#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2db9 s SER 2 N 0.00 -0.27 0.15 1.61 0.15 -1.26 -5.18 113.70 108.89 2db9 s SER 2 Ca 0.00 0.38 -0.06 0.00 0.70 0.00 0.00 55.95 56.97 2db9 s SER 2 Cb 0.00 1.31 -0.02 0.00 -1.71 0.00 0.00 66.02 65.60 2db9 s SER 2 CO 0.00 -0.05 0.19 -0.44 1.20 0.00 0.00 173.24 174.14 2db9 s SER 3 N 2.20 0.15 0.09 5.45 0.01 -1.26 -5.18 113.70 115.16 2db9 s SER 3 Ca -0.01 -0.97 -0.27 0.00 1.31 0.00 0.00 55.95 56.02 2db9 s SER 3 Cb -0.03 0.38 0.09 0.00 0.21 0.00 0.00 66.02 66.67 2db9 s SER 3 CO -0.17 -0.82 1.10 -0.83 0.41 0.00 0.00 173.24 172.93 2db9 s GLY 4 N -2.99 -0.23 0.02 3.44 0.00 -1.26 -5.19 107.32 101.12 2db9 s GLY 4 Ca 0.18 0.24 -0.28 0.00 0.00 0.00 0.00 44.72 44.86 2db9 s GLY 4 CO -0.00 0.74 1.22 -1.35 0.00 0.00 0.00 173.10 173.71 2db9 s SER 5 N -3.08 -0.05 0.07 1.64 1.04 -1.26 -5.19 113.70 106.87 2db9 s SER 5 Ca 0.15 -0.24 -0.27 0.00 0.48 0.00 0.00 55.95 56.07 2db9 s SER 5 Cb 0.01 0.23 0.09 0.00 0.10 0.00 0.00 66.02 66.44 2db9 s SER 5 CO 0.01 -0.44 1.01 -0.55 0.98 0.00 0.00 173.24 174.25 2db9 s SER 6 N -3.23 -0.20 -0.01 7.02 0.15 -1.26 -5.19 113.70 110.98 2db9 s SER 6 Ca 0.19 -0.24 -0.21 0.00 0.70 0.00 0.00 55.95 56.39 2db9 s SER 6 Cb 0.02 0.39 0.04 0.00 -1.71 0.00 0.00 66.02 64.76 2db9 s SER 6 CO -0.01 -0.70 0.45 -0.83 1.20 0.00 0.00 173.24 173.34 2db9 s GLY 7 N -2.80 -0.31 0.04 9.45 0.00 -1.26 -5.14 107.32 107.30 2db9 s GLY 7 Ca 0.11 0.63 -0.30 0.00 0.00 0.00 0.00 44.72 45.16 2db9 s GLY 7 CO -0.02 0.37 1.17 2.56 0.00 0.00 0.00 173.10 177.18 2db9 s PRO 8 N -1.52 4.44 -0.93 2.90 0.04 -1.26 -4.95 135.00 133.73 2db9 s PRO 8 Ca -0.11 1.71 -0.24 0.00 0.04 0.00 0.00 61.00 62.40 2db9 s PRO 8 Cb -0.03 -3.39 0.00 0.00 0.04 0.00 0.00 34.50 31.13 2db9 s PRO 8 CO 0.05 -0.25 1.68 -1.25 0.04 0.00 0.00 177.00 177.26 2db9 s PRO 9 N 1.20 3.07 -0.54 0.56 0.04 -1.26 -4.86 135.00 133.21 2db9 s PRO 9 Ca 0.58 -0.61 0.04 0.00 0.04 0.00 0.00 61.00 61.04 2db9 s PRO 9 Cb -0.28 -5.10 0.16 0.00 0.04 0.00 0.00 34.50 29.31 2db9 s PRO 9 CO 0.28 -2.74 0.36 0.21 0.04 0.00 0.00 177.00 175.16 2db9 s LYS 10 N 6.02 1.66 0.00 4.56 2.20 -1.26 -5.06 119.74 127.86 2db9 s LYS 10 Ca 0.57 -2.57 0.00 0.00 -0.36 0.00 0.00 55.97 53.61 2db9 s LYS 10 Cb -0.04 -2.54 0.00 0.00 -1.51 0.00 0.00 37.83 33.74 2db9 s LYS 10 CO -0.03 -1.27 0.00 0.45 -0.36 0.00 0.00 175.35 174.15 2db9 n SER 11 N 2.74 0.00 -4.37 1.43 2.88 -1.26 -5.05 113.62 109.99 2db9 n SER 11 Ca 0.18 -0.30 -0.33 0.00 -1.33 0.00 0.00 58.87 57.10 2db9 n SER 11 Cb 0.38 0.00 -0.15 0.00 -0.75 0.00 0.00 64.21 63.70 2db9 n SER 11 CO 0.00 0.00 0.00 -1.58 -1.23 0.00 0.00 175.04 172.23 2db9 s GLN 12 N 0.10 3.02 -0.52 -1.46 0.74 -1.26 -4.98 119.66 115.29 2db9 s GLN 12 Ca 0.00 -0.73 -0.28 0.00 0.05 0.00 0.00 55.36 54.40 2db9 s GLN 12 Cb 0.00 -2.48 0.01 0.00 1.10 0.00 0.00 33.01 31.64 2db9 s GLN 12 CO 0.00 0.34 1.47 -1.25 -0.55 0.00 0.00 175.29 175.30 2db9 s PRO 13 N 0.01 3.30 -0.01 1.67 0.04 -1.26 -1.16 135.00 137.59 2db9 s PRO 13 Ca -0.05 0.62 -0.01 0.00 0.04 0.00 0.00 61.00 61.60 2db9 s PRO 13 Cb -0.15 -4.13 0.00 0.00 0.04 0.00 0.00 34.50 30.27 2db9 s PRO 13 CO 0.04 -1.93 0.02 1.33 0.04 0.00 0.00 177.00 176.51 2db9 n VAL 14 N 6.97 -0.52 -0.00 -0.36 0.24 0.29 -4.68 118.33 120.27 2db9 n VAL 14 Ca 0.14 0.10 0.15 0.00 -2.04 0.00 0.00 64.34 62.69 2db9 n VAL 14 Cb 0.49 -0.71 0.59 0.00 -1.47 0.00 0.00 33.84 32.75 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 1.45 0.17 -4.92 -1.34 0.02 -1.88 -3.43 113.55 103.63 2db9 h SER 15 Ca -0.02 0.00 -0.37 0.00 -0.84 0.00 0.00 61.79 60.57 2db9 h SER 15 Cb 0.24 -0.03 -0.14 0.00 0.14 0.00 0.00 62.40 62.61 2db9 h SER 15 CO 0.01 0.10 -0.58 -1.48 -1.14 0.00 0.00 176.83 173.74 2db9 s LEU 16 N -9.07 1.57 0.09 5.07 0.05 -1.26 -5.03 118.68 110.10 2db9 s LEU 16 Ca -0.06 -1.50 0.23 0.00 0.05 0.00 0.00 54.13 52.85 2db9 s LEU 16 Cb 0.19 0.21 0.92 0.00 -2.05 0.00 0.00 46.19 45.47 2db9 s LEU 16 CO 0.73 -0.85 1.72 -0.81 -0.55 0.00 0.00 176.35 176.58 2db9 n PRO 17 N -0.50 0.09 0.04 1.48 -0.04 -1.26 -3.31 135.00 131.50 2db9 n PRO 17 Ca 0.01 0.20 -0.13 0.00 -0.04 0.00 0.00 63.50 63.54 2db9 n PRO 17 Cb 0.65 -1.63 -0.09 0.00 -0.04 0.00 0.00 33.50 32.39 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 -0.12 -0.95 0.54 5.08 -1.96 -2.43 114.58 114.74 2db9 h GLU 18 Ca 0.00 0.01 0.20 0.00 -1.00 0.00 0.00 59.36 58.57 2db9 h GLU 18 Cb 0.44 0.03 -0.08 0.00 0.50 0.00 0.00 28.75 29.64 2db9 h GLU 18 CO 0.00 0.26 0.61 0.93 -1.00 0.00 0.00 179.01 179.81 2db9 h GLU 19 N -0.51 0.51 0.00 2.33 4.39 -1.94 1.61 114.58 120.97 2db9 h GLU 19 Ca -0.01 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.66 2db9 h GLU 19 Cb 0.43 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.96 2db9 h GLU 19 CO 0.02 0.34 0.00 1.25 -1.16 0.00 0.00 179.01 179.46 2db9 h LEU 20 N 0.52 0.00 0.00 1.33 5.85 -1.64 -2.21 115.31 119.16 2db9 h LEU 20 Ca 0.52 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.24 2db9 h LEU 20 Cb 1.12 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.15 2db9 h LEU 20 CO -0.25 0.00 -0.74 0.78 -0.34 0.00 0.00 178.44 177.89 2db9 h ASN 21 N 0.00 0.00 0.23 1.25 2.35 0.27 -3.01 115.58 116.67 2db9 h ASN 21 Ca 0.00 -0.07 -0.15 0.00 -0.55 0.00 0.00 56.30 55.53 2db9 h ASN 21 Cb 0.61 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.97 2db9 h ASN 21 CO 0.00 0.03 -0.59 0.03 -1.65 0.00 0.00 177.43 175.26 2db9 h ARG 22 N 0.00 0.36 -0.67 0.81 3.08 -0.29 -2.80 114.38 114.87 2db9 h ARG 22 Ca 0.00 -0.24 0.00 0.00 0.07 0.00 0.00 59.98 59.81 2db9 h ARG 22 Cb 0.91 0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.00 2db9 h ARG 22 CO 0.00 0.85 0.00 1.33 -1.07 0.00 0.00 179.97 181.08 2db9 n VAL 23 N -3.91 1.07 -2.46 2.04 0.24 -1.21 -4.74 118.33 109.37 2db9 n VAL 23 Ca -0.03 -1.02 -0.43 0.00 -2.04 0.00 0.00 64.34 60.82 2db9 n VAL 23 Cb 0.61 0.47 -0.02 0.00 -1.47 0.00 0.00 33.84 33.43 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 -1.08 4.24 0.94 7.34 3.52 -1.06 -2.86 118.95 130.00 2db9 s ARG 24 Ca 0.45 1.62 -0.16 0.00 -0.13 0.00 0.00 55.73 57.51 2db9 s ARG 24 Cb 0.24 -3.74 0.23 0.00 -1.56 0.00 0.00 34.95 30.12 2db9 s ARG 24 CO 0.30 -0.68 1.08 1.28 -0.81 0.00 0.00 175.30 176.47 2db9 n LEU 25 N 6.48 0.00 -3.74 -0.88 4.77 -1.03 -4.95 117.00 117.66 2db9 n LEU 25 Ca 0.13 -1.16 -0.12 0.00 -0.03 0.00 0.00 56.01 54.83 2db9 n LEU 25 Cb 0.45 -0.88 -0.12 0.00 -2.33 0.00 0.00 43.42 40.54 2db9 n LEU 25 CO 0.55 -1.61 -0.08 -0.94 -1.33 0.00 0.00 177.39 173.98 2db9 s SER 26 N -4.76 -0.31 0.24 -1.43 1.04 -1.26 -4.64 113.70 102.57 2db9 s SER 26 Ca 0.64 0.59 0.05 0.00 0.48 0.00 0.00 55.95 57.72 2db9 s SER 26 Cb -0.04 0.51 0.67 0.00 0.10 0.00 0.00 66.02 67.27 2db9 s SER 26 CO 0.47 -0.15 1.12 -1.14 0.98 0.00 0.00 173.24 174.52 2db9 n ARG 27 N 3.89 -0.05 0.22 4.02 0.63 -1.26 0.85 116.66 124.96 2db9 n ARG 27 Ca -0.22 1.05 -0.12 0.00 -0.92 0.00 0.00 57.85 57.64 2db9 n ARG 27 Cb 0.55 -1.73 -0.06 0.00 0.45 0.00 0.00 32.46 31.67 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 -0.88 -0.87 -0.14 3.86 -1.95 1.26 115.15 116.43 2db9 h HIS 28 Ca 0.49 0.00 0.23 0.00 -1.16 0.00 0.00 60.37 59.92 2db9 h HIS 28 Cb 1.11 0.33 -0.14 0.00 1.06 0.00 0.00 27.41 29.77 2db9 h HIS 28 CO -0.26 -0.45 0.25 0.87 0.86 0.00 0.00 177.93 179.20 2db9 h LYS 29 N -0.69 0.23 -0.34 2.45 1.57 0.05 0.68 116.57 120.52 2db9 h LYS 29 Ca -0.05 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.69 2db9 h LYS 29 Cb 0.58 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.83 2db9 h LYS 29 CO -0.00 0.15 0.10 -0.07 -0.57 0.00 0.00 179.45 179.05 2db9 h LEU 30 N 0.23 0.50 -2.90 2.94 3.38 -0.36 1.42 115.31 120.52 2db9 h LEU 30 Ca 0.54 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.30 2db9 h LEU 30 Cb 1.08 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.70 2db9 h LEU 30 CO -0.63 0.58 0.00 -0.08 0.09 0.00 0.00 178.44 178.41 2db9 h GLU 31 N 0.39 0.00 0.00 1.13 4.22 0.73 1.57 114.58 122.62 2db9 h GLU 31 Ca 0.11 0.00 -0.35 0.00 0.08 0.00 0.00 59.36 59.20 2db9 h GLU 31 Cb 0.27 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.47 2db9 h GLU 31 CO -0.00 0.00 -1.99 0.54 -2.18 0.00 0.00 179.01 175.38 2db9 n ARG 32 N -3.21 0.57 0.18 1.92 1.74 0.68 -4.19 116.66 114.35 2db9 n ARG 32 Ca -0.03 0.37 0.14 0.00 -0.77 0.00 0.00 57.85 57.55 2db9 n ARG 32 Cb 0.07 -1.57 0.60 0.00 -1.02 0.00 0.00 32.46 30.54 2db9 n ARG 32 CO 0.00 0.00 0.00 -1.49 -1.52 0.00 0.00 177.63 174.62 2db9 h TRP 33 N -1.00 0.00 0.00 -1.55 6.55 0.22 0.04 115.95 120.21 2db9 h TRP 33 Ca -0.53 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.31 2db9 h TRP 33 Cb 1.45 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.75 2db9 h TRP 33 CO -0.06 0.00 0.00 0.00 -1.05 0.00 0.00 178.44 177.33 2db9 n HIS 35 N -2.70 0.56 -4.23 0.00 1.44 -0.01 -5.01 115.22 105.27 2db9 n HIS 35 Ca 0.01 -0.95 -0.13 0.00 -2.01 0.00 0.00 57.72 54.64 2db9 n HIS 35 Cb 0.23 -0.25 -0.10 0.00 0.12 0.00 0.00 29.99 29.99 2db9 n HIS 35 CO 0.00 0.00 0.00 -1.64 -2.81 0.00 0.00 176.34 171.89 2db9 s MET 36 N -2.86 1.08 0.52 -1.40 1.00 -0.40 -5.10 119.30 112.13 2db9 s MET 36 Ca 0.38 -1.52 -0.09 0.00 0.00 0.00 0.00 55.69 54.47 2db9 s MET 36 Cb 0.32 -0.24 0.12 0.00 0.00 0.00 0.00 34.83 35.04 2db9 s MET 36 CO 0.06 -0.13 0.57 -0.35 0.00 0.00 0.00 175.02 175.17 2db9 n PRO 37 N -0.22 -1.30 -1.30 2.03 -0.04 -1.26 -3.82 135.00 129.08 2db9 n PRO 37 Ca -0.07 -0.89 -0.04 0.00 -0.04 0.00 0.00 63.50 62.46 2db9 n PRO 37 Cb 0.63 -0.70 -0.02 0.00 -0.04 0.00 0.00 33.50 33.37 2db9 n PRO 37 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 2db9 n PHE 38 N -3.23 -0.94 0.01 0.54 1.16 -1.26 -4.78 117.46 108.96 2db9 n PHE 38 Ca 0.07 0.00 -0.00 0.00 -1.87 0.00 0.00 57.45 55.65 2db9 n PHE 38 Cb 0.27 -1.50 -0.00 0.00 -1.61 0.00 0.00 39.48 36.64 2db9 n PHE 38 CO 0.00 0.00 0.00 0.35 -1.87 0.00 0.00 176.76 175.24 2db9 h PHE 39 N 0.00 -0.02 0.00 2.97 3.57 -1.81 0.62 116.94 122.27 2db9 h PHE 39 Ca -0.09 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.41 2db9 h PHE 39 Cb 0.38 0.01 -0.00 0.00 2.79 0.00 0.00 35.95 39.12 2db9 h PHE 39 CO 0.21 -0.01 -0.03 0.00 -2.23 0.00 0.00 178.31 176.25 2db9 h ALA 40 N -1.98 1.25 0.05 2.41 0.00 -1.88 0.49 119.26 119.60 2db9 h ALA 40 Ca -0.00 -0.03 -0.25 0.00 0.00 0.00 0.00 54.91 54.63 2db9 h ALA 40 Cb 0.02 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 17.81 2db9 h ALA 40 CO 0.00 0.04 -1.07 -0.22 0.00 0.00 0.00 179.25 178.00 2db9 h LYS 41 N 0.00 0.45 0.00 0.00 3.64 -1.91 -3.01 116.57 115.73 2db9 h LYS 41 Ca -0.00 -0.55 0.00 0.00 -1.27 0.00 0.00 60.65 58.83 2db9 h LYS 41 Cb 0.12 0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 2db9 h LYS 41 CO 0.00 1.20 0.00 2.41 -2.27 0.00 0.00 179.45 180.79 2db9 n THR 42 N -3.72 0.00 -0.50 1.00 -1.04 0.22 -3.97 114.28 106.27 2db9 n THR 42 Ca -0.09 0.48 0.40 0.00 -2.04 0.00 0.00 64.05 62.80 2db9 n THR 42 Cb 0.91 -1.44 0.63 0.00 -1.82 0.00 0.00 70.33 68.61 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 -2.02 -0.11 -1.99 12.58 0.24 0.15 -4.01 118.33 123.18 2db9 n VAL 43 Ca 0.00 1.39 -0.43 0.00 -2.04 0.00 0.00 64.34 63.26 2db9 n VAL 43 Cb 0.00 -2.30 -0.03 0.00 -1.47 0.00 0.00 33.84 30.05 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 -4.78 3.50 0.00 3.34 2.01 -1.14 -1.64 115.64 116.93 2db9 s THR 44 Ca -0.05 0.55 0.00 0.00 0.31 0.00 0.00 61.69 62.50 2db9 s THR 44 Cb 0.24 -3.55 0.00 0.00 0.01 0.00 0.00 72.50 69.20 2db9 s THR 44 CO 0.72 -0.27 0.00 0.61 -0.69 0.00 0.00 174.62 175.00 2db9 n GLY 45 N 4.98 0.93 0.60 4.40 0.00 -0.38 -4.93 105.19 110.78 2db9 n GLY 45 Ca 0.21 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.20 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 0.17 0.09 0.13 0.00 0.40 -1.14 -1.49 117.98 116.14 2db9 s PHE 47 Ca 0.10 0.10 0.07 0.00 -0.60 0.00 0.00 56.93 56.60 2db9 s PHE 47 Cb -0.01 -0.27 -0.04 0.00 0.51 0.00 0.00 43.02 43.22 2db9 s PHE 47 CO 0.06 -0.09 -0.17 0.14 0.70 0.00 0.00 175.22 175.86 2db9 s VAL 48 N 1.01 1.59 -0.29 -0.44 -7.23 -0.67 -2.46 120.40 111.91 2db9 s VAL 48 Ca -0.09 -1.72 -0.20 0.00 -1.81 0.00 0.00 61.98 58.15 2db9 s VAL 48 Cb -0.13 -1.62 -0.01 0.00 0.56 0.00 0.00 36.38 35.18 2db9 s VAL 48 CO -0.03 -0.28 0.64 -0.13 -0.31 0.00 0.00 175.10 174.99 2db9 s ARG 49 N -2.48 3.95 0.06 4.82 0.52 -1.25 -2.73 118.95 121.85 2db9 s ARG 49 Ca 0.10 0.37 0.01 0.00 -0.52 0.00 0.00 55.73 55.69 2db9 s ARG 49 Cb -0.07 -3.71 -0.04 0.00 0.52 0.00 0.00 34.95 31.65 2db9 s ARG 49 CO 0.05 -0.54 0.17 -1.50 0.02 0.00 0.00 175.30 173.50 2db9 s ILE 50 N 2.60 5.12 -0.34 1.52 1.10 -1.18 -1.87 121.20 128.16 2db9 s ILE 50 Ca 0.26 -0.50 -0.10 0.00 -0.51 0.00 0.00 60.65 59.80 2db9 s ILE 50 Cb -0.15 -3.48 0.01 0.00 0.15 0.00 0.00 42.46 38.98 2db9 s ILE 50 CO 0.11 0.15 0.18 -0.83 -2.11 0.00 0.00 174.94 172.44 2db9 s GLY 51 N -2.44 1.90 -0.02 1.50 0.00 -1.24 -1.42 107.32 105.60 2db9 s GLY 51 Ca 0.33 -1.55 0.14 0.00 0.00 0.00 0.00 44.72 43.64 2db9 s GLY 51 CO 0.26 0.77 0.68 0.29 0.00 0.00 0.00 173.10 175.10 2db9 n ILE 52 N 4.99 1.45 -4.01 0.90 -5.35 0.36 -4.89 119.36 112.81 2db9 n ILE 52 Ca -0.13 -0.76 -0.15 0.00 -0.27 0.00 0.00 62.75 61.43 2db9 n ILE 52 Cb 0.48 -0.91 -0.15 0.00 -1.74 0.00 0.00 39.64 37.32 2db9 n ILE 52 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2db9 s GLY 53 N -5.02 0.19 -0.40 3.28 0.00 -0.77 -4.99 107.32 99.62 2db9 s GLY 53 Ca -0.04 -0.03 0.03 0.00 0.00 0.00 0.00 44.72 44.68 2db9 s GLY 53 CO 0.82 0.14 0.36 0.54 0.00 0.00 0.00 173.10 174.96 2db9 s ASN 54 N 0.32 1.40 0.48 1.64 4.22 -1.26 -0.68 114.94 121.06 2db9 s ASN 54 Ca -0.03 -2.44 0.02 0.00 -2.14 0.00 0.00 52.86 48.27 2db9 s ASN 54 Cb -0.06 0.02 -0.01 0.00 1.28 0.00 0.00 41.25 42.48 2db9 s ASN 54 CO -0.01 -0.21 0.07 -1.00 -2.04 0.00 0.00 177.10 173.92 2db9 s HIS 55 N 0.64 1.76 0.06 1.54 3.76 -1.26 -5.06 115.29 116.73 2db9 s HIS 55 Ca 0.26 -1.18 -0.19 0.00 -0.15 0.00 0.00 55.06 53.80 2db9 s HIS 55 Cb -0.06 -1.36 -0.07 0.00 1.11 0.00 0.00 32.58 32.19 2db9 s HIS 55 CO -0.10 -0.08 1.31 -0.97 -0.85 0.00 0.00 174.74 174.04 2db9 h ASN 56 N 1.49 -0.93 -2.27 1.40 -1.24 -2.03 -3.43 115.58 108.57 2db9 h ASN 56 Ca -0.39 0.11 -0.25 0.00 0.71 0.00 0.00 56.30 56.47 2db9 h ASN 56 Cb 1.30 0.36 0.15 0.00 0.73 0.00 0.00 38.32 40.86 2db9 h ASN 56 CO 0.63 -0.28 -0.17 -1.20 -1.29 0.00 0.00 177.43 175.12 2db9 n SER 57 N -4.14 -3.39 -4.35 1.15 7.64 -1.26 -4.80 113.62 104.47 2db9 n SER 57 Ca -0.04 -0.55 -0.42 0.00 1.01 0.00 0.00 58.87 58.87 2db9 n SER 57 Cb 0.22 -0.84 0.00 0.00 -1.01 0.00 0.00 64.21 62.58 2db9 n SER 57 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 2db9 n LYS 58 N -3.09 0.17 -0.90 1.43 2.85 -1.26 -4.94 118.16 112.42 2db9 n LYS 58 Ca 0.09 0.06 -0.18 0.00 -1.05 0.00 0.00 58.31 57.23 2db9 n LYS 58 Cb 0.41 -1.16 0.14 0.00 -0.65 0.00 0.00 35.03 33.77 2db9 n LYS 58 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 177.40 177.00 2db9 n PRO 59 N 1.08 -1.53 -3.60 -1.58 -0.04 -1.26 -4.62 135.00 123.45 2db9 n PRO 59 Ca 0.11 -1.16 -0.23 0.00 -0.04 0.00 0.00 63.50 62.19 2db9 n PRO 59 Cb 0.40 -0.91 -0.16 0.00 -0.04 0.00 0.00 33.50 32.79 2db9 n PRO 59 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2db9 s VAL 60 N -2.49 -0.16 0.06 0.52 1.01 0.15 -4.95 120.40 114.53 2db9 s VAL 60 Ca 0.44 -0.02 0.07 0.00 0.00 0.00 0.00 61.98 62.48 2db9 s VAL 60 Cb -0.03 -0.51 -0.03 0.00 0.00 0.00 0.00 36.38 35.81 2db9 s VAL 60 CO 0.33 -0.16 -0.20 -0.31 0.00 0.00 0.00 175.10 174.75 2db9 s TYR 61 N 2.20 1.75 -0.04 5.22 2.02 -1.26 -0.49 117.35 126.75 2db9 s TYR 61 Ca 0.04 -0.38 0.00 0.00 -0.37 0.00 0.00 57.07 56.35 2db9 s TYR 61 Cb -0.15 -1.02 0.02 0.00 -0.40 0.00 0.00 41.96 40.41 2db9 s TYR 61 CO -0.09 0.12 -0.02 1.03 -1.57 0.00 0.00 175.55 175.02 2db9 s ARG 62 N -1.37 0.57 0.32 -0.62 1.81 -0.51 -4.91 118.95 114.25 2db9 s ARG 62 Ca 0.07 0.01 -0.29 0.00 -1.72 0.00 0.00 55.73 53.80 2db9 s ARG 62 Cb -0.09 -0.72 -0.12 0.00 -0.45 0.00 0.00 34.95 33.57 2db9 s ARG 62 CO 0.02 -0.15 1.43 0.28 -0.68 0.00 0.00 175.30 176.21 2db9 n VAL 63 N 4.30 1.62 -3.79 3.52 0.31 -1.26 -3.08 118.33 119.95 2db9 n VAL 63 Ca -0.22 -0.40 -0.13 0.00 -0.01 0.00 0.00 64.34 63.58 2db9 n VAL 63 Cb 0.50 -1.76 -0.13 0.00 -0.91 0.00 0.00 33.84 31.54 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 -0.70 -0.35 -0.15 3.52 0.00 -1.11 -4.68 121.76 118.30 2db9 s ALA 64 Ca 0.59 0.55 -0.07 0.00 0.00 0.00 0.00 51.96 53.02 2db9 s ALA 64 Cb -0.54 -0.34 -0.04 0.00 0.00 0.00 0.00 23.12 22.20 2db9 s ALA 64 CO 0.58 -0.11 0.10 -2.00 0.00 0.00 0.00 175.76 174.33 2db9 s GLU 65 N 0.53 3.71 -0.06 0.00 2.12 -1.03 -1.68 118.70 122.28 2db9 s GLU 65 Ca -0.04 -0.24 -0.30 0.00 0.36 0.00 0.00 54.97 54.75 2db9 s GLU 65 Cb -0.05 -3.20 -0.04 0.00 0.26 0.00 0.00 34.13 31.10 2db9 s GLU 65 CO -0.02 0.52 1.34 0.42 -0.54 0.00 0.00 175.26 176.98 2db9 s ILE 66 N -0.31 3.98 -0.91 -3.70 1.01 -0.56 -0.36 121.20 120.36 2db9 s ILE 66 Ca 0.10 1.30 0.11 0.00 0.00 0.00 0.00 60.65 62.15 2db9 s ILE 66 Cb -0.12 -3.83 -0.02 0.00 0.01 0.00 0.00 42.46 38.50 2db9 s ILE 66 CO 0.01 -0.04 0.62 0.35 0.00 0.00 0.00 174.94 175.89 2db9 n THR 67 N 4.90 0.00 -2.17 2.92 -2.24 0.22 -1.25 114.28 116.66 2db9 n THR 67 Ca 0.13 -0.37 0.00 0.00 -2.27 0.00 0.00 64.05 61.54 2db9 n THR 67 Cb 0.45 1.11 0.00 0.00 -2.10 0.00 0.00 70.33 69.78 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 0.96 -2.05 2.81 3.38 0.00 -1.20 -4.94 105.19 104.15 2db9 n GLY 68 Ca 0.04 -1.26 -0.24 0.00 0.00 0.00 0.00 46.02 44.56 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 -2.55 0.56 0.57 1.61 1.01 -1.26 -0.66 120.40 119.69 2db9 s VAL 69 Ca 0.00 -0.01 0.07 0.00 0.00 0.00 0.00 61.98 62.04 2db9 s VAL 69 Cb 0.00 -0.69 0.08 0.00 0.00 0.00 0.00 36.38 35.77 2db9 s VAL 69 CO 0.00 0.28 0.79 0.68 0.00 0.00 0.00 175.10 176.85 2db9 s VAL 70 N 1.90 2.32 0.16 2.92 -7.23 0.13 -4.90 120.40 115.70 2db9 s VAL 70 Ca 0.05 -0.91 0.10 0.00 -1.81 0.00 0.00 61.98 59.41 2db9 s VAL 70 Cb -0.12 -2.41 -0.04 0.00 0.56 0.00 0.00 36.38 34.36 2db9 s VAL 70 CO -0.06 0.00 -0.23 -1.61 -0.31 0.00 0.00 175.10 172.88 2db9 s GLU 71 N -4.70 1.39 0.41 4.82 2.02 -1.26 -0.03 118.70 121.35 2db9 s GLU 71 Ca 0.61 -1.41 0.03 0.00 0.02 0.00 0.00 54.97 54.23 2db9 s GLU 71 Cb -0.07 -1.71 -0.03 0.00 0.10 0.00 0.00 34.13 32.43 2db9 s GLU 71 CO 0.39 0.38 0.09 0.95 0.02 0.00 0.00 175.26 177.09 2db9 s THR 72 N -1.49 0.81 -0.20 3.63 -4.23 -0.99 -4.78 115.64 108.39 2db9 s THR 72 Ca 0.16 -2.00 0.17 0.00 -1.18 0.00 0.00 61.69 58.84 2db9 s THR 72 Cb -0.08 -2.39 -0.24 0.00 1.34 0.00 0.00 72.50 71.12 2db9 s THR 72 CO 0.07 0.00 0.06 0.00 -0.54 0.00 0.00 174.62 174.21 2db9 n ALA 73 N -0.94 1.51 -2.45 3.99 0.00 -1.26 -4.94 120.51 116.42 2db9 n ALA 73 Ca -0.08 -1.30 -0.34 0.00 0.00 0.00 0.00 53.44 51.73 2db9 n ALA 73 Cb 0.66 -0.17 -0.05 0.00 0.00 0.00 0.00 19.45 19.88 2db9 n ALA 73 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2db9 s LYS 74 N -2.48 3.85 0.07 0.00 1.02 -1.26 -5.09 119.74 115.85 2db9 s LYS 74 Ca -0.10 0.31 0.07 0.00 0.02 0.00 0.00 55.97 56.27 2db9 s LYS 74 Cb 0.06 -2.86 -0.04 0.00 -0.52 0.00 0.00 37.83 34.47 2db9 s LYS 74 CO 0.80 0.45 -0.14 0.08 -0.92 0.00 0.00 175.35 175.62 2db9 s VAL 75 N -1.56 3.09 0.07 3.17 1.01 -1.26 -4.69 120.40 120.22 2db9 s VAL 75 Ca 0.40 -1.21 0.02 0.00 0.00 0.00 0.00 61.98 61.19 2db9 s VAL 75 Cb -0.13 -2.37 -0.03 0.00 0.00 0.00 0.00 36.38 33.84 2db9 s VAL 75 CO 0.20 0.24 -0.07 -0.72 0.00 0.00 0.00 175.10 174.75 2db9 s TYR 76 N -1.06 0.76 0.63 5.22 -0.85 -0.94 -4.98 117.35 116.13 2db9 s TYR 76 Ca 0.17 -0.77 -0.16 0.00 -0.52 0.00 0.00 57.07 55.80 2db9 s TYR 76 Cb -0.11 -0.46 -0.02 0.00 0.38 0.00 0.00 41.96 41.76 2db9 s TYR 76 CO 0.09 -0.15 1.10 -1.14 -1.52 0.00 0.00 175.55 173.93 2db9 s GLN 77 N -2.97 3.00 -0.38 -3.49 0.74 -1.26 -1.78 119.66 113.51 2db9 s GLN 77 Ca 0.03 1.38 0.05 0.00 0.05 0.00 0.00 55.36 56.88 2db9 s GLN 77 Cb -0.00 -1.98 0.17 0.00 1.10 0.00 0.00 33.01 32.30 2db9 s GLN 77 CO -0.03 -1.09 0.51 -1.17 -0.55 0.00 0.00 175.29 172.95 2db9 s LEU 78 N -4.62 -0.87 -0.67 3.68 2.96 0.57 -4.72 118.68 115.01 2db9 s LEU 78 Ca 0.67 -1.04 0.00 0.00 -0.22 0.00 0.00 54.13 53.54 2db9 s LEU 78 Cb -0.20 1.32 0.00 0.00 0.50 0.00 0.00 46.19 47.81 2db9 s LEU 78 CO 0.38 -0.23 0.00 0.61 -1.32 0.00 0.00 176.35 175.79 2db9 n GLY 79 N 4.47 0.67 0.00 7.98 0.00 -1.26 -1.85 105.19 115.20 2db9 n GLY 79 Ca 0.10 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.05 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 -0.09 3.57 3.81 -0.02 0.00 -1.26 -5.09 105.19 106.11 2db9 n GLY 80 Ca -0.06 -1.02 -0.36 0.00 0.00 0.00 0.00 46.02 44.57 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 0.00 4.50 -0.34 2.61 -1.32 -0.77 -4.98 115.64 115.34 2db9 s THR 81 Ca 0.00 1.38 -0.10 0.00 -1.21 0.00 0.00 61.69 61.75 2db9 s THR 81 Cb 0.00 -3.86 0.01 0.00 -1.51 0.00 0.00 72.50 67.14 2db9 s THR 81 CO 0.00 0.14 0.18 -0.13 -2.21 0.00 0.00 174.62 172.60 2db9 s ARG 82 N -2.11 3.11 0.37 7.08 0.52 -1.26 0.21 118.95 126.87 2db9 s ARG 82 Ca 0.46 -0.88 0.08 0.00 -0.52 0.00 0.00 55.73 54.87 2db9 s ARG 82 Cb -0.16 -3.64 -0.05 0.00 0.52 0.00 0.00 34.95 31.62 2db9 s ARG 82 CO 0.21 -0.54 0.12 -0.08 0.02 0.00 0.00 175.30 175.03 2db9 s THR 83 N 1.59 2.60 -0.29 0.02 -1.32 -0.74 -4.87 115.64 112.63 2db9 s THR 83 Ca 0.03 -1.77 0.20 0.00 -1.21 0.00 0.00 61.69 58.94 2db9 s THR 83 Cb -0.18 -2.94 0.48 0.00 -1.51 0.00 0.00 72.50 68.35 2db9 s THR 83 CO 0.06 -0.11 1.05 -0.46 -2.21 0.00 0.00 174.62 172.96 2db9 n ASN 84 N -1.14 1.36 -4.20 8.08 6.94 -1.26 -2.20 115.26 122.84 2db9 n ASN 84 Ca -0.02 -2.36 -0.34 0.00 -0.02 0.00 0.00 54.58 51.83 2db9 n ASN 84 Cb 0.63 -0.44 -0.15 0.00 -2.36 0.00 0.00 39.78 37.46 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 -3.30 3.05 -0.35 -3.83 1.02 -1.26 -2.33 119.74 112.74 2db9 s LYS 85 Ca 0.26 -0.82 -0.26 0.00 0.02 0.00 0.00 55.97 55.17 2db9 s LYS 85 Cb 0.39 -2.82 0.01 0.00 -0.52 0.00 0.00 37.83 34.90 2db9 s LYS 85 CO -0.01 -0.26 0.95 0.20 -0.92 0.00 0.00 175.35 175.31 2db9 s GLY 86 N 1.35 1.58 -0.27 -3.33 0.00 0.96 -4.51 107.32 103.10 2db9 s GLY 86 Ca 0.04 -0.34 -0.29 0.00 0.00 0.00 0.00 44.72 44.13 2db9 s GLY 86 CO -0.08 2.06 1.64 1.08 0.00 0.00 0.00 173.10 177.80 2db9 s LEU 87 N 3.47 3.75 -0.76 0.66 1.43 0.14 0.19 118.68 127.57 2db9 s LEU 87 Ca 0.40 1.45 -0.26 0.00 -1.03 0.00 0.00 54.13 54.68 2db9 s LEU 87 Cb -0.12 -3.53 0.02 0.00 0.03 0.00 0.00 46.19 42.59 2db9 s LEU 87 CO 0.17 -1.40 1.39 -1.58 0.23 0.00 0.00 176.35 175.17 2db9 s GLN 88 N 4.96 3.15 0.05 1.70 0.74 0.17 -1.08 119.66 129.34 2db9 s GLN 88 Ca 0.73 -0.23 0.02 0.00 0.05 0.00 0.00 55.36 55.92 2db9 s GLN 88 Cb -0.23 -4.37 -0.04 0.00 1.10 0.00 0.00 33.01 29.47 2db9 s GLN 88 CO 0.31 -2.26 0.09 -0.51 -0.55 0.00 0.00 175.29 172.36 2db9 s LEU 89 N 6.20 3.86 -0.12 3.68 1.43 -0.71 0.69 118.68 133.71 2db9 s LEU 89 Ca 0.41 0.06 -0.00 0.00 -1.03 0.00 0.00 54.13 53.57 2db9 s LEU 89 Cb -0.08 -2.43 0.03 0.00 0.03 0.00 0.00 46.19 43.74 2db9 s LEU 89 CO 0.12 0.21 -0.07 -0.60 0.23 0.00 0.00 176.35 176.24 2db9 s ARG 90 N -2.16 1.49 -0.46 1.70 3.52 0.52 0.17 118.95 123.72 2db9 s ARG 90 Ca 0.27 -0.26 -0.06 0.00 -0.13 0.00 0.00 55.73 55.55 2db9 s ARG 90 Cb -0.12 -1.60 0.12 0.00 -1.56 0.00 0.00 34.95 31.78 2db9 s ARG 90 CO 0.19 -0.28 0.30 -1.58 -0.81 0.00 0.00 175.30 173.12 2db9 s HIS 91 N 1.71 3.50 0.00 5.12 5.65 0.07 -2.47 115.29 128.87 2db9 s HIS 91 Ca 0.05 -2.15 0.00 0.00 0.25 0.00 0.00 55.06 53.20 2db9 s HIS 91 Cb -0.13 -3.37 0.00 0.00 -1.18 0.00 0.00 32.58 27.90 2db9 s HIS 91 CO -0.08 -0.98 0.00 0.41 -0.65 0.00 0.00 174.74 173.44 2db9 n GLY 92 N 4.69 0.63 1.45 1.59 0.00 -1.26 -2.81 105.19 109.48 2db9 n GLY 92 Ca -0.04 -0.65 0.06 0.00 0.00 0.00 0.00 46.02 45.38 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 6.57 4.26 -4.26 1.61 0.23 -1.26 -4.87 115.26 117.55 2db9 n ASN 93 Ca 0.00 -2.58 -0.24 0.00 -0.53 0.00 0.00 54.58 51.23 2db9 n ASN 93 Cb 0.00 -0.60 -0.13 0.00 -2.08 0.00 0.00 39.78 36.97 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 -0.64 2.42 0.16 0.53 1.01 -1.12 -5.15 116.67 113.88 2db9 s ASP 94 Ca 0.40 -0.60 0.06 0.00 0.71 0.00 0.00 52.55 53.12 2db9 s ASP 94 Cb 0.29 -0.16 -0.04 0.00 1.01 0.00 0.00 42.92 44.02 2db9 s ASP 94 CO 0.14 0.10 0.05 -1.58 0.21 0.00 0.00 175.17 174.08 2db9 s GLN 95 N -1.53 2.61 0.29 8.23 0.74 -1.26 -0.75 119.66 127.99 2db9 s GLN 95 Ca 0.06 -0.98 -0.00 0.00 0.05 0.00 0.00 55.36 54.49 2db9 s GLN 95 Cb -0.09 -2.49 -0.02 0.00 1.10 0.00 0.00 33.01 31.50 2db9 s GLN 95 CO 0.03 0.48 0.33 1.03 -0.55 0.00 0.00 175.29 176.60 2db9 s ARG 96 N -2.90 1.64 -0.24 1.67 0.52 0.44 -4.88 118.95 115.19 2db9 s ARG 96 Ca 0.28 -1.74 -0.02 0.00 -0.52 0.00 0.00 55.73 53.73 2db9 s ARG 96 Cb -0.10 0.37 0.12 0.00 0.52 0.00 0.00 34.95 35.86 2db9 s ARG 96 CO 0.20 -0.63 0.32 0.08 0.02 0.00 0.00 175.30 175.29 2db9 s VAL 97 N -3.57 -0.49 0.00 3.52 1.01 -1.26 -1.74 120.40 117.87 2db9 s VAL 97 Ca 0.35 -0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.17 2db9 s VAL 97 Cb 0.02 -0.81 0.00 0.00 0.00 0.00 0.00 36.38 35.60 2db9 s VAL 97 CO 0.19 -0.21 0.00 0.49 0.00 0.00 0.00 175.10 175.57 2db9 n PHE 98 N 5.34 -0.64 -4.52 5.22 3.01 -0.24 -4.89 117.46 120.75 2db9 n PHE 98 Ca -0.04 0.00 -0.25 0.00 1.01 0.00 0.00 57.45 58.17 2db9 n PHE 98 Cb 0.49 0.00 -0.10 0.00 -0.01 0.00 0.00 39.48 39.86 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 -1.63 1.80 0.36 -1.08 0.52 -1.26 0.24 118.95 117.90 2db9 s ARG 99 Ca 0.00 -1.89 0.05 0.00 -0.52 0.00 0.00 55.73 53.36 2db9 s ARG 99 Cb 0.00 -1.73 0.68 0.00 0.52 0.00 0.00 34.95 34.42 2db9 s ARG 99 CO 0.00 0.18 1.96 -0.07 0.02 0.00 0.00 175.30 177.39 2db9 h LEU 100 N 2.07 0.54 -1.10 2.53 4.07 -1.93 -1.55 115.31 119.93 2db9 h LEU 100 Ca -0.42 -0.06 0.03 0.00 0.08 0.00 0.00 57.88 57.52 2db9 h LEU 100 Cb 1.25 -0.14 -0.05 0.00 1.08 0.00 0.00 40.66 42.80 2db9 h LEU 100 CO 0.68 0.50 0.61 1.05 -1.08 0.00 0.00 178.44 180.19 2db9 h GLU 101 N 0.60 1.14 -0.00 1.13 4.11 -1.96 0.12 114.58 119.72 2db9 h GLU 101 Ca 0.15 -0.07 0.00 0.00 0.07 0.00 0.00 59.36 59.51 2db9 h GLU 101 Cb 0.13 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.12 2db9 h GLU 101 CO -0.01 0.76 -0.00 1.19 0.07 0.00 0.00 179.01 181.01 2db9 n PHE 102 N -4.43 0.00 -2.95 2.06 3.72 -0.63 -4.64 117.46 110.59 2db9 n PHE 102 Ca 0.12 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.09 2db9 n PHE 102 Cb 0.08 -0.33 -0.05 0.00 -0.94 0.00 0.00 39.48 38.24 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 -2.66 4.55 -0.33 -4.37 1.01 0.40 -3.73 120.40 115.28 2db9 s VAL 103 Ca 0.25 0.01 -0.11 0.00 0.00 0.00 0.00 61.98 62.13 2db9 s VAL 103 Cb 0.20 -4.46 -0.00 0.00 0.00 0.00 0.00 36.38 32.11 2db9 s VAL 103 CO 0.48 -1.02 0.19 -0.44 0.00 0.00 0.00 175.10 174.31 2db9 s SER 104 N 2.81 5.72 0.00 3.32 0.01 -0.78 -4.19 113.70 120.59 2db9 s SER 104 Ca 0.25 -0.57 0.00 0.00 1.31 0.00 0.00 55.95 56.94 2db9 s SER 104 Cb -0.15 -2.05 0.00 0.00 0.21 0.00 0.00 66.02 64.04 2db9 s SER 104 CO 0.17 -0.24 0.21 -0.46 0.41 0.00 0.00 173.24 173.33 2db9 n ASN 105 N 5.02 0.00 -0.72 2.44 0.23 -1.26 -3.83 115.26 117.14 2db9 n ASN 105 Ca -0.13 0.21 0.04 0.00 -0.53 0.00 0.00 54.58 54.17 2db9 n ASN 105 Cb 0.49 0.00 -0.01 0.00 -2.08 0.00 0.00 39.78 38.18 2db9 n ASN 105 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2db9 n GLN 106 N -0.44 -0.54 -3.84 -3.83 3.00 -1.26 -4.45 117.38 106.02 2db9 n GLN 106 Ca 0.00 0.36 -0.25 0.00 -0.01 0.00 0.00 57.00 57.10 2db9 n GLN 106 Cb 0.00 -0.66 -0.17 0.00 0.00 0.00 0.00 30.24 29.41 2db9 n GLN 106 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.06 175.23 2db9 s GLU 107 N -0.52 1.09 0.17 -1.09 -1.05 -1.26 -5.02 118.70 111.02 2db9 s GLU 107 Ca 0.00 -0.13 -0.32 0.00 -0.15 0.00 0.00 54.97 54.37 2db9 s GLU 107 Cb 0.00 -1.38 -0.17 0.00 -0.44 0.00 0.00 34.13 32.14 2db9 s GLU 107 CO 0.00 -0.31 0.93 1.19 0.95 0.00 0.00 175.26 178.01 2db9 n PHE 108 N 5.03 0.62 -4.38 4.83 3.72 -1.26 -4.95 117.46 121.08 2db9 n PHE 108 Ca -0.10 0.84 -0.35 0.00 -0.05 0.00 0.00 57.45 57.80 2db9 n PHE 108 Cb 0.50 -2.14 -0.10 0.00 -0.94 0.00 0.00 39.48 36.79 2db9 n PHE 108 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 176.76 176.63 2db9 s THR 109 N -0.53 4.21 0.27 4.37 -1.32 -1.26 -4.86 115.64 116.52 2db9 s THR 109 Ca 0.72 -0.28 -0.01 0.00 -1.21 0.00 0.00 61.69 60.91 2db9 s THR 109 Cb -0.93 -2.79 0.39 0.00 -1.51 0.00 0.00 72.50 67.67 2db9 s THR 109 CO 0.55 0.57 1.42 1.21 -2.21 0.00 0.00 174.62 176.17 2db9 n GLU 110 N 2.52 -0.08 -0.02 7.08 2.13 -1.26 0.10 120.64 131.12 2db9 n GLU 110 Ca -0.18 1.38 -0.03 0.00 0.66 0.00 0.00 57.16 58.99 2db9 n GLU 110 Cb 0.53 -2.15 -0.02 0.00 0.27 0.00 0.00 31.44 30.07 2db9 n GLU 110 CO 0.00 0.00 0.00 0.77 -0.41 0.00 0.00 177.13 177.49 2db9 h SER 111 N 0.00 -0.39 0.24 4.31 0.02 -1.99 0.17 113.55 115.91 2db9 h SER 111 Ca 0.52 0.05 0.01 0.00 -0.84 0.00 0.00 61.79 61.52 2db9 h SER 111 Cb 0.99 0.16 -0.03 0.00 0.14 0.00 0.00 62.40 63.66 2db9 h SER 111 CO -0.88 -0.10 -0.29 -0.33 -1.14 0.00 0.00 176.83 174.09 2db9 h GLU 112 N -0.11 -0.56 -0.98 3.45 5.08 -1.21 0.37 114.58 120.63 2db9 h GLU 112 Ca 0.01 0.04 0.39 0.00 -1.00 0.00 0.00 59.36 58.80 2db9 h GLU 112 Cb 0.14 0.13 -0.18 0.00 0.50 0.00 0.00 28.75 29.34 2db9 h GLU 112 CO -0.11 -0.37 0.46 0.34 -1.00 0.00 0.00 179.01 178.32 2db9 n PHE 113 N -5.41 1.07 0.10 4.33 7.35 0.12 0.18 117.46 125.21 2db9 n PHE 113 Ca -0.08 1.16 -0.18 0.00 -0.76 0.00 0.00 57.45 57.59 2db9 n PHE 113 Cb 0.31 -1.51 -0.12 0.00 0.35 0.00 0.00 39.48 38.51 2db9 n PHE 113 CO 0.00 0.00 0.00 0.52 -0.76 0.00 0.00 176.76 176.52 2db9 h MET 114 N 0.00 0.42 -0.29 -4.13 2.86 0.19 -1.91 114.93 112.07 2db9 h MET 114 Ca 0.80 -0.62 -0.01 0.00 -2.06 0.00 0.00 59.70 57.81 2db9 h MET 114 Cb 2.06 0.22 -0.01 0.00 0.06 0.00 0.00 31.60 33.92 2db9 h MET 114 CO -0.78 1.27 0.16 0.87 1.06 0.00 0.00 176.91 179.49 2db9 h LYS 115 N 0.16 0.40 -0.35 1.72 1.79 0.41 -1.08 116.57 119.62 2db9 h LYS 115 Ca -0.16 -0.05 -0.05 0.00 -2.18 0.00 0.00 60.65 58.22 2db9 h LYS 115 Cb 1.92 -0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 32.48 2db9 h LYS 115 CO 0.22 0.35 0.04 2.35 -1.08 0.00 0.00 179.45 181.33 2db9 h TRP 116 N 0.35 0.63 -0.82 -1.35 7.01 0.04 -2.62 115.95 119.19 2db9 h TRP 116 Ca 0.10 -0.09 0.19 0.00 2.11 0.00 0.00 58.89 61.20 2db9 h TRP 116 Cb 0.06 -0.17 -0.12 0.00 -2.10 0.00 0.00 29.16 26.83 2db9 h TRP 116 CO -0.03 0.66 0.24 0.87 -2.79 0.00 0.00 178.44 177.40 2db9 h LYS 117 N 0.42 0.28 -0.78 2.65 1.57 -0.93 0.15 116.57 119.93 2db9 h LYS 117 Ca 0.10 -0.02 0.15 0.00 -1.87 0.00 0.00 60.65 59.02 2db9 h LYS 117 Cb 0.38 -0.06 -0.15 0.00 0.08 0.00 0.00 32.23 32.48 2db9 h LYS 117 CO 0.01 0.19 -0.21 0.93 -0.57 0.00 0.00 179.45 179.79 2db9 h GLU 118 N 0.29 -0.01 -0.93 3.15 4.39 -0.81 1.43 114.58 122.09 2db9 h GLU 118 Ca 0.49 0.00 0.14 0.00 0.34 0.00 0.00 59.36 60.32 2db9 h GLU 118 Cb 0.90 0.00 -0.08 0.00 -0.10 0.00 0.00 28.75 29.47 2db9 h GLU 118 CO -0.56 -0.01 0.59 0.00 -1.16 0.00 0.00 179.01 177.88 2db9 h ALA 119 N 1.71 1.73 -0.08 3.43 0.00 -0.76 0.88 119.26 126.18 2db9 h ALA 119 Ca 0.37 0.02 -0.23 0.00 0.00 0.00 0.00 54.91 55.07 2db9 h ALA 119 Cb 0.58 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 18.22 2db9 h ALA 119 CO -0.81 0.03 -0.87 0.52 0.00 0.00 0.00 179.25 178.12 2db9 h MET 120 N 0.79 0.64 0.00 0.00 2.86 0.17 0.11 114.93 119.50 2db9 h MET 120 Ca 0.47 -0.59 -0.10 0.00 -2.06 0.00 0.00 59.70 57.42 2db9 h MET 120 Cb 0.65 0.14 -0.01 0.00 0.06 0.00 0.00 31.60 32.43 2db9 h MET 120 CO -0.23 1.20 -0.47 0.74 1.06 0.00 0.00 176.91 179.21 2db9 h PHE 121 N 0.41 0.00 0.10 -0.22 -1.00 0.24 0.47 116.94 116.94 2db9 h PHE 121 Ca -0.07 0.00 -0.17 0.00 2.81 0.00 0.00 57.97 60.54 2db9 h PHE 121 Cb 1.49 0.00 0.01 0.00 3.61 0.00 0.00 35.95 41.06 2db9 h PHE 121 CO 0.08 0.47 -0.79 1.03 -1.61 0.00 0.00 178.31 177.49 2db9 h SER 122 N 0.00 0.32 0.80 2.17 0.87 0.74 -3.25 113.55 115.20 2db9 h SER 122 Ca -0.00 -0.92 0.00 0.00 -1.23 0.00 0.00 61.79 59.64 2db9 h SER 122 Cb 0.93 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.78 2db9 h SER 122 CO 0.06 1.36 0.00 0.00 -0.53 0.00 0.00 176.83 177.72 2db9 n ALA 123 N -2.76 1.85 -1.07 6.23 0.00 0.02 -4.85 120.51 119.91 2db9 n ALA 123 Ca -0.16 -0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.25 2db9 n ALA 123 Cb 0.76 -1.36 -0.01 0.00 0.00 0.00 0.00 19.45 18.84 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 0.40 0.57 3.84 0.00 0.00 0.33 -5.01 105.19 105.32 2db9 n GLY 124 Ca 0.04 -0.42 -0.29 0.00 0.00 0.00 0.00 46.02 45.35 2db9 n GLY 124 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2db9 s MET 125 N -1.45 1.52 0.14 1.61 -1.94 0.14 -4.97 119.30 114.35 2db9 s MET 125 Ca 0.00 0.20 0.07 0.00 -1.71 0.00 0.00 55.69 54.25 2db9 s MET 125 Cb 0.00 -1.89 -0.04 0.00 2.01 0.00 0.00 34.83 34.91 2db9 s MET 125 CO 0.00 -1.92 -0.06 -0.65 -0.01 0.00 0.00 175.02 172.38 2db9 s GLN 126 N -5.43 2.24 0.55 2.03 -0.21 -1.26 -4.53 119.66 113.05 2db9 s GLN 126 Ca 0.63 -1.07 0.01 0.00 0.02 0.00 0.00 55.36 54.94 2db9 s GLN 126 Cb -0.13 -2.32 0.11 0.00 1.00 0.00 0.00 33.01 31.67 2db9 s GLN 126 CO 0.51 0.48 0.75 1.28 -2.12 0.00 0.00 175.29 176.19 2db9 n LEU 127 N 0.31 0.00 -4.71 2.90 4.77 -1.26 -5.04 117.00 113.97 2db9 n LEU 127 Ca -0.11 -1.65 -0.42 0.00 -0.03 0.00 0.00 56.01 53.79 2db9 n LEU 127 Cb 0.54 -0.48 -0.03 0.00 -2.33 0.00 0.00 43.42 41.12 2db9 n LEU 127 CO 0.36 -0.85 0.85 -2.16 -1.33 0.00 0.00 177.39 174.26 2db9 s PRO 128 N -4.42 4.45 0.21 3.23 0.04 -1.26 -4.75 135.00 132.50 2db9 s PRO 128 Ca 0.50 1.72 -0.28 0.00 0.04 0.00 0.00 61.00 62.98 2db9 s PRO 128 Cb -0.03 -3.36 -0.08 0.00 0.04 0.00 0.00 34.50 31.06 2db9 s PRO 128 CO 0.33 -0.22 0.89 0.95 0.04 0.00 0.00 177.00 178.98 2db9 s THR 129 N 1.05 4.19 0.50 1.26 -4.23 -1.26 0.10 115.64 117.26 2db9 s THR 129 Ca 0.58 1.96 0.41 0.00 -1.18 0.00 0.00 61.69 63.46 2db9 s THR 129 Cb -0.28 -4.27 0.62 0.00 1.34 0.00 0.00 72.50 69.91 2db9 s THR 129 CO 0.29 0.50 1.59 -0.07 -0.54 0.00 0.00 174.62 176.39 2db9 h LEU 130 N 4.28 0.10 0.16 4.79 -0.00 -1.51 1.68 115.31 124.81 2db9 h LEU 130 Ca -0.46 0.07 -0.01 0.00 -0.00 0.00 0.00 57.88 57.49 2db9 h LEU 130 Cb 1.20 0.07 0.00 0.00 -0.00 0.00 0.00 40.66 41.93 2db9 h LEU 130 CO 0.68 -0.11 -0.07 -0.78 -0.00 0.00 0.00 178.44 178.15 2db9 h ASP 131 N 0.01 -0.18 -0.64 -0.43 3.58 -1.90 -0.06 116.42 116.80 2db9 h ASP 131 Ca 0.89 -0.20 -0.01 0.00 0.42 0.00 0.00 57.03 58.13 2db9 h ASP 131 Cb 3.24 0.05 -0.03 0.00 1.72 0.00 0.00 39.33 44.31 2db9 h ASP 131 CO -0.22 0.11 0.38 -0.33 -2.88 0.00 0.00 179.24 176.30 2db9 h GLU 132 N -0.47 0.88 -0.54 0.28 4.39 0.20 0.25 114.58 119.56 2db9 h GLU 132 Ca -0.02 -0.09 0.04 0.00 0.34 0.00 0.00 59.36 59.63 2db9 h GLU 132 Cb 0.37 -0.18 -0.04 0.00 -0.10 0.00 0.00 28.75 28.80 2db9 h GLU 132 CO 0.04 0.64 0.29 0.82 -1.16 0.00 0.00 179.01 179.63 2db9 h ILE 133 N 0.87 0.98 0.53 3.13 1.08 -0.57 1.11 117.51 124.64 2db9 h ILE 133 Ca 0.23 -0.19 -0.03 0.00 -0.39 0.00 0.00 64.86 64.48 2db9 h ILE 133 Cb -0.01 0.37 0.01 0.00 -3.07 0.00 0.00 36.82 34.12 2db9 h ILE 133 CO -0.04 0.10 -0.26 0.78 -0.69 0.00 0.00 178.15 178.05 2db9 h ASN 134 N 0.56 -0.60 -1.01 1.72 2.35 -0.45 1.31 115.58 119.46 2db9 h ASN 134 Ca 0.23 0.02 0.24 0.00 -0.55 0.00 0.00 56.30 56.24 2db9 h ASN 134 Cb 0.11 0.16 -0.12 0.00 0.05 0.00 0.00 38.32 38.52 2db9 h ASN 134 CO -0.14 -0.34 0.60 0.11 -1.65 0.00 0.00 177.43 176.00 2db9 h LYS 135 N -0.89 0.59 0.14 0.81 1.57 -0.40 0.16 116.57 118.54 2db9 h LYS 135 Ca -0.07 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.67 2db9 h LYS 135 Cb 0.55 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.73 2db9 h LYS 135 CO 0.12 0.39 -0.06 -0.22 -0.57 0.00 0.00 179.45 179.10 2db9 h LYS 136 N 0.60 -0.17 -0.28 3.15 1.63 0.14 -2.80 116.57 118.84 2db9 h LYS 136 Ca 0.63 0.01 0.04 0.00 -0.85 0.00 0.00 60.65 60.48 2db9 h LYS 136 Cb 1.18 0.04 -0.07 0.00 -0.60 0.00 0.00 32.23 32.79 2db9 h LYS 136 CO -0.46 0.24 -0.48 1.49 -3.45 0.00 0.00 179.45 176.79 2db9 h GLU 137 N -0.65 -0.38 -0.85 1.90 4.81 0.39 0.12 114.58 119.92 2db9 h GLU 137 Ca -0.02 0.03 0.21 0.00 -0.13 0.00 0.00 59.36 59.45 2db9 h GLU 137 Cb 0.49 0.09 -0.15 0.00 0.63 0.00 0.00 28.75 29.81 2db9 h GLU 137 CO 0.03 -0.25 0.05 -0.07 -0.73 0.00 0.00 179.01 178.04 2db9 h LEU 138 N -0.39 -0.33 -0.77 1.64 -0.00 -0.88 0.98 115.31 115.56 2db9 h LEU 138 Ca 0.05 0.22 0.15 0.00 -0.00 0.00 0.00 57.88 58.30 2db9 h LEU 138 Cb 0.53 0.38 -0.10 0.00 -0.00 0.00 0.00 40.66 41.47 2db9 h LEU 138 CO -0.47 -0.23 0.32 -1.28 -0.00 0.00 0.00 178.44 176.78 2db9 h SER 139 N 0.10 0.30 0.29 -0.43 0.87 -0.53 0.13 113.55 114.29 2db9 h SER 139 Ca 0.49 0.11 -0.01 0.00 -1.23 0.00 0.00 61.79 61.15 2db9 h SER 139 Cb 0.94 0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.99 2db9 h SER 139 CO -0.75 0.11 -0.14 0.40 -0.53 0.00 0.00 176.83 175.93 2db9 h ILE 140 N 0.46 0.75 -0.12 2.23 5.03 0.20 -2.14 117.51 123.91 2db9 h ILE 140 Ca 0.43 -0.26 0.02 0.00 -0.12 0.00 0.00 64.86 64.93 2db9 h ILE 140 Cb 0.65 0.89 -0.05 0.00 -3.03 0.00 0.00 36.82 35.28 2db9 h ILE 140 CO -0.41 0.06 -0.37 0.11 -0.68 0.00 0.00 178.15 176.86 2db9 h LYS 141 N -0.52 -0.37 -0.95 2.37 6.56 0.14 -1.06 116.57 122.75 2db9 h LYS 141 Ca -0.04 0.02 0.17 0.00 -1.06 0.00 0.00 60.65 59.74 2db9 h LYS 141 Cb 0.39 0.08 -0.17 0.00 -0.57 0.00 0.00 32.23 31.97 2db9 h LYS 141 CO 0.07 -0.24 -0.32 0.93 -2.06 0.00 0.00 179.45 177.82 2db9 h GLU 142 N -0.38 -0.01 -0.43 3.15 5.08 -0.78 0.33 114.58 121.54 2db9 h GLU 142 Ca 0.03 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.43 2db9 h GLU 142 Cb 0.46 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.65 2db9 h GLU 142 CO -0.31 -0.01 -0.28 0.00 -1.00 0.00 0.00 179.01 177.41 2db9 h ALA 143 N 1.58 -0.31 -1.88 3.43 0.00 -0.50 -3.40 119.26 118.17 2db9 h ALA 143 Ca 0.38 0.05 -0.46 0.00 0.00 0.00 0.00 54.91 54.88 2db9 h ALA 143 Cb 0.64 1.13 0.23 0.00 0.00 0.00 0.00 17.79 19.79 2db9 h ALA 143 CO -0.96 -0.50 -0.70 -1.13 0.00 0.00 0.00 179.25 175.95 2db9 n SER 144 N -4.07 -2.08 0.00 0.00 3.41 0.10 -5.01 113.62 105.98 2db9 n SER 144 Ca 0.00 -0.06 0.00 0.00 -0.26 0.00 0.00 58.87 58.56 2db9 n SER 144 Cb 0.13 -1.08 0.00 0.00 -0.26 0.00 0.00 64.21 63.00 2db9 n SER 144 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2db9 n GLY 145 N 1.64 -0.17 3.77 5.00 0.00 -1.26 -4.87 105.19 109.31 2db9 n GLY 145 Ca 0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.66 2db9 n GLY 145 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2db9 s PRO 146 N 0.00 4.36 -0.12 1.61 0.04 -1.26 -4.93 135.00 134.70 2db9 s PRO 146 Ca 0.00 1.62 -0.02 0.00 0.04 0.00 0.00 61.00 62.65 2db9 s PRO 146 Cb 0.00 -2.81 0.04 0.00 0.04 0.00 0.00 34.50 31.77 2db9 s PRO 146 CO 0.00 0.01 0.00 -1.54 0.04 0.00 0.00 177.00 175.52 2db9 s SER 147 N -1.29 2.16 0.30 6.66 1.04 -1.26 -4.96 113.70 116.35 2db9 s SER 147 Ca 0.52 -0.39 0.00 0.00 0.48 0.00 0.00 55.95 56.56 2db9 s SER 147 Cb -0.26 -0.55 0.00 0.00 0.10 0.00 0.00 66.02 65.31 2db9 s SER 147 CO 0.33 -0.23 0.00 -0.24 0.98 0.00 0.00 173.24 174.08 2db9 n SER 148 N 5.08 -1.47 0.00 7.02 2.88 -1.26 -5.16 113.62 120.72 2db9 n SER 148 Ca -0.08 0.54 0.00 0.00 -1.33 0.00 0.00 58.87 58.00 2db9 n SER 148 Cb 0.49 1.52 0.00 0.00 -0.75 0.00 0.00 64.21 65.47 2db9 n SER 148 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42