#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ka7 s LYS 2 N 0.00 0.60 0.13 3.17 2.20 -1.26 -4.66 119.74 119.92 2ka7 s LYS 2 Ca 0.00 1.27 0.01 0.00 -0.36 0.00 0.00 55.97 56.90 2ka7 s LYS 2 Cb 0.00 0.50 -0.04 0.00 -1.51 0.00 0.00 37.83 36.78 2ka7 s LYS 2 CO 0.00 -0.17 -0.03 1.41 -0.36 0.00 0.00 175.35 176.21 2ka7 s MET 3 N 2.26 0.94 -0.01 4.03 -2.45 0.23 -5.00 119.30 119.30 2ka7 s MET 3 Ca -0.08 -1.41 -0.08 0.00 -1.25 0.00 0.00 55.69 52.87 2ka7 s MET 3 Cb -0.08 -0.17 0.01 0.00 1.25 0.00 0.00 34.83 35.84 2ka7 s MET 3 CO -0.19 -0.09 0.16 0.21 1.05 0.00 0.00 175.02 176.16 2ka7 s LYS 4 N -3.89 0.45 0.41 4.11 2.20 -1.26 -0.97 119.74 120.80 2ka7 s LYS 4 Ca 0.17 -0.27 0.03 0.00 -0.36 0.00 0.00 55.97 55.54 2ka7 s LYS 4 Cb 0.06 0.19 -0.03 0.00 -1.51 0.00 0.00 37.83 36.54 2ka7 s LYS 4 CO -0.01 -0.10 0.08 0.15 -0.36 0.00 0.00 175.35 175.11 2ka7 s LYS 5 N -1.12 1.93 0.18 4.03 -0.14 -1.20 -4.57 119.74 118.84 2ka7 s LYS 5 Ca -0.12 -2.17 -0.01 0.00 -1.36 0.00 0.00 55.97 52.31 2ka7 s LYS 5 Cb -0.06 -0.91 -0.04 0.00 -1.68 0.00 0.00 37.83 35.14 2ka7 s LYS 5 CO 0.02 -0.38 0.10 0.71 -0.76 0.00 0.00 175.35 175.04 2ka7 s TYR 6 N -3.13 1.08 0.39 3.18 1.51 0.45 -0.91 117.35 119.93 2ka7 s TYR 6 Ca 0.23 -1.30 0.04 0.00 -1.01 0.00 0.00 57.07 55.03 2ka7 s TYR 6 Cb 0.04 -0.56 -0.03 0.00 -0.11 0.00 0.00 41.96 41.30 2ka7 s TYR 6 CO 0.12 -0.56 0.13 0.95 -1.11 0.00 0.00 175.55 175.08 2ka7 s THR 7 N -4.07 0.61 0.00 -0.71 -4.23 -1.06 -2.74 115.64 103.43 2ka7 s THR 7 Ca 0.33 -2.00 0.17 0.00 -1.18 0.00 0.00 61.69 59.01 2ka7 s THR 7 Cb 0.07 -2.40 0.10 0.00 1.34 0.00 0.00 72.50 71.61 2ka7 s THR 7 CO 0.08 0.00 1.58 0.11 -0.54 0.00 0.00 174.62 175.86 2ka7 h LYS 8 N 1.85 0.00 -0.72 3.99 1.57 -2.00 -2.31 116.57 118.95 2ka7 h LYS 8 Ca -0.35 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.43 2ka7 h LYS 8 Cb 1.27 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.58 2ka7 h LYS 8 CO 0.57 0.44 0.00 -2.37 -0.57 0.00 0.00 179.45 177.52 2ka7 n THR 9 N -3.36 0.26 -2.80 -0.16 5.66 -1.26 -4.89 114.28 107.74 2ka7 n THR 9 Ca 0.01 -0.15 -0.11 0.00 -3.05 0.00 0.00 64.05 60.75 2ka7 n THR 9 Cb 0.63 -0.33 0.05 0.00 -1.55 0.00 0.00 70.33 69.13 2ka7 n THR 9 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 175.07 173.43 2ka7 n HIS 10 N -0.01 -1.79 -4.09 1.09 -0.00 -0.87 -4.90 115.22 104.64 2ka7 n HIS 10 Ca 0.03 0.64 -0.23 0.00 -0.00 0.00 0.00 57.72 58.16 2ka7 n HIS 10 Cb 0.28 -3.74 -0.06 0.00 -0.00 0.00 0.00 29.99 26.47 2ka7 n HIS 10 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 2ka7 s GLU 11 N -4.10 2.37 0.09 -0.41 2.02 -1.24 -0.58 118.70 116.86 2ka7 s GLU 11 Ca 0.31 -1.56 0.05 0.00 0.02 0.00 0.00 54.97 53.78 2ka7 s GLU 11 Cb -0.04 -2.17 -0.03 0.00 0.10 0.00 0.00 34.13 31.99 2ka7 s GLU 11 CO 0.54 0.09 -0.13 1.67 0.02 0.00 0.00 175.26 177.46 2ka7 s TRP 12 N -2.43 1.18 -0.39 1.61 1.48 -0.63 -2.56 118.94 117.20 2ka7 s TRP 12 Ca 0.38 -0.55 0.01 0.00 -1.06 0.00 0.00 56.10 54.88 2ka7 s TRP 12 Cb -0.02 -0.65 0.14 0.00 -1.16 0.00 0.00 33.47 31.78 2ka7 s TRP 12 CO 0.23 0.05 0.23 0.08 -4.06 0.00 0.00 176.95 173.48 2ka7 s VAL 13 N -1.86 0.66 -1.16 -0.66 1.01 -0.08 -3.20 120.40 115.11 2ka7 s VAL 13 Ca 0.03 -2.08 -0.22 0.00 0.00 0.00 0.00 61.98 59.71 2ka7 s VAL 13 Cb -0.07 -1.47 -0.04 0.00 0.00 0.00 0.00 36.38 34.81 2ka7 s VAL 13 CO 0.02 -0.96 1.86 -0.44 0.00 0.00 0.00 175.10 175.57 2ka7 s SER 14 N 0.75 5.57 -0.12 3.32 0.01 0.13 -3.27 113.70 120.08 2ka7 s SER 14 Ca 0.18 -1.68 -0.23 0.00 1.31 0.00 0.00 55.95 55.54 2ka7 s SER 14 Cb -0.23 -2.58 -0.03 0.00 0.21 0.00 0.00 66.02 63.39 2ka7 s SER 14 CO 0.00 -2.48 0.68 -0.63 0.41 0.00 0.00 173.24 171.22 2ka7 s ILE 15 N 8.89 5.03 0.00 1.44 -1.09 -0.14 -2.15 121.20 133.18 2ka7 s ILE 15 Ca 0.64 1.36 0.00 0.00 -2.23 0.00 0.00 60.65 60.42 2ka7 s ILE 15 Cb -0.01 -4.01 0.00 0.00 -1.58 0.00 0.00 42.46 36.87 2ka7 s ILE 15 CO 0.08 0.19 0.00 -1.84 -1.23 0.00 0.00 174.94 172.14 2ka7 n GLU 16 N 4.33 4.65 0.00 2.79 0.28 -1.12 -0.60 120.64 130.97 2ka7 n GLU 16 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.99 2ka7 n GLU 16 Cb 0.51 -0.46 0.00 0.00 1.43 0.00 0.00 31.44 32.92 2ka7 n GLU 16 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 2ka7 n ASP 17 N -0.08 0.00 -0.58 -1.84 2.03 -1.26 -4.54 116.55 110.28 2ka7 n ASP 17 Ca 0.00 0.00 0.05 0.00 0.52 0.00 0.00 54.79 55.36 2ka7 n ASP 17 Cb 0.00 0.00 0.14 0.00 -0.72 0.00 0.00 41.12 40.54 2ka7 n ASP 17 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2ka7 n LYS 18 N 0.00 2.80 -4.46 -0.67 5.02 -1.26 -4.92 118.16 114.67 2ka7 n LYS 18 Ca 0.00 -1.98 -0.32 0.00 -2.02 0.00 0.00 58.31 53.99 2ka7 n LYS 18 Cb 0.00 -1.25 -0.10 0.00 -0.02 0.00 0.00 35.03 33.66 2ka7 n LYS 18 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2ka7 s VAL 19 N -0.99 3.63 -0.04 -0.18 1.01 -1.26 -0.74 120.40 121.82 2ka7 s VAL 19 Ca 0.21 -0.79 0.01 0.00 0.00 0.00 0.00 61.98 61.41 2ka7 s VAL 19 Cb 0.11 -2.57 -0.03 0.00 0.00 0.00 0.00 36.38 33.88 2ka7 s VAL 19 CO 0.14 0.39 -0.03 0.00 0.00 0.00 0.00 175.10 175.60 2ka7 s ALA 20 N -0.99 3.13 0.06 5.51 0.00 -0.27 -2.79 121.76 126.40 2ka7 s ALA 20 Ca 0.17 -0.91 -0.24 0.00 0.00 0.00 0.00 51.96 50.98 2ka7 s ALA 20 Cb -0.11 -1.30 -0.06 0.00 0.00 0.00 0.00 23.12 21.65 2ka7 s ALA 20 CO 0.07 0.60 0.72 0.99 0.00 0.00 0.00 175.76 178.15 2ka7 s THR 21 N -0.93 4.69 -0.20 0.00 2.01 -0.91 -1.78 115.64 118.52 2ka7 s THR 21 Ca 0.15 1.55 -0.05 0.00 0.31 0.00 0.00 61.69 63.65 2ka7 s THR 21 Cb -0.11 -4.07 -0.02 0.00 0.01 0.00 0.00 72.50 68.30 2ka7 s THR 21 CO 0.05 0.42 0.00 -0.69 -0.69 0.00 0.00 174.62 173.71 2ka7 s VAL 22 N -0.36 3.95 0.27 3.82 1.01 -0.21 -0.70 120.40 128.19 2ka7 s VAL 22 Ca 0.36 -0.31 -0.16 0.00 0.00 0.00 0.00 61.98 61.87 2ka7 s VAL 22 Cb -0.21 -2.79 0.01 0.00 0.00 0.00 0.00 36.38 33.39 2ka7 s VAL 22 CO 0.22 0.42 0.60 -0.83 0.00 0.00 0.00 175.10 175.52 2ka7 s GLY 23 N 1.05 0.30 0.20 4.51 0.00 -1.19 -1.13 107.32 111.07 2ka7 s GLY 23 Ca 0.02 -0.66 -0.11 0.00 0.00 0.00 0.00 44.72 43.97 2ka7 s GLY 23 CO 0.02 -0.40 0.55 -0.26 0.00 0.00 0.00 173.10 173.01 2ka7 s ILE 24 N -3.82 4.91 0.63 0.90 -4.36 -1.26 -1.61 121.20 116.59 2ka7 s ILE 24 Ca 0.18 0.59 -0.13 0.00 -0.26 0.00 0.00 60.65 61.02 2ka7 s ILE 24 Cb -0.03 -3.65 -0.02 0.00 1.25 0.00 0.00 42.46 40.00 2ka7 s ILE 24 CO 0.09 0.04 1.04 0.42 0.24 0.00 0.00 174.94 176.77 2ka7 s THR 25 N -1.70 4.15 -0.67 8.37 -4.23 0.26 -4.51 115.64 117.31 2ka7 s THR 25 Ca 0.44 0.82 0.00 0.00 -1.18 0.00 0.00 61.69 61.77 2ka7 s THR 25 Cb -0.12 -3.51 0.00 0.00 1.34 0.00 0.00 72.50 70.20 2ka7 s THR 25 CO 0.20 -0.80 0.00 -3.20 -0.54 0.00 0.00 174.62 170.29 2ka7 n ASN 26 N -2.59 0.00 -0.08 3.99 4.05 -1.26 -1.16 115.26 118.21 2ka7 n ASN 26 Ca 0.07 0.00 -0.11 0.00 0.45 0.00 0.00 54.58 54.99 2ka7 n ASN 26 Cb 0.53 0.00 -0.07 0.00 1.23 0.00 0.00 39.78 41.47 2ka7 n ASN 26 CO 0.00 0.00 0.00 1.57 -3.05 0.00 0.00 177.26 175.78 2ka7 n HIS 27 N 0.60 0.00 0.01 1.20 -0.00 -1.26 -4.81 115.22 110.96 2ka7 n HIS 27 Ca 0.00 0.00 -0.12 0.00 0.46 0.00 0.00 57.72 58.06 2ka7 n HIS 27 Cb 0.00 -0.63 -0.09 0.00 -0.12 0.00 0.00 29.99 29.15 2ka7 n HIS 27 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2ka7 h ALA 28 N -0.00 -0.09 -0.94 1.57 0.00 -1.45 -3.28 119.26 115.06 2ka7 h ALA 28 Ca -0.36 -0.27 0.26 0.00 0.00 0.00 0.00 54.91 54.54 2ka7 h ALA 28 Cb 1.56 0.04 -0.17 0.00 0.00 0.00 0.00 17.79 19.22 2ka7 h ALA 28 CO -0.06 -0.26 0.11 -0.56 0.00 0.00 0.00 179.25 178.49 2ka7 h GLN 29 N -0.68 0.06 -0.53 0.00 -0.00 -1.86 -0.54 115.11 111.56 2ka7 h GLN 29 Ca -0.01 -0.00 0.10 0.00 -0.00 0.00 0.00 58.65 58.74 2ka7 h GLN 29 Cb 0.56 -0.01 -0.08 0.00 -0.00 0.00 0.00 27.48 27.95 2ka7 h GLN 29 CO 0.02 0.04 0.04 1.49 -0.00 0.00 0.00 178.83 180.41 2ka7 h GLU 30 N 0.06 0.15 0.00 0.06 4.22 -1.87 0.17 114.58 117.38 2ka7 h GLU 30 Ca 0.59 -0.01 -0.03 0.00 0.08 0.00 0.00 59.36 59.99 2ka7 h GLU 30 Cb 1.23 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.45 2ka7 h GLU 30 CO -0.83 0.10 -0.14 1.96 -2.18 0.00 0.00 179.01 177.93 2ka7 h GLN 31 N 0.15 0.00 0.00 1.92 4.20 -1.23 -1.66 115.11 118.50 2ka7 h GLN 31 Ca 0.27 0.00 -0.24 0.00 0.06 0.00 0.00 58.65 58.74 2ka7 h GLN 31 Cb 0.41 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.15 2ka7 h GLN 31 CO -0.42 0.14 -1.52 -0.07 -0.67 0.00 0.00 178.83 176.29 2ka7 h LEU 32 N 0.00 0.00 0.00 1.46 3.38 -1.10 -3.51 115.31 115.54 2ka7 h LEU 32 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2ka7 h LEU 32 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 2ka7 h LEU 32 CO 0.02 0.85 0.00 0.61 0.09 0.00 0.00 178.44 180.01 2ka7 n GLY 33 N 1.48 2.40 3.62 0.83 0.00 0.51 -4.66 105.19 109.37 2ka7 n GLY 33 Ca -0.13 -0.45 -0.43 0.00 0.00 0.00 0.00 46.02 45.02 2ka7 n GLY 33 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2ka7 s ASP 34 N -4.00 5.90 0.71 1.61 1.01 -1.26 -4.80 116.67 115.84 2ka7 s ASP 34 Ca 0.00 1.90 -0.01 0.00 0.71 0.00 0.00 52.55 55.15 2ka7 s ASP 34 Cb 0.00 -2.52 0.03 0.00 1.01 0.00 0.00 42.92 41.43 2ka7 s ASP 34 CO 0.00 -1.60 0.16 0.52 0.21 0.00 0.00 175.17 174.46 2ka7 n VAL 35 N 7.00 0.00 0.00 -1.27 0.31 -1.26 -3.43 118.33 119.68 2ka7 n VAL 35 Ca 0.25 -0.18 0.00 0.00 -0.01 0.00 0.00 64.34 64.40 2ka7 n VAL 35 Cb 0.45 -1.62 0.00 0.00 -0.91 0.00 0.00 33.84 31.76 2ka7 n VAL 35 CO 0.00 0.00 0.00 0.55 -1.32 0.00 0.00 176.83 176.06 2ka7 n VAL 36 N -1.91 0.00 -3.65 2.52 3.14 -1.26 -4.60 118.33 112.57 2ka7 n VAL 36 Ca 0.02 0.00 -0.15 0.00 -2.96 0.00 0.00 64.34 61.25 2ka7 n VAL 36 Cb 0.08 0.00 -0.07 0.00 -1.06 0.00 0.00 33.84 32.79 2ka7 n VAL 36 CO 0.00 0.00 0.00 -0.47 -6.46 0.00 0.00 176.83 169.90 2ka7 s TYR 37 N -1.10 -0.41 -0.10 1.45 5.04 -0.93 -4.78 117.35 116.52 2ka7 s TYR 37 Ca 0.00 0.70 -0.07 0.00 -2.44 0.00 0.00 57.07 55.25 2ka7 s TYR 37 Cb 0.00 0.24 0.03 0.00 0.35 0.00 0.00 41.96 42.59 2ka7 s TYR 37 CO 0.00 -0.49 0.25 0.14 -1.34 0.00 0.00 175.55 174.11 2ka7 s VAL 38 N -1.22 -0.02 0.11 3.14 -7.23 -1.26 -1.86 120.40 112.06 2ka7 s VAL 38 Ca -0.12 0.07 -0.14 0.00 -1.81 0.00 0.00 61.98 59.98 2ka7 s VAL 38 Cb -0.03 -0.36 -0.06 0.00 0.56 0.00 0.00 36.38 36.48 2ka7 s VAL 38 CO 0.07 0.03 0.50 -0.62 -0.31 0.00 0.00 175.10 174.76 2ka7 s ASP 39 N 0.65 6.80 -0.03 4.85 2.15 0.63 -4.86 116.67 126.86 2ka7 s ASP 39 Ca -0.04 1.01 -0.02 0.00 0.43 0.00 0.00 52.55 53.92 2ka7 s ASP 39 Cb -0.06 -2.26 0.01 0.00 -0.30 0.00 0.00 42.92 40.31 2ka7 s ASP 39 CO -0.04 0.16 0.06 -0.76 -0.17 0.00 0.00 175.17 174.43 2ka7 s LEU 40 N -1.77 1.63 1.02 -1.34 2.01 -1.26 -3.97 118.68 114.99 2ka7 s LEU 40 Ca 0.34 0.13 -0.16 0.00 0.01 0.00 0.00 54.13 54.45 2ka7 s LEU 40 Cb -0.15 0.19 0.21 0.00 0.01 0.00 0.00 46.19 46.45 2ka7 s LEU 40 CO 0.18 -0.04 1.21 -2.16 1.01 0.00 0.00 176.35 176.55 2ka7 s PRO 41 N 0.21 0.25 0.37 1.29 0.04 -1.11 -4.97 135.00 131.09 2ka7 s PRO 41 Ca -0.01 -0.12 -0.22 0.00 0.04 0.00 0.00 61.00 60.69 2ka7 s PRO 41 Cb -0.02 -1.77 -0.10 0.00 0.04 0.00 0.00 34.50 32.64 2ka7 s PRO 41 CO -0.01 -2.72 0.90 -2.00 0.04 0.00 0.00 177.00 173.22 2ka7 s GLU 42 N -5.59 4.31 0.00 4.56 2.12 -1.26 -4.89 118.70 117.94 2ka7 s GLU 42 Ca 0.70 1.10 0.00 0.00 0.36 0.00 0.00 54.97 57.13 2ka7 s GLU 42 Cb -0.08 -2.45 0.00 0.00 0.26 0.00 0.00 34.13 31.86 2ka7 s GLU 42 CO 0.54 0.12 0.34 1.55 -0.54 0.00 0.00 175.26 177.26 2ka7 n VAL 43 N -0.15 0.00 -1.69 3.70 3.14 -1.26 -1.30 118.33 120.78 2ka7 n VAL 43 Ca 0.04 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.42 2ka7 n VAL 43 Cb 0.53 -0.27 0.00 0.00 -1.06 0.00 0.00 33.84 33.04 2ka7 n VAL 43 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2ka7 n GLY 44 N 0.19 0.52 3.77 7.55 0.00 -1.12 -3.77 105.19 112.32 2ka7 n GLY 44 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2ka7 n GLY 44 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2ka7 s ARG 45 N 0.00 4.12 0.13 1.61 3.52 -0.42 -4.60 118.95 123.31 2ka7 s ARG 45 Ca 0.00 2.56 -0.20 0.00 -0.13 0.00 0.00 55.73 57.96 2ka7 s ARG 45 Cb 0.00 -2.98 -0.07 0.00 -1.56 0.00 0.00 34.95 30.33 2ka7 s ARG 45 CO 0.00 -0.55 0.64 -1.21 -0.81 0.00 0.00 175.30 173.37 2ka7 s GLU 46 N -1.72 4.27 0.26 5.12 2.02 -1.26 -0.66 118.70 126.73 2ka7 s GLU 46 Ca 0.55 0.83 0.01 0.00 0.02 0.00 0.00 54.97 56.38 2ka7 s GLU 46 Cb -0.47 -3.15 -0.05 0.00 0.10 0.00 0.00 34.13 30.57 2ka7 s GLU 46 CO 0.59 0.56 0.11 0.14 0.02 0.00 0.00 175.26 176.68 2ka7 s VAL 47 N -1.23 0.51 0.19 2.63 -7.23 -0.10 -4.97 120.40 110.20 2ka7 s VAL 47 Ca 0.34 -2.00 0.07 0.00 -1.81 0.00 0.00 61.98 58.58 2ka7 s VAL 47 Cb -0.19 -2.61 -0.05 0.00 0.56 0.00 0.00 36.38 34.09 2ka7 s VAL 47 CO 0.21 0.00 -0.14 -0.54 -0.31 0.00 0.00 175.10 174.32 2ka7 s LYS 48 N -4.01 1.27 0.00 4.82 1.02 -1.26 -2.71 119.74 118.87 2ka7 s LYS 48 Ca 0.37 -1.55 0.00 0.00 0.02 0.00 0.00 55.97 54.81 2ka7 s LYS 48 Cb 0.07 -1.02 0.00 0.00 -0.52 0.00 0.00 37.83 36.36 2ka7 s LYS 48 CO 0.14 0.17 0.06 0.36 -0.92 0.00 0.00 175.35 175.15 2ka7 n LYS 49 N -0.31 0.06 -2.72 1.68 -0.00 -1.21 -2.57 118.16 113.10 2ka7 n LYS 49 Ca -0.09 0.00 -0.07 0.00 -0.00 0.00 0.00 58.31 58.16 2ka7 n LYS 49 Cb 0.60 -1.00 0.07 0.00 -0.00 0.00 0.00 35.03 34.70 2ka7 n LYS 49 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2ka7 n GLY 50 N -0.39 -0.54 2.78 2.58 0.00 -0.97 -4.57 105.19 104.08 2ka7 n GLY 50 Ca 0.00 0.43 -0.15 0.00 0.00 0.00 0.00 46.02 46.30 2ka7 n GLY 50 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2ka7 s GLU 51 N 0.43 -0.03 -0.45 1.61 2.12 -1.06 -4.89 118.70 116.43 2ka7 s GLU 51 Ca 0.28 0.23 -0.29 0.00 0.36 0.00 0.00 54.97 55.55 2ka7 s GLU 51 Cb 0.23 -0.26 0.03 0.00 0.26 0.00 0.00 34.13 34.39 2ka7 s GLU 51 CO -0.17 -0.18 1.17 0.08 -0.54 0.00 0.00 175.26 175.61 2ka7 s VAL 52 N 1.17 4.19 0.00 3.70 1.01 -1.26 -0.10 120.40 129.11 2ka7 s VAL 52 Ca -0.08 1.24 0.00 0.00 0.00 0.00 0.00 61.98 63.13 2ka7 s VAL 52 Cb -0.13 -4.54 0.00 0.00 0.00 0.00 0.00 36.38 31.71 2ka7 s VAL 52 CO -0.03 -0.93 0.01 1.33 0.00 0.00 0.00 175.10 175.47 2ka7 n VAL 53 N 6.78 0.00 -2.71 2.92 0.24 -1.09 -4.92 118.33 119.55 2ka7 n VAL 53 Ca 0.13 -0.01 -0.05 0.00 -2.04 0.00 0.00 64.34 62.37 2ka7 n VAL 53 Cb 0.49 1.76 0.09 0.00 -1.47 0.00 0.00 33.84 34.71 2ka7 n VAL 53 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2ka7 n ALA 54 N -0.00 2.40 -1.49 2.33 0.00 -1.21 -2.76 120.51 119.78 2ka7 n ALA 54 Ca 0.00 -1.84 -0.41 0.00 0.00 0.00 0.00 53.44 51.19 2ka7 n ALA 54 Cb 0.19 -0.91 0.01 0.00 0.00 0.00 0.00 19.45 18.74 2ka7 n ALA 54 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2ka7 n SER 55 N -0.77 -0.38 -4.01 0.00 7.64 -1.25 -3.75 113.62 111.09 2ka7 n SER 55 Ca -0.03 0.91 -0.31 0.00 1.01 0.00 0.00 58.87 60.45 2ka7 n SER 55 Cb 0.84 -1.18 -0.15 0.00 -1.01 0.00 0.00 64.21 62.71 2ka7 n SER 55 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2ka7 s ILE 56 N -1.46 1.95 -0.16 0.44 1.01 0.44 -0.27 121.20 123.16 2ka7 s ILE 56 Ca 0.64 -1.65 -0.16 0.00 0.00 0.00 0.00 60.65 59.48 2ka7 s ILE 56 Cb -0.57 -2.20 -0.04 0.00 0.01 0.00 0.00 42.46 39.66 2ka7 s ILE 56 CO 0.57 -0.20 0.38 -1.61 0.00 0.00 0.00 174.94 174.08 2ka7 s GLU 57 N 1.17 4.27 0.16 2.79 8.01 -0.78 -0.58 118.70 133.73 2ka7 s GLU 57 Ca -0.03 0.24 0.02 0.00 0.01 0.00 0.00 54.97 55.21 2ka7 s GLU 57 Cb -0.19 -3.46 0.02 0.00 -4.31 0.00 0.00 34.13 26.19 2ka7 s GLU 57 CO -0.07 0.14 0.17 -1.13 0.01 0.00 0.00 175.26 174.38 2ka7 n SER 58 N 3.84 1.04 0.01 -0.19 3.41 0.12 -2.18 113.62 119.67 2ka7 n SER 58 Ca -0.09 -1.47 0.22 0.00 -0.26 0.00 0.00 58.87 57.27 2ka7 n SER 58 Cb 0.52 -0.06 0.73 0.00 -0.26 0.00 0.00 64.21 65.13 2ka7 n SER 58 CO 0.00 0.00 0.00 -0.37 -0.16 0.00 0.00 175.04 174.51 2ka7 h VAL 59 N 0.29 0.44 0.00 -3.33 -1.51 -1.84 -3.24 116.25 107.06 2ka7 h VAL 59 Ca -0.09 0.00 -0.13 0.00 -1.23 0.00 0.00 66.70 65.25 2ka7 h VAL 59 Cb 0.35 0.62 -0.15 0.00 -2.13 0.00 0.00 31.29 29.98 2ka7 h VAL 59 CO 0.13 0.00 -0.35 1.17 -1.23 0.00 0.00 177.57 177.29 2ka7 n LYS 60 N -3.90 0.00 -4.01 5.19 4.81 -1.26 -5.15 118.16 113.83 2ka7 n LYS 60 Ca 0.10 -1.06 -0.16 0.00 -0.87 0.00 0.00 58.31 56.32 2ka7 n LYS 60 Cb 0.72 0.45 -0.05 0.00 0.02 0.00 0.00 35.03 36.16 2ka7 n LYS 60 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2ka7 n ALA 61 N 0.04 0.15 -2.95 3.14 0.00 -1.23 -5.18 120.51 114.49 2ka7 n ALA 61 Ca -0.25 -1.71 -0.09 0.00 0.00 0.00 0.00 53.44 51.39 2ka7 n ALA 61 Cb 0.73 1.38 -0.11 0.00 0.00 0.00 0.00 19.45 21.46 2ka7 n ALA 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ka7 s ALA 62 N -3.00 0.14 -0.16 0.00 0.00 -1.26 -0.70 121.76 116.78 2ka7 s ALA 62 Ca 0.33 -0.61 -0.04 0.00 0.00 0.00 0.00 51.96 51.64 2ka7 s ALA 62 Cb 0.00 0.15 0.05 0.00 0.00 0.00 0.00 23.12 23.33 2ka7 s ALA 62 CO 0.23 -0.16 0.07 0.00 0.00 0.00 0.00 175.76 175.90 2ka7 s ALA 63 N -1.54 0.57 -0.20 0.00 0.00 0.25 -4.99 121.76 115.85 2ka7 s ALA 63 Ca -0.15 -0.34 -0.29 0.00 0.00 0.00 0.00 51.96 51.18 2ka7 s ALA 63 Cb -0.09 -1.01 -0.03 0.00 0.00 0.00 0.00 23.12 21.98 2ka7 s ALA 63 CO -0.01 -1.06 1.68 -0.51 0.00 0.00 0.00 175.76 175.86 2ka7 s ASP 64 N 2.06 6.32 -0.67 0.00 1.01 -1.26 -0.42 116.67 123.71 2ka7 s ASP 64 Ca 0.02 1.71 -0.27 0.00 0.71 0.00 0.00 52.55 54.71 2ka7 s ASP 64 Cb -0.16 -2.53 0.02 0.00 1.01 0.00 0.00 42.92 41.26 2ka7 s ASP 64 CO -0.08 -1.29 1.39 -0.69 0.21 0.00 0.00 175.17 174.71 2ka7 s VAL 65 N 5.35 3.70 0.01 -1.27 1.01 -1.25 -4.92 120.40 123.04 2ka7 s VAL 65 Ca 0.74 0.47 -0.30 0.00 0.00 0.00 0.00 61.98 62.89 2ka7 s VAL 65 Cb -0.27 -4.67 -0.06 0.00 0.00 0.00 0.00 36.38 31.38 2ka7 s VAL 65 CO 0.30 -1.55 1.53 -0.31 0.00 0.00 0.00 175.10 175.07 2ka7 s TYR 66 N 6.24 2.56 0.17 5.22 2.02 -1.26 -2.69 117.35 129.62 2ka7 s TYR 66 Ca 0.44 0.55 -0.33 0.00 -0.37 0.00 0.00 57.07 57.35 2ka7 s TYR 66 Cb -0.09 -3.80 -0.15 0.00 -0.40 0.00 0.00 41.96 37.51 2ka7 s TYR 66 CO 0.19 -3.15 1.33 0.00 -1.57 0.00 0.00 175.55 172.35 2ka7 n ALA 67 N 5.77 -0.00 0.07 3.71 0.00 0.86 -4.72 120.51 126.19 2ka7 n ALA 67 Ca 0.15 0.46 -0.10 0.00 0.00 0.00 0.00 53.44 53.94 2ka7 n ALA 67 Cb 0.42 -2.15 -0.13 0.00 0.00 0.00 0.00 19.45 17.59 2ka7 n ALA 67 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2ka7 h PRO 68 N 4.22 0.10 -5.74 0.00 0.13 -1.81 -2.58 132.00 126.32 2ka7 h PRO 68 Ca -0.45 -0.16 -0.49 0.00 -0.87 0.00 0.00 66.00 64.03 2ka7 h PRO 68 Cb 1.31 0.06 -0.16 0.00 0.13 0.00 0.00 31.00 32.34 2ka7 h PRO 68 CO 0.76 1.04 -0.75 -0.51 -0.23 0.00 0.00 178.00 178.30 2ka7 s LEU 69 N -6.81 2.51 0.53 1.56 2.01 -1.26 -4.60 118.68 112.62 2ka7 s LEU 69 Ca -0.02 -0.95 -0.17 0.00 0.01 0.00 0.00 54.13 53.00 2ka7 s LEU 69 Cb 0.09 -0.75 -0.07 0.00 0.01 0.00 0.00 46.19 45.47 2ka7 s LEU 69 CO 0.84 -0.10 1.02 -0.44 1.01 0.00 0.00 176.35 178.67 2ka7 s SER 70 N -3.05 6.29 0.00 2.29 0.01 -1.26 -3.32 113.70 114.66 2ka7 s SER 70 Ca 0.20 1.72 0.00 0.00 1.31 0.00 0.00 55.95 59.18 2ka7 s SER 70 Cb -0.03 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.67 2ka7 s SER 70 CO 0.07 -0.81 0.00 0.61 0.41 0.00 0.00 173.24 173.52 2ka7 n GLY 71 N -1.11 -0.59 2.86 3.44 0.00 -1.10 -4.29 105.19 104.40 2ka7 n GLY 71 Ca 0.08 -1.49 -0.18 0.00 0.00 0.00 0.00 46.02 44.42 2ka7 n GLY 71 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ka7 s LYS 72 N -1.96 0.51 0.62 1.61 1.02 -0.88 -0.93 119.74 119.72 2ka7 s LYS 72 Ca 0.00 -0.02 -0.18 0.00 0.02 0.00 0.00 55.97 55.79 2ka7 s LYS 72 Cb 0.00 -0.60 -0.03 0.00 -0.52 0.00 0.00 37.83 36.69 2ka7 s LYS 72 CO 0.00 -0.09 1.23 0.42 -0.92 0.00 0.00 175.35 176.00 2ka7 s ILE 73 N 0.85 2.43 0.00 2.17 -1.09 0.16 -0.27 121.20 125.46 2ka7 s ILE 73 Ca -0.10 0.27 0.00 0.00 -2.23 0.00 0.00 60.65 58.59 2ka7 s ILE 73 Cb -0.13 -3.09 0.00 0.00 -1.58 0.00 0.00 42.46 37.66 2ka7 s ILE 73 CO -0.01 -0.06 0.10 1.33 -1.23 0.00 0.00 174.94 175.07 2ka7 n VAL 74 N -1.74 0.00 -3.53 2.92 0.24 -0.19 -2.80 118.33 113.23 2ka7 n VAL 74 Ca 0.14 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.33 2ka7 n VAL 74 Cb 0.49 0.93 -0.03 0.00 -1.47 0.00 0.00 33.84 33.76 2ka7 n VAL 74 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 2ka7 s GLU 75 N 0.00 1.18 0.21 7.34 2.12 -0.84 -4.94 118.70 123.76 2ka7 s GLU 75 Ca 0.00 -0.60 0.00 0.00 0.36 0.00 0.00 54.97 54.74 2ka7 s GLU 75 Cb 0.00 0.53 -0.05 0.00 0.26 0.00 0.00 34.13 34.87 2ka7 s GLU 75 CO 0.00 -0.49 0.08 0.14 -0.54 0.00 0.00 175.26 174.45 2ka7 s VAL 76 N -3.78 0.38 -0.75 3.70 -7.23 -1.26 -0.66 120.40 110.81 2ka7 s VAL 76 Ca 0.02 -1.98 0.04 0.00 -1.81 0.00 0.00 61.98 58.25 2ka7 s VAL 76 Cb 0.00 -2.40 0.19 0.00 0.56 0.00 0.00 36.38 34.74 2ka7 s VAL 76 CO -0.12 -0.18 0.61 -3.20 -0.31 0.00 0.00 175.10 171.89 2ka7 n ASN 77 N -0.31 3.43 0.06 4.85 5.15 -0.33 -4.92 115.26 123.19 2ka7 n ASN 77 Ca -0.02 -3.23 0.04 0.00 -0.60 0.00 0.00 54.58 50.77 2ka7 n ASN 77 Cb 0.65 -0.82 0.19 0.00 -0.53 0.00 0.00 39.78 39.27 2ka7 n ASN 77 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2ka7 n GLU 78 N 1.88 0.05 -0.12 1.20 1.02 -1.26 -1.30 120.64 122.10 2ka7 n GLU 78 Ca 0.22 0.49 0.21 0.00 -0.02 0.00 0.00 57.16 58.06 2ka7 n GLU 78 Cb 0.36 -1.76 0.63 0.00 -0.02 0.00 0.00 31.44 30.66 2ka7 n GLU 78 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 2ka7 h LYS 79 N 0.00 0.15 0.00 3.49 1.57 -1.95 -1.44 116.57 118.39 2ka7 h LYS 79 Ca 0.00 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 2ka7 h LYS 79 Cb 0.20 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.48 2ka7 h LYS 79 CO 0.00 0.10 -0.10 -0.07 -0.57 0.00 0.00 179.45 178.81 2ka7 h LEU 80 N 0.15 0.00 0.00 2.94 -0.00 -1.40 -0.18 115.31 116.83 2ka7 h LEU 80 Ca 0.36 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.24 2ka7 h LEU 80 Cb 1.20 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.86 2ka7 h LEU 80 CO -0.06 0.10 0.00 -0.67 -0.00 0.00 0.00 178.44 177.81 2ka7 n ASP 81 N -3.18 0.00 0.00 -0.43 2.03 -0.54 -2.33 116.55 112.11 2ka7 n ASP 81 Ca 0.02 0.15 0.00 0.00 0.52 0.00 0.00 54.79 55.47 2ka7 n ASP 81 Cb 0.44 -0.30 0.00 0.00 -0.72 0.00 0.00 41.12 40.54 2ka7 n ASP 81 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 2ka7 n THR 82 N -1.30 0.00 -3.06 5.18 -2.24 -1.11 -4.93 114.28 106.81 2ka7 n THR 82 Ca 0.05 0.00 -0.26 0.00 -2.27 0.00 0.00 64.05 61.57 2ka7 n THR 82 Cb 0.09 -0.10 -0.05 0.00 -2.10 0.00 0.00 70.33 68.17 2ka7 n THR 82 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2ka7 n GLU 83 N -1.10 2.76 0.27 -0.78 -0.58 -0.10 -4.88 120.64 116.23 2ka7 n GLU 83 Ca 0.00 -4.60 0.16 0.00 -0.42 0.00 0.00 57.16 52.30 2ka7 n GLU 83 Cb 0.06 -2.15 0.62 0.00 -0.57 0.00 0.00 31.44 29.41 2ka7 n GLU 83 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 2ka7 h PRO 84 N 3.22 0.00 0.00 3.49 0.13 -1.67 -1.85 132.00 135.32 2ka7 h PRO 84 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 2ka7 h PRO 84 Cb 0.60 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.73 2ka7 h PRO 84 CO 0.77 0.03 0.00 0.93 -0.23 0.00 0.00 178.00 179.50 2ka7 h GLU 85 N 0.00 0.00 0.00 0.86 5.08 -1.88 -3.14 114.58 115.50 2ka7 h GLU 85 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2ka7 h GLU 85 Cb 0.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.83 2ka7 h GLU 85 CO 0.00 0.00 0.00 -0.07 -1.00 0.00 0.00 179.01 177.94 2ka7 h LEU 86 N 0.00 0.00 -1.66 1.33 3.38 -1.73 0.14 115.31 116.78 2ka7 h LEU 86 Ca 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 2ka7 h LEU 86 Cb 0.04 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 2ka7 h LEU 86 CO 0.00 0.00 -0.14 0.40 0.09 0.00 0.00 178.44 178.79 2ka7 h ILE 87 N 0.00 0.47 0.07 1.22 2.04 -1.75 -1.66 117.51 117.91 2ka7 h ILE 87 Ca 0.00 -0.70 -0.00 0.00 1.00 0.00 0.00 64.86 65.15 2ka7 h ILE 87 Cb 0.33 1.49 0.00 0.00 -0.74 0.00 0.00 36.82 37.90 2ka7 h ILE 87 CO 0.00 0.13 -0.04 0.78 0.00 0.00 0.00 178.15 179.03 2ka7 h ASN 88 N 0.00 -0.08 -0.96 1.72 2.35 -0.98 -3.17 115.58 114.45 2ka7 h ASN 88 Ca -0.00 -0.50 0.01 0.00 -0.55 0.00 0.00 56.30 55.25 2ka7 h ASN 88 Cb 0.48 0.02 -0.05 0.00 0.05 0.00 0.00 38.32 38.82 2ka7 h ASN 88 CO 0.02 0.60 0.64 0.50 -1.65 0.00 0.00 177.43 177.53 2ka7 h LYS 89 N -0.91 1.26 -0.61 0.81 3.11 -1.20 -3.37 116.57 115.67 2ka7 h LYS 89 Ca -0.01 -0.08 -0.16 0.00 -2.81 0.00 0.00 60.65 57.60 2ka7 h LYS 89 Cb 0.58 -0.28 -0.15 0.00 -1.00 0.00 0.00 32.23 31.37 2ka7 h LYS 89 CO 0.02 0.84 -0.45 -3.47 -2.81 0.00 0.00 179.45 173.57 2ka7 n ASP 90 N -4.42 -3.08 0.32 4.20 2.03 -0.65 -5.04 116.55 109.92 2ka7 n ASP 90 Ca 0.11 -2.86 0.21 0.00 0.52 0.00 0.00 54.79 52.78 2ka7 n ASP 90 Cb 0.01 1.67 1.09 0.00 -0.72 0.00 0.00 41.12 43.17 2ka7 n ASP 90 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2ka7 h PRO 91 N 4.58 0.00 0.00 -0.67 0.13 -1.64 0.15 132.00 134.55 2ka7 h PRO 91 Ca -0.02 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.10 2ka7 h PRO 91 Cb 1.09 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.20 2ka7 h PRO 91 CO 0.09 0.00 -0.22 0.39 -0.23 0.00 0.00 178.00 178.03 2ka7 n GLU 92 N -3.04 1.07 0.00 0.86 1.02 -1.26 -4.32 120.64 114.97 2ka7 n GLU 92 Ca -0.02 -2.43 0.00 0.00 -0.02 0.00 0.00 57.16 54.69 2ka7 n GLU 92 Cb 0.12 -1.29 0.00 0.00 -0.02 0.00 0.00 31.44 30.25 2ka7 n GLU 92 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ka7 n GLY 93 N -1.06 0.11 0.14 0.62 0.00 -1.15 -5.01 105.19 98.85 2ka7 n GLY 93 Ca 0.13 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.94 2ka7 n GLY 93 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2ka7 h GLU 94 N 0.00 0.40 -1.99 1.61 4.39 -1.85 -3.39 114.58 113.75 2ka7 h GLU 94 Ca 0.00 -0.69 -0.14 0.00 0.34 0.00 0.00 59.36 58.87 2ka7 h GLU 94 Cb 0.00 0.26 -0.05 0.00 -0.10 0.00 0.00 28.75 28.86 2ka7 h GLU 94 CO 0.00 1.31 -0.22 0.41 -1.16 0.00 0.00 179.01 179.36 2ka7 n GLY 95 N 1.76 2.89 3.90 -3.84 0.00 0.53 -4.91 105.19 105.52 2ka7 n GLY 95 Ca -0.20 -0.81 -0.29 0.00 0.00 0.00 0.00 46.02 44.73 2ka7 n GLY 95 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2ka7 s TRP 96 N 0.52 3.05 -0.01 1.61 1.48 -1.26 -4.39 118.94 119.94 2ka7 s TRP 96 Ca 0.43 0.76 -0.01 0.00 -1.06 0.00 0.00 56.10 56.22 2ka7 s TRP 96 Cb 0.21 -3.30 -0.00 0.00 -1.16 0.00 0.00 33.47 29.22 2ka7 s TRP 96 CO -0.01 -1.52 -0.02 1.28 -4.06 0.00 0.00 176.95 172.63 2ka7 n LEU 97 N -3.13 0.13 -4.26 -4.66 4.77 -0.28 -4.73 117.00 104.82 2ka7 n LEU 97 Ca 0.08 0.02 -0.16 0.00 -0.03 0.00 0.00 56.01 55.92 2ka7 n LEU 97 Cb 0.60 -0.35 -0.09 0.00 -2.33 0.00 0.00 43.42 41.24 2ka7 n LEU 97 CO 0.56 -0.49 -0.20 0.72 -1.33 0.00 0.00 177.39 176.64 2ka7 s PHE 98 N -1.12 1.44 0.09 -1.77 -0.12 -1.18 -1.19 117.98 114.12 2ka7 s PHE 98 Ca -0.01 -1.43 0.06 0.00 -0.05 0.00 0.00 56.93 55.50 2ka7 s PHE 98 Cb 0.00 -0.70 -0.03 0.00 -0.63 0.00 0.00 43.02 41.66 2ka7 s PHE 98 CO 0.02 -0.64 -0.17 0.15 -0.05 0.00 0.00 175.22 174.54 2ka7 s LYS 99 N -3.90 0.95 -0.01 1.99 1.02 0.17 -1.04 119.74 118.92 2ka7 s LYS 99 Ca 0.38 -1.06 -0.07 0.00 0.02 0.00 0.00 55.97 55.24 2ka7 s LYS 99 Cb 0.06 -1.05 0.00 0.00 -0.52 0.00 0.00 37.83 36.32 2ka7 s LYS 99 CO 0.17 0.24 0.15 0.00 -0.92 0.00 0.00 175.35 174.98 2ka7 s MET 100 N -1.88 0.45 -0.16 1.68 0.23 -0.73 -1.03 119.30 117.87 2ka7 s MET 100 Ca 0.02 -0.32 -0.29 0.00 -1.03 0.00 0.00 55.69 54.07 2ka7 s MET 100 Cb -0.10 0.19 -0.03 0.00 -1.53 0.00 0.00 34.83 33.36 2ka7 s MET 100 CO 0.03 -0.11 1.56 -2.00 -2.03 0.00 0.00 175.02 172.47 2ka7 s GLU 101 N -1.20 4.00 -0.69 3.16 2.12 0.63 -1.12 118.70 125.61 2ka7 s GLU 101 Ca -0.13 1.82 -0.26 0.00 0.36 0.00 0.00 54.97 56.76 2ka7 s GLU 101 Cb -0.07 -3.97 -0.03 0.00 0.26 0.00 0.00 34.13 30.33 2ka7 s GLU 101 CO 0.01 -1.04 1.86 0.96 -0.54 0.00 0.00 175.26 176.52 2ka7 s ILE 102 N 4.50 3.39 0.38 -3.70 -4.36 0.09 -2.08 121.20 119.41 2ka7 s ILE 102 Ca 0.69 0.07 0.05 0.00 -0.26 0.00 0.00 60.65 61.20 2ka7 s ILE 102 Cb -0.27 -3.99 0.25 0.00 1.25 0.00 0.00 42.46 39.70 2ka7 s ILE 102 CO 0.26 -0.95 2.02 0.28 0.24 0.00 0.00 174.94 176.79 2ka7 h SER 103 N 13.97 0.54 -2.68 4.36 0.02 -1.85 -3.39 113.55 124.52 2ka7 h SER 103 Ca -0.17 -0.03 -0.60 0.00 -0.84 0.00 0.00 61.79 60.15 2ka7 h SER 103 Cb 1.12 -0.14 -0.39 0.00 0.14 0.00 0.00 62.40 63.13 2ka7 h SER 103 CO 1.22 0.43 -0.85 -1.81 -1.14 0.00 0.00 176.83 174.67 2ka7 s ASP 104 N -6.64 2.55 0.17 3.07 1.11 -1.26 -4.92 116.67 110.75 2ka7 s ASP 104 Ca -0.09 -3.03 0.16 0.00 0.18 0.00 0.00 52.55 49.77 2ka7 s ASP 104 Cb 0.17 -0.73 0.76 0.00 1.07 0.00 0.00 42.92 44.20 2ka7 s ASP 104 CO 0.75 -0.19 1.50 1.21 1.18 0.00 0.00 175.17 179.62 2ka7 n GLU 105 N 2.94 0.10 0.23 8.23 2.13 -1.26 -2.81 120.64 130.20 2ka7 n GLU 105 Ca 0.23 0.46 0.07 0.00 0.66 0.00 0.00 57.16 58.58 2ka7 n GLU 105 Cb 0.42 -1.75 0.55 0.00 0.27 0.00 0.00 31.44 30.93 2ka7 n GLU 105 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 2ka7 h GLY 106 N 1.22 0.00 1.96 8.31 0.00 -1.97 -2.23 103.07 110.35 2ka7 h GLY 106 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.13 2ka7 h GLY 106 CO 0.00 0.00 -0.95 0.83 0.00 0.00 0.00 176.54 176.42 2ka7 h GLU 107 N 0.00 0.00 -0.95 4.80 5.08 -1.96 -3.36 114.58 118.19 2ka7 h GLU 107 Ca -0.00 0.00 0.26 0.00 -1.00 0.00 0.00 59.36 58.62 2ka7 h GLU 107 Cb 0.39 0.00 -0.17 0.00 0.50 0.00 0.00 28.75 29.47 2ka7 h GLU 107 CO 0.03 0.90 0.08 -0.07 -1.00 0.00 0.00 179.01 178.95 2ka7 h LEU 108 N 0.00 -0.36 -0.13 1.33 3.38 -1.57 -0.27 115.31 117.69 2ka7 h LEU 108 Ca -0.02 0.26 0.00 0.00 0.09 0.00 0.00 57.88 58.21 2ka7 h LEU 108 Cb 1.72 0.43 0.00 0.00 0.09 0.00 0.00 40.66 42.90 2ka7 h LEU 108 CO 0.12 -0.31 0.00 -1.84 0.09 0.00 0.00 178.44 176.50 2ka7 n GLU 109 N -5.42 0.06 0.07 1.13 -0.00 -1.26 -1.56 120.64 113.66 2ka7 n GLU 109 Ca 0.22 0.22 -0.13 0.00 -0.00 0.00 0.00 57.16 57.47 2ka7 n GLU 109 Cb 0.74 -1.60 -0.05 0.00 -0.00 0.00 0.00 31.44 30.53 2ka7 n GLU 109 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.13 177.35 2ka7 h ASP 110 N 0.00 0.52 -3.45 -1.84 3.58 -1.28 -3.48 116.42 110.47 2ka7 h ASP 110 Ca 0.00 -0.42 -0.43 0.00 0.42 0.00 0.00 57.03 56.60 2ka7 h ASP 110 Cb 0.38 -0.16 0.19 0.00 1.72 0.00 0.00 39.33 41.47 2ka7 h ASP 110 CO 0.00 1.22 0.07 -0.76 -2.88 0.00 0.00 179.24 176.89 2ka7 s LEU 111 N -7.69 0.86 -0.09 2.28 2.01 -0.60 -4.94 118.68 110.52 2ka7 s LEU 111 Ca -0.06 1.26 -0.30 0.00 0.01 0.00 0.00 54.13 55.05 2ka7 s LEU 111 Cb 0.09 -3.20 -0.04 0.00 0.01 0.00 0.00 46.19 43.05 2ka7 s LEU 111 CO 0.87 -3.96 1.47 -0.76 1.01 0.00 0.00 176.35 174.97 2ka7 s LEU 112 N -7.01 4.27 0.00 1.79 1.43 -1.11 -4.85 118.68 113.21 2ka7 s LEU 112 Ca 0.68 2.02 -0.23 0.00 -1.03 0.00 0.00 54.13 55.56 2ka7 s LEU 112 Cb -0.21 -3.54 0.36 0.00 0.03 0.00 0.00 46.19 42.83 2ka7 s LEU 112 CO 0.61 -0.83 0.86 0.47 0.23 0.00 0.00 176.35 177.69 2ka7 n ASP 113 N 6.66 -3.84 -0.03 2.29 8.00 -1.26 -0.41 116.55 127.97 2ka7 n ASP 113 Ca 0.15 -0.89 -0.12 0.00 0.71 0.00 0.00 54.79 54.64 2ka7 n ASP 113 Cb 0.44 -0.96 0.00 0.00 -0.02 0.00 0.00 41.12 40.58 2ka7 n ASP 113 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 2ka7 h GLU 114 N 0.00 0.70 -0.15 -1.24 4.81 -1.96 0.31 114.58 117.05 2ka7 h GLU 114 Ca -0.38 -0.46 -0.06 0.00 -0.13 0.00 0.00 59.36 58.32 2ka7 h GLU 114 Cb 1.27 0.06 -0.00 0.00 0.63 0.00 0.00 28.75 30.71 2ka7 h GLU 114 CO 0.23 1.08 -0.15 0.37 -0.73 0.00 0.00 179.01 179.82 2ka7 h GLN 115 N 0.53 0.37 0.00 1.92 4.15 -1.99 -3.09 115.11 116.99 2ka7 h GLN 115 Ca 0.00 -0.19 -0.08 0.00 0.77 0.00 0.00 58.65 59.15 2ka7 h GLN 115 Cb 1.17 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.85 2ka7 h GLN 115 CO 0.12 0.75 -0.38 0.00 -1.93 0.00 0.00 178.83 177.38 2ka7 h ALA 116 N 0.62 1.21 -0.15 3.38 0.00 -1.87 -2.14 119.26 120.31 2ka7 h ALA 116 Ca 0.02 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 2ka7 h ALA 116 Cb 0.68 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2ka7 h ALA 116 CO 0.04 0.48 0.05 -0.92 0.00 0.00 0.00 179.25 178.90 2ka7 h TYR 117 N 0.00 0.23 -0.85 0.00 3.20 -0.43 -0.44 116.97 118.68 2ka7 h TYR 117 Ca -0.00 -0.02 0.06 0.00 3.14 0.00 0.00 58.73 61.91 2ka7 h TYR 117 Cb 0.75 -0.07 -0.06 0.00 1.54 0.00 0.00 36.73 38.89 2ka7 h TYR 117 CO 0.00 0.31 0.52 0.37 -1.64 0.00 0.00 178.16 177.73 2ka7 h GLN 118 N 0.07 0.92 -0.44 1.82 4.15 -1.41 -0.32 115.11 119.91 2ka7 h GLN 118 Ca 0.05 -0.06 0.05 0.00 0.77 0.00 0.00 58.65 59.47 2ka7 h GLN 118 Cb 0.19 -0.21 -0.05 0.00 0.21 0.00 0.00 27.48 27.62 2ka7 h GLN 118 CO -0.00 0.61 0.16 1.49 -1.93 0.00 0.00 178.83 179.16 2ka7 h GLU 119 N 0.95 0.33 -0.83 1.69 4.81 -0.98 -2.16 114.58 118.38 2ka7 h GLU 119 Ca 0.37 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.57 2ka7 h GLU 119 Cb 0.18 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.45 2ka7 h GLU 119 CO -0.18 0.22 0.46 0.35 -0.73 0.00 0.00 179.01 179.13 2ka7 h PHE 120 N 0.34 1.14 0.00 0.92 3.57 -0.17 -0.75 116.94 121.98 2ka7 h PHE 120 Ca 0.20 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.68 2ka7 h PHE 120 Cb 0.19 -0.36 0.00 0.00 2.79 0.00 0.00 35.95 38.56 2ka7 h PHE 120 CO -0.15 0.78 0.06 0.00 -2.23 0.00 0.00 178.31 176.77 2ka7 h ALA 122 N 1.85 0.57 -0.35 0.00 0.00 -0.56 -3.32 119.26 117.45 2ka7 h ALA 122 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.69 2ka7 h ALA 122 Cb 0.11 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 17.76 2ka7 h ALA 122 CO 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 179.25 178.94 2ka7 n GLN 123 N -2.46 2.13 0.00 0.00 10.64 -0.61 -5.12 117.38 121.96 2ka7 n GLN 123 Ca 0.02 -3.42 0.00 0.00 -1.83 0.00 0.00 57.00 51.77 2ka7 n GLN 123 Cb 0.50 -1.87 0.00 0.00 -0.86 0.00 0.00 30.24 28.01 2ka7 n GLN 123 CO 0.00 0.00 0.00 -0.85 -1.83 0.00 0.00 177.06 174.38