#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2db9 n SER 2 N 0.00 -3.36 -3.55 1.61 7.64 -1.26 -5.08 113.62 109.63 2db9 n SER 2 Ca 0.00 1.48 -0.10 0.00 1.01 0.00 0.00 58.87 61.26 2db9 n SER 2 Cb 0.00 -4.99 -0.04 0.00 -1.01 0.00 0.00 64.21 58.17 2db9 n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2db9 s SER 3 N -0.60 -0.38 0.00 6.43 0.15 -1.26 -5.18 113.70 112.86 2db9 s SER 3 Ca -0.19 0.30 0.00 0.00 0.70 0.00 0.00 55.95 56.76 2db9 s SER 3 Cb 0.01 0.34 0.00 0.00 -1.71 0.00 0.00 66.02 64.66 2db9 s SER 3 CO 0.51 -0.44 0.00 0.61 1.20 0.00 0.00 173.24 175.12 2db9 n GLY 4 N 0.44 3.08 0.00 9.45 0.00 -1.26 -5.19 105.19 111.72 2db9 n GLY 4 Ca -0.10 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.76 2db9 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2db9 n SER 5 N 0.00 0.00 -3.51 1.61 7.64 -1.26 -5.19 113.62 112.91 2db9 n SER 5 Ca 0.00 0.00 -0.11 0.00 1.01 0.00 0.00 58.87 59.77 2db9 n SER 5 Cb 0.00 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.18 2db9 n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2db9 s SER 6 N 0.00 -0.50 -0.30 6.43 0.15 -1.26 -5.16 113.70 113.06 2db9 s SER 6 Ca 0.00 -0.13 -0.18 0.00 0.70 0.00 0.00 55.95 56.34 2db9 s SER 6 Cb 0.00 0.61 0.18 0.00 -1.71 0.00 0.00 66.02 65.10 2db9 s SER 6 CO 0.00 -1.03 1.23 -0.83 1.20 0.00 0.00 173.24 173.82 2db9 s GLY 7 N -2.78 -0.02 0.06 9.45 0.00 -1.26 -5.15 107.32 107.62 2db9 s GLY 7 Ca 0.03 3.23 -0.30 0.00 0.00 0.00 0.00 44.72 47.68 2db9 s GLY 7 CO -0.09 3.86 1.16 2.56 0.00 0.00 0.00 173.10 180.59 2db9 s PRO 8 N 2.81 4.46 -0.11 2.90 0.04 -1.26 -4.99 135.00 138.85 2db9 s PRO 8 Ca -0.08 1.72 -0.30 0.00 0.04 0.00 0.00 61.00 62.39 2db9 s PRO 8 Cb -0.07 -3.36 -0.02 0.00 0.04 0.00 0.00 34.50 31.09 2db9 s PRO 8 CO -0.09 -0.21 1.25 -1.25 0.04 0.00 0.00 177.00 176.74 2db9 s PRO 9 N 0.95 4.28 -0.42 0.56 0.04 -1.26 -4.96 135.00 134.20 2db9 s PRO 9 Ca 0.57 1.69 0.06 0.00 0.04 0.00 0.00 61.00 63.36 2db9 s PRO 9 Cb -0.28 -3.67 0.17 0.00 0.04 0.00 0.00 34.50 30.76 2db9 s PRO 9 CO 0.29 -0.59 0.54 0.15 0.04 0.00 0.00 177.00 177.43 2db9 s LYS 10 N 2.92 0.82 0.01 4.56 1.02 -1.26 -5.13 119.74 122.67 2db9 s LYS 10 Ca 0.56 -0.77 -0.07 0.00 0.02 0.00 0.00 55.97 55.72 2db9 s LYS 10 Cb -0.23 -0.32 0.02 0.00 -0.52 0.00 0.00 37.83 36.78 2db9 s LYS 10 CO 0.18 -1.24 0.30 0.43 -0.92 0.00 0.00 175.35 174.11 2db9 n SER 11 N 3.95 -0.32 -4.72 2.83 7.64 -1.26 -5.01 113.62 116.73 2db9 n SER 11 Ca 0.14 -1.09 -0.35 0.00 1.01 0.00 0.00 58.87 58.57 2db9 n SER 11 Cb 0.52 0.50 -0.08 0.00 -1.01 0.00 0.00 64.21 64.14 2db9 n SER 11 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 2db9 s GLN 12 N -2.01 3.89 -0.51 1.43 0.74 -1.26 -4.94 119.66 117.00 2db9 s GLN 12 Ca 0.07 -0.26 -0.28 0.00 0.05 0.00 0.00 55.36 54.94 2db9 s GLN 12 Cb -0.00 -3.26 0.01 0.00 1.10 0.00 0.00 33.01 30.86 2db9 s GLN 12 CO 0.00 0.41 1.46 -1.25 -0.55 0.00 0.00 175.29 175.37 2db9 s PRO 13 N 0.01 3.34 -0.01 1.67 0.04 -1.26 -0.96 135.00 137.82 2db9 s PRO 13 Ca 0.08 0.65 -0.01 0.00 0.04 0.00 0.00 61.00 61.76 2db9 s PRO 13 Cb -0.12 -4.12 0.00 0.00 0.04 0.00 0.00 34.50 30.31 2db9 s PRO 13 CO 0.00 -1.88 0.02 1.33 0.04 0.00 0.00 177.00 176.51 2db9 n VAL 14 N 6.98 -0.45 -0.14 -0.36 0.24 0.31 -4.67 118.33 120.23 2db9 n VAL 14 Ca 0.15 0.09 0.17 0.00 -2.04 0.00 0.00 64.34 62.70 2db9 n VAL 14 Cb 0.49 -0.62 0.54 0.00 -1.47 0.00 0.00 33.84 32.78 2db9 n VAL 14 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 2db9 h SER 15 N 1.38 0.32 -5.00 -1.34 0.02 -1.88 -3.43 113.55 103.63 2db9 h SER 15 Ca -0.02 0.02 -0.38 0.00 -0.84 0.00 0.00 61.79 60.58 2db9 h SER 15 Cb 0.21 -0.05 -0.14 0.00 0.14 0.00 0.00 62.40 62.57 2db9 h SER 15 CO 0.01 0.17 -0.57 -1.48 -1.14 0.00 0.00 176.83 173.81 2db9 s LEU 16 N -9.26 1.57 0.00 5.07 0.05 -1.26 -5.02 118.68 109.83 2db9 s LEU 16 Ca -0.07 -1.52 0.22 0.00 0.05 0.00 0.00 54.13 52.80 2db9 s LEU 16 Cb 0.21 0.25 1.01 0.00 -2.05 0.00 0.00 46.19 45.60 2db9 s LEU 16 CO 0.76 -0.88 1.71 -0.81 -0.55 0.00 0.00 176.35 176.59 2db9 n PRO 17 N -0.51 0.11 0.09 1.48 -0.04 -1.26 -3.36 135.00 131.51 2db9 n PRO 17 Ca 0.02 0.11 -0.12 0.00 -0.04 0.00 0.00 63.50 63.46 2db9 n PRO 17 Cb 0.65 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.53 2db9 n PRO 17 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2db9 h GLU 18 N 0.00 -0.26 -1.00 0.54 5.08 -1.95 -2.31 114.58 114.69 2db9 h GLU 18 Ca 0.00 0.02 0.25 0.00 -1.00 0.00 0.00 59.36 58.62 2db9 h GLU 18 Cb 0.32 0.06 -0.08 0.00 0.50 0.00 0.00 28.75 29.55 2db9 h GLU 18 CO 0.00 0.13 0.65 0.93 -1.00 0.00 0.00 179.01 179.73 2db9 h GLU 19 N -0.77 0.37 0.00 2.33 4.39 -1.94 1.64 114.58 120.60 2db9 h GLU 19 Ca -0.03 -0.02 -0.06 0.00 0.34 0.00 0.00 59.36 59.59 2db9 h GLU 19 Cb 0.51 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.07 2db9 h GLU 19 CO 0.04 0.25 -0.29 1.25 -1.16 0.00 0.00 179.01 179.10 2db9 h LEU 20 N 0.38 0.00 -0.05 1.33 5.85 -1.66 -2.44 115.31 118.72 2db9 h LEU 20 Ca 0.55 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.27 2db9 h LEU 20 Cb 1.42 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.45 2db9 h LEU 20 CO -0.24 0.29 0.00 0.78 -0.34 0.00 0.00 178.44 178.93 2db9 h ASN 21 N 0.00 0.00 0.32 1.25 2.35 0.29 -1.47 115.58 118.32 2db9 h ASN 21 Ca -0.00 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.58 2db9 h ASN 21 Cb 0.91 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.27 2db9 h ASN 21 CO 0.04 0.00 -0.69 0.03 -1.65 0.00 0.00 177.43 175.16 2db9 h ARG 22 N 0.00 0.33 -0.27 0.81 3.08 -0.55 -3.07 114.38 114.72 2db9 h ARG 22 Ca 0.00 -0.26 0.00 0.00 0.07 0.00 0.00 59.98 59.79 2db9 h ARG 22 Cb 0.95 0.05 0.00 0.00 0.08 0.00 0.00 29.97 31.05 2db9 h ARG 22 CO 0.00 0.89 0.00 1.33 -1.07 0.00 0.00 179.97 181.12 2db9 n VAL 23 N -3.84 2.18 -2.60 2.04 0.24 -1.19 -4.75 118.33 110.42 2db9 n VAL 23 Ca -0.03 -1.81 -0.41 0.00 -2.04 0.00 0.00 64.34 60.04 2db9 n VAL 23 Cb 0.68 -0.19 -0.03 0.00 -1.47 0.00 0.00 33.84 32.83 2db9 n VAL 23 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 2db9 s ARG 24 N -2.68 3.21 0.90 7.34 3.52 -0.56 -1.84 118.95 128.84 2db9 s ARG 24 Ca 0.41 -0.39 -0.13 0.00 -0.13 0.00 0.00 55.73 55.49 2db9 s ARG 24 Cb 0.32 -4.26 0.04 0.00 -1.56 0.00 0.00 34.95 29.49 2db9 s ARG 24 CO 0.09 -2.11 0.55 1.28 -0.81 0.00 0.00 175.30 174.31 2db9 n LEU 25 N 9.10 0.61 -4.00 -0.88 4.77 0.20 -4.90 117.00 121.90 2db9 n LEU 25 Ca 0.04 0.40 -0.24 0.00 -0.03 0.00 0.00 56.01 56.18 2db9 n LEU 25 Cb 0.49 -1.25 -0.17 0.00 -2.33 0.00 0.00 43.42 40.16 2db9 n LEU 25 CO 0.70 -3.28 -0.46 -0.94 -1.33 0.00 0.00 177.39 172.08 2db9 s SER 26 N -1.99 1.74 0.32 -1.43 1.04 -1.26 -4.65 113.70 107.48 2db9 s SER 26 Ca 0.60 -0.28 0.21 0.00 0.48 0.00 0.00 55.95 56.96 2db9 s SER 26 Cb -0.24 -0.79 1.13 0.00 0.10 0.00 0.00 66.02 66.22 2db9 s SER 26 CO 0.64 0.01 1.25 -1.14 0.98 0.00 0.00 173.24 174.97 2db9 n ARG 27 N 3.98 -0.04 0.41 4.02 0.63 -1.26 0.15 116.66 124.54 2db9 n ARG 27 Ca -0.22 1.05 -0.17 0.00 -0.92 0.00 0.00 57.85 57.59 2db9 n ARG 27 Cb 0.51 -1.97 -0.08 0.00 0.45 0.00 0.00 32.46 31.37 2db9 n ARG 27 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 2db9 h HIS 28 N 0.00 -0.96 -0.99 -0.14 3.86 -1.94 0.43 115.15 115.39 2db9 h HIS 28 Ca 0.69 -0.02 0.19 0.00 -1.16 0.00 0.00 60.37 60.06 2db9 h HIS 28 Cb 2.02 0.32 -0.10 0.00 1.06 0.00 0.00 27.41 30.71 2db9 h HIS 28 CO -0.01 -0.58 0.61 0.87 0.86 0.00 0.00 177.93 179.68 2db9 h LYS 29 N -1.19 0.72 0.46 2.45 1.57 0.92 -0.80 116.57 120.69 2db9 h LYS 29 Ca -0.11 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.61 2db9 h LYS 29 Cb 0.81 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.97 2db9 h LYS 29 CO 0.17 0.47 -0.22 -0.07 -0.57 0.00 0.00 179.45 179.24 2db9 h LEU 30 N 0.74 -0.52 -1.44 2.94 3.38 -0.53 0.58 115.31 120.46 2db9 h LEU 30 Ca 0.56 -0.08 0.14 0.00 0.09 0.00 0.00 57.88 58.59 2db9 h LEU 30 Cb 0.90 0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.77 2db9 h LEU 30 CO -0.34 -0.21 0.73 -0.08 0.09 0.00 0.00 178.44 178.63 2db9 h GLU 31 N -0.84 0.00 0.00 1.13 4.22 0.12 2.56 114.58 121.77 2db9 h GLU 31 Ca -0.06 0.00 -0.26 0.00 0.08 0.00 0.00 59.36 59.12 2db9 h GLU 31 Cb 0.57 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.78 2db9 h GLU 31 CO 0.10 0.00 -1.47 0.54 -2.18 0.00 0.00 179.01 176.00 2db9 n ARG 32 N -3.25 0.56 0.00 1.92 1.74 -0.61 -3.98 116.66 113.04 2db9 n ARG 32 Ca 0.09 0.51 0.06 0.00 -0.77 0.00 0.00 57.85 57.75 2db9 n ARG 32 Cb 0.90 -1.69 0.28 0.00 -1.02 0.00 0.00 32.46 30.93 2db9 n ARG 32 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 2db9 n TRP 33 N -4.41 0.00 0.21 -1.55 8.01 0.20 -1.89 117.44 118.02 2db9 n TRP 33 Ca -0.35 0.00 0.14 0.00 -1.31 0.00 0.00 57.50 55.98 2db9 n TRP 33 Cb 0.70 -0.48 0.76 0.00 -2.01 0.00 0.00 31.31 30.28 2db9 n TRP 33 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2db9 n HIS 35 N -2.49 0.00 -1.39 0.00 8.25 -0.79 -5.02 115.22 113.78 2db9 n HIS 35 Ca -0.02 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.08 2db9 n HIS 35 Cb 0.06 -0.24 0.08 0.00 1.12 0.00 0.00 29.99 31.01 2db9 n HIS 35 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 2db9 n MET 36 N -1.84 0.56 -0.00 -0.41 2.00 0.93 -4.96 117.12 113.41 2db9 n MET 36 Ca -0.02 0.25 -0.11 0.00 0.00 0.00 0.00 57.70 57.82 2db9 n MET 36 Cb 0.31 -2.23 -0.09 0.00 0.00 0.00 0.00 33.22 31.21 2db9 n MET 36 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 175.97 174.97 2db9 h PRO 37 N -0.17 -0.09 -0.35 0.03 0.13 -1.95 -3.22 132.00 126.37 2db9 h PRO 37 Ca -0.48 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2db9 h PRO 37 Cb 1.34 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.49 2db9 h PRO 37 CO 0.47 0.48 0.00 1.97 -0.23 0.00 0.00 178.00 180.70 2db9 n PHE 38 N -4.81 0.24 0.00 1.56 1.16 -1.26 -4.52 117.46 109.84 2db9 n PHE 38 Ca -0.08 -0.11 0.00 0.00 -1.87 0.00 0.00 57.45 55.40 2db9 n PHE 38 Cb 0.30 -0.05 0.00 0.00 -1.61 0.00 0.00 39.48 38.12 2db9 n PHE 38 CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 2db9 n PHE 39 N -0.03 0.00 -0.27 2.97 7.35 -1.22 0.21 117.46 126.47 2db9 n PHE 39 Ca 0.05 0.00 0.08 0.00 -0.76 0.00 0.00 57.45 56.82 2db9 n PHE 39 Cb 0.20 -0.21 0.21 0.00 0.35 0.00 0.00 39.48 40.04 2db9 n PHE 39 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2db9 h ALA 40 N -1.13 1.00 -0.31 3.13 0.00 -1.86 0.77 119.26 120.86 2db9 h ALA 40 Ca 0.00 0.23 0.06 0.00 0.00 0.00 0.00 54.91 55.20 2db9 h ALA 40 Cb 0.00 0.36 -0.06 0.00 0.00 0.00 0.00 17.79 18.09 2db9 h ALA 40 CO 0.00 -0.43 -0.07 -0.22 0.00 0.00 0.00 179.25 178.53 2db9 h LYS 41 N 0.16 0.01 0.00 0.00 1.63 -0.22 0.40 116.57 118.55 2db9 h LYS 41 Ca 0.47 -0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.27 2db9 h LYS 41 Cb 0.87 -0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.50 2db9 h LYS 41 CO -0.65 0.00 0.00 2.41 -3.45 0.00 0.00 179.45 177.77 2db9 n THR 42 N -5.25 0.00 -0.45 1.00 -1.04 0.56 -3.12 114.28 105.98 2db9 n THR 42 Ca 0.00 1.03 0.37 0.00 -2.04 0.00 0.00 64.05 63.42 2db9 n THR 42 Cb 0.17 -1.97 0.62 0.00 -1.82 0.00 0.00 70.33 67.33 2db9 n THR 42 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 2db9 n VAL 43 N -1.75 -0.19 -1.94 12.58 0.24 0.22 -3.99 118.33 123.51 2db9 n VAL 43 Ca 0.00 1.55 -0.43 0.00 -2.04 0.00 0.00 64.34 63.42 2db9 n VAL 43 Cb 0.00 -2.54 -0.03 0.00 -1.47 0.00 0.00 33.84 29.80 2db9 n VAL 43 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 2db9 s THR 44 N -4.99 3.41 0.00 3.34 2.01 0.14 -1.26 115.64 118.29 2db9 s THR 44 Ca -0.06 0.43 0.00 0.00 0.31 0.00 0.00 61.69 62.37 2db9 s THR 44 Cb 0.27 -3.52 0.00 0.00 0.01 0.00 0.00 72.50 69.26 2db9 s THR 44 CO 0.73 -0.31 0.00 0.61 -0.69 0.00 0.00 174.62 174.96 2db9 n GLY 45 N 5.34 0.97 2.84 4.40 0.00 0.05 -4.91 105.19 113.88 2db9 n GLY 45 Ca 0.23 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.09 2db9 n GLY 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2db9 s PHE 47 N -2.14 0.60 0.09 0.00 0.40 -0.77 -2.39 117.98 113.77 2db9 s PHE 47 Ca 0.48 -0.13 0.03 0.00 -0.60 0.00 0.00 56.93 56.71 2db9 s PHE 47 Cb -0.03 -0.47 -0.03 0.00 0.51 0.00 0.00 43.02 43.00 2db9 s PHE 47 CO 0.32 -0.08 -0.09 0.14 0.70 0.00 0.00 175.22 176.21 2db9 s VAL 48 N 0.32 0.82 -0.25 -0.44 -7.23 -0.89 0.60 120.40 113.33 2db9 s VAL 48 Ca -0.04 -1.59 -0.21 0.00 -1.81 0.00 0.00 61.98 58.33 2db9 s VAL 48 Cb -0.08 -1.29 -0.02 0.00 0.56 0.00 0.00 36.38 35.56 2db9 s VAL 48 CO -0.00 -0.58 0.65 -0.60 -0.31 0.00 0.00 175.10 174.26 2db9 s ARG 49 N -2.77 4.12 0.15 4.82 3.52 -1.26 -2.27 118.95 125.27 2db9 s ARG 49 Ca 0.04 0.59 0.03 0.00 -0.13 0.00 0.00 55.73 56.27 2db9 s ARG 49 Cb -0.03 -3.65 -0.04 0.00 -1.56 0.00 0.00 34.95 29.68 2db9 s ARG 49 CO -0.01 -0.42 0.24 -1.50 -0.81 0.00 0.00 175.30 172.80 2db9 s ILE 50 N 2.52 5.07 -0.72 4.11 1.10 -1.08 0.14 121.20 132.33 2db9 s ILE 50 Ca 0.27 -0.80 -0.01 0.00 -0.51 0.00 0.00 60.65 59.61 2db9 s ILE 50 Cb -0.15 -3.60 0.18 0.00 0.15 0.00 0.00 42.46 39.04 2db9 s ILE 50 CO 0.08 -0.09 0.55 -0.83 -2.11 0.00 0.00 174.94 172.55 2db9 s GLY 51 N -3.17 2.77 0.60 1.50 0.00 -1.21 -1.56 107.32 106.25 2db9 s GLY 51 Ca 0.33 -3.56 0.28 0.00 0.00 0.00 0.00 44.72 41.78 2db9 s GLY 51 CO 0.27 1.12 1.62 0.16 0.00 0.00 0.00 173.10 176.27 2db9 h ILE 52 N 4.73 0.18 0.00 0.90 3.07 -1.93 -3.44 117.51 121.02 2db9 h ILE 52 Ca 0.06 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.47 2db9 h ILE 52 Cb 0.87 0.33 0.00 0.00 -0.27 0.00 0.00 36.82 37.75 2db9 h ILE 52 CO 0.76 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 178.47 2db9 n GLY 53 N -1.60 1.20 3.19 0.16 0.00 -1.26 -5.11 105.19 101.77 2db9 n GLY 53 Ca 0.16 -0.08 0.01 0.00 0.00 0.00 0.00 46.02 46.11 2db9 n GLY 53 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2db9 s ASN 54 N 2.00 -1.50 0.37 1.61 2.47 -1.26 -4.16 114.94 114.47 2db9 s ASN 54 Ca 0.00 -0.63 -0.16 0.00 0.42 0.00 0.00 52.86 52.49 2db9 s ASN 54 Cb 0.00 1.92 -0.09 0.00 -1.45 0.00 0.00 41.25 41.63 2db9 s ASN 54 CO 0.00 -0.18 0.82 -1.00 -3.72 0.00 0.00 177.10 173.01 2db9 s HIS 55 N 1.99 3.37 1.19 0.43 3.76 -1.25 -4.91 115.29 119.87 2db9 s HIS 55 Ca 0.15 1.32 -0.14 0.00 -0.15 0.00 0.00 55.06 56.24 2db9 s HIS 55 Cb -0.05 -2.63 0.26 0.00 1.11 0.00 0.00 32.58 31.28 2db9 s HIS 55 CO -0.10 -0.02 0.78 -1.71 -0.85 0.00 0.00 174.74 172.84 2db9 n ASN 56 N -0.63 -2.02 0.00 1.40 2.85 -1.26 -3.43 115.26 112.17 2db9 n ASN 56 Ca 0.05 -0.20 0.00 0.00 -0.11 0.00 0.00 54.58 54.32 2db9 n ASN 56 Cb 0.54 -1.18 0.00 0.00 1.24 0.00 0.00 39.78 40.38 2db9 n ASN 56 CO 0.00 0.00 0.00 -0.24 -2.11 0.00 0.00 177.26 174.91 2db9 n SER 57 N -4.30 0.00 -4.00 1.20 2.88 -1.26 -4.61 113.62 103.53 2db9 n SER 57 Ca 0.02 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.42 2db9 n SER 57 Cb 0.56 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.89 2db9 n SER 57 CO 0.00 0.00 0.00 -1.59 -1.23 0.00 0.00 175.04 172.22 2db9 s LYS 58 N 0.00 0.42 0.73 -1.46 0.00 -1.22 -5.15 119.74 113.05 2db9 s LYS 58 Ca 0.00 -0.47 -0.11 0.00 0.00 0.00 0.00 55.97 55.39 2db9 s LYS 58 Cb 0.00 -0.26 0.03 0.00 0.00 0.00 0.00 37.83 37.60 2db9 s LYS 58 CO 0.00 0.06 1.07 -1.25 0.00 0.00 0.00 175.35 175.23 2db9 s PRO 59 N -0.90 2.63 -0.12 1.78 0.04 -1.24 -3.75 135.00 133.44 2db9 s PRO 59 Ca -0.06 0.84 -0.05 0.00 0.04 0.00 0.00 61.00 61.78 2db9 s PRO 59 Cb -0.06 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.48 2db9 s PRO 59 CO -0.00 -1.29 0.07 0.54 0.04 0.00 0.00 177.00 176.36 2db9 s VAL 60 N -3.08 4.90 -0.13 -0.36 0.11 -1.26 -4.80 120.40 115.77 2db9 s VAL 60 Ca 0.59 -0.02 -0.11 0.00 -2.93 0.00 0.00 61.98 59.52 2db9 s VAL 60 Cb -0.14 -3.12 0.04 0.00 -1.53 0.00 0.00 36.38 31.63 2db9 s VAL 60 CO 0.55 0.59 0.33 -0.31 -3.33 0.00 0.00 175.10 172.92 2db9 s TYR 61 N -0.72 -0.39 -0.05 1.54 2.02 -1.26 -3.99 117.35 114.50 2db9 s TYR 61 Ca 0.12 0.92 0.00 0.00 -0.37 0.00 0.00 57.07 57.75 2db9 s TYR 61 Cb -0.12 0.13 0.02 0.00 -0.40 0.00 0.00 41.96 41.60 2db9 s TYR 61 CO 0.03 -0.20 -0.02 1.03 -1.57 0.00 0.00 175.55 174.81 2db9 s ARG 62 N 0.44 0.66 0.46 -0.62 0.52 -0.60 -4.88 118.95 114.93 2db9 s ARG 62 Ca -0.02 -0.01 -0.25 0.00 -0.52 0.00 0.00 55.73 54.94 2db9 s ARG 62 Cb -0.04 -0.80 -0.08 0.00 0.52 0.00 0.00 34.95 34.55 2db9 s ARG 62 CO -0.02 -0.15 1.36 0.28 0.02 0.00 0.00 175.30 176.79 2db9 n VAL 63 N 4.37 2.94 -3.90 3.52 0.31 -1.26 -2.65 118.33 121.66 2db9 n VAL 63 Ca -0.20 -0.50 -0.10 0.00 -0.01 0.00 0.00 64.34 63.53 2db9 n VAL 63 Cb 0.50 -1.71 -0.10 0.00 -0.91 0.00 0.00 33.84 31.62 2db9 n VAL 63 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2db9 s ALA 64 N -1.22 -0.19 -0.14 3.52 0.00 -0.96 -4.90 121.76 117.86 2db9 s ALA 64 Ca 0.63 -0.34 -0.01 0.00 0.00 0.00 0.00 51.96 52.24 2db9 s ALA 64 Cb -0.46 0.18 -0.01 0.00 0.00 0.00 0.00 23.12 22.83 2db9 s ALA 64 CO 0.56 -0.26 -0.12 -2.00 0.00 0.00 0.00 175.76 173.94 2db9 s GLU 65 N -1.94 3.39 -0.39 0.00 2.12 -1.24 -2.09 118.70 118.54 2db9 s GLU 65 Ca -0.10 -0.68 -0.29 0.00 0.36 0.00 0.00 54.97 54.26 2db9 s GLU 65 Cb -0.05 -2.68 0.00 0.00 0.26 0.00 0.00 34.13 31.67 2db9 s GLU 65 CO -0.01 0.17 1.50 0.42 -0.54 0.00 0.00 175.26 176.80 2db9 s ILE 66 N 0.48 3.80 -1.13 -3.70 1.01 -1.00 -1.72 121.20 118.94 2db9 s ILE 66 Ca -0.09 0.82 0.25 0.00 0.00 0.00 0.00 60.65 61.63 2db9 s ILE 66 Cb -0.16 -4.07 0.03 0.00 0.01 0.00 0.00 42.46 38.27 2db9 s ILE 66 CO 0.04 -0.67 1.39 0.35 0.00 0.00 0.00 174.94 176.06 2db9 n THR 67 N 7.14 0.00 -3.63 2.92 -2.24 0.13 -0.77 114.28 117.82 2db9 n THR 67 Ca 0.18 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.94 2db9 n THR 67 Cb 0.48 0.35 0.00 0.00 -2.10 0.00 0.00 70.33 69.05 2db9 n THR 67 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2db9 n GLY 68 N 1.47 -0.93 2.78 3.38 0.00 -1.23 -4.92 105.19 105.74 2db9 n GLY 68 Ca 0.06 -1.00 -0.20 0.00 0.00 0.00 0.00 46.02 44.89 2db9 n GLY 68 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2db9 s VAL 69 N -3.00 0.23 0.46 1.61 1.01 -1.26 -1.74 120.40 117.71 2db9 s VAL 69 Ca 0.00 0.14 0.06 0.00 0.00 0.00 0.00 61.98 62.18 2db9 s VAL 69 Cb 0.00 -0.36 0.08 0.00 0.00 0.00 0.00 36.38 36.10 2db9 s VAL 69 CO 0.00 0.20 0.64 1.33 0.00 0.00 0.00 175.10 177.27 2db9 n VAL 70 N 4.66 0.00 -3.77 2.92 0.24 0.52 -4.93 118.33 117.96 2db9 n VAL 70 Ca -0.16 -1.42 -0.25 0.00 -2.04 0.00 0.00 64.34 60.47 2db9 n VAL 70 Cb 0.50 -0.70 -0.17 0.00 -1.47 0.00 0.00 33.84 32.00 2db9 n VAL 70 CO 0.00 0.00 0.00 -1.83 -2.14 0.00 0.00 176.83 172.86 2db9 s GLU 71 N -4.10 0.72 0.67 7.34 -1.05 -1.26 -2.16 118.70 118.85 2db9 s GLU 71 Ca 0.47 -0.12 -0.08 0.00 -0.15 0.00 0.00 54.97 55.10 2db9 s GLU 71 Cb -0.04 -1.44 0.03 0.00 -0.44 0.00 0.00 34.13 32.25 2db9 s GLU 71 CO 0.30 -0.42 1.00 0.95 0.95 0.00 0.00 175.26 178.04 2db9 s THR 72 N 1.91 3.03 -0.04 1.83 -4.23 -0.31 -4.95 115.64 112.87 2db9 s THR 72 Ca 0.03 0.01 -0.17 0.00 -1.18 0.00 0.00 61.69 60.38 2db9 s THR 72 Cb -0.14 -3.27 -0.32 0.00 1.34 0.00 0.00 72.50 70.11 2db9 s THR 72 CO -0.06 -0.31 0.79 0.00 -0.54 0.00 0.00 174.62 174.50 2db9 h ALA 73 N -0.48 0.00 -3.63 3.99 0.00 -2.01 -3.46 119.26 113.67 2db9 h ALA 73 Ca -0.45 -0.93 -0.68 0.00 0.00 0.00 0.00 54.91 52.85 2db9 h ALA 73 Cb 1.28 0.29 -0.19 0.00 0.00 0.00 0.00 17.79 19.17 2db9 h ALA 73 CO 0.62 0.70 -0.69 0.15 0.00 0.00 0.00 179.25 180.03 2db9 s LYS 74 N -2.52 2.79 0.35 0.00 -0.14 -1.26 -5.07 119.74 113.88 2db9 s LYS 74 Ca -0.14 -0.53 -0.11 0.00 -1.36 0.00 0.00 55.97 53.83 2db9 s LYS 74 Cb 0.03 -2.61 -0.07 0.00 -1.68 0.00 0.00 37.83 33.50 2db9 s LYS 74 CO 0.85 0.66 0.71 0.14 -0.76 0.00 0.00 175.35 176.95 2db9 s VAL 75 N -0.79 4.81 0.45 3.17 -7.23 -1.26 -4.76 120.40 114.79 2db9 s VAL 75 Ca 0.12 0.60 0.04 0.00 -1.81 0.00 0.00 61.98 60.93 2db9 s VAL 75 Cb -0.11 -3.69 -0.05 0.00 0.56 0.00 0.00 36.38 33.09 2db9 s VAL 75 CO 0.02 -0.36 0.01 -0.72 -0.31 0.00 0.00 175.10 173.73 2db9 s TYR 76 N -2.18 2.19 0.09 2.82 -0.85 -0.67 -4.89 117.35 113.85 2db9 s TYR 76 Ca 0.50 -0.83 -0.26 0.00 -0.52 0.00 0.00 57.07 55.96 2db9 s TYR 76 Cb -0.10 -1.66 -0.06 0.00 0.38 0.00 0.00 41.96 40.52 2db9 s TYR 76 CO 0.27 0.31 0.81 -1.14 -1.52 0.00 0.00 175.55 174.27 2db9 s GLN 77 N -3.79 4.56 -0.50 -3.49 0.74 -1.26 -2.17 119.66 113.75 2db9 s GLN 77 Ca 0.22 1.16 0.08 0.00 0.05 0.00 0.00 55.36 56.87 2db9 s GLN 77 Cb 0.06 -3.34 0.35 0.00 1.10 0.00 0.00 33.01 31.18 2db9 s GLN 77 CO 0.11 0.34 0.88 -0.11 -0.55 0.00 0.00 175.29 175.96 2db9 n LEU 78 N 2.51 3.24 0.00 3.68 7.94 0.50 -4.52 117.00 130.35 2db9 n LEU 78 Ca -0.02 -5.41 0.00 0.00 -1.11 0.00 0.00 56.01 49.47 2db9 n LEU 78 Cb 0.50 -0.11 0.00 0.00 0.53 0.00 0.00 43.42 44.33 2db9 n LEU 78 CO 0.48 2.32 0.00 0.61 -1.11 0.00 0.00 177.39 179.68 2db9 n GLY 79 N -0.08 2.59 0.27 -3.96 0.00 -1.26 -3.79 105.19 98.95 2db9 n GLY 79 Ca 0.29 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.29 2db9 n GLY 79 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2db9 n GLY 80 N 0.00 -0.05 3.81 -0.02 0.00 -1.26 -5.14 105.19 102.54 2db9 n GLY 80 Ca 0.00 -0.02 -0.36 0.00 0.00 0.00 0.00 46.02 45.64 2db9 n GLY 80 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2db9 s THR 81 N -1.44 4.52 -0.37 2.61 -1.32 -1.25 -5.03 115.64 113.36 2db9 s THR 81 Ca 0.00 1.35 -0.12 0.00 -1.21 0.00 0.00 61.69 61.72 2db9 s THR 81 Cb 0.00 -3.88 0.02 0.00 -1.51 0.00 0.00 72.50 67.13 2db9 s THR 81 CO 0.00 0.19 0.22 -0.13 -2.21 0.00 0.00 174.62 172.69 2db9 s ARG 82 N -2.00 2.97 0.02 7.08 0.52 -1.26 -0.37 118.95 125.91 2db9 s ARG 82 Ca 0.44 -0.99 0.07 0.00 -0.52 0.00 0.00 55.73 54.74 2db9 s ARG 82 Cb -0.17 -3.76 -0.03 0.00 0.52 0.00 0.00 34.95 31.51 2db9 s ARG 82 CO 0.21 -0.65 -0.21 -0.08 0.02 0.00 0.00 175.30 174.59 2db9 s THR 83 N 1.60 2.56 -0.42 0.02 -1.32 -0.92 -4.85 115.64 112.31 2db9 s THR 83 Ca 0.03 -1.17 0.05 0.00 -1.21 0.00 0.00 61.69 59.39 2db9 s THR 83 Cb -0.19 -2.03 0.57 0.00 -1.51 0.00 0.00 72.50 69.34 2db9 s THR 83 CO 0.07 0.41 1.74 -0.46 -2.21 0.00 0.00 174.62 174.17 2db9 n ASN 84 N 1.81 4.00 -4.87 8.08 6.94 -1.26 -1.66 115.26 128.29 2db9 n ASN 84 Ca -0.16 -3.71 -0.33 0.00 -0.02 0.00 0.00 54.58 50.35 2db9 n ASN 84 Cb 0.52 -0.76 -0.05 0.00 -2.36 0.00 0.00 39.78 37.12 2db9 n ASN 84 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 2db9 s LYS 85 N -3.39 3.35 -0.18 -3.83 1.02 -1.26 -1.17 119.74 114.28 2db9 s LYS 85 Ca 0.54 -0.35 0.01 0.00 0.02 0.00 0.00 55.97 56.19 2db9 s LYS 85 Cb 0.46 -3.05 0.03 0.00 -0.52 0.00 0.00 37.83 34.75 2db9 s LYS 85 CO 0.05 0.67 -0.13 0.20 -0.92 0.00 0.00 175.35 175.22 2db9 s GLY 86 N -1.85 1.28 -0.23 -3.33 0.00 -0.92 -4.69 107.32 97.59 2db9 s GLY 86 Ca 0.26 -1.16 -0.29 0.00 0.00 0.00 0.00 44.72 43.52 2db9 s GLY 86 CO 0.17 0.56 1.55 1.08 0.00 0.00 0.00 173.10 176.45 2db9 s LEU 87 N 1.38 3.92 -0.86 0.66 1.43 -0.58 -0.36 118.68 124.28 2db9 s LEU 87 Ca 0.01 1.57 -0.25 0.00 -1.03 0.00 0.00 54.13 54.43 2db9 s LEU 87 Cb -0.15 -3.53 0.03 0.00 0.03 0.00 0.00 46.19 42.57 2db9 s LEU 87 CO -0.10 -1.19 1.40 -1.58 0.23 0.00 0.00 176.35 175.11 2db9 s GLN 88 N 4.51 3.31 0.21 1.70 0.74 -0.71 -1.85 119.66 127.57 2db9 s GLN 88 Ca 0.68 -0.57 -0.01 0.00 0.05 0.00 0.00 55.36 55.51 2db9 s GLN 88 Cb -0.24 -4.71 -0.04 0.00 1.10 0.00 0.00 33.01 29.13 2db9 s GLN 88 CO 0.28 -2.24 0.40 -0.51 -0.55 0.00 0.00 175.29 172.66 2db9 s LEU 89 N 5.72 4.22 0.20 3.68 1.43 -1.05 0.19 118.68 133.07 2db9 s LEU 89 Ca 0.42 0.41 0.11 0.00 -1.03 0.00 0.00 54.13 54.04 2db9 s LEU 89 Cb -0.05 -3.18 -0.04 0.00 0.03 0.00 0.00 46.19 42.95 2db9 s LEU 89 CO 0.04 -0.05 -0.22 -0.60 0.23 0.00 0.00 176.35 175.75 2db9 s ARG 90 N -3.34 1.49 -0.20 1.70 3.52 -0.70 -0.49 118.95 120.93 2db9 s ARG 90 Ca 0.39 -1.54 -0.05 0.00 -0.13 0.00 0.00 55.73 54.40 2db9 s ARG 90 Cb -0.11 -1.72 0.10 0.00 -1.56 0.00 0.00 34.95 31.66 2db9 s ARG 90 CO 0.29 0.36 0.35 -1.58 -0.81 0.00 0.00 175.30 173.91 2db9 s HIS 91 N -1.90 -0.67 0.00 5.12 2.46 -0.08 -3.66 115.29 116.56 2db9 s HIS 91 Ca 0.21 1.03 0.00 0.00 0.47 0.00 0.00 55.06 56.77 2db9 s HIS 91 Cb -0.07 0.06 0.00 0.00 -0.13 0.00 0.00 32.58 32.44 2db9 s HIS 91 CO 0.10 -0.55 0.00 0.41 -2.47 0.00 0.00 174.74 172.23 2db9 n GLY 92 N 5.37 1.01 0.01 1.59 0.00 -1.26 -0.65 105.19 111.24 2db9 n GLY 92 Ca -0.06 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.36 2db9 n GLY 92 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2db9 n ASN 93 N 9.81 1.54 -4.54 1.61 0.23 -1.26 -4.82 115.26 117.82 2db9 n ASN 93 Ca 0.00 -1.83 -0.26 0.00 -0.53 0.00 0.00 54.58 51.96 2db9 n ASN 93 Cb 0.00 -0.02 -0.10 0.00 -2.08 0.00 0.00 39.78 37.58 2db9 n ASN 93 CO 0.00 0.00 0.00 -1.81 -0.93 0.00 0.00 177.26 174.52 2db9 s ASP 94 N -0.86 4.10 0.18 0.53 1.11 0.17 -5.14 116.67 116.75 2db9 s ASP 94 Ca 0.01 -0.66 0.06 0.00 0.18 0.00 0.00 52.55 52.15 2db9 s ASP 94 Cb 0.01 -0.63 -0.04 0.00 1.07 0.00 0.00 42.92 43.34 2db9 s ASP 94 CO 0.00 0.10 0.07 -1.58 1.18 0.00 0.00 175.17 174.94 2db9 s GLN 95 N -2.90 2.66 0.29 8.23 0.74 -1.26 -0.91 119.66 126.51 2db9 s GLN 95 Ca 0.25 -1.00 0.01 0.00 0.05 0.00 0.00 55.36 54.67 2db9 s GLN 95 Cb -0.08 -2.50 -0.02 0.00 1.10 0.00 0.00 33.01 31.50 2db9 s GLN 95 CO 0.15 0.46 0.30 1.03 -0.55 0.00 0.00 175.29 176.68 2db9 s ARG 96 N -3.08 1.61 -0.25 1.67 0.52 0.36 -4.92 118.95 114.87 2db9 s ARG 96 Ca 0.29 -1.77 -0.02 0.00 -0.52 0.00 0.00 55.73 53.71 2db9 s ARG 96 Cb -0.09 0.35 0.12 0.00 0.52 0.00 0.00 34.95 35.85 2db9 s ARG 96 CO 0.21 -0.61 0.28 0.08 0.02 0.00 0.00 175.30 175.29 2db9 s VAL 97 N -3.61 -0.41 0.10 3.52 1.01 -1.26 -2.54 120.40 117.21 2db9 s VAL 97 Ca 0.36 -0.26 0.01 0.00 0.00 0.00 0.00 61.98 62.08 2db9 s VAL 97 Cb 0.03 -0.84 0.01 0.00 0.00 0.00 0.00 36.38 35.58 2db9 s VAL 97 CO 0.20 -0.30 0.07 0.49 0.00 0.00 0.00 175.10 175.56 2db9 n PHE 98 N 5.32 -1.25 -4.44 5.22 3.01 -0.77 -4.94 117.46 119.61 2db9 n PHE 98 Ca -0.04 -0.42 -0.23 0.00 1.01 0.00 0.00 57.45 57.77 2db9 n PHE 98 Cb 0.48 -0.08 -0.10 0.00 -0.01 0.00 0.00 39.48 39.77 2db9 n PHE 98 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 2db9 s ARG 99 N -2.40 1.60 0.42 -1.08 1.81 -1.26 -1.53 118.95 116.50 2db9 s ARG 99 Ca 0.05 -1.74 0.09 0.00 -1.72 0.00 0.00 55.73 52.41 2db9 s ARG 99 Cb -0.00 -1.58 0.88 0.00 -0.45 0.00 0.00 34.95 33.80 2db9 s ARG 99 CO 0.03 0.26 2.03 -0.07 -0.68 0.00 0.00 175.30 176.88 2db9 h LEU 100 N 2.32 0.36 -2.35 2.53 4.07 -1.94 0.51 115.31 120.82 2db9 h LEU 100 Ca -0.40 -0.02 -0.01 0.00 0.08 0.00 0.00 57.88 57.53 2db9 h LEU 100 Cb 1.25 -0.09 -0.00 0.00 1.08 0.00 0.00 40.66 42.90 2db9 h LEU 100 CO 0.62 0.32 -0.04 1.05 -1.08 0.00 0.00 178.44 179.31 2db9 h GLU 101 N 0.41 0.00 -0.02 1.13 4.11 -1.94 0.10 114.58 118.37 2db9 h GLU 101 Ca 0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.54 2db9 h GLU 101 Cb 0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.30 2db9 h GLU 101 CO -0.01 0.04 -0.18 1.19 0.07 0.00 0.00 179.01 180.11 2db9 n PHE 102 N -3.69 0.00 -2.80 2.06 3.72 0.11 -4.77 117.46 112.09 2db9 n PHE 102 Ca -0.03 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.95 2db9 n PHE 102 Cb 0.13 -0.01 -0.03 0.00 -0.94 0.00 0.00 39.48 38.64 2db9 n PHE 102 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 2db9 s VAL 103 N -2.20 4.40 1.03 -4.37 1.01 0.35 -3.35 120.40 117.27 2db9 s VAL 103 Ca 0.25 -1.09 -0.11 0.00 0.00 0.00 0.00 61.98 61.03 2db9 s VAL 103 Cb 0.19 -4.85 0.21 0.00 0.00 0.00 0.00 36.38 31.93 2db9 s VAL 103 CO 0.41 -1.64 1.08 -1.20 0.00 0.00 0.00 175.10 173.76 2db9 n SER 104 N 7.48 -0.56 -0.06 3.32 7.64 0.12 -4.15 113.62 127.41 2db9 n SER 104 Ca 0.22 0.17 0.00 0.00 1.01 0.00 0.00 58.87 60.27 2db9 n SER 104 Cb 0.49 -1.38 0.00 0.00 -1.01 0.00 0.00 64.21 62.31 2db9 n SER 104 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 2db9 n ASN 105 N -4.52 1.29 -0.12 6.43 0.23 -1.26 -4.00 115.26 113.30 2db9 n ASN 105 Ca 0.08 -0.03 0.02 0.00 -0.53 0.00 0.00 54.58 54.11 2db9 n ASN 105 Cb 0.53 0.00 -0.01 0.00 -2.08 0.00 0.00 39.78 38.22 2db9 n ASN 105 CO 0.00 0.00 0.00 1.67 -0.93 0.00 0.00 177.26 178.00 2db9 n GLN 106 N -0.01 -0.27 -2.69 -3.83 7.27 -1.26 -4.90 117.38 111.69 2db9 n GLN 106 Ca 0.00 0.21 -0.38 0.00 0.07 0.00 0.00 57.00 56.90 2db9 n GLN 106 Cb 0.00 -0.32 -0.06 0.00 2.41 0.00 0.00 30.24 32.27 2db9 n GLN 106 CO 0.00 0.00 0.00 -1.21 0.07 0.00 0.00 177.06 175.92 2db9 s GLU 107 N -2.46 4.62 1.02 3.69 2.02 -1.26 -4.96 118.70 121.37 2db9 s GLU 107 Ca 0.00 1.49 -0.14 0.00 0.02 0.00 0.00 54.97 56.33 2db9 s GLU 107 Cb 0.00 -2.98 0.16 0.00 0.10 0.00 0.00 34.13 31.41 2db9 s GLU 107 CO 0.00 0.28 0.25 1.19 0.02 0.00 0.00 175.26 177.01 2db9 n PHE 108 N 0.87 -2.25 -4.87 1.61 3.72 -1.26 -5.01 117.46 110.26 2db9 n PHE 108 Ca 0.01 0.01 -0.26 0.00 -0.05 0.00 0.00 57.45 57.15 2db9 n PHE 108 Cb 0.48 -1.40 -0.16 0.00 -0.94 0.00 0.00 39.48 37.46 2db9 n PHE 108 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 2db9 s THR 109 N -2.09 1.46 0.55 4.37 -4.23 -1.26 -5.00 115.64 109.45 2db9 s THR 109 Ca 0.38 -0.76 0.36 0.00 -1.18 0.00 0.00 61.69 60.50 2db9 s THR 109 Cb -0.06 -1.24 0.53 0.00 1.34 0.00 0.00 72.50 73.07 2db9 s THR 109 CO 0.38 0.42 1.78 -0.08 -0.54 0.00 0.00 174.62 176.57 2db9 h GLU 110 N 6.02 0.00 0.01 3.99 4.57 -1.95 0.62 114.58 127.85 2db9 h GLU 110 Ca -0.34 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 57.83 2db9 h GLU 110 Cb 1.16 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.75 2db9 h GLU 110 CO 0.48 0.00 -0.00 1.03 -1.18 0.00 0.00 179.01 179.33 2db9 h SER 111 N 0.00 -0.01 -0.95 1.04 0.87 -1.99 -2.97 113.55 109.53 2db9 h SER 111 Ca 0.54 0.00 0.26 0.00 -1.23 0.00 0.00 61.79 61.35 2db9 h SER 111 Cb 2.25 0.00 -0.17 0.00 -0.44 0.00 0.00 62.40 64.04 2db9 h SER 111 CO -0.01 0.00 0.04 -0.33 -0.53 0.00 0.00 176.83 176.00 2db9 h GLU 112 N -0.03 0.03 -0.49 2.24 3.07 -1.70 0.77 114.58 118.47 2db9 h GLU 112 Ca -0.00 -0.00 0.10 0.00 -0.50 0.00 0.00 59.36 58.95 2db9 h GLU 112 Cb 0.01 -0.01 -0.09 0.00 -0.84 0.00 0.00 28.75 27.82 2db9 h GLU 112 CO 0.00 0.02 -0.07 0.35 -1.40 0.00 0.00 179.01 177.92 2db9 h PHE 113 N 0.03 -0.15 -0.25 4.33 3.57 -1.01 1.33 116.94 124.80 2db9 h PHE 113 Ca 0.57 0.04 -0.19 0.00 3.53 0.00 0.00 57.97 61.93 2db9 h PHE 113 Cb 1.16 0.14 0.00 0.00 2.79 0.00 0.00 35.95 40.05 2db9 h PHE 113 CO -0.47 -0.17 -0.58 0.52 -2.23 0.00 0.00 178.31 175.38 2db9 h MET 114 N 0.05 0.83 -0.65 1.11 2.86 0.44 0.47 114.93 120.04 2db9 h MET 114 Ca 0.24 -0.56 -0.01 0.00 -2.06 0.00 0.00 59.70 57.30 2db9 h MET 114 Cb 0.37 0.08 -0.03 0.00 0.06 0.00 0.00 31.60 32.08 2db9 h MET 114 CO -0.46 1.19 0.35 0.87 1.06 0.00 0.00 176.91 179.92 2db9 h LYS 115 N 0.59 0.92 -0.17 1.72 1.79 0.88 -1.20 116.57 121.10 2db9 h LYS 115 Ca -0.00 -0.11 -0.04 0.00 -2.18 0.00 0.00 60.65 58.31 2db9 h LYS 115 Cb 1.20 -0.18 -0.00 0.00 -1.58 0.00 0.00 32.23 31.66 2db9 h LYS 115 CO 0.13 0.70 -0.06 2.35 -1.08 0.00 0.00 179.45 181.48 2db9 h TRP 116 N 0.89 0.38 -0.74 -1.35 7.01 0.18 -2.98 115.95 119.34 2db9 h TRP 116 Ca 0.23 -0.09 0.16 0.00 2.11 0.00 0.00 58.89 61.30 2db9 h TRP 116 Cb 0.06 -0.09 -0.13 0.00 -2.10 0.00 0.00 29.16 26.89 2db9 h TRP 116 CO -0.01 0.63 -0.04 0.87 -2.79 0.00 0.00 178.44 177.10 2db9 h LYS 117 N 0.03 0.07 -0.95 2.65 1.57 -0.48 0.15 116.57 119.62 2db9 h LYS 117 Ca 0.04 -0.00 0.17 0.00 -1.87 0.00 0.00 60.65 58.98 2db9 h LYS 117 Cb 0.52 -0.02 -0.17 0.00 0.08 0.00 0.00 32.23 32.65 2db9 h LYS 117 CO 0.02 0.05 -0.32 0.93 -0.57 0.00 0.00 179.45 179.55 2db9 h GLU 118 N 0.07 -0.01 -0.82 3.15 4.39 -1.07 1.59 114.58 121.88 2db9 h GLU 118 Ca 0.39 0.00 0.14 0.00 0.34 0.00 0.00 59.36 60.23 2db9 h GLU 118 Cb 0.67 0.00 -0.09 0.00 -0.10 0.00 0.00 28.75 29.23 2db9 h GLU 118 CO -0.68 -0.01 0.41 0.00 -1.16 0.00 0.00 179.01 177.57 2db9 h ALA 119 N 1.58 1.20 -0.42 3.43 0.00 -0.77 0.75 119.26 125.03 2db9 h ALA 119 Ca 0.38 0.08 -0.15 0.00 0.00 0.00 0.00 54.91 55.23 2db9 h ALA 119 Cb 0.63 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 2db9 h ALA 119 CO -0.96 -0.09 -0.32 0.52 0.00 0.00 0.00 179.25 178.40 2db9 h MET 120 N 0.60 0.96 -0.17 0.00 2.86 0.21 0.88 114.93 120.27 2db9 h MET 120 Ca 0.44 -0.47 -0.09 0.00 -2.06 0.00 0.00 59.70 57.52 2db9 h MET 120 Cb 0.59 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.24 2db9 h MET 120 CO -0.35 1.13 -0.29 0.74 1.06 0.00 0.00 176.91 179.20 2db9 h PHE 121 N 0.79 0.36 0.06 -0.22 -1.00 0.25 0.42 116.94 117.59 2db9 h PHE 121 Ca 0.08 -0.08 -0.21 0.00 2.81 0.00 0.00 57.97 60.58 2db9 h PHE 121 Cb 0.91 -0.09 0.02 0.00 3.61 0.00 0.00 35.95 40.40 2db9 h PHE 121 CO 0.06 0.58 -0.85 1.03 -1.61 0.00 0.00 178.31 177.53 2db9 h SER 122 N 0.28 0.64 0.25 2.17 0.87 0.57 -3.05 113.55 115.28 2db9 h SER 122 Ca 0.04 -0.82 0.00 0.00 -1.23 0.00 0.00 61.79 59.78 2db9 h SER 122 Cb 0.66 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.42 2db9 h SER 122 CO 0.05 1.38 0.00 0.00 -0.53 0.00 0.00 176.83 177.73 2db9 n ALA 123 N -2.63 2.32 -2.28 6.23 0.00 0.29 -4.85 120.51 119.58 2db9 n ALA 123 Ca -0.12 -0.13 -0.21 0.00 0.00 0.00 0.00 53.44 52.98 2db9 n ALA 123 Cb 0.80 -1.40 -0.02 0.00 0.00 0.00 0.00 19.45 18.83 2db9 n ALA 123 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2db9 n GLY 124 N 0.67 -0.14 0.86 0.00 0.00 0.11 -4.97 105.19 101.71 2db9 n GLY 124 Ca 0.15 -0.01 -0.06 0.00 0.00 0.00 0.00 46.02 46.10 2db9 n GLY 124 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2db9 n MET 125 N -2.91 0.15 -4.34 1.61 2.81 0.12 -5.00 117.12 109.57 2db9 n MET 125 Ca -0.24 -0.54 -0.23 0.00 -1.81 0.00 0.00 57.70 54.88 2db9 n MET 125 Cb 0.69 -0.21 -0.13 0.00 -0.71 0.00 0.00 33.22 32.86 2db9 n MET 125 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 2db9 s GLN 126 N -3.26 1.09 0.57 0.03 -1.52 -1.26 -4.71 119.66 110.60 2db9 s GLN 126 Ca 0.16 -1.03 -0.01 0.00 -1.95 0.00 0.00 55.36 52.53 2db9 s GLN 126 Cb -0.01 -1.24 0.11 0.00 -0.22 0.00 0.00 33.01 31.66 2db9 s GLN 126 CO 0.11 0.29 0.79 1.28 -0.25 0.00 0.00 175.29 177.50 2db9 n LEU 127 N 1.37 0.00 -4.71 2.90 4.77 -1.26 -5.04 117.00 115.03 2db9 n LEU 127 Ca -0.19 -1.62 -0.42 0.00 -0.03 0.00 0.00 56.01 53.74 2db9 n LEU 127 Cb 0.54 -0.51 -0.03 0.00 -2.33 0.00 0.00 43.42 41.09 2db9 n LEU 127 CO 0.22 -0.89 0.88 -2.16 -1.33 0.00 0.00 177.39 174.11 2db9 s PRO 128 N -4.52 4.43 0.23 3.23 0.04 -1.26 -4.75 135.00 132.39 2db9 s PRO 128 Ca 0.52 1.72 -0.29 0.00 0.04 0.00 0.00 61.00 62.98 2db9 s PRO 128 Cb -0.03 -3.40 -0.09 0.00 0.04 0.00 0.00 34.50 31.02 2db9 s PRO 128 CO 0.34 -0.28 0.91 0.95 0.04 0.00 0.00 177.00 178.97 2db9 s THR 129 N 1.30 4.12 0.56 1.26 -4.23 -1.26 0.11 115.64 117.52 2db9 s THR 129 Ca 0.57 2.01 0.47 0.00 -1.18 0.00 0.00 61.69 63.57 2db9 s THR 129 Cb -0.28 -4.29 0.69 0.00 1.34 0.00 0.00 72.50 69.97 2db9 s THR 129 CO 0.28 0.49 1.57 -0.07 -0.54 0.00 0.00 174.62 176.35 2db9 h LEU 130 N 4.14 0.00 0.12 4.79 -0.00 -1.41 1.73 115.31 124.67 2db9 h LEU 130 Ca -0.45 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.42 2db9 h LEU 130 Cb 1.20 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.86 2db9 h LEU 130 CO 0.68 0.00 -0.06 -0.78 -0.00 0.00 0.00 178.44 178.28 2db9 h ASP 131 N 0.00 -0.14 -0.73 -0.43 3.58 -1.90 -1.14 116.42 115.66 2db9 h ASP 131 Ca 0.86 -0.34 -0.03 0.00 0.42 0.00 0.00 57.03 57.94 2db9 h ASP 131 Cb 3.55 0.03 -0.03 0.00 1.72 0.00 0.00 39.33 44.60 2db9 h ASP 131 CO -0.01 0.29 0.36 -0.33 -2.88 0.00 0.00 179.24 176.67 2db9 h GLU 132 N -0.59 1.07 -0.02 0.28 4.39 0.21 0.96 114.58 120.87 2db9 h GLU 132 Ca -0.02 -0.15 0.00 0.00 0.34 0.00 0.00 59.36 59.54 2db9 h GLU 132 Cb 0.47 -0.20 -0.00 0.00 -0.10 0.00 0.00 28.75 28.92 2db9 h GLU 132 CO 0.03 0.82 -0.00 0.82 -1.16 0.00 0.00 179.01 179.52 2db9 h ILE 133 N 1.06 0.99 0.93 3.13 1.08 -0.57 0.86 117.51 124.98 2db9 h ILE 133 Ca 0.26 -0.00 -0.05 0.00 -0.39 0.00 0.00 64.86 64.68 2db9 h ILE 133 Cb 0.11 0.98 0.01 0.00 -3.07 0.00 0.00 36.82 34.85 2db9 h ILE 133 CO -0.03 0.00 -0.45 -1.13 -0.69 0.00 0.00 178.15 175.85 2db9 h ASN 134 N 0.01 -1.06 -0.57 1.72 -0.73 -0.81 1.03 115.58 115.17 2db9 h ASN 134 Ca 0.01 0.04 0.12 0.00 1.87 0.00 0.00 56.30 58.33 2db9 h ASN 134 Cb 0.01 0.27 -0.10 0.00 0.27 0.00 0.00 38.32 38.77 2db9 h ASN 134 CO -0.01 -0.73 -0.09 0.07 -0.37 0.00 0.00 177.43 176.30 2db9 h LYS 135 N -1.31 0.04 0.32 6.67 2.10 -0.75 0.27 116.57 123.90 2db9 h LYS 135 Ca -0.13 -0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.51 2db9 h LYS 135 Cb 0.96 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.28 2db9 h LYS 135 CO 0.21 0.02 -0.16 -0.22 -2.00 0.00 0.00 179.45 177.30 2db9 h LYS 136 N 0.04 -0.42 -0.42 0.07 1.63 0.91 -2.49 116.57 115.88 2db9 h LYS 136 Ca 0.28 0.03 0.04 0.00 -0.85 0.00 0.00 60.65 60.16 2db9 h LYS 136 Cb 0.44 0.10 -0.06 0.00 -0.60 0.00 0.00 32.23 32.11 2db9 h LYS 136 CO -0.56 -0.28 -0.37 1.49 -3.45 0.00 0.00 179.45 176.29 2db9 h GLU 137 N -0.44 -0.14 -0.91 1.90 4.81 0.27 0.34 114.58 120.42 2db9 h GLU 137 Ca -0.04 0.01 0.24 0.00 -0.13 0.00 0.00 59.36 59.43 2db9 h GLU 137 Cb 0.34 0.03 -0.16 0.00 0.63 0.00 0.00 28.75 29.59 2db9 h GLU 137 CO 0.07 -0.09 0.05 -0.07 -0.73 0.00 0.00 179.01 178.23 2db9 h LEU 138 N -0.15 -0.38 -0.93 1.64 -0.00 -0.94 1.54 115.31 116.10 2db9 h LEU 138 Ca 0.07 0.24 0.17 0.00 -0.00 0.00 0.00 57.88 58.36 2db9 h LEU 138 Cb 0.33 0.42 -0.10 0.00 -0.00 0.00 0.00 40.66 41.31 2db9 h LEU 138 CO -0.47 -0.28 0.52 -1.28 -0.00 0.00 0.00 178.44 176.93 2db9 h SER 139 N 0.07 0.65 -0.01 -0.43 0.87 0.11 -0.08 113.55 114.72 2db9 h SER 139 Ca 0.54 0.10 -0.00 0.00 -1.23 0.00 0.00 61.79 61.19 2db9 h SER 139 Cb 1.06 -0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 63.01 2db9 h SER 139 CO -0.81 0.25 -0.00 0.40 -0.53 0.00 0.00 176.83 176.13 2db9 h ILE 140 N 0.69 1.26 -0.34 2.23 5.03 0.32 -2.89 117.51 123.81 2db9 h ILE 140 Ca 0.52 -0.78 0.05 0.00 -0.12 0.00 0.00 64.86 64.53 2db9 h ILE 140 Cb 0.78 1.77 -0.08 0.00 -3.03 0.00 0.00 36.82 36.25 2db9 h ILE 140 CO -0.38 0.21 -0.52 0.11 -0.68 0.00 0.00 178.15 176.89 2db9 h LYS 141 N -0.30 -0.41 -0.78 2.37 1.57 0.57 -0.03 116.57 119.56 2db9 h LYS 141 Ca 0.00 0.03 0.09 0.00 -1.87 0.00 0.00 60.65 58.90 2db9 h LYS 141 Cb 0.33 0.09 -0.12 0.00 0.08 0.00 0.00 32.23 32.62 2db9 h LYS 141 CO 0.00 -0.27 -0.52 0.93 -0.57 0.00 0.00 179.45 179.02 2db9 h GLU 142 N -0.42 -0.13 -0.26 3.15 5.08 -1.08 0.39 114.58 121.31 2db9 h GLU 142 Ca 0.08 0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.50 2db9 h GLU 142 Cb 0.61 0.03 -0.07 0.00 0.50 0.00 0.00 28.75 29.82 2db9 h GLU 142 CO -0.55 -0.09 -0.51 0.00 -1.00 0.00 0.00 179.01 176.86 2db9 h ALA 143 N 0.56 -0.74 0.00 3.43 0.00 -1.01 -3.43 119.26 118.07 2db9 h ALA 143 Ca 0.18 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2db9 h ALA 143 Cb 0.51 1.00 0.00 0.00 0.00 0.00 0.00 17.79 19.30 2db9 h ALA 143 CO -0.82 -1.02 0.00 0.45 0.00 0.00 0.00 179.25 177.86 2db9 n SER 144 N -5.42 0.00 0.00 0.00 2.88 0.04 -5.12 113.62 106.00 2db9 n SER 144 Ca -0.04 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.50 2db9 n SER 144 Cb 0.36 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.82 2db9 n SER 144 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2db9 n GLY 145 N 0.00 -0.08 2.91 0.46 0.00 -0.64 -4.71 105.19 103.13 2db9 n GLY 145 Ca 0.00 0.70 -0.23 0.00 0.00 0.00 0.00 46.02 46.48 2db9 n GLY 145 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2db9 n PRO 146 N 0.00 -1.84 -3.92 1.61 -0.04 -1.26 -4.17 135.00 125.38 2db9 n PRO 146 Ca 0.00 -1.50 -0.09 0.00 -0.04 0.00 0.00 63.50 61.87 2db9 n PRO 146 Cb 0.00 -1.18 -0.02 0.00 -0.04 0.00 0.00 33.50 32.25 2db9 n PRO 146 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2db9 s SER 147 N -4.35 -0.03 0.30 3.54 0.15 -1.26 -5.02 113.70 107.04 2db9 s SER 147 Ca 0.58 -0.92 0.00 0.00 0.70 0.00 0.00 55.95 56.31 2db9 s SER 147 Cb -0.03 0.70 0.00 0.00 -1.71 0.00 0.00 66.02 64.98 2db9 s SER 147 CO 0.42 -1.34 0.00 -0.24 1.20 0.00 0.00 173.24 173.28 2db9 n SER 148 N -0.72 -2.07 0.00 5.45 2.88 -1.26 -5.30 113.62 112.61 2db9 n SER 148 Ca -0.04 0.57 0.00 0.00 -1.33 0.00 0.00 58.87 58.07 2db9 n SER 148 Cb 0.60 2.06 0.00 0.00 -0.75 0.00 0.00 64.21 66.13 2db9 n SER 148 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42