#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 0.00 -0.43 0.03 0.28 -1.26 -4.84 120.64 114.42 2k9q n GLU 2 Ca 0.00 0.00 0.36 0.00 -0.16 0.00 0.00 57.16 57.36 2k9q n GLU 2 Cb 0.00 0.00 0.64 0.00 1.43 0.00 0.00 31.44 33.51 2k9q n GLU 2 CO 0.00 0.00 0.00 1.25 -0.16 0.00 0.00 177.13 178.22 2k9q h LEU 3 N 0.00 0.26 0.01 -1.84 5.85 -1.96 1.66 115.31 119.29 2k9q h LEU 3 Ca 0.00 0.16 -0.24 0.00 0.84 0.00 0.00 57.88 58.64 2k9q h LEU 3 Cb 0.00 0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 2k9q h LEU 3 CO 0.00 -0.23 -1.09 0.28 -0.34 0.00 0.00 178.44 177.06 2k9q h SER 4 N 0.07 0.23 -0.22 1.25 0.02 -1.93 -2.85 113.55 110.13 2k9q h SER 4 Ca 0.83 -0.24 -0.02 0.00 -0.84 0.00 0.00 61.79 61.53 2k9q h SER 4 Cb 2.53 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 64.99 2k9q h SER 4 CO -0.49 1.16 0.08 -1.13 -1.14 0.00 0.00 176.83 175.31 2k9q h ASN 5 N 0.05 0.31 -0.27 3.07 -0.73 0.21 0.55 115.58 118.77 2k9q h ASN 5 Ca -0.07 -0.18 -0.06 0.00 1.87 0.00 0.00 56.30 57.85 2k9q h ASN 5 Cb 1.82 -0.08 -0.01 0.00 0.27 0.00 0.00 38.32 40.32 2k9q h ASN 5 CO 0.16 0.41 -0.07 1.05 -0.37 0.00 0.00 177.43 178.62 2k9q h GLU 6 N 0.20 0.53 -0.31 6.67 4.11 -1.40 0.29 114.58 124.66 2k9q h GLU 6 Ca 0.07 -0.20 -0.03 0.00 0.07 0.00 0.00 59.36 59.27 2k9q h GLU 6 Cb 0.20 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 2k9q h GLU 6 CO -0.00 0.74 0.07 -0.07 0.07 0.00 0.00 179.01 179.82 2k9q h LEU 7 N 0.28 0.48 -0.94 3.06 3.38 -1.37 -2.52 115.31 117.68 2k9q h LEU 7 Ca 0.07 -0.24 -0.08 0.00 0.09 0.00 0.00 57.88 57.73 2k9q h LEU 7 Cb 0.54 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 2k9q h LEU 7 CO 0.03 0.59 -0.05 0.50 0.09 0.00 0.00 178.44 179.60 2k9q h LYS 8 N 0.35 0.71 -0.63 1.13 3.64 0.15 -2.78 116.57 119.14 2k9q h LYS 8 Ca 0.10 -0.20 -0.01 0.00 -1.27 0.00 0.00 60.65 59.26 2k9q h LYS 8 Cb 0.30 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.02 2k9q h LYS 8 CO 0.00 0.76 0.34 0.28 -2.27 0.00 0.00 179.45 178.57 2k9q h VAL 9 N 0.66 1.20 -0.57 2.00 2.07 -0.73 -2.06 116.25 118.83 2k9q h VAL 9 Ca 0.12 -0.51 -0.03 0.00 0.82 0.00 0.00 66.70 67.11 2k9q h VAL 9 Cb 0.49 0.39 -0.03 0.00 -1.52 0.00 0.00 31.29 30.63 2k9q h VAL 9 CO 0.03 0.22 0.24 -0.33 0.02 0.00 0.00 177.57 177.75 2k9q h GLU 10 N 0.86 0.81 -0.64 1.57 5.08 -1.19 -2.16 114.58 118.91 2k9q h GLU 10 Ca 0.22 -0.11 -0.03 0.00 -1.00 0.00 0.00 59.36 58.44 2k9q h GLU 10 Cb 0.05 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.12 2k9q h GLU 10 CO -0.04 0.65 0.29 0.00 -1.00 0.00 0.00 179.01 178.92 2k9q h ARG 11 N 0.81 0.93 0.16 2.33 3.08 -1.16 0.40 114.38 120.93 2k9q h ARG 11 Ca 0.20 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 60.09 2k9q h ARG 11 Cb 0.13 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.02 2k9q h ARG 11 CO -0.02 0.76 -0.08 0.82 -1.07 0.00 0.00 179.97 180.38 2k9q h ILE 12 N 0.88 0.88 -0.46 2.04 2.04 -0.87 0.90 117.51 122.92 2k9q h ILE 12 Ca 0.22 -0.19 -0.11 0.00 1.00 0.00 0.00 64.86 65.77 2k9q h ILE 12 Cb 0.14 1.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.21 2k9q h ILE 12 CO -0.02 0.05 -0.16 0.03 0.00 0.00 0.00 178.15 178.04 2k9q h ARG 13 N -0.31 0.89 -0.00 2.37 3.08 -1.32 -1.97 114.38 117.11 2k9q h ARG 13 Ca -0.02 -0.34 0.00 0.00 0.07 0.00 0.00 59.98 59.69 2k9q h ARG 13 Cb 0.24 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.24 2k9q h ARG 13 CO 0.04 0.98 -0.03 1.28 -1.07 0.00 0.00 179.97 181.17 2k9q n LEU 14 N -4.13 0.29 -3.22 3.04 4.77 0.14 -4.95 117.00 112.94 2k9q n LEU 14 Ca 0.01 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.88 2k9q n LEU 14 Cb 0.41 -0.10 0.01 0.00 -2.33 0.00 0.00 43.42 41.41 2k9q n LEU 14 CO 0.45 0.05 0.08 -0.24 -1.33 0.00 0.00 177.39 176.40 2k9q n SER 15 N -0.91 -6.96 -4.49 -1.43 2.88 0.29 -4.99 113.62 98.02 2k9q n SER 15 Ca 0.19 -0.13 -0.32 0.00 -1.33 0.00 0.00 58.87 57.29 2k9q n SER 15 Cb 0.21 -4.15 -0.12 0.00 -0.75 0.00 0.00 64.21 59.39 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 -3.70 2.74 0.17 2.46 1.02 0.03 -5.01 118.68 116.40 2k9q s LEU 16 Ca 0.10 -0.31 0.11 0.00 0.02 0.00 0.00 54.13 54.06 2k9q s LEU 16 Cb -0.02 -1.59 -0.04 0.00 0.02 0.00 0.00 46.19 44.56 2k9q s LEU 16 CO 0.80 0.29 -0.23 0.42 0.02 0.00 0.00 176.35 177.65 2k9q s THR 17 N -0.88 2.44 0.24 5.49 -4.23 -1.26 -4.84 115.64 112.59 2k9q s THR 17 Ca 0.14 -1.91 -0.06 0.00 -1.18 0.00 0.00 61.69 58.68 2k9q s THR 17 Cb -0.11 -2.15 0.18 0.00 1.34 0.00 0.00 72.50 71.76 2k9q s THR 17 CO 0.04 -0.06 1.82 0.00 -0.54 0.00 0.00 174.62 175.89 2k9q h ALA 18 N 3.36 1.13 -0.18 3.99 0.00 -2.00 -1.15 119.26 124.41 2k9q h ALA 18 Ca -0.48 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.23 2k9q h ALA 18 Cb 1.20 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 2k9q h ALA 18 CO 0.46 0.64 -0.00 -0.22 0.00 0.00 0.00 179.25 180.13 2k9q h LYS 19 N 1.14 0.31 -0.24 0.00 1.63 -1.97 0.25 116.57 117.69 2k9q h LYS 19 Ca 0.27 -0.10 -0.01 0.00 -0.85 0.00 0.00 60.65 59.95 2k9q h LYS 19 Cb 0.15 -0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 31.75 2k9q h LYS 19 CO -0.03 0.53 0.10 1.03 -3.45 0.00 0.00 179.45 177.63 2k9q h SER 20 N 0.06 0.33 -0.24 4.20 0.87 -1.93 0.38 113.55 117.22 2k9q h SER 20 Ca 0.05 -0.16 -0.07 0.00 -1.23 0.00 0.00 61.79 60.38 2k9q h SER 20 Cb 0.39 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.26 2k9q h SER 20 CO 0.01 0.40 -0.13 0.58 -0.53 0.00 0.00 176.83 177.16 2k9q h VAL 21 N 0.24 1.30 -0.12 2.23 2.07 -1.21 0.19 116.25 120.95 2k9q h VAL 21 Ca 0.08 -1.22 -0.01 0.00 0.82 0.00 0.00 66.70 66.37 2k9q h VAL 21 Cb 0.17 1.58 -0.00 0.00 -1.52 0.00 0.00 31.29 31.51 2k9q h VAL 21 CO -0.01 0.38 0.02 0.00 0.02 0.00 0.00 177.57 177.98 2k9q h ALA 22 N 0.72 0.16 -0.23 1.67 0.00 -0.39 0.42 119.26 121.60 2k9q h ALA 22 Ca 0.05 -0.15 -0.12 0.00 0.00 0.00 0.00 54.91 54.70 2k9q h ALA 22 Cb 0.64 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 2k9q h ALA 22 CO 0.04 -0.20 -0.36 1.49 0.00 0.00 0.00 179.25 180.22 2k9q h GLU 23 N -0.02 0.51 0.07 0.00 4.81 -0.26 0.25 114.58 119.93 2k9q h GLU 23 Ca 0.04 -0.24 -0.00 0.00 -0.13 0.00 0.00 59.36 59.03 2k9q h GLU 23 Cb 0.28 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.65 2k9q h GLU 23 CO 0.00 0.80 -0.03 1.49 -0.73 0.00 0.00 179.01 180.54 2k9q h GLU 24 N 0.43 -0.09 -0.61 1.92 4.22 -0.47 -3.28 114.58 116.71 2k9q h GLU 24 Ca 0.05 0.01 -0.09 0.00 0.08 0.00 0.00 59.36 59.40 2k9q h GLU 24 Cb 0.83 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.07 2k9q h GLU 24 CO 0.07 0.47 0.02 0.52 -2.18 0.00 0.00 179.01 177.90 2k9q h MET 25 N -0.73 1.05 -0.00 1.92 2.86 -0.16 -3.47 114.93 116.39 2k9q h MET 25 Ca -0.01 -0.32 0.00 0.00 -2.06 0.00 0.00 59.70 57.31 2k9q h MET 25 Cb 0.60 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 32.15 2k9q h MET 25 CO 0.01 1.02 0.00 0.41 1.06 0.00 0.00 176.91 179.41 2k9q n GLY 26 N -0.47 1.65 3.37 8.32 0.00 0.81 -5.07 105.19 113.80 2k9q n GLY 26 Ca 0.03 -0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.85 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 1.76 0.67 -0.61 -4.36 -0.75 -5.03 121.20 110.88 2k9q s ILE 27 Ca 0.00 -2.20 -0.12 0.00 -0.26 0.00 0.00 60.65 58.07 2k9q s ILE 27 Cb 0.00 -2.16 -0.01 0.00 1.25 0.00 0.00 42.46 41.54 2k9q s ILE 27 CO 0.00 -0.51 1.06 -0.55 0.24 0.00 0.00 174.94 175.18 2k9q s SER 28 N -3.36 5.52 0.28 4.36 0.15 -1.26 -4.52 113.70 114.87 2k9q s SER 28 Ca 0.25 1.65 -0.01 0.00 0.70 0.00 0.00 55.95 58.53 2k9q s SER 28 Cb 0.00 -2.50 0.40 0.00 -1.71 0.00 0.00 66.02 62.21 2k9q s SER 28 CO 0.09 -1.35 1.83 0.03 1.20 0.00 0.00 173.24 175.04 2k9q h ARG 29 N -0.43 0.84 -0.90 5.44 3.08 -1.95 -2.36 114.38 118.10 2k9q h ARG 29 Ca -0.44 -0.17 0.06 0.00 0.07 0.00 0.00 59.98 59.50 2k9q h ARG 29 Cb 1.21 -0.13 -0.06 0.00 0.08 0.00 0.00 29.97 31.07 2k9q h ARG 29 CO 0.57 0.75 0.57 0.37 -1.07 0.00 0.00 179.97 181.16 2k9q h GLN 30 N 0.81 1.01 -0.60 0.04 4.15 -2.00 -0.66 115.11 117.87 2k9q h GLN 30 Ca 0.18 -0.06 -0.08 0.00 0.77 0.00 0.00 58.65 59.46 2k9q h GLN 30 Cb 0.28 -0.23 -0.02 0.00 0.21 0.00 0.00 27.48 27.72 2k9q h GLN 30 CO -0.00 0.67 0.05 0.37 -1.93 0.00 0.00 178.83 177.99 2k9q h GLN 31 N 1.04 1.01 -0.60 1.69 4.15 -1.81 -2.08 115.11 118.52 2k9q h GLN 31 Ca 0.39 -0.28 -0.03 0.00 0.77 0.00 0.00 58.65 59.50 2k9q h GLN 31 Cb 0.16 -0.11 -0.03 0.00 0.21 0.00 0.00 27.48 27.71 2k9q h GLN 31 CO -0.17 0.96 0.25 1.25 -1.93 0.00 0.00 178.83 179.18 2k9q h LEU 32 N 0.94 0.82 -1.06 -2.39 5.85 -0.86 -2.40 115.31 116.21 2k9q h LEU 32 Ca 0.18 -0.16 -0.05 0.00 0.84 0.00 0.00 57.88 58.68 2k9q h LEU 32 Cb 0.47 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 2k9q h LEU 32 CO 0.02 0.76 0.08 0.00 -0.34 0.00 0.00 178.44 178.96 2k9q h ASN 34 N 0.73 0.63 -0.57 0.00 -0.26 -0.91 -2.45 115.58 112.75 2k9q h ASN 34 Ca 0.16 -0.10 -0.01 0.00 -0.56 0.00 0.00 56.30 55.78 2k9q h ASN 34 Cb 0.32 -0.16 -0.03 0.00 -1.06 0.00 0.00 38.32 37.39 2k9q h ASN 34 CO 0.00 0.63 0.31 0.40 -1.06 0.00 0.00 177.43 177.71 2k9q h ILE 35 N 0.66 1.19 -0.44 2.81 2.04 -0.94 -1.72 117.51 121.13 2k9q h ILE 35 Ca 0.15 -0.50 -0.04 0.00 1.00 0.00 0.00 64.86 65.47 2k9q h ILE 35 Cb 0.25 0.48 -0.02 0.00 -0.74 0.00 0.00 36.82 36.79 2k9q h ILE 35 CO -0.00 0.21 0.11 -0.33 0.00 0.00 0.00 178.15 178.14 2k9q h GLU 36 N 0.77 0.65 -1.08 2.37 4.39 -1.34 -1.97 114.58 118.37 2k9q h GLU 36 Ca 0.20 -0.11 -0.60 0.00 0.34 0.00 0.00 59.36 59.18 2k9q h GLU 36 Cb 0.06 -0.11 -0.26 0.00 -0.10 0.00 0.00 28.75 28.34 2k9q h GLU 36 CO -0.03 0.58 0.78 1.04 -1.16 0.00 0.00 179.01 180.22 2k9q n GLN 37 N -4.32 2.50 0.08 2.33 1.13 -0.72 -4.49 117.38 113.89 2k9q n GLN 37 Ca 0.03 -2.96 0.10 0.00 -1.94 0.00 0.00 57.00 52.23 2k9q n GLN 37 Cb 0.19 -2.16 0.43 0.00 0.11 0.00 0.00 30.24 28.81 2k9q n GLN 37 CO 0.00 0.00 0.00 -1.13 -1.44 0.00 0.00 177.06 174.49 2k9q n SER 38 N -0.72 0.44 0.00 1.08 3.41 -0.74 -4.85 113.62 112.23 2k9q n SER 38 Ca 0.57 0.61 0.00 0.00 -0.26 0.00 0.00 58.87 59.79 2k9q n SER 38 Cb 0.73 -0.70 0.00 0.00 -0.26 0.00 0.00 64.21 63.98 2k9q n SER 38 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2k9q n GLU 39 N -1.98 0.00 -3.60 4.33 4.07 -1.26 -4.57 120.64 117.63 2k9q n GLU 39 Ca 0.03 0.00 -0.24 0.00 -0.06 0.00 0.00 57.16 56.88 2k9q n GLU 39 Cb 0.21 0.00 -0.02 0.00 -0.06 0.00 0.00 31.44 31.57 2k9q n GLU 39 CO 0.00 0.00 0.00 -0.08 -0.06 0.00 0.00 177.13 176.99 2k9q s THR 40 N 0.00 5.16 -0.21 6.31 -1.32 -1.26 -4.96 115.64 119.36 2k9q s THR 40 Ca 0.00 -0.55 -0.11 0.00 -1.21 0.00 0.00 61.69 59.82 2k9q s THR 40 Cb 0.00 -3.83 -0.05 0.00 -1.51 0.00 0.00 72.50 67.11 2k9q s THR 40 CO 0.00 -0.40 0.18 0.00 -2.21 0.00 0.00 174.62 172.19 2k9q s ALA 41 N -2.12 3.63 0.43 11.08 0.00 -1.26 -5.06 121.76 128.47 2k9q s ALA 41 Ca 0.38 -0.74 -0.22 0.00 0.00 0.00 0.00 51.96 51.38 2k9q s ALA 41 Cb -0.10 -2.30 -0.12 0.00 0.00 0.00 0.00 23.12 20.61 2k9q s ALA 41 CO 0.32 -0.04 0.64 -2.30 0.00 0.00 0.00 175.76 174.39 2k9q n PRO 42 N 3.94 0.71 0.19 0.00 -0.02 -1.26 -4.87 135.00 133.70 2k9q n PRO 42 Ca -0.15 0.26 0.03 0.00 -2.02 0.00 0.00 63.50 61.63 2k9q n PRO 42 Cb 0.52 -1.63 0.41 0.00 -0.02 0.00 0.00 33.50 32.77 2k9q n PRO 42 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 2k9q h VAL 43 N 0.89 1.22 -0.21 -1.45 -1.51 -2.01 -2.29 116.25 110.88 2k9q h VAL 43 Ca -0.42 -1.02 -0.04 0.00 -1.23 0.00 0.00 66.70 63.99 2k9q h VAL 43 Cb 1.39 1.53 -0.01 0.00 -2.13 0.00 0.00 31.29 32.07 2k9q h VAL 43 CO 0.52 0.29 -0.04 1.62 -1.23 0.00 0.00 177.57 178.74 2k9q h VAL 44 N 0.02 1.16 -0.22 7.19 3.04 -2.00 -1.70 116.25 123.74 2k9q h VAL 44 Ca 0.00 -0.64 -0.01 0.00 -1.01 0.00 0.00 66.70 65.04 2k9q h VAL 44 Cb 0.53 1.04 -0.01 0.00 -2.01 0.00 0.00 31.29 30.84 2k9q h VAL 44 CO 0.04 0.21 0.11 0.58 -1.01 0.00 0.00 177.57 177.50 2k9q h VAL 45 N 0.31 1.13 -0.39 1.51 2.07 -1.76 -2.41 116.25 116.72 2k9q h VAL 45 Ca 0.07 -0.38 -0.07 0.00 0.82 0.00 0.00 66.70 67.14 2k9q h VAL 45 Cb 0.28 0.98 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 2k9q h VAL 45 CO 0.01 0.13 -0.03 0.11 0.02 0.00 0.00 177.57 177.81 2k9q h LYS 46 N 0.23 0.63 -0.87 1.57 1.57 -1.51 -2.28 116.57 115.91 2k9q h LYS 46 Ca 0.08 -0.16 0.10 0.00 -1.87 0.00 0.00 60.65 58.79 2k9q h LYS 46 Cb 0.11 -0.08 -0.08 0.00 0.08 0.00 0.00 32.23 32.27 2k9q h LYS 46 CO -0.01 0.68 0.52 -0.92 -0.57 0.00 0.00 179.45 179.14 2k9q h TYR 47 N 0.60 0.94 -0.50 -1.35 3.20 -0.84 0.11 116.97 119.12 2k9q h TYR 47 Ca 0.12 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.99 2k9q h TYR 47 Cb 0.43 -0.29 -0.02 0.00 1.54 0.00 0.00 36.73 38.38 2k9q h TYR 47 CO 0.02 0.38 0.19 0.82 -1.64 0.00 0.00 178.16 177.93 2k9q h ILE 48 N 0.85 1.22 -0.57 1.81 2.04 -1.02 -2.35 117.51 119.49 2k9q h ILE 48 Ca 0.42 -0.68 -0.02 0.00 1.00 0.00 0.00 64.86 65.58 2k9q h ILE 48 Cb 0.38 0.73 -0.03 0.00 -0.74 0.00 0.00 36.82 37.17 2k9q h ILE 48 CO -0.25 0.26 0.27 0.00 0.00 0.00 0.00 178.15 178.43 2k9q h ALA 49 N 1.04 1.41 -0.57 1.87 0.00 -0.78 -2.29 119.26 119.94 2k9q h ALA 49 Ca 0.16 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.96 2k9q h ALA 49 Cb 0.22 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2k9q h ALA 49 CO -0.01 0.46 0.38 0.35 0.00 0.00 0.00 179.25 180.43 2k9q h PHE 50 N 0.80 0.72 -0.76 0.00 3.57 -0.35 -1.58 116.94 119.34 2k9q h PHE 50 Ca 0.20 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.69 2k9q h PHE 50 Cb 0.09 -0.24 -0.03 0.00 2.79 0.00 0.00 35.95 38.55 2k9q h PHE 50 CO 0.01 0.45 0.37 -0.07 -2.23 0.00 0.00 178.31 176.84 2k9q h LEU 51 N 0.77 0.98 -1.57 0.59 3.38 -1.08 -1.64 115.31 116.74 2k9q h LEU 51 Ca 0.21 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 2k9q h LEU 51 Cb -0.09 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.40 2k9q h LEU 51 CO -0.05 0.84 0.01 0.03 0.09 0.00 0.00 178.44 179.36 2k9q h ARG 52 N 1.06 0.28 -0.04 1.13 3.08 -1.01 -0.54 114.38 118.34 2k9q h ARG 52 Ca 0.26 -0.04 0.01 0.00 0.07 0.00 0.00 59.98 60.28 2k9q h ARG 52 Cb 0.10 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.10 2k9q h ARG 52 CO -0.03 0.30 0.12 1.03 -1.07 0.00 0.00 179.97 180.31 2k9q h SER 53 N 0.28 0.00 -0.17 7.04 0.87 -0.32 0.62 113.55 121.86 2k9q h SER 53 Ca 0.07 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.63 2k9q h SER 53 Cb 0.18 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.14 2k9q h SER 53 CO 0.00 0.00 0.00 0.29 -0.53 0.00 0.00 176.83 176.59 2k9q n LYS 54 N -3.28 2.22 -1.07 2.24 4.01 -0.24 -4.92 118.16 117.14 2k9q n LYS 54 Ca -0.02 -1.81 0.00 0.00 -0.51 0.00 0.00 58.31 55.97 2k9q n LYS 54 Cb 0.19 -1.47 0.00 0.00 -0.51 0.00 0.00 35.03 33.24 2k9q n LYS 54 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2k9q n GLY 55 N 1.35 0.60 3.75 0.72 0.00 0.22 -5.02 105.19 106.81 2k9q n GLY 55 Ca 0.17 -0.79 -0.41 0.00 0.00 0.00 0.00 46.02 44.99 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 2.86 -1.02 1.61 1.01 -1.05 -4.89 120.40 116.93 2k9q s VAL 56 Ca 0.00 0.77 -0.23 0.00 0.00 0.00 0.00 61.98 62.52 2k9q s VAL 56 Cb 0.00 -3.49 0.01 0.00 0.00 0.00 0.00 36.38 32.89 2k9q s VAL 56 CO 0.00 0.15 1.69 -0.62 0.00 0.00 0.00 175.10 176.31 2k9q s ASP 57 N -0.01 5.96 0.19 3.32 -1.08 -1.26 -4.65 116.67 119.14 2k9q s ASP 57 Ca 0.54 -1.29 0.11 0.00 -0.52 0.00 0.00 52.55 51.39 2k9q s ASP 57 Cb -0.39 -2.57 -0.08 0.00 -1.46 0.00 0.00 42.92 38.42 2k9q s ASP 57 CO 0.45 -2.02 1.36 0.25 0.52 0.00 0.00 175.17 175.73 2k9q h LEU 58 N 14.90 0.00 -0.73 -1.34 5.85 -1.97 -3.30 115.31 128.72 2k9q h LEU 58 Ca 0.19 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.89 2k9q h LEU 58 Cb 0.99 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.99 2k9q h LEU 58 CO 1.34 0.77 0.39 0.78 -0.34 0.00 0.00 178.44 181.37 2k9q h ASN 59 N 0.00 0.92 -0.72 1.25 2.35 -1.99 -0.30 115.58 117.09 2k9q h ASN 59 Ca -0.01 -0.11 -0.06 0.00 -0.55 0.00 0.00 56.30 55.57 2k9q h ASN 59 Cb 1.59 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 39.69 2k9q h ASN 59 CO 0.10 0.76 0.21 0.00 -1.65 0.00 0.00 177.43 176.85 2k9q h ALA 60 N 1.20 0.99 -0.26 -0.83 0.00 -1.97 0.32 119.26 118.71 2k9q h ALA 60 Ca 0.25 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 2k9q h ALA 60 Cb 0.06 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 2k9q h ALA 60 CO -0.04 0.67 0.05 1.25 0.00 0.00 0.00 179.25 181.17 2k9q h LEU 61 N 1.09 0.41 -0.61 0.00 5.85 -1.50 -2.19 115.31 118.35 2k9q h LEU 61 Ca 0.23 -0.25 -0.13 0.00 0.84 0.00 0.00 57.88 58.57 2k9q h LEU 61 Cb 0.33 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 2k9q h LEU 61 CO -0.00 0.56 -0.32 -0.26 -0.34 0.00 0.00 178.44 178.07 2k9q h PHE 62 N 0.24 0.87 -0.41 1.25 -1.00 -0.84 -1.73 116.94 115.33 2k9q h PHE 62 Ca 0.08 -0.23 0.00 0.00 2.81 0.00 0.00 57.97 60.63 2k9q h PHE 62 Cb 0.32 -0.20 -0.02 0.00 3.61 0.00 0.00 35.95 39.66 2k9q h PHE 62 CO 0.02 0.97 0.27 -0.44 -1.61 0.00 0.00 178.31 177.52 2k9q h ASP 63 N 0.63 0.46 -0.33 2.17 3.32 -0.21 0.77 116.42 123.24 2k9q h ASP 63 Ca 0.07 -0.01 -0.07 0.00 0.02 0.00 0.00 57.03 57.04 2k9q h ASP 63 Cb 0.85 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.27 2k9q h ASP 63 CO 0.07 0.33 -0.05 -0.09 -1.72 0.00 0.00 179.24 177.78 2k9q h ARG 64 N 0.55 0.61 -0.47 3.56 2.43 -1.31 -3.11 114.38 116.64 2k9q h ARG 64 Ca 0.15 -0.22 -0.05 0.00 -0.81 0.00 0.00 59.98 59.04 2k9q h ARG 64 Cb -0.06 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.43 2k9q h ARG 64 CO -0.03 0.78 0.08 0.82 -1.51 0.00 0.00 179.97 180.10 2k9q h ILE 65 N 0.40 1.25 -3.00 1.20 2.04 -0.94 -3.41 117.51 115.04 2k9q h ILE 65 Ca 0.09 -0.90 -0.55 0.00 1.00 0.00 0.00 64.86 64.49 2k9q h ILE 65 Cb 0.54 0.93 -0.02 0.00 -0.74 0.00 0.00 36.82 37.52 2k9q h ILE 65 CO 0.03 0.32 0.78 -0.63 0.00 0.00 0.00 178.15 178.65 2k9q s ILE 66 N -5.21 4.16 -0.28 -0.67 1.01 0.27 -4.98 121.20 115.50 2k9q s ILE 66 Ca -0.13 1.48 -0.05 0.00 0.00 0.00 0.00 60.65 61.94 2k9q s ILE 66 Cb 0.11 -3.95 0.15 0.00 0.01 0.00 0.00 42.46 38.78 2k9q s ILE 66 CO 0.79 -0.04 0.56 0.68 0.00 0.00 0.00 174.94 176.93 2k9q s VAL 67 N 2.63 -0.89 -0.30 2.92 -7.23 -1.26 -4.82 120.40 111.45 2k9q s VAL 67 Ca 0.57 0.02 -0.29 0.00 -1.81 0.00 0.00 61.98 60.47 2k9q s VAL 67 Cb -0.25 -0.92 -0.01 0.00 0.56 0.00 0.00 36.38 35.75 2k9q s VAL 67 CO 0.21 -0.01 1.57 0.21 -0.31 0.00 0.00 175.10 176.78 2k9q s ASN 68 N 2.79 6.28 0.29 4.85 3.84 -1.26 -4.99 114.94 126.74 2k9q s ASN 68 Ca 0.07 1.31 -0.11 0.00 0.21 0.00 0.00 52.86 54.33 2k9q s ASN 68 Cb -0.14 -2.53 -0.08 0.00 -0.55 0.00 0.00 41.25 37.96 2k9q s ASN 68 CO -0.18 -1.39 0.64 -0.54 -2.79 0.00 0.00 177.10 172.84 2k9q s LYS 69 N 4.92 3.85 0.00 0.43 1.02 -1.26 -4.97 119.74 123.73 2k9q s LYS 69 Ca 0.69 0.41 0.28 0.00 0.02 0.00 0.00 55.97 57.37 2k9q s LYS 69 Cb -0.21 -2.54 1.05 0.00 -0.52 0.00 0.00 37.83 35.61 2k9q s LYS 69 CO 0.30 0.21 1.75 1.28 -0.92 0.00 0.00 175.35 177.98 2k9q n LEU 70 N -0.42 0.60 -4.63 3.17 4.77 -1.26 -4.78 117.00 114.46 2k9q n LEU 70 Ca 0.02 -0.04 -0.41 0.00 -0.03 0.00 0.00 56.01 55.54 2k9q n LEU 70 Cb 0.53 -0.19 -0.06 0.00 -2.33 0.00 0.00 43.42 41.37 2k9q n LEU 70 CO 0.44 0.12 0.42 -1.61 -1.33 0.00 0.00 177.39 175.43 2k9q s GLU 71 N -2.54 4.12 0.00 3.23 0.41 -1.26 -4.99 118.70 117.67 2k9q s GLU 71 Ca 0.26 0.59 0.00 0.00 -0.41 0.00 0.00 54.97 55.40 2k9q s GLU 71 Cb 0.20 -3.65 0.00 0.00 -1.78 0.00 0.00 34.13 28.90 2k9q s GLU 71 CO 0.50 -0.42 0.00 -2.39 -0.49 0.00 0.00 175.26 172.47 2k9q n HIS 72 N 5.71 0.00 0.00 1.61 1.44 -1.26 -4.91 115.22 117.81 2k9q n HIS 72 Ca -0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 2k9q n HIS 72 Cb 0.49 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.60 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 0.00 0.00 -4.11 -1.40 8.25 -1.26 -4.79 115.22 111.91 2k9q n HIS 73 Ca 0.00 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.18 2k9q n HIS 73 Cb 0.00 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.06 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 12.32 -1.51 -0.13 4.41 8.25 -1.26 -4.83 115.22 132.47 2k9q n HIS 74 Ca 0.00 0.70 -0.10 0.00 -0.26 0.00 0.00 57.72 58.06 2k9q n HIS 74 Cb 0.00 -3.33 -0.02 0.00 1.12 0.00 0.00 29.99 27.76 2k9q n HIS 74 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2k9q h HIS 75 N -1.78 0.68 -3.33 4.41 2.76 -2.02 -3.42 115.15 112.46 2k9q h HIS 75 Ca -0.64 -0.11 -0.64 0.00 -2.20 0.00 0.00 60.37 56.78 2k9q h HIS 75 Cb 1.38 -0.18 -0.33 0.00 1.55 0.00 0.00 27.41 29.83 2k9q h HIS 75 CO 0.51 0.70 -0.86 -1.58 -1.30 0.00 0.00 177.93 175.40 2k9q s HIS 76 N -5.10 2.35 0.00 5.26 5.65 -1.26 -5.17 115.29 117.02 2k9q s HIS 76 Ca -0.13 -1.00 0.00 0.00 0.25 0.00 0.00 55.06 54.18 2k9q s HIS 76 Cb 0.10 -1.60 0.00 0.00 -1.18 0.00 0.00 32.58 29.90 2k9q s HIS 76 CO 0.78 -0.43 0.00 1.58 -0.65 0.00 0.00 174.74 176.02