#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 4.27 0.17 0.03 1.03 -1.26 -4.91 118.70 118.03 2k9q s GLU 2 Ca 0.00 2.31 -0.11 0.00 0.03 0.00 0.00 54.97 57.21 2k9q s GLU 2 Cb 0.00 -3.07 0.07 0.00 -0.80 0.00 0.00 34.13 30.32 2k9q s GLU 2 CO 0.00 -0.36 1.68 1.25 -1.33 0.00 0.00 175.26 176.50 2k9q h LEU 3 N 4.13 0.92 -1.57 1.83 6.46 -1.99 -2.74 115.31 122.36 2k9q h LEU 3 Ca -0.48 -0.24 0.07 0.00 -0.12 0.00 0.00 57.88 57.11 2k9q h LEU 3 Cb 1.22 -0.24 -0.03 0.00 -0.73 0.00 0.00 40.66 40.88 2k9q h LEU 3 CO 0.71 0.93 0.39 0.28 -0.62 0.00 0.00 178.44 180.13 2k9q h SER 4 N 0.87 0.46 -0.82 1.25 0.02 -1.91 -1.57 113.55 111.85 2k9q h SER 4 Ca 0.18 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.10 2k9q h SER 4 Cb 0.38 -0.10 -0.04 0.00 0.14 0.00 0.00 62.40 62.79 2k9q h SER 4 CO 0.01 0.30 0.37 -1.13 -1.14 0.00 0.00 176.83 175.24 2k9q h ASN 5 N 0.52 1.09 -0.61 3.07 -1.24 -1.82 -1.80 115.58 114.79 2k9q h ASN 5 Ca 0.25 -0.15 -0.07 0.00 0.71 0.00 0.00 56.30 57.05 2k9q h ASN 5 Cb 0.33 -0.28 -0.02 0.00 0.73 0.00 0.00 38.32 39.08 2k9q h ASN 5 CO -0.07 0.93 0.12 -0.33 -1.29 0.00 0.00 177.43 176.79 2k9q h GLU 6 N 1.17 1.00 -0.67 6.67 4.39 -1.32 -1.24 114.58 124.58 2k9q h GLU 6 Ca 0.28 -0.25 -0.02 0.00 0.34 0.00 0.00 59.36 59.70 2k9q h GLU 6 Cb 0.15 -0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 28.64 2k9q h GLU 6 CO -0.03 0.92 0.34 -0.07 -1.16 0.00 0.00 179.01 179.01 2k9q h LEU 7 N 0.91 0.86 -0.34 1.33 3.38 -1.20 0.18 115.31 120.43 2k9q h LEU 7 Ca 0.19 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 2k9q h LEU 7 Cb 0.39 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 2k9q h LEU 7 CO 0.01 0.74 0.10 0.50 0.09 0.00 0.00 178.44 179.88 2k9q h LYS 8 N 0.92 0.54 -0.20 1.13 3.64 -1.07 -0.22 116.57 121.31 2k9q h LYS 8 Ca 0.23 -0.12 -0.01 0.00 -1.27 0.00 0.00 60.65 59.48 2k9q h LYS 8 Cb 0.10 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 2k9q h LYS 8 CO -0.03 0.57 0.08 0.28 -2.27 0.00 0.00 179.45 178.08 2k9q h VAL 9 N 0.40 1.17 -0.50 2.00 2.07 -0.90 -1.00 116.25 119.49 2k9q h VAL 9 Ca 0.11 -0.52 -0.02 0.00 0.82 0.00 0.00 66.70 67.08 2k9q h VAL 9 Cb 0.26 1.14 -0.02 0.00 -1.52 0.00 0.00 31.29 31.15 2k9q h VAL 9 CO -0.00 0.17 0.22 -0.33 0.02 0.00 0.00 177.57 177.65 2k9q h GLU 10 N 0.17 0.74 -0.56 1.57 5.08 -0.88 0.38 114.58 121.08 2k9q h GLU 10 Ca 0.07 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2k9q h GLU 10 Cb 0.19 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.29 2k9q h GLU 10 CO -0.00 0.64 0.36 -0.09 -1.00 0.00 0.00 179.01 178.91 2k9q h ARG 11 N 0.67 0.74 -0.44 2.33 2.43 -0.90 0.19 114.38 119.40 2k9q h ARG 11 Ca 0.17 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 59.22 2k9q h ARG 11 Cb 0.16 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 2k9q h ARG 11 CO -0.02 0.51 0.02 0.82 -1.51 0.00 0.00 179.97 179.79 2k9q h ILE 12 N 0.75 1.26 -0.60 1.20 2.04 -0.81 0.35 117.51 121.71 2k9q h ILE 12 Ca 0.20 -1.01 -0.02 0.00 1.00 0.00 0.00 64.86 65.04 2k9q h ILE 12 Cb -0.06 1.04 -0.03 0.00 -0.74 0.00 0.00 36.82 37.03 2k9q h ILE 12 CO -0.04 0.35 0.31 -0.09 0.00 0.00 0.00 178.15 178.68 2k9q h ARG 13 N 0.62 0.84 -0.00 2.37 9.65 0.35 -1.39 114.38 126.82 2k9q h ARG 13 Ca 0.13 -0.11 0.00 0.00 -1.10 0.00 0.00 59.98 58.90 2k9q h ARG 13 Cb 0.47 -0.16 0.00 0.00 -1.39 0.00 0.00 29.97 28.89 2k9q h ARG 13 CO 0.02 0.66 -0.12 1.28 2.80 0.00 0.00 179.97 184.61 2k9q n LEU 14 N -4.56 0.62 -4.03 3.80 4.77 0.61 -4.94 117.00 113.27 2k9q n LEU 14 Ca 0.04 -0.08 -0.43 0.00 -0.03 0.00 0.00 56.01 55.51 2k9q n LEU 14 Cb 0.10 -0.15 0.02 0.00 -2.33 0.00 0.00 43.42 41.06 2k9q n LEU 14 CO 0.37 0.11 -0.17 -1.54 -1.33 0.00 0.00 177.39 174.83 2k9q n SER 15 N -0.82 -3.95 -4.88 -1.43 3.41 0.12 -4.92 113.62 101.16 2k9q n SER 15 Ca 0.15 -1.25 -0.36 0.00 -0.26 0.00 0.00 58.87 57.15 2k9q n SER 15 Cb 0.29 -1.96 -0.06 0.00 -0.26 0.00 0.00 64.21 62.22 2k9q n SER 15 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2k9q s LEU 16 N -7.30 4.40 0.13 1.04 1.43 -1.06 -5.04 118.68 112.27 2k9q s LEU 16 Ca 0.45 0.58 -0.28 0.00 -1.03 0.00 0.00 54.13 53.86 2k9q s LEU 16 Cb -0.24 -2.42 -0.07 0.00 0.03 0.00 0.00 46.19 43.50 2k9q s LEU 16 CO 0.96 0.33 0.87 0.42 0.23 0.00 0.00 176.35 179.15 2k9q s THR 17 N -1.16 4.46 0.28 5.49 -4.23 -1.26 -4.95 115.64 114.27 2k9q s THR 17 Ca 0.22 1.88 0.00 0.00 -1.18 0.00 0.00 61.69 62.61 2k9q s THR 17 Cb -0.13 -4.23 0.11 0.00 1.34 0.00 0.00 72.50 69.59 2k9q s THR 17 CO 0.11 0.41 1.77 0.00 -0.54 0.00 0.00 174.62 176.37 2k9q h ALA 18 N 5.08 1.15 -0.26 3.99 0.00 -1.98 -2.38 119.26 124.86 2k9q h ALA 18 Ca -0.44 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.19 2k9q h ALA 18 Cb 1.21 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 2k9q h ALA 18 CO 0.70 0.54 0.12 -0.22 0.00 0.00 0.00 179.25 180.39 2k9q h LYS 19 N 0.63 0.38 -0.43 0.00 3.64 -1.94 0.48 116.57 119.32 2k9q h LYS 19 Ca 0.12 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.43 2k9q h LYS 19 Cb 0.48 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.21 2k9q h LYS 19 CO 0.02 0.39 0.23 1.03 -2.27 0.00 0.00 179.45 178.85 2k9q h SER 20 N 0.28 0.55 -0.39 4.20 0.87 -1.93 -1.26 113.55 115.86 2k9q h SER 20 Ca 0.09 -0.10 -0.09 0.00 -1.23 0.00 0.00 61.79 60.46 2k9q h SER 20 Cb 0.14 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 61.95 2k9q h SER 20 CO -0.01 0.49 -0.10 0.58 -0.53 0.00 0.00 176.83 177.26 2k9q h VAL 21 N 0.56 1.28 -0.57 2.23 2.07 -1.24 -2.50 116.25 118.08 2k9q h VAL 21 Ca 0.15 -1.19 0.03 0.00 0.82 0.00 0.00 66.70 66.51 2k9q h VAL 21 Cb 0.07 1.24 -0.04 0.00 -1.52 0.00 0.00 31.29 31.04 2k9q h VAL 21 CO -0.02 0.40 0.34 0.00 0.02 0.00 0.00 177.57 178.31 2k9q h ALA 22 N 0.84 0.73 -0.49 1.67 0.00 0.23 0.58 119.26 122.81 2k9q h ALA 22 Ca 0.10 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 2k9q h ALA 22 Cb 0.62 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 2k9q h ALA 22 CO 0.04 0.07 -0.03 0.93 0.00 0.00 0.00 179.25 180.25 2k9q h GLU 23 N 0.68 0.85 -0.10 0.00 5.08 -1.17 0.23 114.58 120.14 2k9q h GLU 23 Ca 0.23 -0.25 -0.13 0.00 -1.00 0.00 0.00 59.36 58.21 2k9q h GLU 23 Cb 0.03 -0.09 0.01 0.00 0.50 0.00 0.00 28.75 29.20 2k9q h GLU 23 CO -0.10 0.87 -0.44 1.49 -1.00 0.00 0.00 179.01 179.83 2k9q h GLU 24 N 0.78 0.48 -0.62 2.33 4.57 -0.92 -3.23 114.58 117.96 2k9q h GLU 24 Ca 0.14 -0.37 -0.08 0.00 -1.18 0.00 0.00 59.36 57.87 2k9q h GLU 24 Cb 0.51 0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 29.15 2k9q h GLU 24 CO 0.03 1.00 0.06 0.52 -1.18 0.00 0.00 179.01 179.44 2k9q h MET 25 N 0.06 1.04 0.00 1.92 2.86 0.27 -3.47 114.93 117.60 2k9q h MET 25 Ca -0.03 -0.29 0.00 0.00 -2.06 0.00 0.00 59.70 57.33 2k9q h MET 25 Cb 1.08 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.62 2k9q h MET 25 CO 0.09 0.98 0.00 0.41 1.06 0.00 0.00 176.91 179.45 2k9q n GLY 26 N -0.56 1.52 3.43 8.32 0.00 0.78 -5.07 105.19 113.62 2k9q n GLY 26 Ca 0.04 -0.12 -0.21 0.00 0.00 0.00 0.00 46.02 45.73 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 1.28 0.64 -0.61 -4.36 -0.95 -5.04 121.20 110.15 2k9q s ILE 27 Ca 0.00 -2.03 -0.15 0.00 -0.26 0.00 0.00 60.65 58.21 2k9q s ILE 27 Cb 0.00 -2.67 -0.01 0.00 1.25 0.00 0.00 42.46 41.03 2k9q s ILE 27 CO 0.00 -0.10 1.09 -0.44 0.24 0.00 0.00 174.94 175.73 2k9q s SER 28 N -3.46 5.33 0.18 4.36 0.01 -1.26 -4.50 113.70 114.36 2k9q s SER 28 Ca 0.34 1.94 -0.12 0.00 1.31 0.00 0.00 55.95 59.42 2k9q s SER 28 Cb 0.07 -2.54 0.09 0.00 0.21 0.00 0.00 66.02 63.85 2k9q s SER 28 CO 0.14 -1.48 1.79 -0.09 0.41 0.00 0.00 173.24 174.01 2k9q h ARG 29 N 0.15 0.88 -0.47 12.44 2.43 -1.93 -1.39 114.38 126.49 2k9q h ARG 29 Ca -0.47 -0.11 -0.07 0.00 -0.81 0.00 0.00 59.98 58.53 2k9q h ARG 29 Cb 1.24 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 30.60 2k9q h ARG 29 CO 0.55 0.67 0.01 0.37 -1.51 0.00 0.00 179.97 180.07 2k9q h GLN 30 N 0.85 0.76 -0.57 0.20 -0.00 -1.98 -2.03 115.11 112.35 2k9q h GLN 30 Ca 0.22 -0.19 -0.04 0.00 -0.00 0.00 0.00 58.65 58.63 2k9q h GLN 30 Cb 0.05 -0.09 -0.03 0.00 0.00 0.00 0.00 27.48 27.41 2k9q h GLN 30 CO -0.03 0.76 0.19 1.96 0.00 0.00 0.00 178.83 181.71 2k9q h GLN 31 N 0.72 0.85 -0.50 1.69 1.08 -1.75 0.83 115.11 118.03 2k9q h GLN 31 Ca 0.14 -0.15 -0.00 0.00 -1.45 0.00 0.00 58.65 57.19 2k9q h GLN 31 Cb 0.42 -0.14 -0.02 0.00 -0.05 0.00 0.00 27.48 27.69 2k9q h GLN 31 CO 0.02 0.72 0.30 1.25 -0.95 0.00 0.00 178.83 180.17 2k9q h LEU 32 N 0.83 0.60 -0.96 1.46 5.85 -0.55 -0.30 115.31 122.23 2k9q h LEU 32 Ca 0.19 -0.06 -0.10 0.00 0.84 0.00 0.00 57.88 58.75 2k9q h LEU 32 Cb 0.22 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 2k9q h LEU 32 CO -0.01 0.48 -0.32 0.00 -0.34 0.00 0.00 178.44 178.26 2k9q h ASN 34 N 0.32 0.71 -0.61 0.00 -1.24 0.14 -2.55 115.58 112.34 2k9q h ASN 34 Ca 0.04 -0.16 -0.01 0.00 0.71 0.00 0.00 56.30 56.88 2k9q h ASN 34 Cb 0.72 -0.19 -0.03 0.00 0.73 0.00 0.00 38.32 39.55 2k9q h ASN 34 CO 0.05 0.77 0.35 0.40 -1.29 0.00 0.00 177.43 177.71 2k9q h ILE 35 N 0.70 1.19 -0.48 2.57 2.04 -0.82 0.46 117.51 123.16 2k9q h ILE 35 Ca 0.14 -0.46 -0.07 0.00 1.00 0.00 0.00 64.86 65.47 2k9q h ILE 35 Cb 0.42 0.39 -0.02 0.00 -0.74 0.00 0.00 36.82 36.87 2k9q h ILE 35 CO 0.02 0.20 0.03 -0.33 0.00 0.00 0.00 178.15 178.07 2k9q h GLU 36 N 0.82 0.79 -0.86 2.37 4.39 -1.49 -2.61 114.58 117.98 2k9q h GLU 36 Ca 0.21 -0.20 -0.58 0.00 0.34 0.00 0.00 59.36 59.13 2k9q h GLU 36 Cb 0.02 -0.10 -0.32 0.00 -0.10 0.00 0.00 28.75 28.25 2k9q h GLU 36 CO -0.04 0.77 0.22 1.04 -1.16 0.00 0.00 179.01 179.85 2k9q n GLN 37 N -4.23 2.90 0.00 2.33 1.13 -0.82 -4.63 117.38 114.05 2k9q n GLN 37 Ca 0.03 -3.56 0.00 0.00 -1.94 0.00 0.00 57.00 51.53 2k9q n GLN 37 Cb 0.28 -2.24 0.00 0.00 0.11 0.00 0.00 30.24 28.39 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 -0.88 0.00 0.00 1.08 3.41 0.16 -4.92 113.62 112.47 2k9q n SER 38 Ca 0.54 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.15 2k9q n SER 38 Cb 0.86 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.81 2k9q n SER 38 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 2k9q n GLU 39 N 0.00 0.00 -1.35 4.33 0.28 -1.26 -5.07 120.64 117.56 2k9q n GLU 39 Ca 0.00 0.00 -0.29 0.00 -0.16 0.00 0.00 57.16 56.71 2k9q n GLU 39 Cb 0.00 0.00 0.13 0.00 1.43 0.00 0.00 31.44 33.00 2k9q n GLU 39 CO 0.00 0.00 0.00 0.95 -0.16 0.00 0.00 177.13 177.92 2k9q s THR 40 N -0.15 2.59 0.29 3.84 -4.23 -1.26 -4.96 115.64 111.76 2k9q s THR 40 Ca 0.00 0.19 -0.10 0.00 -1.18 0.00 0.00 61.69 60.60 2k9q s THR 40 Cb 0.00 -2.80 -0.07 0.00 1.34 0.00 0.00 72.50 70.97 2k9q s THR 40 CO 0.00 -0.25 0.63 0.00 -0.54 0.00 0.00 174.62 174.46 2k9q s ALA 41 N -3.06 3.48 0.54 3.99 0.00 -1.26 -5.06 121.76 120.38 2k9q s ALA 41 Ca 0.63 -0.23 -0.19 0.00 0.00 0.00 0.00 51.96 52.16 2k9q s ALA 41 Cb -0.16 -2.54 -0.06 0.00 0.00 0.00 0.00 23.12 20.35 2k9q s ALA 41 CO 0.56 0.33 1.10 -1.25 0.00 0.00 0.00 175.76 176.50 2k9q s PRO 42 N -3.16 3.44 0.44 0.00 0.04 -1.26 -4.91 135.00 129.59 2k9q s PRO 42 Ca 0.49 1.53 0.30 0.00 0.04 0.00 0.00 61.00 63.36 2k9q s PRO 42 Cb -0.11 -2.03 1.50 0.00 0.04 0.00 0.00 34.50 33.90 2k9q s PRO 42 CO 0.23 -0.76 1.91 -0.24 0.04 0.00 0.00 177.00 178.19 2k9q h VAL 43 N 1.22 0.00 -0.76 -0.36 3.04 -2.01 -2.65 116.25 114.73 2k9q h VAL 43 Ca -0.50 -0.13 0.02 0.00 -1.01 0.00 0.00 66.70 65.08 2k9q h VAL 43 Cb 1.25 0.89 -0.04 0.00 -2.01 0.00 0.00 31.29 31.38 2k9q h VAL 43 CO 0.57 0.00 0.49 0.58 -1.01 0.00 0.00 177.57 178.21 2k9q h VAL 44 N 0.00 1.15 -0.75 1.51 2.07 -2.00 -2.11 116.25 116.12 2k9q h VAL 44 Ca 0.00 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.19 2k9q h VAL 44 Cb 0.16 0.08 -0.04 0.00 -1.52 0.00 0.00 31.29 29.98 2k9q h VAL 44 CO 0.00 0.18 0.48 0.58 0.02 0.00 0.00 177.57 178.83 2k9q h VAL 45 N 0.98 1.20 -0.72 2.57 2.07 -1.86 -1.47 116.25 119.03 2k9q h VAL 45 Ca 0.29 -0.40 -0.01 0.00 0.82 0.00 0.00 66.70 67.40 2k9q h VAL 45 Cb -0.05 0.12 -0.03 0.00 -1.52 0.00 0.00 31.29 29.80 2k9q h VAL 45 CO -0.09 0.20 0.40 0.11 0.02 0.00 0.00 177.57 178.21 2k9q h LYS 46 N 1.02 1.00 0.50 1.57 1.57 -1.54 -2.15 116.57 118.54 2k9q h LYS 46 Ca 0.27 -0.12 -0.02 0.00 -1.87 0.00 0.00 60.65 58.91 2k9q h LYS 46 Cb -0.08 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.03 2k9q h LYS 46 CO -0.06 0.75 -0.24 -0.92 -0.57 0.00 0.00 179.45 178.41 2k9q h TYR 47 N 0.99 -0.62 -1.13 -1.35 5.03 -0.80 -1.60 116.97 117.50 2k9q h TYR 47 Ca 0.25 -0.01 0.32 0.00 2.58 0.00 0.00 58.73 61.87 2k9q h TYR 47 Cb 0.04 0.20 -0.10 0.00 1.55 0.00 0.00 36.73 38.42 2k9q h TYR 47 CO -0.00 -0.37 0.73 0.82 -1.32 0.00 0.00 178.16 178.01 2k9q h ILE 48 N -0.69 0.39 -0.59 1.81 2.04 -1.04 0.82 117.51 120.26 2k9q h ILE 48 Ca -0.07 -0.10 -0.08 0.00 1.00 0.00 0.00 64.86 65.62 2k9q h ILE 48 Cb 0.52 0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 36.66 2k9q h ILE 48 CO 0.11 0.05 0.07 0.00 0.00 0.00 0.00 178.15 178.38 2k9q h ALA 49 N 1.61 0.79 -0.35 1.87 0.00 -0.65 -1.15 119.26 121.39 2k9q h ALA 49 Ca 0.67 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 55.28 2k9q h ALA 49 Cb 1.85 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 19.41 2k9q h ALA 49 CO -0.33 0.57 0.14 0.35 0.00 0.00 0.00 179.25 179.98 2k9q h PHE 50 N 0.89 0.52 -0.60 0.00 3.57 0.12 0.83 116.94 122.28 2k9q h PHE 50 Ca 0.18 -0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.60 2k9q h PHE 50 Cb 0.46 -0.16 -0.03 0.00 2.79 0.00 0.00 35.95 39.02 2k9q h PHE 50 CO 0.03 0.48 0.23 -0.07 -2.23 0.00 0.00 178.31 176.75 2k9q h LEU 51 N 0.41 0.84 -0.81 0.59 3.38 -1.17 -2.55 115.31 116.00 2k9q h LEU 51 Ca 0.12 -0.18 -0.08 0.00 0.09 0.00 0.00 57.88 57.82 2k9q h LEU 51 Cb 0.17 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 2k9q h LEU 51 CO -0.01 0.79 -0.03 -0.09 0.09 0.00 0.00 178.44 179.19 2k9q h ARG 52 N 0.84 0.87 -0.00 1.13 2.43 -0.97 -1.65 114.38 117.03 2k9q h ARG 52 Ca 0.20 -0.26 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 2k9q h ARG 52 Cb 0.22 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 29.68 2k9q h ARG 52 CO -0.01 0.88 0.03 0.77 -1.51 0.00 0.00 179.97 180.12 2k9q h SER 53 N 0.80 0.00 -0.13 -3.80 0.02 -0.42 0.56 113.55 110.57 2k9q h SER 53 Ca 0.15 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 2k9q h SER 53 Cb 0.52 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.06 2k9q h SER 53 CO 0.03 0.00 0.00 0.29 -1.14 0.00 0.00 176.83 176.01 2k9q n LYS 54 N -3.14 1.77 -1.54 3.45 4.76 -0.65 -4.89 118.16 117.92 2k9q n LYS 54 Ca -0.03 -1.15 0.00 0.00 -2.87 0.00 0.00 58.31 54.26 2k9q n LYS 54 Cb 0.10 -1.43 0.00 0.00 -1.84 0.00 0.00 35.03 31.86 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 1.17 0.38 3.76 0.72 0.00 0.20 -5.00 105.19 106.41 2k9q n GLY 55 Ca 0.17 -0.99 -0.41 0.00 0.00 0.00 0.00 46.02 44.80 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 -0.51 1.61 1.01 -1.02 -4.83 120.40 117.52 2k9q s VAL 56 Ca 0.00 0.80 -0.10 0.00 0.00 0.00 0.00 61.98 62.68 2k9q s VAL 56 Cb 0.00 -3.51 -0.10 0.00 0.00 0.00 0.00 36.38 32.77 2k9q s VAL 56 CO 0.00 0.17 1.69 0.47 0.00 0.00 0.00 175.10 177.43 2k9q n ASP 57 N 1.50 2.57 -0.19 3.32 9.92 -1.26 -4.50 116.55 127.90 2k9q n ASP 57 Ca 0.02 -2.32 -0.09 0.00 -0.53 0.00 0.00 54.79 51.87 2k9q n ASP 57 Cb 0.42 -0.86 0.02 0.00 -0.64 0.00 0.00 41.12 40.06 2k9q n ASP 57 CO 0.00 0.00 0.00 0.25 0.13 0.00 0.00 177.20 177.58 2k9q h LEU 58 N 11.08 0.90 -0.63 0.64 5.85 -1.94 -2.28 115.31 128.93 2k9q h LEU 58 Ca 0.31 -0.28 0.00 0.00 0.84 0.00 0.00 57.88 58.76 2k9q h LEU 58 Cb 0.28 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.04 2k9q h LEU 58 CO 1.50 0.95 0.41 -0.55 -0.34 0.00 0.00 178.44 180.41 2k9q h ASN 59 N 0.82 0.73 -0.49 1.25 -1.07 -2.00 -1.40 115.58 113.42 2k9q h ASN 59 Ca 0.16 -0.03 -0.08 0.00 0.07 0.00 0.00 56.30 56.42 2k9q h ASN 59 Cb 0.46 -0.18 -0.02 0.00 -2.07 0.00 0.00 38.32 36.50 2k9q h ASN 59 CO 0.02 0.54 0.01 0.00 0.07 0.00 0.00 177.43 178.06 2k9q h ALA 60 N 1.23 0.99 0.25 4.14 0.00 -1.90 0.28 119.26 124.24 2k9q h ALA 60 Ca 0.23 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2k9q h ALA 60 Cb -0.09 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.49 2k9q h ALA 60 CO -0.05 0.62 -0.12 1.25 0.00 0.00 0.00 179.25 180.95 2k9q h LEU 61 N 0.85 -0.28 -0.31 0.00 6.46 -0.81 -2.59 115.31 118.64 2k9q h LEU 61 Ca 0.16 -0.08 -0.12 0.00 -0.12 0.00 0.00 57.88 57.72 2k9q h LEU 61 Cb 0.49 0.07 -0.01 0.00 -0.73 0.00 0.00 40.66 40.49 2k9q h LEU 61 CO 0.02 -0.10 -0.28 -0.26 -0.62 0.00 0.00 178.44 177.21 2k9q h PHE 62 N -0.45 0.87 -0.87 1.25 -1.00 -1.21 -2.75 116.94 112.78 2k9q h PHE 62 Ca -0.03 -0.26 0.20 0.00 2.81 0.00 0.00 57.97 60.69 2k9q h PHE 62 Cb 0.34 -0.19 -0.12 0.00 3.61 0.00 0.00 35.95 39.60 2k9q h PHE 62 CO -0.03 1.01 0.37 0.22 -1.61 0.00 0.00 178.31 178.28 2k9q h ASP 63 N 0.49 0.32 -0.20 2.17 3.58 -0.41 0.65 116.42 123.03 2k9q h ASP 63 Ca 0.05 0.14 -0.05 0.00 0.42 0.00 0.00 57.03 57.59 2k9q h ASP 63 Cb 0.85 0.12 -0.01 0.00 1.72 0.00 0.00 39.33 42.02 2k9q h ASP 63 CO 0.07 0.03 -0.08 -0.09 -2.88 0.00 0.00 179.24 176.29 2k9q h ARG 64 N 0.42 0.40 -0.43 0.28 1.12 -1.35 -3.22 114.38 111.60 2k9q h ARG 64 Ca 0.53 -0.17 -0.05 0.00 -1.11 0.00 0.00 59.98 59.17 2k9q h ARG 64 Cb 0.96 -0.01 -0.02 0.00 -0.01 0.00 0.00 29.97 30.89 2k9q h ARG 64 CO -0.50 0.69 0.06 0.82 -3.11 0.00 0.00 179.97 177.93 2k9q h ILE 65 N 0.10 1.25 -0.30 1.20 2.04 -0.58 -3.39 117.51 117.82 2k9q h ILE 65 Ca 0.04 -0.91 -0.12 0.00 1.00 0.00 0.00 64.86 64.88 2k9q h ILE 65 Cb 0.56 1.01 -0.03 0.00 -0.74 0.00 0.00 36.82 37.62 2k9q h ILE 65 CO 0.03 0.31 0.62 -0.38 0.00 0.00 0.00 178.15 178.73 2k9q n ILE 66 N -4.48 -0.00 -4.74 -0.67 5.41 0.20 -4.87 119.36 110.22 2k9q n ILE 66 Ca -0.00 -0.51 -0.33 0.00 1.00 0.00 0.00 62.75 62.91 2k9q n ILE 66 Cb 0.25 -1.50 -0.14 0.00 -0.71 0.00 0.00 39.64 37.54 2k9q n ILE 66 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 2k9q s VAL 67 N 10.90 3.19 0.00 1.39 0.11 -1.26 -4.96 120.40 129.77 2k9q s VAL 67 Ca 1.04 -0.62 0.00 0.00 -2.93 0.00 0.00 61.98 59.47 2k9q s VAL 67 Cb -0.33 -2.34 0.00 0.00 -1.53 0.00 0.00 36.38 32.18 2k9q s VAL 67 CO 0.22 0.53 0.00 0.59 -3.33 0.00 0.00 175.10 173.11 2k9q n ASN 68 N 3.33 -0.52 -0.73 3.54 3.02 -1.26 -3.95 115.26 118.69 2k9q n ASN 68 Ca -0.18 -0.41 -0.08 0.00 -0.03 0.00 0.00 54.58 53.88 2k9q n ASN 68 Cb 0.53 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.66 2k9q n ASN 68 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2k9q n LYS 69 N -0.93 -1.70 -3.26 3.52 5.02 -1.26 -3.60 118.16 115.95 2k9q n LYS 69 Ca 0.00 0.71 -0.35 0.00 -2.02 0.00 0.00 58.31 56.65 2k9q n LYS 69 Cb 0.00 -4.95 0.03 0.00 -0.02 0.00 0.00 35.03 30.10 2k9q n LYS 69 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2k9q n LEU 70 N -1.04 -2.26 -0.12 -0.35 4.32 -1.25 -4.91 117.00 111.38 2k9q n LEU 70 Ca -0.08 -0.13 -0.17 0.00 -0.02 0.00 0.00 56.01 55.60 2k9q n LEU 70 Cb 0.49 -1.43 -0.11 0.00 -1.62 0.00 0.00 43.42 40.74 2k9q n LEU 70 CO 0.13 -0.05 -1.30 -0.62 -1.22 0.00 0.00 177.39 174.33 2k9q n GLU 71 N -0.10 0.61 -0.08 3.23 -0.58 -1.24 -4.46 120.64 118.01 2k9q n GLU 71 Ca -0.08 0.14 -0.13 0.00 -0.42 0.00 0.00 57.16 56.68 2k9q n GLU 71 Cb 0.62 -1.48 -0.01 0.00 -0.57 0.00 0.00 31.44 29.99 2k9q n GLU 71 CO 0.00 0.00 0.00 1.12 -0.48 0.00 0.00 177.13 177.77 2k9q h HIS 72 N -0.02 1.03 -3.02 -0.32 2.07 -1.90 -3.42 115.15 109.57 2k9q h HIS 72 Ca -0.54 -0.33 -0.57 0.00 -2.85 0.00 0.00 60.37 56.07 2k9q h HIS 72 Cb 1.83 -0.21 -0.04 0.00 2.57 0.00 0.00 27.41 31.56 2k9q h HIS 72 CO 0.03 1.14 0.81 -1.58 -3.07 0.00 0.00 177.93 175.25 2k9q s HIS 73 N -4.26 3.12 -0.30 6.12 5.65 -1.26 -4.95 115.29 119.41 2k9q s HIS 73 Ca -0.10 1.25 -0.16 0.00 0.25 0.00 0.00 55.06 56.30 2k9q s HIS 73 Cb 0.11 -3.38 0.18 0.00 -1.18 0.00 0.00 32.58 28.30 2k9q s HIS 73 CO 0.88 -1.10 1.15 -1.58 -0.65 0.00 0.00 174.74 173.44 2k9q s HIS 74 N 3.08 -0.31 0.30 3.88 5.04 -1.26 -4.97 115.29 121.06 2k9q s HIS 74 Ca 0.51 0.36 0.00 0.00 -1.54 0.00 0.00 55.06 54.39 2k9q s HIS 74 Cb -0.19 0.12 0.00 0.00 0.04 0.00 0.00 32.58 32.55 2k9q s HIS 74 CO 0.13 -0.16 0.00 0.72 -2.34 0.00 0.00 174.74 173.09 2k9q n HIS 75 N 5.33 -2.94 -1.98 3.88 8.25 -1.26 -5.11 115.22 121.40 2k9q n HIS 75 Ca -0.08 0.72 -0.32 0.00 -0.26 0.00 0.00 57.72 57.79 2k9q n HIS 75 Cb 0.54 1.55 0.01 0.00 1.12 0.00 0.00 29.99 33.21 2k9q n HIS 75 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 2k9q s HIS 76 N -2.00 3.35 -0.27 4.41 0.00 -1.26 -5.36 115.29 114.16 2k9q s HIS 76 Ca 0.00 1.41 0.00 0.00 -3.00 0.00 0.00 55.06 53.47 2k9q s HIS 76 Cb 0.00 -2.83 0.00 0.00 -4.00 0.00 0.00 32.58 25.75 2k9q s HIS 76 CO 0.00 -0.80 0.07 0.72 -1.00 0.00 0.00 174.74 173.73