#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 0.09 0.11 2.12 1.02 -1.26 -4.73 120.64 117.99 2k9q n GLU 2 Ca 0.00 -0.26 -0.13 0.00 -0.02 0.00 0.00 57.16 56.75 2k9q n GLU 2 Cb 0.00 -0.13 -0.08 0.00 -0.02 0.00 0.00 31.44 31.22 2k9q n GLU 2 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2k9q h LEU 3 N 0.00 -0.19 -0.98 -4.62 7.12 -1.99 -1.61 115.31 113.04 2k9q h LEU 3 Ca -0.04 -0.05 -0.10 0.00 0.13 0.00 0.00 57.88 57.82 2k9q h LEU 3 Cb 0.13 0.05 -0.01 0.00 -0.53 0.00 0.00 40.66 40.30 2k9q h LEU 3 CO 0.04 -0.07 -0.37 0.77 -0.13 0.00 0.00 178.44 178.67 2k9q h SER 4 N -0.28 0.28 -0.56 1.25 4.64 -1.82 -2.73 113.55 114.32 2k9q h SER 4 Ca -0.02 -0.11 -0.03 0.00 -0.47 0.00 0.00 61.79 61.15 2k9q h SER 4 Cb 0.22 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 62.21 2k9q h SER 4 CO 0.04 0.63 0.21 -1.13 -0.87 0.00 0.00 176.83 175.71 2k9q h ASN 5 N 0.23 0.78 -0.49 4.97 -1.24 -1.80 -1.28 115.58 116.75 2k9q h ASN 5 Ca 0.03 -0.18 -0.09 0.00 0.71 0.00 0.00 56.30 56.77 2k9q h ASN 5 Cb 0.76 -0.20 -0.02 0.00 0.73 0.00 0.00 38.32 39.59 2k9q h ASN 5 CO 0.06 0.75 -0.04 -0.33 -1.29 0.00 0.00 177.43 176.58 2k9q h GLU 6 N 0.77 0.93 -0.74 6.67 5.08 -1.18 -2.59 114.58 123.52 2k9q h GLU 6 Ca 0.19 -0.29 -0.04 0.00 -1.00 0.00 0.00 59.36 58.21 2k9q h GLU 6 Cb 0.22 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.35 2k9q h GLU 6 CO -0.01 0.94 0.32 1.25 -1.00 0.00 0.00 179.01 180.51 2k9q h LEU 7 N 0.85 1.01 -0.97 1.33 5.85 -1.16 -2.45 115.31 119.78 2k9q h LEU 7 Ca 0.15 -0.16 -0.06 0.00 0.84 0.00 0.00 57.88 58.66 2k9q h LEU 7 Cb 0.55 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.30 2k9q h LEU 7 CO 0.03 0.89 0.13 0.11 -0.34 0.00 0.00 178.44 179.27 2k9q h LYS 8 N 1.06 0.89 -0.49 1.25 1.57 -0.98 -1.91 116.57 117.94 2k9q h LYS 8 Ca 0.25 -0.19 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 2k9q h LYS 8 Cb 0.18 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 2k9q h LYS 8 CO -0.02 0.80 0.32 0.28 -0.57 0.00 0.00 179.45 180.25 2k9q h VAL 9 N 0.85 1.14 -0.49 0.50 2.07 -1.07 -0.28 116.25 118.97 2k9q h VAL 9 Ca 0.18 -0.28 -0.11 0.00 0.82 0.00 0.00 66.70 67.32 2k9q h VAL 9 Cb 0.32 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.50 2k9q h VAL 9 CO -0.00 0.14 -0.13 -0.33 0.02 0.00 0.00 177.57 177.26 2k9q h GLU 10 N 0.67 0.93 -0.52 1.57 3.07 -1.23 0.34 114.58 119.40 2k9q h GLU 10 Ca 0.18 -0.34 0.02 0.00 -0.50 0.00 0.00 59.36 58.72 2k9q h GLU 10 Cb -0.05 -0.06 -0.03 0.00 -0.84 0.00 0.00 28.75 27.77 2k9q h GLU 10 CO -0.04 1.00 0.32 -0.09 -1.40 0.00 0.00 179.01 178.80 2k9q h ARG 11 N 0.82 0.61 -0.37 2.33 2.43 -0.86 0.16 114.38 119.51 2k9q h ARG 11 Ca 0.13 -0.04 -0.11 0.00 -0.81 0.00 0.00 59.98 59.15 2k9q h ARG 11 Cb 0.67 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.07 2k9q h ARG 11 CO 0.05 0.40 -0.21 0.82 -1.51 0.00 0.00 179.97 179.53 2k9q h ILE 12 N 0.63 1.28 -0.66 1.20 2.04 -0.70 0.58 117.51 121.88 2k9q h ILE 12 Ca 0.21 -1.35 0.03 0.00 1.00 0.00 0.00 64.86 64.75 2k9q h ILE 12 Cb 0.01 1.34 -0.04 0.00 -0.74 0.00 0.00 36.82 37.39 2k9q h ILE 12 CO -0.09 0.45 0.40 -0.09 0.00 0.00 0.00 178.15 178.82 2k9q h ARG 13 N 0.60 0.76 -0.01 2.37 2.43 0.33 -1.12 114.38 119.74 2k9q h ARG 13 Ca 0.08 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 2k9q h ARG 13 Cb 0.76 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.14 2k9q h ARG 13 CO 0.06 0.51 -0.22 1.28 -1.51 0.00 0.00 179.97 180.09 2k9q n LEU 14 N -4.71 1.37 -3.78 3.80 4.77 -0.02 -4.98 117.00 113.46 2k9q n LEU 14 Ca 0.07 -0.42 -0.26 0.00 -0.03 0.00 0.00 56.01 55.37 2k9q n LEU 14 Cb 0.09 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 2k9q n LEU 14 CO 0.32 0.25 -0.26 -0.24 -1.33 0.00 0.00 177.39 176.13 2k9q n SER 15 N -0.28 -4.78 -4.70 -1.43 2.88 0.20 -4.92 113.62 100.59 2k9q n SER 15 Ca 0.13 -0.93 -0.35 0.00 -1.33 0.00 0.00 58.87 56.39 2k9q n SER 15 Cb 0.38 -1.58 -0.09 0.00 -0.75 0.00 0.00 64.21 62.18 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 -4.81 3.88 0.24 2.46 1.43 -1.04 -5.03 118.68 115.81 2k9q s LEU 16 Ca 0.02 0.19 -0.30 0.00 -1.03 0.00 0.00 54.13 53.01 2k9q s LEU 16 Cb -0.00 -1.95 -0.09 0.00 0.03 0.00 0.00 46.19 44.18 2k9q s LEU 16 CO 0.89 0.28 1.10 0.42 0.23 0.00 0.00 176.35 179.27 2k9q s THR 17 N -0.28 3.62 0.26 5.49 -4.23 -1.26 -4.93 115.64 114.30 2k9q s THR 17 Ca 0.08 1.54 -0.02 0.00 -1.18 0.00 0.00 61.69 62.11 2k9q s THR 17 Cb -0.12 -3.98 0.12 0.00 1.34 0.00 0.00 72.50 69.86 2k9q s THR 17 CO 0.02 0.33 1.77 0.00 -0.54 0.00 0.00 174.62 176.20 2k9q h ALA 18 N 4.29 1.12 -0.54 3.99 0.00 -1.99 -2.72 119.26 123.40 2k9q h ALA 18 Ca -0.46 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.18 2k9q h ALA 18 Cb 1.21 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 2k9q h ALA 18 CO 0.69 0.57 0.24 -0.22 0.00 0.00 0.00 179.25 180.53 2k9q h LYS 19 N 0.79 0.80 0.03 0.00 3.64 -1.97 0.38 116.57 120.23 2k9q h LYS 19 Ca 0.16 -0.13 -0.00 0.00 -1.27 0.00 0.00 60.65 59.41 2k9q h LYS 19 Cb 0.40 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.08 2k9q h LYS 19 CO 0.01 0.67 -0.01 0.66 -2.27 0.00 0.00 179.45 178.51 2k9q h SER 20 N 0.73 -0.03 -0.30 4.20 4.64 -1.89 0.11 113.55 121.02 2k9q h SER 20 Ca 0.18 -0.01 -0.11 0.00 -0.47 0.00 0.00 61.79 61.38 2k9q h SER 20 Cb 0.15 0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 62.25 2k9q h SER 20 CO -0.02 -0.01 -0.26 0.58 -0.87 0.00 0.00 176.83 176.25 2k9q h VAL 21 N -0.05 1.30 -0.29 0.95 2.07 -1.37 -1.79 116.25 117.06 2k9q h VAL 21 Ca -0.00 -1.42 0.01 0.00 0.82 0.00 0.00 66.70 66.11 2k9q h VAL 21 Cb 0.04 1.55 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 2k9q h VAL 21 CO 0.01 0.46 0.17 0.00 0.02 0.00 0.00 177.57 178.22 2k9q h ALA 22 N 0.72 0.36 -0.47 1.67 0.00 -0.07 0.22 119.26 121.68 2k9q h ALA 22 Ca 0.05 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.83 2k9q h ALA 22 Cb 0.83 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2k9q h ALA 22 CO 0.07 -0.21 -0.20 1.49 0.00 0.00 0.00 179.25 180.40 2k9q h GLU 23 N 0.35 0.94 -0.46 0.00 4.81 -0.78 -0.42 114.58 119.02 2k9q h GLU 23 Ca 0.12 -0.38 -0.10 0.00 -0.13 0.00 0.00 59.36 58.87 2k9q h GLU 23 Cb 0.00 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.33 2k9q h GLU 23 CO -0.06 1.04 -0.09 1.49 -0.73 0.00 0.00 179.01 180.66 2k9q h GLU 24 N 0.81 0.87 -0.49 1.92 4.22 -0.97 -2.95 114.58 118.00 2k9q h GLU 24 Ca 0.11 -0.32 -0.09 0.00 0.08 0.00 0.00 59.36 59.14 2k9q h GLU 24 Cb 0.75 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.93 2k9q h GLU 24 CO 0.06 0.96 -0.06 0.52 -2.18 0.00 0.00 179.01 178.31 2k9q h MET 25 N 0.71 0.85 0.00 1.92 2.86 -0.48 -3.47 114.93 117.33 2k9q h MET 25 Ca 0.12 -0.27 0.00 0.00 -2.06 0.00 0.00 59.70 57.49 2k9q h MET 25 Cb 0.63 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.21 2k9q h MET 25 CO 0.04 0.89 0.00 0.41 1.06 0.00 0.00 176.91 179.31 2k9q n GLY 26 N -0.48 1.35 3.43 8.32 0.00 -0.54 -5.08 105.19 112.19 2k9q n GLY 26 Ca 0.02 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.83 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 1.56 0.68 -0.61 -4.36 -0.28 -4.68 121.20 111.52 2k9q s ILE 27 Ca 0.00 -2.10 -0.05 0.00 -0.26 0.00 0.00 60.65 58.24 2k9q s ILE 27 Cb 0.00 -2.48 0.07 0.00 1.25 0.00 0.00 42.46 41.30 2k9q s ILE 27 CO 0.00 -0.27 0.97 -0.44 0.24 0.00 0.00 174.94 175.44 2k9q s SER 28 N -3.44 4.79 0.32 4.36 0.01 -1.26 -3.64 113.70 114.84 2k9q s SER 28 Ca 0.30 0.27 0.02 0.00 1.31 0.00 0.00 55.95 57.84 2k9q s SER 28 Cb 0.04 -0.91 0.55 0.00 0.21 0.00 0.00 66.02 65.91 2k9q s SER 28 CO 0.12 -1.58 1.92 0.03 0.41 0.00 0.00 173.24 174.14 2k9q h ARG 29 N -0.49 0.76 -0.65 12.44 3.08 -1.92 -2.59 114.38 125.01 2k9q h ARG 29 Ca -0.43 -0.11 0.13 0.00 0.07 0.00 0.00 59.98 59.64 2k9q h ARG 29 Cb 1.30 -0.14 -0.12 0.00 0.08 0.00 0.00 29.97 31.09 2k9q h ARG 29 CO 0.56 0.61 -0.21 0.37 -1.07 0.00 0.00 179.97 180.23 2k9q h GLN 30 N 0.75 -0.04 -0.21 0.04 5.75 -1.99 0.57 115.11 119.97 2k9q h GLN 30 Ca 0.18 0.00 -0.17 0.00 -0.15 0.00 0.00 58.65 58.52 2k9q h GLN 30 Cb 0.13 0.01 -0.00 0.00 1.07 0.00 0.00 27.48 28.69 2k9q h GLN 30 CO -0.02 -0.03 -0.55 1.96 -2.65 0.00 0.00 178.83 177.54 2k9q h GLN 31 N -0.05 0.63 -0.58 1.69 4.20 -1.89 -2.41 115.11 116.70 2k9q h GLN 31 Ca 0.30 -0.40 -0.02 0.00 0.06 0.00 0.00 58.65 58.59 2k9q h GLN 31 Cb 0.51 0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.31 2k9q h GLN 31 CO -0.69 1.01 0.29 1.25 -0.67 0.00 0.00 178.83 180.02 2k9q h LEU 32 N 0.48 0.75 -0.69 1.46 5.85 -0.36 -1.77 115.31 121.03 2k9q h LEU 32 Ca 0.01 -0.12 -0.13 0.00 0.84 0.00 0.00 57.88 58.48 2k9q h LEU 32 Cb 1.11 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.93 2k9q h LEU 32 CO 0.11 0.66 -0.37 0.00 -0.34 0.00 0.00 178.44 178.50 2k9q h ASN 34 N 0.49 0.95 -0.58 0.00 -0.26 -1.02 -2.65 115.58 112.51 2k9q h ASN 34 Ca 0.05 -0.18 -0.02 0.00 -0.56 0.00 0.00 56.30 55.58 2k9q h ASN 34 Cb 0.87 -0.25 -0.03 0.00 -1.06 0.00 0.00 38.32 37.85 2k9q h ASN 34 CO 0.07 0.91 0.27 0.40 -1.06 0.00 0.00 177.43 178.03 2k9q h ILE 35 N 0.96 1.21 -0.49 2.81 2.04 -1.20 -2.19 117.51 120.65 2k9q h ILE 35 Ca 0.21 -0.61 -0.01 0.00 1.00 0.00 0.00 64.86 65.45 2k9q h ILE 35 Cb 0.33 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 36.92 2k9q h ILE 35 CO -0.00 0.24 0.25 -0.08 0.00 0.00 0.00 178.15 178.56 2k9q h GLU 36 N 0.79 0.68 -0.92 2.37 4.81 -1.42 -0.02 114.58 120.87 2k9q h GLU 36 Ca 0.20 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 2k9q h GLU 36 Cb 0.13 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.38 2k9q h GLU 36 CO -0.02 0.52 0.00 1.04 -0.73 0.00 0.00 179.01 179.82 2k9q n GLN 37 N -4.39 1.27 0.00 1.92 6.02 -0.83 -3.61 117.38 117.75 2k9q n GLN 37 Ca 0.04 -0.22 0.15 0.00 -0.01 0.00 0.00 57.00 56.96 2k9q n GLN 37 Cb 0.11 -1.53 0.76 0.00 1.02 0.00 0.00 30.24 30.61 2k9q n GLN 37 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 2k9q n SER 38 N 0.02 0.00 0.00 1.08 7.64 -0.02 -4.89 113.62 117.45 2k9q n SER 38 Ca 0.02 -0.16 0.00 0.00 1.01 0.00 0.00 58.87 59.74 2k9q n SER 38 Cb 0.30 -0.28 0.00 0.00 -1.01 0.00 0.00 64.21 63.22 2k9q n SER 38 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2k9q n GLU 39 N -1.28 0.00 -3.13 1.43 -0.58 -1.24 -4.57 120.64 111.28 2k9q n GLU 39 Ca 0.14 0.00 -0.21 0.00 -0.42 0.00 0.00 57.16 56.68 2k9q n GLU 39 Cb 0.24 0.00 0.01 0.00 -0.57 0.00 0.00 31.44 31.12 2k9q n GLU 39 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 2k9q s THR 40 N 0.00 3.82 0.43 2.62 -4.23 -1.26 -2.52 115.64 114.50 2k9q s THR 40 Ca 0.00 -0.73 -0.02 0.00 -1.18 0.00 0.00 61.69 59.77 2k9q s THR 40 Cb 0.00 -3.37 -0.02 0.00 1.34 0.00 0.00 72.50 70.44 2k9q s THR 40 CO 0.00 -0.21 0.67 0.00 -0.54 0.00 0.00 174.62 174.54 2k9q s ALA 41 N -2.43 3.59 0.51 3.99 0.00 -1.26 -4.96 121.76 121.20 2k9q s ALA 41 Ca 0.48 -0.81 -0.20 0.00 0.00 0.00 0.00 51.96 51.44 2k9q s ALA 41 Cb -0.10 -2.29 -0.07 0.00 0.00 0.00 0.00 23.12 20.65 2k9q s ALA 41 CO 0.35 -0.26 1.07 -2.14 0.00 0.00 0.00 175.76 174.79 2k9q s PRO 42 N -4.55 3.62 0.58 0.00 0.02 -1.26 -4.93 135.00 128.48 2k9q s PRO 42 Ca 0.45 1.45 0.36 0.00 0.02 0.00 0.00 61.00 63.28 2k9q s PRO 42 Cb -0.10 -2.06 1.64 0.00 0.02 0.00 0.00 34.50 34.00 2k9q s PRO 42 CO 0.40 -0.60 2.09 -0.39 -0.33 0.00 0.00 177.00 178.17 2k9q h VAL 43 N 1.39 0.08 -0.55 3.83 -1.51 -2.00 -2.66 116.25 114.83 2k9q h VAL 43 Ca -0.50 -0.41 -0.06 0.00 -1.23 0.00 0.00 66.70 64.51 2k9q h VAL 43 Cb 1.24 1.37 -0.02 0.00 -2.13 0.00 0.00 31.29 31.75 2k9q h VAL 43 CO 0.58 0.02 0.13 0.58 -1.23 0.00 0.00 177.57 177.65 2k9q h VAL 44 N 0.00 1.25 -0.49 7.19 2.07 -1.99 0.10 116.25 124.38 2k9q h VAL 44 Ca -0.00 -0.89 0.00 0.00 0.82 0.00 0.00 66.70 66.64 2k9q h VAL 44 Cb 0.37 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 2k9q h VAL 44 CO 0.00 0.33 0.32 0.58 0.02 0.00 0.00 177.57 178.82 2k9q h VAL 45 N 0.79 1.13 -0.41 2.57 2.07 -1.86 -1.36 116.25 119.17 2k9q h VAL 45 Ca 0.17 -0.24 -0.09 0.00 0.82 0.00 0.00 66.70 67.36 2k9q h VAL 45 Cb 0.35 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.51 2k9q h VAL 45 CO 0.00 0.13 -0.12 0.11 0.02 0.00 0.00 177.57 177.71 2k9q h LYS 46 N 0.67 0.73 0.36 1.57 1.57 -1.55 -0.46 116.57 119.45 2k9q h LYS 46 Ca 0.18 -0.24 -0.02 0.00 -1.87 0.00 0.00 60.65 58.70 2k9q h LYS 46 Cb -0.07 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.18 2k9q h LYS 46 CO -0.04 0.83 -0.17 -0.92 -0.57 0.00 0.00 179.45 178.58 2k9q h TYR 47 N 0.66 -0.44 0.00 -1.35 3.20 -0.21 0.25 116.97 119.09 2k9q h TYR 47 Ca 0.11 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.91 2k9q h TYR 47 Cb 0.58 0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.99 2k9q h TYR 47 CO 0.03 -0.26 -0.30 -0.84 -1.64 0.00 0.00 178.16 175.14 2k9q h ILE 48 N -0.50 1.07 -0.43 1.81 3.07 -1.22 -2.24 117.51 119.08 2k9q h ILE 48 Ca -0.05 -1.09 -0.09 0.00 1.55 0.00 0.00 64.86 65.18 2k9q h ILE 48 Cb 0.38 1.61 -0.02 0.00 -0.27 0.00 0.00 36.82 38.52 2k9q h ILE 48 CO 0.08 0.30 -0.11 0.00 -1.05 0.00 0.00 178.15 177.36 2k9q h ALA 49 N 1.70 1.00 -0.42 0.16 0.00 -0.52 -0.67 119.26 120.51 2k9q h ALA 49 Ca -0.00 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 2k9q h ALA 49 Cb 0.59 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 2k9q h ALA 49 CO 0.04 0.60 0.23 0.35 0.00 0.00 0.00 179.25 180.46 2k9q h PHE 50 N 0.70 0.58 -0.65 0.00 3.57 -0.35 0.18 116.94 120.96 2k9q h PHE 50 Ca 0.12 -0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.55 2k9q h PHE 50 Cb 0.59 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 39.12 2k9q h PHE 50 CO 0.03 0.45 0.19 -0.07 -2.23 0.00 0.00 178.31 176.68 2k9q h LEU 51 N 0.54 0.93 -0.82 0.59 3.38 -1.31 -2.31 115.31 116.31 2k9q h LEU 51 Ca 0.15 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 2k9q h LEU 51 Cb 0.06 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.53 2k9q h LEU 51 CO -0.02 0.88 0.43 -0.09 0.09 0.00 0.00 178.44 179.72 2k9q h ARG 52 N 0.96 1.16 0.00 1.13 2.43 -0.37 -0.97 114.38 118.72 2k9q h ARG 52 Ca 0.21 -0.15 -0.00 0.00 -0.81 0.00 0.00 59.98 59.23 2k9q h ARG 52 Cb 0.29 -0.22 -0.00 0.00 -0.42 0.00 0.00 29.97 29.62 2k9q h ARG 52 CO -0.01 0.87 -0.02 0.66 -1.51 0.00 0.00 179.97 179.97 2k9q h SER 53 N 1.16 0.00 -0.11 -3.80 4.64 -0.42 0.17 113.55 115.19 2k9q h SER 53 Ca 0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.61 2k9q h SER 53 Cb 0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 2k9q h SER 53 CO -0.04 0.02 0.00 0.29 -0.87 0.00 0.00 176.83 176.23 2k9q n LYS 54 N -3.28 1.33 -0.85 4.77 4.76 -0.40 -4.84 118.16 119.66 2k9q n LYS 54 Ca -0.02 -0.51 0.00 0.00 -2.87 0.00 0.00 58.31 54.91 2k9q n LYS 54 Cb 0.14 -1.24 0.00 0.00 -1.84 0.00 0.00 35.03 32.08 2k9q n LYS 54 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2k9q n GLY 55 N 0.85 0.54 3.74 0.72 0.00 0.61 -5.01 105.19 106.64 2k9q n GLY 55 Ca 0.11 -0.29 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 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 2.99 -1.18 1.61 1.01 -1.03 -4.86 120.40 116.94 2k9q s VAL 56 Ca 0.00 0.81 -0.22 0.00 0.00 0.00 0.00 61.98 62.56 2k9q s VAL 56 Cb 0.00 -3.52 -0.09 0.00 0.00 0.00 0.00 36.38 32.78 2k9q s VAL 56 CO 0.00 0.12 1.93 -0.67 0.00 0.00 0.00 175.10 176.47 2k9q n ASP 57 N 2.71 3.12 -0.03 3.32 2.03 -1.26 -4.56 116.55 121.87 2k9q n ASP 57 Ca 0.07 -2.71 -0.13 0.00 0.52 0.00 0.00 54.79 52.55 2k9q n ASP 57 Cb 0.42 -1.72 -0.14 0.00 -0.72 0.00 0.00 41.12 38.96 2k9q n ASP 57 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 2k9q n LEU 58 N 13.95 1.37 -0.07 -2.67 7.94 -1.26 -3.43 117.00 132.82 2k9q n LEU 58 Ca 0.45 0.26 -0.10 0.00 -1.11 0.00 0.00 56.01 55.51 2k9q n LEU 58 Cb 0.46 -0.20 -0.03 0.00 0.53 0.00 0.00 43.42 44.18 2k9q n LEU 58 CO 0.70 0.57 0.90 -0.55 -1.11 0.00 0.00 177.39 177.90 2k9q h ASN 59 N 0.02 0.33 0.05 1.96 7.08 -2.01 -2.21 115.58 120.81 2k9q h ASN 59 Ca -0.38 -0.12 -0.12 0.00 -3.08 0.00 0.00 56.30 52.59 2k9q h ASN 59 Cb 2.05 -0.09 -0.01 0.00 -2.08 0.00 0.00 38.32 38.19 2k9q h ASN 59 CO 0.06 0.36 -0.41 0.00 -2.08 0.00 0.00 177.43 175.36 2k9q h ALA 60 N 0.98 0.93 -0.57 4.14 0.00 -1.95 -1.73 119.26 121.06 2k9q h ALA 60 Ca 0.09 -0.43 0.02 0.00 0.00 0.00 0.00 54.91 54.59 2k9q h ALA 60 Cb 0.12 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 2k9q h ALA 60 CO -0.01 0.63 0.36 1.25 0.00 0.00 0.00 179.25 181.47 2k9q h LEU 61 N 0.38 0.59 0.01 0.00 6.46 -1.51 -2.82 115.31 118.42 2k9q h LEU 61 Ca 0.03 -0.00 -0.00 0.00 -0.12 0.00 0.00 57.88 57.79 2k9q h LEU 61 Cb 0.88 -0.13 0.00 0.00 -0.73 0.00 0.00 40.66 40.68 2k9q h LEU 61 CO 0.07 0.41 -0.01 -0.26 -0.62 0.00 0.00 178.44 178.04 2k9q h PHE 62 N 0.71 -0.02 -1.22 1.25 -1.00 -1.30 -3.13 116.94 112.24 2k9q h PHE 62 Ca 0.23 -0.00 0.43 0.00 2.81 0.00 0.00 57.97 61.44 2k9q h PHE 62 Cb -0.00 0.01 -0.15 0.00 3.61 0.00 0.00 35.95 39.41 2k9q h PHE 62 CO -0.05 0.62 0.75 0.22 -1.61 0.00 0.00 178.31 178.24 2k9q h ASP 63 N -0.67 0.28 1.32 2.17 1.82 -1.16 1.74 116.42 121.90 2k9q h ASP 63 Ca -0.00 0.18 -0.12 0.00 -0.39 0.00 0.00 57.03 56.70 2k9q h ASP 63 Cb 0.65 0.18 -0.02 0.00 0.68 0.00 0.00 39.33 40.81 2k9q h ASP 63 CO 0.00 -0.27 -0.71 0.08 -1.61 0.00 0.00 179.24 176.73 2k9q h ARG 64 N 0.06 0.00 -0.37 0.28 0.11 -1.54 -3.27 114.38 109.65 2k9q h ARG 64 Ca 0.84 0.00 -0.09 0.00 0.10 0.00 0.00 59.98 60.82 2k9q h ARG 64 Cb 2.47 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 33.54 2k9q h ARG 64 CO -0.55 0.45 -0.14 0.82 0.10 0.00 0.00 179.97 180.65 2k9q h ILE 65 N 0.00 1.28 0.00 0.08 1.08 0.26 -2.50 117.51 117.71 2k9q h ILE 65 Ca -0.04 -1.24 0.00 0.00 -0.39 0.00 0.00 64.86 63.19 2k9q h ILE 65 Cb 1.42 1.31 0.00 0.00 -3.07 0.00 0.00 36.82 36.48 2k9q h ILE 65 CO 0.06 0.41 0.00 2.30 -0.69 0.00 0.00 178.15 180.23 2k9q n ILE 66 N -4.33 0.86 -1.57 -0.67 -5.35 -0.60 -4.82 119.36 102.89 2k9q n ILE 66 Ca -0.02 0.21 -0.47 0.00 -0.27 0.00 0.00 62.75 62.20 2k9q n ILE 66 Cb 0.38 -0.97 -0.03 0.00 -1.74 0.00 0.00 39.64 37.29 2k9q n ILE 66 CO 0.00 0.00 0.00 0.55 -1.76 0.00 0.00 176.55 175.34 2k9q n VAL 67 N -1.66 1.56 -2.00 7.28 3.14 -0.94 -4.61 118.33 121.10 2k9q n VAL 67 Ca 0.04 -0.39 0.04 0.00 -2.96 0.00 0.00 64.34 61.07 2k9q n VAL 67 Cb 0.20 -0.84 -0.01 0.00 -1.06 0.00 0.00 33.84 32.13 2k9q n VAL 67 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 2k9q n ASN 68 N 1.61 -3.86 0.00 6.55 3.02 -1.26 -4.97 115.26 116.34 2k9q n ASN 68 Ca 0.13 0.33 0.00 0.00 -0.03 0.00 0.00 54.58 55.01 2k9q n ASN 68 Cb 0.28 -1.02 0.00 0.00 -0.61 0.00 0.00 39.78 38.43 2k9q n ASN 68 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 2k9q n LYS 69 N -1.67 0.00 -0.45 3.52 4.81 -1.26 -4.93 118.16 118.17 2k9q n LYS 69 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2k9q n LYS 69 Cb 0.14 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.19 2k9q n LYS 69 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 2k9q n LEU 70 N 0.00 0.59 -4.79 3.14 4.77 -1.26 -4.86 117.00 114.59 2k9q n LEU 70 Ca 0.00 0.00 -0.36 0.00 -0.03 0.00 0.00 56.01 55.62 2k9q n LEU 70 Cb 0.00 -1.30 -0.08 0.00 -2.33 0.00 0.00 43.42 39.71 2k9q n LEU 70 CO 0.00 -0.45 -0.22 -0.70 -1.33 0.00 0.00 177.39 174.69 2k9q s GLU 71 N -0.90 3.39 -0.14 3.23 2.56 -1.26 -5.09 118.70 120.49 2k9q s GLU 71 Ca 0.00 -0.24 -0.12 0.00 0.00 0.00 0.00 54.97 54.61 2k9q s GLU 71 Cb 0.00 -3.08 0.04 0.00 2.00 0.00 0.00 34.13 33.09 2k9q s GLU 71 CO 0.00 0.68 0.37 -3.38 -0.56 0.00 0.00 175.26 172.37 2k9q s HIS 72 N -0.77 -0.44 0.82 5.30 -3.43 -1.26 -5.04 115.29 110.48 2k9q s HIS 72 Ca 0.13 1.04 -0.10 0.00 -0.80 0.00 0.00 55.06 55.32 2k9q s HIS 72 Cb -0.12 0.16 0.09 0.00 -1.43 0.00 0.00 32.58 31.28 2k9q s HIS 72 CO 0.03 -0.22 1.11 -1.01 -2.00 0.00 0.00 174.74 172.65 2k9q s HIS 73 N 0.44 2.22 -0.71 0.38 0.09 -1.26 -4.92 115.29 111.52 2k9q s HIS 73 Ca -0.02 1.65 -0.02 0.00 -0.00 0.00 0.00 55.06 56.66 2k9q s HIS 73 Cb -0.04 -3.16 0.33 0.00 -0.00 0.00 0.00 32.58 29.71 2k9q s HIS 73 CO -0.02 -2.18 2.13 1.58 -0.00 0.00 0.00 174.74 176.25 2k9q n HIS 74 N -3.77 2.77 -3.33 1.40 -0.00 -1.26 -4.86 115.22 106.17 2k9q n HIS 74 Ca 0.10 -2.46 -0.10 0.00 0.46 0.00 0.00 57.72 55.73 2k9q n HIS 74 Cb 0.53 -1.28 0.00 0.00 -0.12 0.00 0.00 29.99 29.12 2k9q n HIS 74 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38 2k9q n HIS 75 N -0.40 -2.65 -3.82 1.57 -0.00 -1.26 -5.02 115.22 103.64 2k9q n HIS 75 Ca 0.54 1.03 -0.12 0.00 0.46 0.00 0.00 57.72 59.64 2k9q n HIS 75 Cb 0.42 -3.60 -0.10 0.00 -0.12 0.00 0.00 29.99 26.59 2k9q n HIS 75 CO 0.00 0.00 0.00 -1.58 0.46 0.00 0.00 176.34 175.22 2k9q s HIS 76 N -2.97 -0.11 -1.45 1.57 5.04 -1.26 -5.32 115.29 110.80 2k9q s HIS 76 Ca 0.01 0.20 0.00 0.00 -1.54 0.00 0.00 55.06 53.73 2k9q s HIS 76 Cb -0.00 0.03 0.00 0.00 0.04 0.00 0.00 32.58 32.65 2k9q s HIS 76 CO 0.81 -0.27 0.36 0.72 -2.34 0.00 0.00 174.74 174.02