.00 64.86 65.67 2k9q h ILE 48 Cb -0.04 0.48 -0.02 0.00 -0.74 0.00 0.00 36.82 36.49 2k9q h ILE 48 CO -0.11 0.23 0.31 0.00 0.00 0.00 0.00 178.15 178.59 2k9q h ALA 49 N 1.13 1.62 -0.07 1.87 0.00 -0.82 0.46 119.26 123.46 2k9q h ALA 49 Ca 0.21 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2k9q h ALA 49 Cb 0.10 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 2k9q h ALA 49 CO -0.03 0.34 0.04 0.35 0.00 0.00 0.00 179.25 179.96 2k9q h PHE 50 N 0.67 0.09 -0.22 0.00 3.04 -0.24 0.12 116.94 120.39 2k9q h PHE 50 Ca 0.18 0.00 -0.20 0.00 3.98 0.00 0.00 57.97 61.93 2k9q h PHE 50 Cb -0.05 -0.03 0.00 0.00 2.56 0.00 0.00 35.95 38.43 2k9q h PHE 50 CO 0.00 0.07 -0.65 -0.07 -2.02 0.00 0.00 178.31 175.63 2k9q h LEU 51 N 0.08 0.94 -0.83 0.59 3.38 -1.02 -3.18 115.31 115.27 2k9q h LEU 51 Ca 0.02 -0.55 0.02 0.00 0.09 0.00 0.00 57.88 57.46 2k9q h LEU 51 Cb 0.00 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.44 2k9q h LEU 51 CO -0.01 1.35 0.55 -0.09 0.09 0.00 0.00 178.44 180.33 2k9q h ARG 52 N 0.60 1.06 -0.03 1.13 2.43 0.14 0.09 114.38 119.79 2k9q h ARG 52 Ca -0.02 -0.06 0.01 0.00 -0.81 0.00 0.00 59.98 59.10 2k9q h ARG 52 Cb 1.27 -0.24 -0.00 0.00 -0.42 0.00 0.00 29.97 30.58 2k9q h ARG 52 CO 0.14 0.70 0.08 0.77 -1.51 0.00 0.00 179.97 180.15 2k9q h SER 53 N 1.09 0.00 -0.15 -3.80 0.02 -0.74 0.47 113.55 110.44 2k9q h SER 53 Ca 0.32 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.27 2k9q h SER 53 Cb -0.07 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.47 2k9q h SER 53 CO -0.09 0.00 0.00 0.29 -1.14 0.00 0.00 176.83 175.89 2k9q n LYS 54 N -3.37 1.84 -0.90 3.45 5.02 -0.03 -4.90 118.16 119.27 2k9q n LYS 54 Ca -0.02 -1.25 0.00 0.00 -2.02 0.00 0.00 58.31 55.02 2k9q n LYS 54 Cb 0.16 -1.43 0.00 0.00 -0.02 0.00 0.00 35.03 33.74 2k9q n LYS 54 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2k9q n GLY 55 N 1.19 0.50 3.73 0.72 0.00 0.16 -5.01 105.19 106.49 2k9q n GLY 55 Ca 0.17 -0.89 -0.42 0.00 0.00 0.00 0.00 46.02 44.88 2k9q n GLY 55 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2k9q s VAL 56 N -2.00 3.26 -0.50 1.61 1.01 -0.91 -4.91 120.40 117.96 2k9q s VAL 56 Ca 0.00 0.99 -0.28 0.00 0.00 0.00 0.00 61.98 62.69 2k9q s VAL 56 Cb 0.00 -3.63 -0.01 0.00 0.00 0.00 0.00 36.38 32.74 2k9q s VAL 56 CO 0.00 0.12 1.69 -1.81 0.00 0.00 0.00 175.10 175.10 2k9q s ASP 57 N 0.59 5.77 0.14 3.32 1.11 -1.26 -4.62 116.67 121.71 2k9q s ASP 57 Ca 0.59 0.65 0.23 0.00 0.18 0.00 0.00 52.55 54.21 2k9q s ASP 57 Cb -0.36 -2.53 0.12 0.00 1.07 0.00 0.00 42.92 41.22 2k9q s ASP 57 CO 0.36 -1.93 1.13 0.00 1.18 0.00 0.00 175.17 175.91 2k9q n LEU 58 N 10.86 0.73 -0.26 1.23 -0.00 -1.26 -3.95 117.00 124.35 2k9q n LEU 58 Ca 0.19 0.21 -0.06 0.00 -0.00 0.00 0.00 56.01 56.35 2k9q n LEU 58 Cb 0.49 -0.11 0.05 0.00 -0.00 0.00 0.00 43.42 43.85 2k9q n LEU 58 CO 0.70 -0.09 1.03 -0.55 -0.00 0.00 0.00 177.39 178.48 2k9q h ASN 59 N 0.00 0.97 -0.14 1.45 7.08 -1.99 -0.44 115.58 122.52 2k9q h ASN 59 Ca 0.00 -0.16 -0.01 0.00 -3.08 0.00 0.00 56.30 53.05 2k9q h ASN 59 Cb 0.85 -0.25 -0.01 0.00 -2.08 0.00 0.00 38.32 36.84 2k9q h ASN 59 CO 0.00 0.87 0.06 0.00 -2.08 0.00 0.00 177.43 176.28 2k9q h ALA 60 N 1.14 0.18 -0.79 4.14 0.00 -1.98 0.40 119.26 122.35 2k9q h ALA 60 Ca 0.24 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 2k9q h ALA 60 Cb 0.19 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 2k9q h ALA 60 CO -0.02 -0.24 0.40 -0.07 0.00 0.00 0.00 179.25 179.31 2k9q h LEU 61 N 0.08 1.02 -0.27 0.00 4.07 -1.66 -2.74 115.31 115.81 2k9q h LEU 61 Ca 0.05 -0.12 -0.16 0.00 0.08 0.00 0.00 57.88 57.72 2k9q h LEU 61 Cb 0.15 -0.26 0.00 0.00 1.08 0.00 0.00 40.66 41.63 2k9q h LEU 61 CO -0.00 0.85 -0.48 -0.26 -1.08 0.00 0.00 178.44 177.47 2k9q h PHE 62 N 1.11 1.00 -0.95 1.13 -1.00 -0.85 -2.86 116.94 114.52 2k9q h PHE 62 Ca 0.27 -0.35 0.16 0.00 2.81 0.00 0.00 57.97 60.86 2k9q h PHE 62 Cb 0.09 -0.19 -0.10 0.00 3.61 0.00 0.00 35.95 39.37 2k9q h PHE 62 CO 0.01 1.16 0.55 -0.44 -1.61 0.00 0.00 178.31 177.98 2k9q h ASP 63 N 0.55 0.73 -0.24 2.17 5.19 0.07 0.53 116.42 125.43 2k9q h ASP 63 Ca 0.02 0.08 -0.13 0.00 -0.62 0.00 0.00 57.03 56.38 2k9q h ASP 63 Cb 1.08 -0.05 -0.01 0.00 0.18 0.00 0.00 39.33 40.53 2k9q h ASP 63 CO 0.11 0.31 -0.30 0.03 -3.12 0.00 0.00 179.24 176.26 2k9q h ARG 64 N 0.77 0.74 0.01 3.56 3.08 -1.41 -3.35 114.38 117.79 2k9q h ARG 64 Ca 0.52 -0.34 -0.00 0.00 0.07 0.00 0.00 59.98 60.23 2k9q h ARG 64 Cb 0.71 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.74 2k9q h ARG 64 CO -0.35 0.95 -0.01 0.82 -1.07 0.00 0.00 179.97 180.32 2k9q h ILE 65 N 0.63 0.00 -4.08 2.04 2.04 -0.38 -3.46 117.51 114.30 2k9q h ILE 65 Ca 0.07 -0.04 -0.47 0.00 1.00 0.00 0.00 64.86 65.42 2k9q h ILE 65 Cb 0.83 0.00 0.03 0.00 -0.74 0.00 0.00 36.82 36.94 2k9q h ILE 65 CO 0.07 0.00 0.39 0.27 0.00 0.00 0.00 178.15 178.88 2k9q s ILE 66 N -1.59 3.78 0.05 -0.67 -4.36 0.15 -4.68 121.20 113.88 2k9q s ILE 66 Ca -0.00 1.09 0.00 0.00 -0.26 0.00 0.00 60.65 61.48 2k9q s ILE 66 Cb 0.00 -3.44 0.00 0.00 1.25 0.00 0.00 42.46 40.27 2k9q s ILE 66 CO 0.01 -0.25 0.00 0.52 0.24 0.00 0.00 174.94 175.46 2k9q n VAL 67 N -1.02-11.74 -2.41 8.37 0.31 -1.26 -4.56 118.33 106.01 2k9q n VAL 67 Ca 0.09 2.73 -0.37 0.00 -0.01 0.00 0.00 64.34 66.78 2k9q n VAL 67 Cb 0.52 -5.53 -0.03 0.00 -0.91 0.00 0.00 33.84 27.90 2k9q n VAL 67 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2k9q s ASN 68 N -0.49 6.61 -0.15 4.52 6.03 -1.26 -4.78 114.94 125.40 2k9q s ASN 68 Ca 0.00 2.20 0.17 0.00 -1.03 0.00 0.00 52.86 54.20 2k9q s ASN 68 Cb 0.00 -2.60 0.76 0.00 -3.03 0.00 0.00 41.25 36.38 2k9q s ASN 68 CO 0.00 -0.61 1.67 0.29 -2.03 0.00 0.00 177.10 176.43 2k9q n LYS 69 N -0.03 4.11 0.00 3.55 4.76 -1.26 -4.38 118.16 124.91 2k9q n LYS 69 Ca 0.05 -2.99 0.00 0.00 -2.87 0.00 0.00 58.31 52.50 2k9q n LYS 69 Cb 0.48 -2.02 0.00 0.00 -1.84 0.00 0.00 35.03 31.65 2k9q n LYS 69 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2k9q n LEU 70 N 0.97 0.08 -4.42 -0.35 4.77 -1.26 -4.85 117.00 111.94 2k9q n LEU 70 Ca 0.27 -0.04 -0.45 0.00 -0.03 0.00 0.00 56.01 55.75 2k9q n LEU 70 Cb 0.99 -0.04 -0.02 0.00 -2.33 0.00 0.00 43.42 42.03 2k9q n LEU 70 CO 0.27 0.02 0.02 -0.62 -1.33 0.00 0.00 177.39 175.75 2k9q n GLU 71 N -0.39 0.33 -2.53 3.23 1.02 -1.26 -4.83 120.64 116.21 2k9q n GLU 71 Ca 0.00 0.12 -0.41 0.00 -0.02 0.00 0.00 57.16 56.84 2k9q n GLU 71 Cb 0.02 -1.24 0.01 0.00 -0.02 0.00 0.00 31.44 30.21 2k9q n GLU 71 CO 0.00 0.00 0.00 -2.39 1.18 0.00 0.00 177.13 175.92 2k9q n HIS 72 N -0.32 2.62 1.25 -0.32 1.44 -1.26 -4.68 115.22 113.94 2k9q n HIS 72 Ca 0.14 -2.65 0.12 0.00 -2.01 0.00 0.00 57.72 53.32 2k9q n HIS 72 Cb 0.32 -1.45 0.63 0.00 0.12 0.00 0.00 29.99 29.61 2k9q n HIS 72 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 2k9q n HIS 73 N 1.14 0.00 0.00 -1.40 8.25 -1.26 -4.87 115.22 117.08 2k9q n HIS 73 Ca 0.45 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.91 2k9q n HIS 73 Cb 0.28 -0.18 0.00 0.00 1.12 0.00 0.00 29.99 31.22 2k9q n HIS 73 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2k9q n HIS 74 N -1.18 0.00 -1.54 4.41 8.25 -1.26 -4.42 115.22 119.48 2k9q n HIS 74 Ca 0.14 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.34 2k9q n HIS 74 Cb 0.15 0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.17 2k9q n HIS 74 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 2k9q n HIS 75 N 0.00 1.04 -3.45 4.41 -0.00 -1.26 -4.81 115.22 111.14 2k9q n HIS 75 Ca 0.00 0.08 -0.11 0.00 -0.00 0.00 0.00 57.72 57.69 2k9q n HIS 75 Cb 0.00 -2.33 -0.02 0.00 -0.00 0.00 0.00 29.99 27.64 2k9q n HIS 75 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2k9q s HIS 76 N 11.36 -0.47 0.00 -1.40 5.04 -1.26 -5.22 115.29 123.34 2k9q s HIS 76 Ca 1.05 0.30 0.00 0.00 -1.54 0.00 0.00 55.06 54.87 2k9q s HIS 76 Cb -0.37 0.55 0.00 0.00 0.04 0.00 0.00 32.58 32.80 2k9q s HIS 76 CO 0.26 -0.73 0.00 1.58 -2.34 0.00 0.00 174.74 173.51