#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k9q n GLU 2 N 0.00 -5.69 -0.22 2.12 2.13 -1.26 -4.30 120.64 113.42 2k9q n GLU 2 Ca 0.00 4.04 -0.07 0.00 0.66 0.00 0.00 57.16 61.78 2k9q n GLU 2 Cb 0.00 -4.38 0.03 0.00 0.27 0.00 0.00 31.44 27.36 2k9q n GLU 2 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 2k9q h LEU 3 N 4.09 0.89 -0.96 4.31 5.85 -2.00 -2.82 115.31 124.66 2k9q h LEU 3 Ca 0.00 -0.19 0.01 0.00 0.84 0.00 0.00 57.88 58.53 2k9q h LEU 3 Cb 0.00 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 40.75 2k9q h LEU 3 CO 0.00 0.84 0.62 0.28 -0.34 0.00 0.00 178.44 179.84 2k9q h SER 4 N 0.88 1.11 -0.72 1.25 0.02 -1.88 -2.13 113.55 112.09 2k9q h SER 4 Ca 0.20 -0.04 -0.03 0.00 -0.84 0.00 0.00 61.79 61.08 2k9q h SER 4 Cb 0.26 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 62.49 2k9q h SER 4 CO -0.01 0.82 0.32 -1.13 -1.14 0.00 0.00 176.83 175.68 2k9q h ASN 5 N 1.31 0.98 -0.20 3.07 -0.73 -1.72 -2.58 115.58 115.70 2k9q h ASN 5 Ca 0.35 -0.16 -0.09 0.00 1.87 0.00 0.00 56.30 58.27 2k9q h ASN 5 Cb -0.13 -0.25 -0.02 0.00 0.27 0.00 0.00 38.32 38.19 2k9q h ASN 5 CO -0.07 0.86 -0.18 -0.33 -0.37 0.00 0.00 177.43 177.34 2k9q h GLU 6 N 1.03 0.63 -0.60 6.67 5.08 -1.25 -2.53 114.58 123.59 2k9q h GLU 6 Ca 0.24 -0.22 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 2k9q h GLU 6 Cb 0.17 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.35 2k9q h GLU 6 CO -0.02 0.77 0.32 1.25 -1.00 0.00 0.00 179.01 180.33 2k9q h LEU 7 N 0.56 0.76 -0.55 1.33 5.85 -1.01 -1.36 115.31 120.89 2k9q h LEU 7 Ca 0.09 -0.10 -0.11 0.00 0.84 0.00 0.00 57.88 58.60 2k9q h LEU 7 Cb 0.62 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.44 2k9q h LEU 7 CO 0.04 0.65 -0.08 0.50 -0.34 0.00 0.00 178.44 179.21 2k9q h LYS 8 N 0.82 1.03 -0.44 1.25 3.64 -1.34 -2.51 116.57 119.02 2k9q h LYS 8 Ca 0.21 -0.37 -0.02 0.00 -1.27 0.00 0.00 60.65 59.20 2k9q h LYS 8 Cb 0.06 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.79 2k9q h LYS 8 CO -0.03 1.06 0.21 0.28 -2.27 0.00 0.00 179.45 178.70 2k9q h VAL 9 N 0.91 1.19 -0.76 2.00 2.07 -1.11 -0.73 116.25 119.81 2k9q h VAL 9 Ca 0.15 -0.54 -0.00 0.00 0.82 0.00 0.00 66.70 67.13 2k9q h VAL 9 Cb 0.65 0.72 -0.04 0.00 -1.52 0.00 0.00 31.29 31.10 2k9q h VAL 9 CO 0.04 0.21 0.47 -0.33 0.02 0.00 0.00 177.57 177.98 2k9q h GLU 10 N 0.58 1.03 -0.16 1.57 4.39 -1.16 0.42 114.58 121.25 2k9q h GLU 10 Ca 0.15 -0.09 -0.01 0.00 0.34 0.00 0.00 59.36 59.75 2k9q h GLU 10 Cb 0.13 -0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 28.56 2k9q h GLU 10 CO -0.02 0.72 0.05 -0.09 -1.16 0.00 0.00 179.01 178.52 2k9q h ARG 11 N 1.04 0.24 -0.37 2.33 9.65 -1.10 0.08 114.38 126.25 2k9q h ARG 11 Ca 0.27 -0.05 -0.08 0.00 -1.10 0.00 0.00 59.98 59.02 2k9q h ARG 11 Cb -0.05 -0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 28.49 2k9q h ARG 11 CO -0.05 0.36 -0.08 0.82 2.80 0.00 0.00 179.97 183.82 2k9q h ILE 12 N 0.08 1.27 -0.80 1.20 2.04 -0.85 0.41 117.51 120.86 2k9q h ILE 12 Ca 0.05 -1.14 -0.02 0.00 1.00 0.00 0.00 64.86 64.75 2k9q h ILE 12 Cb 0.22 1.25 -0.04 0.00 -0.74 0.00 0.00 36.82 37.52 2k9q h ILE 12 CO -0.00 0.38 0.44 -0.09 0.00 0.00 0.00 178.15 178.87 2k9q h ARG 13 N 0.52 1.12 -0.00 2.37 2.43 -0.08 -0.86 114.38 119.86 2k9q h ARG 13 Ca 0.10 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 2k9q h ARG 13 Cb 0.59 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 29.92 2k9q h ARG 13 CO 0.03 0.83 -0.17 1.28 -1.51 0.00 0.00 179.97 180.43 2k9q n LEU 14 N -4.41 0.46 -3.71 3.80 4.77 0.01 -4.96 117.00 112.95 2k9q n LEU 14 Ca 0.08 0.06 -0.23 0.00 -0.03 0.00 0.00 56.01 55.88 2k9q n LEU 14 Cb 0.10 -0.24 0.00 0.00 -2.33 0.00 0.00 43.42 40.95 2k9q n LEU 14 CO 0.38 0.09 -0.20 -0.24 -1.33 0.00 0.00 177.39 176.09 2k9q n SER 15 N -1.10 -5.14 -4.61 -1.43 2.88 0.14 -4.94 113.62 99.42 2k9q n SER 15 Ca 0.12 -0.84 -0.34 0.00 -1.33 0.00 0.00 58.87 56.47 2k9q n SER 15 Cb 0.30 -1.98 -0.11 0.00 -0.75 0.00 0.00 64.21 61.68 2k9q n SER 15 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2k9q s LEU 16 N -4.73 3.47 0.39 2.46 1.43 -1.08 -5.04 118.68 115.57 2k9q s LEU 16 Ca 0.02 0.03 -0.23 0.00 -1.03 0.00 0.00 54.13 52.93 2k9q s LEU 16 Cb -0.00 -1.81 -0.11 0.00 0.03 0.00 0.00 46.19 44.30 2k9q s LEU 16 CO 0.88 0.28 0.95 0.42 0.23 0.00 0.00 176.35 179.11 2k9q s THR 17 N -0.30 4.33 0.16 5.49 -4.23 -1.26 -4.96 115.64 114.86 2k9q s THR 17 Ca 0.06 1.61 -0.04 0.00 -1.18 0.00 0.00 61.69 62.14 2k9q s THR 17 Cb -0.12 -3.75 -0.11 0.00 1.34 0.00 0.00 72.50 69.85 2k9q s THR 17 CO 0.02 -0.15 1.41 0.00 -0.54 0.00 0.00 174.62 175.37 2k9q h ALA 18 N 2.38 0.54 -0.22 3.99 0.00 -1.98 -2.68 119.26 121.29 2k9q h ALA 18 Ca -0.48 -0.59 -0.00 0.00 0.00 0.00 0.00 54.91 53.83 2k9q h ALA 18 Cb 1.18 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 2k9q h ALA 18 CO 0.62 0.74 0.13 -0.22 0.00 0.00 0.00 179.25 180.52 2k9q h LYS 19 N 0.36 0.31 -0.18 0.00 3.64 -1.97 0.56 116.57 119.28 2k9q h LYS 19 Ca -0.03 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 2k9q h LYS 19 Cb 1.30 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 33.05 2k9q h LYS 19 CO 0.13 0.26 0.06 1.03 -2.27 0.00 0.00 179.45 178.66 2k9q h SER 20 N 0.26 0.26 -0.41 4.20 0.87 -1.97 -0.82 113.55 115.95 2k9q h SER 20 Ca 0.08 -0.20 -0.05 0.00 -1.23 0.00 0.00 61.79 60.39 2k9q h SER 20 Cb 0.04 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 61.92 2k9q h SER 20 CO -0.01 0.39 0.07 0.58 -0.53 0.00 0.00 176.83 177.33 2k9q h VAL 21 N 0.12 1.24 -0.51 2.23 2.07 -1.32 -2.66 116.25 117.43 2k9q h VAL 21 Ca 0.06 -0.87 -0.01 0.00 0.82 0.00 0.00 66.70 66.69 2k9q h VAL 21 Cb 0.22 1.01 -0.03 0.00 -1.52 0.00 0.00 31.29 30.98 2k9q h VAL 21 CO -0.00 0.30 0.27 0.00 0.02 0.00 0.00 177.57 178.16 2k9q h ALA 22 N 0.93 1.52 -0.24 1.67 0.00 0.23 0.27 119.26 123.64 2k9q h ALA 22 Ca 0.13 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 2k9q h ALA 22 Cb 0.37 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2k9q h ALA 22 CO 0.01 0.40 0.04 1.49 0.00 0.00 0.00 179.25 181.19 2k9q h GLU 23 N 0.70 0.39 0.03 0.00 4.81 -0.81 0.19 114.58 119.89 2k9q h GLU 23 Ca 0.18 -0.10 -0.26 0.00 -0.13 0.00 0.00 59.36 59.05 2k9q h GLU 23 Cb 0.04 -0.05 0.01 0.00 0.63 0.00 0.00 28.75 29.38 2k9q h GLU 23 CO -0.03 0.52 -1.06 0.93 -0.73 0.00 0.00 179.01 178.64 2k9q h GLU 24 N 0.20 0.54 -0.64 1.92 5.08 -1.20 -3.24 114.58 117.25 2k9q h GLU 24 Ca 0.07 -0.63 -0.08 0.00 -1.00 0.00 0.00 59.36 57.73 2k9q h GLU 24 Cb 0.31 0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 2k9q h GLU 24 CO 0.00 1.24 0.08 0.52 -1.00 0.00 0.00 179.01 179.86 2k9q h MET 25 N 0.28 1.07 -0.01 2.33 2.86 -0.44 -3.47 114.93 117.55 2k9q h MET 25 Ca -0.12 -0.30 0.00 0.00 -2.06 0.00 0.00 59.70 57.22 2k9q h MET 25 Cb 1.71 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 33.26 2k9q h MET 25 CO 0.20 1.00 0.00 0.41 1.06 0.00 0.00 176.91 179.58 2k9q n GLY 26 N -0.53 1.29 3.38 8.32 0.00 0.63 -5.06 105.19 113.22 2k9q n GLY 26 Ca 0.04 -0.38 -0.19 0.00 0.00 0.00 0.00 46.02 45.49 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 -2.01 1.09 0.67 -0.61 -4.36 -1.01 -5.05 121.20 109.91 2k9q s ILE 27 Ca 0.00 -2.03 -0.12 0.00 -0.26 0.00 0.00 60.65 58.24 2k9q s ILE 27 Cb 0.00 -2.55 -0.00 0.00 1.25 0.00 0.00 42.46 41.16 2k9q s ILE 27 CO 0.00 -0.17 1.06 -0.44 0.24 0.00 0.00 174.94 175.63 2k9q s SER 28 N -3.38 5.44 0.30 4.36 0.01 -1.26 -4.60 113.70 114.57 2k9q s SER 28 Ca 0.32 1.71 0.01 0.00 1.31 0.00 0.00 55.95 59.31 2k9q s SER 28 Cb 0.07 -2.51 0.48 0.00 0.21 0.00 0.00 66.02 64.27 2k9q s SER 28 CO 0.12 -1.40 1.83 0.03 0.41 0.00 0.00 173.24 174.23 2k9q h ARG 29 N -0.35 0.66 -0.69 12.44 3.08 -1.95 -2.31 114.38 125.26 2k9q h ARG 29 Ca -0.45 -0.15 -0.08 0.00 0.07 0.00 0.00 59.98 59.38 2k9q h ARG 29 Cb 1.22 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 31.15 2k9q h ARG 29 CO 0.56 0.66 0.14 0.37 -1.07 0.00 0.00 179.97 180.64 2k9q h GLN 30 N 0.63 1.13 -0.61 0.04 4.15 -1.99 -1.59 115.11 116.88 2k9q h GLN 30 Ca 0.13 -0.29 0.03 0.00 0.77 0.00 0.00 58.65 59.30 2k9q h GLN 30 Cb 0.35 -0.14 -0.04 0.00 0.21 0.00 0.00 27.48 27.86 2k9q h GLN 30 CO 0.01 1.01 0.36 1.96 -1.93 0.00 0.00 178.83 180.24 2k9q h GLN 31 N 1.06 0.69 -0.46 1.69 1.08 -1.79 0.35 115.11 117.73 2k9q h GLN 31 Ca 0.21 -0.04 -0.04 0.00 -1.45 0.00 0.00 58.65 57.33 2k9q h GLN 31 Cb 0.41 -0.15 -0.02 0.00 -0.05 0.00 0.00 27.48 27.67 2k9q h GLN 31 CO 0.01 0.45 0.14 1.25 -0.95 0.00 0.00 178.83 179.73 2k9q h LEU 32 N 0.71 0.68 -1.20 1.46 5.85 -1.21 -2.19 115.31 119.41 2k9q h LEU 32 Ca 0.25 -0.21 -0.05 0.00 0.84 0.00 0.00 57.88 58.71 2k9q h LEU 32 Cb 0.06 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 40.89 2k9q h LEU 32 CO -0.12 0.71 -0.02 0.00 -0.34 0.00 0.00 178.44 178.67 2k9q h ASN 34 N 0.50 0.72 -0.59 0.00 -1.24 0.16 -2.48 115.58 112.65 2k9q h ASN 34 Ca 0.11 -0.14 -0.03 0.00 0.71 0.00 0.00 56.30 56.95 2k9q h ASN 34 Cb 0.36 -0.19 -0.03 0.00 0.73 0.00 0.00 38.32 39.19 2k9q h ASN 34 CO 0.01 0.74 0.24 0.40 -1.29 0.00 0.00 177.43 177.53 2k9q h ILE 35 N 0.73 1.22 -0.47 2.57 2.04 -0.79 -1.30 117.51 121.51 2k9q h ILE 35 Ca 0.16 -0.69 -0.02 0.00 1.00 0.00 0.00 64.86 65.31 2k9q h ILE 35 Cb 0.33 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 36.97 2k9q h ILE 35 CO 0.00 0.27 0.22 -0.33 0.00 0.00 0.00 178.15 178.32 2k9q h GLU 36 N 0.81 0.66 -0.11 2.37 5.08 -1.27 -0.23 114.58 121.89 2k9q h GLU 36 Ca 0.20 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 2k9q h GLU 36 Cb 0.19 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.31 2k9q h GLU 36 CO -0.02 0.52 0.00 1.04 -1.00 0.00 0.00 179.01 179.55 2k9q n GLN 37 N -4.39 1.56 -2.07 2.33 6.02 -0.90 -4.90 117.38 115.03 2k9q n GLN 37 Ca 0.04 -0.84 -0.39 0.00 -0.01 0.00 0.00 57.00 55.80 2k9q n GLN 37 Cb 0.12 -1.39 0.00 0.00 1.02 0.00 0.00 30.24 30.00 2k9q n GLN 37 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2k9q s SER 38 N -1.64 6.11 0.00 1.08 0.15 -0.10 -5.01 113.70 114.29 2k9q s SER 38 Ca 0.33 2.57 0.00 0.00 0.70 0.00 0.00 55.95 59.55 2k9q s SER 38 Cb 0.17 -2.63 0.00 0.00 -1.71 0.00 0.00 66.02 61.85 2k9q s SER 38 CO 0.27 -0.98 0.00 -0.62 1.20 0.00 0.00 173.24 173.11 2k9q n GLU 39 N -0.22 0.00 -2.02 5.44 -0.58 -1.26 -4.92 120.64 117.09 2k9q n GLU 39 Ca 0.06 0.00 -0.29 0.00 -0.42 0.00 0.00 57.16 56.50 2k9q n GLU 39 Cb 0.45 0.00 0.04 0.00 -0.57 0.00 0.00 31.44 31.36 2k9q n GLU 39 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 2k9q s THR 40 N 0.19 3.65 0.39 2.62 2.01 -1.26 -4.83 115.64 118.41 2k9q s THR 40 Ca 0.00 0.40 -0.03 0.00 0.31 0.00 0.00 61.69 62.37 2k9q s THR 40 Cb 0.00 -3.51 -0.04 0.00 0.01 0.00 0.00 72.50 68.96 2k9q s THR 40 CO 0.00 -0.64 0.64 0.00 -0.69 0.00 0.00 174.62 173.94 2k9q s ALA 41 N -3.25 3.56 0.81 7.40 0.00 -1.26 -5.07 121.76 123.96 2k9q s ALA 41 Ca 0.57 -0.66 -0.11 0.00 0.00 0.00 0.00 51.96 51.76 2k9q s ALA 41 Cb -0.11 -2.34 0.08 0.00 0.00 0.00 0.00 23.12 20.75 2k9q s ALA 41 CO 0.50 -0.08 1.10 -1.25 0.00 0.00 0.00 175.76 176.03 2k9q s PRO 42 N -4.29 1.90 0.64 0.00 0.04 -1.26 -4.90 135.00 127.13 2k9q s PRO 42 Ca 0.44 1.17 0.40 0.00 0.04 0.00 0.00 61.00 63.05 2k9q s PRO 42 Cb -0.10 -1.86 2.22 0.00 0.04 0.00 0.00 34.50 34.80 2k9q s PRO 42 CO 0.38 -1.89 2.32 -0.39 0.04 0.00 0.00 177.00 177.45 2k9q h VAL 43 N -1.31 0.13 -0.46 -0.36 -1.51 -2.00 -2.05 116.25 108.69 2k9q h VAL 43 Ca -0.44 -0.05 -0.01 0.00 -1.23 0.00 0.00 66.70 64.97 2k9q h VAL 43 Cb 1.24 1.04 -0.02 0.00 -2.13 0.00 0.00 31.29 31.43 2k9q h VAL 43 CO 0.50 0.00 0.25 0.58 -1.23 0.00 0.00 177.57 177.68 2k9q h VAL 44 N 0.00 1.16 -0.57 7.19 2.07 -2.00 -1.03 116.25 123.07 2k9q h VAL 44 Ca -0.00 -0.42 -0.06 0.00 0.82 0.00 0.00 66.70 67.03 2k9q h VAL 44 Cb 0.04 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 2k9q h VAL 44 CO 0.00 0.17 0.11 0.58 0.02 0.00 0.00 177.57 178.46 2k9q h VAL 45 N 0.61 1.25 -0.66 2.57 2.07 -1.73 -2.05 116.25 118.31 2k9q h VAL 45 Ca 0.16 -0.94 -0.01 0.00 0.82 0.00 0.00 66.70 66.73 2k9q h VAL 45 Cb 0.05 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 30.55 2k9q h VAL 45 CO -0.03 0.35 0.39 0.11 0.02 0.00 0.00 177.57 178.41 2k9q h LYS 46 N 0.83 0.90 -0.60 1.57 1.57 -1.43 -0.07 116.57 119.34 2k9q h LYS 46 Ca 0.18 -0.09 -0.02 0.00 -1.87 0.00 0.00 60.65 58.84 2k9q h LYS 46 Cb 0.39 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.48 2k9q h LYS 46 CO 0.01 0.65 0.28 -0.92 -0.57 0.00 0.00 179.45 178.90 2k9q h TYR 47 N 0.90 0.88 -0.67 -1.35 5.03 -0.99 -2.07 116.97 118.71 2k9q h TYR 47 Ca 0.24 -0.05 -0.02 0.00 2.58 0.00 0.00 58.73 61.48 2k9q h TYR 47 Cb -0.01 -0.27 -0.03 0.00 1.55 0.00 0.00 36.73 37.97 2k9q h TYR 47 CO -0.01 0.67 0.33 0.82 -1.32 0.00 0.00 178.16 178.65 2k9q h ILE 48 N 0.83 1.22 -0.45 1.81 2.04 -0.87 -1.72 117.51 120.36 2k9q h ILE 48 Ca 0.21 -0.62 0.03 0.00 1.00 0.00 0.00 64.86 65.48 2k9q h ILE 48 Cb 0.13 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 36.59 2k9q h ILE 48 CO -0.02 0.26 0.30 0.00 0.00 0.00 0.00 178.15 178.68 2k9q h ALA 49 N 1.15 1.79 -0.26 1.87 0.00 -0.53 -0.72 119.26 122.57 2k9q h ALA 49 Ca 0.23 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 2k9q h ALA 49 Cb 0.11 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2k9q h ALA 49 CO -0.03 0.16 0.16 0.35 0.00 0.00 0.00 179.25 179.88 2k9q h PHE 50 N 0.51 0.34 -0.53 0.00 3.57 -0.64 -0.35 116.94 119.84 2k9q h PHE 50 Ca 0.18 -0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.59 2k9q h PHE 50 Cb 0.10 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 38.70 2k9q h PHE 50 CO -0.00 0.25 -0.02 -0.07 -2.23 0.00 0.00 178.31 176.24 2k9q h LEU 51 N 0.32 0.89 -0.41 0.59 -0.00 -1.16 -3.00 115.31 112.56 2k9q h LEU 51 Ca 0.09 -0.24 -0.01 0.00 -0.00 0.00 0.00 57.88 57.72 2k9q h LEU 51 Cb 0.01 -0.24 -0.02 0.00 -0.00 0.00 0.00 40.66 40.41 2k9q h LEU 51 CO -0.02 0.96 0.23 -0.09 -0.00 0.00 0.00 178.44 179.52 2k9q h ARG 52 N 0.84 0.57 0.00 1.13 9.65 -0.64 -1.80 114.38 124.13 2k9q h ARG 52 Ca 0.15 -0.07 0.00 0.00 -1.10 0.00 0.00 59.98 58.97 2k9q h ARG 52 Cb 0.52 -0.11 0.00 0.00 -1.39 0.00 0.00 29.97 28.99 2k9q h ARG 52 CO 0.03 0.46 0.12 1.03 2.80 0.00 0.00 179.97 184.41 2k9q h SER 53 N 0.53 0.00 -0.72 -3.80 0.87 -0.92 0.43 113.55 109.94 2k9q h SER 53 Ca 0.14 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.70 2k9q h SER 53 Cb 0.05 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.01 2k9q h SER 53 CO -0.02 0.00 0.00 0.29 -0.53 0.00 0.00 176.83 176.57 2k9q n LYS 54 N -2.48 3.02 -2.67 2.24 5.02 -0.70 -4.93 118.16 117.66 2k9q n LYS 54 Ca -0.02 -2.73 -0.14 0.00 -2.02 0.00 0.00 58.31 53.40 2k9q n LYS 54 Cb 0.16 -1.67 0.02 0.00 -0.02 0.00 0.00 35.03 33.52 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 1.53 -0.11 0.27 0.72 0.00 0.15 -4.88 105.19 102.87 2k9q n GLY 55 Ca 0.25 -0.22 0.16 0.00 0.00 0.00 0.00 46.02 46.21 2k9q n GLY 55 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2k9q h VAL 56 N -0.76 0.13 -4.95 1.61 2.07 -1.62 -3.48 116.25 109.25 2k9q h VAL 56 Ca -0.34 -0.64 0.01 0.00 0.82 0.00 0.00 66.70 66.54 2k9q h VAL 56 Cb 1.24 1.56 -0.08 0.00 -1.52 0.00 0.00 31.29 32.49 2k9q h VAL 56 CO 0.37 0.05 -1.27 0.47 0.02 0.00 0.00 177.57 177.21 2k9q n ASP 57 N -3.17 -3.89 -0.42 0.57 9.92 -1.26 -4.87 116.55 113.42 2k9q n ASP 57 Ca 0.00 1.51 0.13 0.00 -0.53 0.00 0.00 54.79 55.91 2k9q n ASP 57 Cb 0.33 -4.96 0.39 0.00 -0.64 0.00 0.00 41.12 36.25 2k9q n ASP 57 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 2k9q n LEU 58 N 1.83 1.46 -0.17 0.64 4.77 -1.26 -4.17 117.00 120.09 2k9q n LEU 58 Ca -0.25 -0.46 -0.07 0.00 -0.03 0.00 0.00 56.01 55.20 2k9q n LEU 58 Cb 0.38 -0.05 0.02 0.00 -2.33 0.00 0.00 43.42 41.44 2k9q n LEU 58 CO 0.23 0.25 1.05 0.78 -1.33 0.00 0.00 177.39 178.37 2k9q h ASN 59 N 2.07 0.61 0.10 -1.43 2.35 -1.99 -1.16 115.58 116.12 2k9q h ASN 59 Ca 0.00 -0.06 -0.19 0.00 -0.55 0.00 0.00 56.30 55.50 2k9q h ASN 59 Cb 0.56 -0.15 -0.00 0.00 0.05 0.00 0.00 38.32 38.77 2k9q h ASN 59 CO 0.00 0.49 -0.69 0.00 -1.65 0.00 0.00 177.43 175.58 2k9q h ALA 60 N 1.14 0.56 0.49 -0.83 0.00 -1.94 -1.35 119.26 117.33 2k9q h ALA 60 Ca 0.18 -0.58 -0.02 0.00 0.00 0.00 0.00 54.91 54.49 2k9q h ALA 60 Cb -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2k9q h ALA 60 CO -0.03 0.73 -0.23 1.25 0.00 0.00 0.00 179.25 180.96 2k9q h LEU 61 N 0.38 -0.55 -0.53 0.00 6.46 -1.66 -2.51 115.31 116.89 2k9q h LEU 61 Ca -0.03 -0.03 -0.15 0.00 -0.12 0.00 0.00 57.88 57.55 2k9q h LEU 61 Cb 1.27 0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 41.34 2k9q h LEU 61 CO 0.13 -0.32 -0.46 -0.26 -0.62 0.00 0.00 178.44 176.91 2k9q h PHE 62 N -0.76 0.82 -0.70 1.25 0.04 -1.31 -2.86 116.94 113.43 2k9q h PHE 62 Ca -0.07 -0.26 0.13 0.00 2.80 0.00 0.00 57.97 60.57 2k9q h PHE 62 Cb 0.55 -0.17 -0.05 0.00 2.20 0.00 0.00 35.95 38.49 2k9q h PHE 62 CO -0.02 1.01 0.47 -0.44 -0.60 0.00 0.00 178.31 178.73 2k9q h ASP 63 N 0.54 0.40 0.05 2.17 3.32 -1.20 0.18 116.42 121.88 2k9q h ASP 63 Ca 0.03 0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.10 2k9q h ASP 63 Cb 1.00 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.49 2k9q h ASP 63 CO 0.09 0.22 -0.02 0.03 -1.72 0.00 0.00 179.24 177.84 2k9q h ARG 64 N 0.44 -0.07 -0.34 3.56 2.47 -1.21 -3.10 114.38 116.13 2k9q h ARG 64 Ca 0.34 0.00 -0.10 0.00 -1.26 0.00 0.00 59.98 58.96 2k9q h ARG 64 Cb 0.71 0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 29.03 2k9q h ARG 64 CO -0.10 0.08 -0.18 0.82 0.56 0.00 0.00 179.97 181.14 2k9q h ILE 65 N -0.20 1.29 -2.52 2.04 2.04 -1.28 -3.43 117.51 115.45 2k9q h ILE 65 Ca -0.01 -1.31 -0.53 0.00 1.00 0.00 0.00 64.86 64.01 2k9q h ILE 65 Cb 0.17 1.40 0.05 0.00 -0.74 0.00 0.00 36.82 37.70 2k9q h ILE 65 CO 0.01 0.43 1.06 -0.38 0.00 0.00 0.00 178.15 179.27 2k9q n ILE 66 N -4.31 0.22 0.90 -0.67 5.41 0.51 -4.86 119.36 116.56 2k9q n ILE 66 Ca -0.03 -0.04 0.11 0.00 1.00 0.00 0.00 62.75 63.80 2k9q n ILE 66 Cb 0.41 -2.03 0.05 0.00 -0.71 0.00 0.00 39.64 37.36 2k9q n ILE 66 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 176.55 177.88 2k9q n VAL 67 N 4.37 0.03 -0.19 1.39 0.24 -1.26 -4.17 118.33 118.74 2k9q n VAL 67 Ca 0.17 -0.05 -0.05 0.00 -2.04 0.00 0.00 64.34 62.37 2k9q n VAL 67 Cb 0.36 0.55 0.04 0.00 -1.47 0.00 0.00 33.84 33.32 2k9q n VAL 67 CO 0.00 0.00 0.00 -1.13 -2.14 0.00 0.00 176.83 173.56 2k9q h ASN 68 N 0.00 0.58 -4.19 -1.34 -0.73 -1.93 -3.48 115.58 104.49 2k9q h ASN 68 Ca 0.00 -0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 2k9q h ASN 68 Cb 0.55 -0.13 0.00 0.00 0.27 0.00 0.00 38.32 39.01 2k9q h ASN 68 CO 0.00 0.41 -0.68 1.17 -0.37 0.00 0.00 177.43 177.97 2k9q n LYS 69 N -4.74 -3.83 -0.15 6.67 4.81 -1.26 -4.78 118.16 114.87 2k9q n LYS 69 Ca 0.04 2.72 -0.03 0.00 -0.87 0.00 0.00 58.31 60.18 2k9q n LYS 69 Cb 0.06 -3.26 0.18 0.00 0.02 0.00 0.00 35.03 32.03 2k9q n LYS 69 CO 0.00 0.00 0.00 -0.07 1.17 0.00 0.00 177.40 178.50 2k9q h LEU 70 N 4.10 0.82 0.00 3.14 3.38 -1.96 -3.45 115.31 121.35 2k9q h LEU 70 Ca 0.00 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.84 2k9q h LEU 70 Cb 0.00 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.54 2k9q h LEU 70 CO 0.00 0.77 0.00 1.21 0.09 0.00 0.00 178.44 180.51 2k9q n GLU 71 N -4.29 0.00 -2.73 1.13 4.07 -1.26 -4.93 120.64 112.64 2k9q n GLU 71 Ca 0.05 0.00 -0.38 0.00 -0.06 0.00 0.00 57.16 56.77 2k9q n GLU 71 Cb 0.21 -3.61 -0.06 0.00 -0.06 0.00 0.00 31.44 27.91 2k9q n GLU 71 CO 0.00 0.00 0.00 -1.58 -0.06 0.00 0.00 177.13 175.49 2k9q s HIS 72 N -1.76 3.69 0.21 4.31 5.65 -1.26 -5.05 115.29 121.09 2k9q s HIS 72 Ca 0.00 1.79 -0.20 0.00 0.25 0.00 0.00 55.06 56.90 2k9q s HIS 72 Cb 0.00 -2.98 0.03 0.00 -1.18 0.00 0.00 32.58 28.45 2k9q s HIS 72 CO 0.00 0.11 0.60 -3.38 -0.65 0.00 0.00 174.74 171.42 2k9q s HIS 73 N -1.50 -0.22 -0.27 3.88 -3.43 -1.26 -5.14 115.29 107.34 2k9q s HIS 73 Ca 0.49 -0.12 -0.03 0.00 -0.80 0.00 0.00 55.06 54.60 2k9q s HIS 73 Cb -0.21 0.52 0.03 0.00 -1.43 0.00 0.00 32.58 31.48 2k9q s HIS 73 CO 0.27 -1.00 -0.01 -1.01 -2.00 0.00 0.00 174.74 170.99 2k9q s HIS 74 N -3.86 3.14 0.00 0.38 3.76 -1.26 -5.04 115.29 112.40 2k9q s HIS 74 Ca 0.08 -1.52 0.00 0.00 -0.15 0.00 0.00 55.06 53.47 2k9q s HIS 74 Cb -0.02 -2.11 0.00 0.00 1.11 0.00 0.00 32.58 31.55 2k9q s HIS 74 CO -0.02 -0.72 0.00 0.72 -0.85 0.00 0.00 174.74 173.87 2k9q n HIS 75 N 4.70 0.00 -4.19 1.40 8.25 -1.26 -4.72 115.22 119.39 2k9q n HIS 75 Ca -0.15 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.19 2k9q n HIS 75 Cb 0.46 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.47 2k9q n HIS 75 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2k9q s HIS 76 N 0.00 1.03 -0.06 4.41 0.09 -1.26 -5.25 115.29 114.25 2k9q s HIS 76 Ca 0.00 -0.83 0.00 0.00 -0.00 0.00 0.00 55.06 54.23 2k9q s HIS 76 Cb 0.00 -0.56 0.00 0.00 -0.00 0.00 0.00 32.58 32.02 2k9q s HIS 76 CO 0.00 -0.06 0.01 -2.39 -0.00 0.00 0.00 174.74 172.31