#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 -0.07 -0.20 1.61 0.01 -1.26 -5.19 113.70 108.60 2db9 s SER 2 Ca 0.00 -0.17 -0.36 0.00 1.31 0.00 0.00 55.95 56.73 2db9 s SER 2 Cb 0.00 0.20 0.15 0.00 0.21 0.00 0.00 66.02 66.58 2db9 s SER 2 CO 0.00 -0.37 1.36 -0.94 0.41 0.00 0.00 173.24 173.70 2db9 s SER 3 N -3.01 -0.04 0.00 2.44 1.04 -1.26 -5.14 113.70 107.73 2db9 s SER 3 Ca 0.15 -0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.56 2db9 s SER 3 Cb 0.04 0.05 0.00 0.00 0.10 0.00 0.00 66.02 66.21 2db9 s SER 3 CO -0.03 -0.08 0.00 0.61 0.98 0.00 0.00 173.24 174.72 2db9 n GLY 4 N -0.18 0.01 1.83 7.32 0.00 -1.26 -5.14 105.19 107.77 2db9 n GLY 4 Ca -0.00 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2db9 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2db9 n SER 5 N 0.00 -8.82 -3.57 1.61 2.88 -1.26 -5.09 113.62 99.37 2db9 n SER 5 Ca 0.00 1.27 -0.08 0.00 -1.33 0.00 0.00 58.87 58.73 2db9 n SER 5 Cb 0.00 -4.72 -0.04 0.00 -0.75 0.00 0.00 64.21 58.70 2db9 n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2db9 s SER 6 N -1.40 -0.29 0.00 -3.46 0.15 -1.26 -5.18 113.70 102.27 2db9 s SER 6 Ca 0.00 0.18 0.00 0.00 0.70 0.00 0.00 55.95 56.83 2db9 s SER 6 Cb 0.00 0.27 0.00 0.00 -1.71 0.00 0.00 66.02 64.58 2db9 s SER 6 CO 0.00 -0.37 0.00 0.61 1.20 0.00 0.00 173.24 174.68 2db9 n GLY 7 N 0.28 2.45 3.73 9.45 0.00 -1.26 -5.14 105.19 114.69 2db9 n GLY 7 Ca -0.07 0.11 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 2db9 n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2db9 s PRO 8 N -0.18 4.51 -0.36 1.61 0.04 -1.26 -4.98 135.00 134.39 2db9 s PRO 8 Ca 0.00 1.73 -0.29 0.00 0.04 0.00 0.00 61.00 62.49 2db9 s PRO 8 Cb 0.00 -3.32 0.00 0.00 0.04 0.00 0.00 34.50 31.23 2db9 s PRO 8 CO 0.00 -0.09 1.38 -1.25 0.04 0.00 0.00 177.00 177.08 2db9 s PRO 9 N 0.36 3.72 -0.32 0.56 0.04 -1.26 -4.89 135.00 133.20 2db9 s PRO 9 Ca 0.54 1.10 -0.07 0.00 0.04 0.00 0.00 61.00 62.61 2db9 s PRO 9 Cb -0.29 -3.97 0.19 0.00 0.04 0.00 0.00 34.50 30.47 2db9 s PRO 9 CO 0.32 -1.38 0.97 -1.59 0.04 0.00 0.00 177.00 175.36 2db9 s LYS 10 N 4.63 0.27 0.00 4.56 -2.85 -1.26 -5.17 119.74 119.92 2db9 s LYS 10 Ca 0.60 0.03 0.00 0.00 -1.00 0.00 0.00 55.97 55.60 2db9 s LYS 10 Cb -0.15 0.06 0.00 0.00 -2.06 0.00 0.00 37.83 35.68 2db9 s LYS 10 CO 0.29 -0.42 0.00 0.45 0.10 0.00 0.00 175.35 175.76 2db9 n SER 11 N 4.39 0.00 -4.41 0.03 2.88 -1.26 -5.08 113.62 110.17 2db9 n SER 11 Ca 0.08 -0.48 -0.33 0.00 -1.33 0.00 0.00 58.87 56.80 2db9 n SER 11 Cb 0.60 0.00 -0.14 0.00 -0.75 0.00 0.00 64.21 63.92 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 -0.45 3.19 -0.56 -1.46 0.74 -1.26 -4.99 119.66 114.87 2db9 s GLN 12 Ca 0.00 -0.67 -0.28 0.00 0.05 0.00 0.00 55.36 54.46 2db9 s GLN 12 Cb 0.00 -2.59 0.01 0.00 1.10 0.00 0.00 33.01 31.53 2db9 s GLN 12 CO 0.00 0.32 1.50 -1.25 -0.55 0.00 0.00 175.29 175.31 2db9 s PRO 13 N 0.08 3.19 -0.01 1.67 0.04 -1.26 -1.03 135.00 137.68 2db9 s PRO 13 Ca -0.05 0.51 -0.01 0.00 0.04 0.00 0.00 61.00 61.49 2db9 s PRO 13 Cb -0.15 -4.17 0.00 0.00 0.04 0.00 0.00 34.50 30.22 2db9 s PRO 13 CO 0.04 -2.07 0.01 1.33 0.04 0.00 0.00 177.00 176.36 2db9 n VAL 14 N 6.92 -0.29 -0.01 -0.36 0.24 0.28 -4.66 118.33 120.46 2db9 n VAL 14 Ca 0.14 0.06 0.18 0.00 -2.04 0.00 0.00 64.34 62.68 2db9 n VAL 14 Cb 0.49 -0.41 0.64 0.00 -1.47 0.00 0.00 33.84 33.10 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 1.25 0.09 -4.86 -1.34 0.02 -1.88 -3.43 113.55 103.39 2db9 h SER 15 Ca -0.01 0.00 -0.36 0.00 -0.84 0.00 0.00 61.79 60.59 2db9 h SER 15 Cb 0.14 -0.01 -0.14 0.00 0.14 0.00 0.00 62.40 62.52 2db9 h SER 15 CO 0.00 0.05 -0.59 -1.48 -1.14 0.00 0.00 176.83 173.68 2db9 s LEU 16 N -8.92 1.56 0.39 5.07 0.05 -1.26 -5.04 118.68 110.53 2db9 s LEU 16 Ca -0.06 -1.47 0.21 0.00 0.05 0.00 0.00 54.13 52.86 2db9 s LEU 16 Cb 0.20 0.19 0.60 0.00 -2.05 0.00 0.00 46.19 45.12 2db9 s LEU 16 CO 0.73 -0.83 1.69 1.55 -0.55 0.00 0.00 176.35 178.93 2db9 h PRO 17 N 2.35 0.00 0.12 1.48 0.13 -1.90 -3.28 132.00 130.89 2db9 h PRO 17 Ca -0.35 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.80 2db9 h PRO 17 Cb 1.25 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.34 2db9 h PRO 17 CO 0.55 0.29 -0.35 0.93 -0.23 0.00 0.00 178.00 179.19 2db9 h GLU 18 N 0.00 -0.56 -0.87 0.86 5.08 -1.95 -0.00 114.58 117.14 2db9 h GLU 18 Ca -0.00 0.04 0.21 0.00 -1.00 0.00 0.00 59.36 58.60 2db9 h GLU 18 Cb 0.97 0.13 -0.12 0.00 0.50 0.00 0.00 28.75 30.23 2db9 h GLU 18 CO 0.04 -0.37 0.36 0.93 -1.00 0.00 0.00 179.01 178.96 2db9 h GLU 19 N -0.58 0.37 0.00 2.33 4.39 -1.96 1.51 114.58 120.64 2db9 h GLU 19 Ca 0.03 -0.02 -0.04 0.00 0.34 0.00 0.00 59.36 59.67 2db9 h GLU 19 Cb 0.61 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.17 2db9 h GLU 19 CO -0.21 0.25 -0.20 1.25 -1.16 0.00 0.00 179.01 178.94 2db9 h LEU 20 N 0.38 0.00 -0.40 1.33 5.85 -1.39 -0.80 115.31 120.28 2db9 h LEU 20 Ca 0.53 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 59.14 2db9 h LEU 20 Cb 0.99 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.00 2db9 h LEU 20 CO -0.52 0.20 -0.55 0.78 -0.34 0.00 0.00 178.44 178.01 2db9 h ASN 21 N 0.00 0.00 0.52 1.25 2.35 0.38 -0.10 115.58 119.98 2db9 h ASN 21 Ca -0.00 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.71 2db9 h ASN 21 Cb 0.40 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.77 2db9 h ASN 21 CO 0.03 0.55 -0.19 0.03 -1.65 0.00 0.00 177.43 176.19 2db9 h ARG 22 N 0.00 0.00 -0.04 0.81 3.08 0.72 -2.36 114.38 116.59 2db9 h ARG 22 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2db9 h ARG 22 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.30 2db9 h ARG 22 CO 0.07 0.19 0.00 1.33 -1.07 0.00 0.00 179.97 180.49 2db9 n VAL 23 N -3.64 1.47 -2.71 2.04 0.24 -1.12 -4.67 118.33 109.94 2db9 n VAL 23 Ca -0.01 -1.61 -0.42 0.00 -2.04 0.00 0.00 64.34 60.26 2db9 n VAL 23 Cb 0.32 0.13 -0.03 0.00 -1.47 0.00 0.00 33.84 32.79 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 -1.93 3.56 0.74 7.34 3.52 -0.07 -0.74 118.95 131.37 2db9 s ARG 24 Ca 0.18 -1.31 -0.16 0.00 -0.13 0.00 0.00 55.73 54.31 2db9 s ARG 24 Cb 0.15 -5.10 -0.06 0.00 -1.56 0.00 0.00 34.95 28.39 2db9 s ARG 24 CO 0.03 -2.03 0.28 1.28 -0.81 0.00 0.00 175.30 174.06 2db9 n LEU 25 N 7.98 -0.61 -4.08 -0.88 4.77 0.53 -4.88 117.00 119.84 2db9 n LEU 25 Ca 0.27 0.54 -0.23 0.00 -0.03 0.00 0.00 56.01 56.55 2db9 n LEU 25 Cb 0.50 -1.12 -0.16 0.00 -2.33 0.00 0.00 43.42 40.32 2db9 n LEU 25 CO 0.60 -3.70 -0.47 -0.94 -1.33 0.00 0.00 177.39 171.55 2db9 s SER 26 N -1.40 1.70 0.30 -1.43 1.04 -1.26 -4.55 113.70 108.10 2db9 s SER 26 Ca 0.61 -0.27 0.15 0.00 0.48 0.00 0.00 55.95 56.91 2db9 s SER 26 Cb -0.34 -0.43 1.03 0.00 0.10 0.00 0.00 66.02 66.38 2db9 s SER 26 CO 0.63 0.12 1.29 -1.14 0.98 0.00 0.00 173.24 175.12 2db9 n ARG 27 N 3.15 -0.05 0.12 4.02 0.63 -1.25 0.42 116.66 123.69 2db9 n ARG 27 Ca -0.18 1.15 -0.09 0.00 -0.92 0.00 0.00 57.85 57.81 2db9 n ARG 27 Cb 0.54 -2.02 -0.05 0.00 0.45 0.00 0.00 32.46 31.38 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 -0.72 -0.68 -0.14 3.86 -1.93 1.55 115.15 117.09 2db9 h HIS 28 Ca 0.66 0.01 0.13 0.00 -1.16 0.00 0.00 60.37 60.02 2db9 h HIS 28 Cb 1.71 0.29 -0.10 0.00 1.06 0.00 0.00 27.41 30.37 2db9 h HIS 28 CO -0.08 -0.32 0.18 0.87 0.86 0.00 0.00 177.93 179.44 2db9 h LYS 29 N -0.46 0.30 -0.10 2.45 1.57 -0.45 0.34 116.57 120.22 2db9 h LYS 29 Ca -0.02 -0.02 0.02 0.00 -1.87 0.00 0.00 60.65 58.76 2db9 h LYS 29 Cb 0.42 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.64 2db9 h LYS 29 CO -0.07 0.20 -0.04 -0.07 -0.57 0.00 0.00 179.45 178.89 2db9 h LEU 30 N 0.30 -0.15 -2.13 2.94 3.38 -0.42 1.60 115.31 120.84 2db9 h LEU 30 Ca 0.37 0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.40 2db9 h LEU 30 Cb 0.58 0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 2db9 h LEU 30 CO -0.44 -0.06 0.30 -0.08 0.09 0.00 0.00 178.44 178.25 2db9 h GLU 31 N -0.03 0.00 0.00 1.13 4.22 0.43 2.11 114.58 122.44 2db9 h GLU 31 Ca 0.06 0.00 -0.39 0.00 0.08 0.00 0.00 59.36 59.11 2db9 h GLU 31 Cb 0.11 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.31 2db9 h GLU 31 CO -0.12 0.00 -2.14 0.54 -2.18 0.00 0.00 179.01 175.11 2db9 n ARG 32 N -3.11 0.59 0.18 1.92 1.74 0.30 -4.16 116.66 114.11 2db9 n ARG 32 Ca -0.00 0.35 0.13 0.00 -0.77 0.00 0.00 57.85 57.56 2db9 n ARG 32 Cb 0.38 -1.58 0.59 0.00 -1.02 0.00 0.00 32.46 30.82 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 -0.89 0.00 0.00 -1.55 6.55 0.31 -0.38 115.95 119.99 2db9 h TRP 33 Ca -0.58 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.26 2db9 h TRP 33 Cb 1.56 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.86 2db9 h TRP 33 CO -0.02 0.00 0.00 0.00 -1.05 0.00 0.00 178.44 177.37 2db9 n HIS 35 N -2.17 0.39 -4.16 0.00 1.44 -0.15 -5.00 115.22 105.57 2db9 n HIS 35 Ca 0.01 -0.49 -0.22 0.00 -2.01 0.00 0.00 57.72 55.01 2db9 n HIS 35 Cb 0.16 -0.03 -0.05 0.00 0.12 0.00 0.00 29.99 30.19 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 -1.00 2.70 -0.07 -1.40 1.00 0.24 -5.05 119.30 115.71 2db9 s MET 36 Ca 0.20 -1.20 -0.26 0.00 0.00 0.00 0.00 55.69 54.42 2db9 s MET 36 Cb 0.10 -2.42 -0.23 0.00 0.00 0.00 0.00 34.83 32.28 2db9 s MET 36 CO 0.13 0.37 1.03 -1.00 0.00 0.00 0.00 175.02 175.55 2db9 h PRO 37 N 1.61 0.05 -2.04 2.03 0.13 -1.95 -3.30 132.00 128.53 2db9 h PRO 37 Ca -0.47 -0.05 -0.17 0.00 -0.87 0.00 0.00 66.00 64.44 2db9 h PRO 37 Cb 1.24 0.01 -0.06 0.00 0.13 0.00 0.00 31.00 32.32 2db9 h PRO 37 CO 0.61 0.79 -0.34 1.97 -0.23 0.00 0.00 178.00 180.80 2db9 n PHE 38 N -4.67 0.00 -0.01 1.56 1.16 -1.26 -4.35 117.46 109.90 2db9 n PHE 38 Ca -0.09 -1.41 -0.00 0.00 -1.87 0.00 0.00 57.45 54.07 2db9 n PHE 38 Cb 0.40 -1.50 -0.00 0.00 -1.61 0.00 0.00 39.48 36.77 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 3.04 0.00 -0.59 2.97 3.57 -1.77 -3.00 116.94 121.17 2db9 h PHE 39 Ca 0.17 0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.76 2db9 h PHE 39 Cb 1.43 0.00 -0.07 0.00 2.79 0.00 0.00 35.95 40.10 2db9 h PHE 39 CO 1.69 0.00 0.21 0.00 -2.23 0.00 0.00 178.31 177.98 2db9 h ALA 40 N -1.91 0.75 -0.25 2.41 0.00 -1.88 1.21 119.26 119.58 2db9 h ALA 40 Ca 0.00 0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.04 2db9 h ALA 40 Cb 0.03 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 2db9 h ALA 40 CO 0.00 -0.20 -0.00 -0.22 0.00 0.00 0.00 179.25 178.82 2db9 h LYS 41 N 0.39 0.07 0.00 0.00 3.11 -1.84 0.19 116.57 118.49 2db9 h LYS 41 Ca 0.30 -0.00 0.00 0.00 -2.81 0.00 0.00 60.65 58.13 2db9 h LYS 41 Cb 0.37 -0.02 0.00 0.00 -1.00 0.00 0.00 32.23 31.58 2db9 h LYS 41 CO -0.30 0.05 0.00 2.41 -2.81 0.00 0.00 179.45 178.79 2db9 n THR 42 N -5.15 0.00 -0.31 1.00 -1.04 -0.37 -3.30 114.28 105.10 2db9 n THR 42 Ca -0.01 0.93 0.28 0.00 -2.04 0.00 0.00 64.05 63.21 2db9 n THR 42 Cb 0.13 -1.82 0.49 0.00 -1.82 0.00 0.00 70.33 67.31 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 -1.65 -0.25 -1.69 12.58 0.24 0.40 -3.93 118.33 124.03 2db9 n VAL 43 Ca 0.00 1.47 -0.40 0.00 -2.04 0.00 0.00 64.34 63.37 2db9 n VAL 43 Cb 0.00 -2.40 -0.03 0.00 -1.47 0.00 0.00 33.84 29.94 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 -5.01 3.11 0.00 3.34 2.01 0.66 -0.79 115.64 118.96 2db9 s THR 44 Ca -0.06 0.10 0.00 0.00 0.31 0.00 0.00 61.69 62.03 2db9 s THR 44 Cb 0.25 -3.19 0.00 0.00 0.01 0.00 0.00 72.50 69.57 2db9 s THR 44 CO 0.62 -0.15 0.00 0.61 -0.69 0.00 0.00 174.62 175.01 2db9 n GLY 45 N 5.79 0.99 3.81 4.40 0.00 -0.24 -4.92 105.19 115.01 2db9 n GLY 45 Ca 0.30 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.03 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 -3.21 2.42 0.04 0.00 0.40 0.08 -1.07 117.98 116.63 2db9 s PHE 47 Ca 0.62 -0.32 -0.04 0.00 -0.60 0.00 0.00 56.93 56.59 2db9 s PHE 47 Cb -0.14 -1.29 -0.02 0.00 0.51 0.00 0.00 43.02 42.08 2db9 s PHE 47 CO 0.54 0.37 0.05 0.14 0.70 0.00 0.00 175.22 177.02 2db9 s VAL 48 N -1.14 0.14 -0.23 -0.44 -7.23 -0.65 0.20 120.40 111.06 2db9 s VAL 48 Ca 0.16 -1.19 -0.13 0.00 -1.81 0.00 0.00 61.98 59.01 2db9 s VAL 48 Cb -0.10 -0.90 -0.04 0.00 0.56 0.00 0.00 36.38 35.89 2db9 s VAL 48 CO 0.08 -0.66 0.29 -0.60 -0.31 0.00 0.00 175.10 173.91 2db9 s ARG 49 N -2.66 4.10 -0.03 4.82 3.52 -1.26 -2.12 118.95 125.33 2db9 s ARG 49 Ca -0.05 -0.03 -0.03 0.00 -0.13 0.00 0.00 55.73 55.50 2db9 s ARG 49 Cb -0.01 -3.56 -0.04 0.00 -1.56 0.00 0.00 34.95 29.78 2db9 s ARG 49 CO -0.05 -0.03 0.16 -1.50 -0.81 0.00 0.00 175.30 173.07 2db9 s ILE 50 N 1.32 5.36 -0.86 4.11 1.10 0.19 0.16 121.20 132.58 2db9 s ILE 50 Ca 0.13 -0.13 0.00 0.00 -0.51 0.00 0.00 60.65 60.15 2db9 s ILE 50 Cb -0.14 -3.47 0.25 0.00 0.15 0.00 0.00 42.46 39.25 2db9 s ILE 50 CO 0.07 0.38 0.95 0.61 -2.11 0.00 0.00 174.94 174.84 2db9 n GLY 51 N 1.14 4.62 0.30 1.50 0.00 -1.20 -0.96 105.19 110.59 2db9 n GLY 51 Ca -0.13 -2.67 0.24 0.00 0.00 0.00 0.00 46.02 43.46 2db9 n GLY 51 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2db9 n ILE 52 N 1.57 -0.38 -3.43 -0.61 -0.00 -1.26 -4.81 119.36 110.43 2db9 n ILE 52 Ca 0.25 1.91 0.00 0.00 -0.00 0.00 0.00 62.75 64.92 2db9 n ILE 52 Cb 0.37 -2.99 0.00 0.00 -0.00 0.00 0.00 39.64 37.02 2db9 n ILE 52 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 2db9 n GLY 53 N -1.32 -0.70 2.60 3.28 0.00 -1.25 -5.09 105.19 102.70 2db9 n GLY 53 Ca 0.30 -0.86 -0.22 0.00 0.00 0.00 0.00 46.02 45.25 2db9 n GLY 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2db9 s ASN 54 N -4.00 1.60 -0.07 1.61 4.22 -1.26 -2.62 114.94 114.41 2db9 s ASN 54 Ca 0.00 -2.08 -0.10 0.00 -2.14 0.00 0.00 52.86 48.54 2db9 s ASN 54 Cb 0.00 0.16 -0.05 0.00 1.28 0.00 0.00 41.25 42.64 2db9 s ASN 54 CO 0.00 -0.24 0.25 -2.28 -2.04 0.00 0.00 177.10 172.78 2db9 s HIS 55 N 1.00 3.65 0.43 1.54 2.46 -1.26 -4.93 115.29 118.18 2db9 s HIS 55 Ca 0.21 0.71 0.00 0.00 0.47 0.00 0.00 55.06 56.45 2db9 s HIS 55 Cb -0.13 -2.08 0.00 0.00 -0.13 0.00 0.00 32.58 30.24 2db9 s HIS 55 CO -0.05 0.69 0.00 0.09 -2.47 0.00 0.00 174.74 173.01 2db9 n ASN 56 N 1.94 -8.80 0.00 9.88 4.13 -1.26 -4.31 115.26 116.85 2db9 n ASN 56 Ca -0.18 0.86 0.00 0.00 1.68 0.00 0.00 54.58 56.94 2db9 n ASN 56 Cb 0.54 -4.63 0.00 0.00 -1.54 0.00 0.00 39.78 34.15 2db9 n ASN 56 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 2db9 n SER 57 N -4.33 0.00 -4.67 6.41 7.64 -1.26 -4.44 113.62 112.96 2db9 n SER 57 Ca -0.02 0.93 -0.42 0.00 1.01 0.00 0.00 58.87 60.37 2db9 n SER 57 Cb 0.68 -0.43 -0.00 0.00 -1.01 0.00 0.00 64.21 63.45 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 -2.62 1.90 -0.35 1.43 2.85 -1.26 -4.98 118.16 115.14 2db9 n LYS 58 Ca 0.00 0.67 -0.07 0.00 -1.05 0.00 0.00 58.31 57.86 2db9 n LYS 58 Cb 0.00 -2.24 0.05 0.00 -0.65 0.00 0.00 35.03 32.20 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 0.45 -0.90 -3.76 -1.58 -0.04 -1.26 -4.19 135.00 123.72 2db9 n PRO 59 Ca 0.06 -0.45 -0.13 0.00 -0.04 0.00 0.00 63.50 62.95 2db9 n PRO 59 Cb 0.36 -0.35 -0.13 0.00 -0.04 0.00 0.00 33.50 33.34 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 -1.57 -0.03 0.18 0.52 1.01 -1.08 -4.73 120.40 114.69 2db9 s VAL 60 Ca 0.17 0.13 -0.12 0.00 0.00 0.00 0.00 61.98 62.15 2db9 s VAL 60 Cb -0.01 -0.29 0.01 0.00 0.00 0.00 0.00 36.38 36.09 2db9 s VAL 60 CO 0.13 0.05 0.38 -0.31 0.00 0.00 0.00 175.10 175.35 2db9 s TYR 61 N 0.93 0.19 -0.15 5.22 2.02 -1.26 -3.90 117.35 120.39 2db9 s TYR 61 Ca -0.07 -0.55 -0.14 0.00 -0.37 0.00 0.00 57.07 55.94 2db9 s TYR 61 Cb -0.09 0.13 0.04 0.00 -0.40 0.00 0.00 41.96 41.64 2db9 s TYR 61 CO -0.05 -0.81 0.41 1.03 -1.57 0.00 0.00 175.55 174.56 2db9 s ARG 62 N -3.93 0.49 0.12 -0.62 0.52 -0.13 -4.91 118.95 110.49 2db9 s ARG 62 Ca 0.14 0.55 -0.21 0.00 -0.52 0.00 0.00 55.73 55.69 2db9 s ARG 62 Cb 0.01 0.24 -0.07 0.00 0.52 0.00 0.00 34.95 35.65 2db9 s ARG 62 CO -0.01 -0.06 0.66 0.08 0.02 0.00 0.00 175.30 175.99 2db9 s VAL 63 N 0.18 4.59 0.05 3.52 1.01 -1.26 -0.64 120.40 127.85 2db9 s VAL 63 Ca -0.00 1.39 -0.06 0.00 0.00 0.00 0.00 61.98 63.31 2db9 s VAL 63 Cb -0.03 -3.98 -0.01 0.00 0.00 0.00 0.00 36.38 32.36 2db9 s VAL 63 CO 0.01 0.50 0.10 0.00 0.00 0.00 0.00 175.10 175.71 2db9 s ALA 64 N -1.17 -0.02 -0.09 5.51 0.00 -0.90 -4.88 121.76 120.22 2db9 s ALA 64 Ca 0.33 -0.68 0.04 0.00 0.00 0.00 0.00 51.96 51.65 2db9 s ALA 64 Cb -0.20 0.32 -0.01 0.00 0.00 0.00 0.00 23.12 23.22 2db9 s ALA 64 CO 0.22 -0.38 -0.21 -2.00 0.00 0.00 0.00 175.76 173.39 2db9 s GLU 65 N -3.18 2.88 0.07 0.00 2.12 -1.21 -1.64 118.70 117.75 2db9 s GLU 65 Ca -0.00 -0.82 -0.31 0.00 0.36 0.00 0.00 54.97 54.20 2db9 s GLU 65 Cb 0.02 -2.34 -0.07 0.00 0.26 0.00 0.00 34.13 32.00 2db9 s GLU 65 CO -0.07 0.32 1.41 0.42 -0.54 0.00 0.00 175.26 176.79 2db9 s ILE 66 N 0.03 3.47 -0.56 -3.70 1.01 -0.24 -1.35 121.20 119.87 2db9 s ILE 66 Ca -0.08 0.98 0.06 0.00 0.00 0.00 0.00 60.65 61.61 2db9 s ILE 66 Cb -0.15 -3.63 0.12 0.00 0.01 0.00 0.00 42.46 38.81 2db9 s ILE 66 CO 0.05 0.04 0.99 0.35 0.00 0.00 0.00 174.94 176.38 2db9 n THR 67 N 4.28 0.69 0.00 2.92 -2.24 0.32 -1.08 114.28 119.16 2db9 n THR 67 Ca 0.12 -0.84 0.00 0.00 -2.27 0.00 0.00 64.05 61.06 2db9 n THR 67 Cb 0.43 0.69 0.00 0.00 -2.10 0.00 0.00 70.33 69.35 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 0.12 0.08 3.01 3.38 0.00 -1.24 -4.96 105.19 105.57 2db9 n GLY 68 Ca 0.05 -1.59 -0.29 0.00 0.00 0.00 0.00 46.02 44.19 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 -1.59 1.45 0.51 1.61 1.01 -1.26 -1.02 120.40 121.11 2db9 s VAL 69 Ca 0.00 -0.57 0.07 0.00 0.00 0.00 0.00 61.98 61.48 2db9 s VAL 69 Cb 0.00 -1.37 0.09 0.00 0.00 0.00 0.00 36.38 35.10 2db9 s VAL 69 CO 0.00 0.44 0.70 1.33 0.00 0.00 0.00 175.10 177.57 2db9 n VAL 70 N 4.68 0.00 -3.91 2.92 0.24 -0.04 -4.93 118.33 117.29 2db9 n VAL 70 Ca -0.17 -1.57 -0.24 0.00 -2.04 0.00 0.00 64.34 60.32 2db9 n VAL 70 Cb 0.50 -0.66 -0.17 0.00 -1.47 0.00 0.00 33.84 32.04 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 -4.29 1.05 0.63 7.34 -1.05 -1.26 -1.95 118.70 119.17 2db9 s GLU 71 Ca 0.52 -0.08 0.03 0.00 -0.15 0.00 0.00 54.97 55.28 2db9 s GLU 71 Cb -0.04 -1.22 0.09 0.00 -0.44 0.00 0.00 34.13 32.52 2db9 s GLU 71 CO 0.33 -0.25 0.87 0.95 0.95 0.00 0.00 175.26 178.12 2db9 s THR 72 N 1.68 2.31 -0.18 1.83 -4.23 -0.57 -4.93 115.64 111.55 2db9 s THR 72 Ca 0.02 -0.74 0.12 0.00 -1.18 0.00 0.00 61.69 59.91 2db9 s THR 72 Cb -0.13 -2.57 -0.23 0.00 1.34 0.00 0.00 72.50 70.91 2db9 s THR 72 CO -0.05 0.00 0.14 0.00 -0.54 0.00 0.00 174.62 174.17 2db9 n ALA 73 N -2.52 1.44 -2.60 3.99 0.00 -1.26 -4.94 120.51 114.62 2db9 n ALA 73 Ca 0.13 -1.13 -0.31 0.00 0.00 0.00 0.00 53.44 52.14 2db9 n ALA 73 Cb 0.61 -0.33 -0.04 0.00 0.00 0.00 0.00 19.45 19.68 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 -2.52 3.65 0.12 0.00 1.02 -1.26 -5.10 119.74 115.65 2db9 s LYS 74 Ca -0.15 -0.03 0.09 0.00 0.02 0.00 0.00 55.97 55.90 2db9 s LYS 74 Cb 0.07 -2.77 -0.04 0.00 -0.52 0.00 0.00 37.83 34.57 2db9 s LYS 74 CO 0.78 0.39 -0.19 0.08 -0.92 0.00 0.00 175.35 175.49 2db9 s VAL 75 N -1.79 2.79 0.16 3.17 1.01 -1.26 -4.70 120.40 119.79 2db9 s VAL 75 Ca 0.43 -1.54 0.02 0.00 0.00 0.00 0.00 61.98 60.88 2db9 s VAL 75 Cb -0.12 -2.28 -0.05 0.00 0.00 0.00 0.00 36.38 33.94 2db9 s VAL 75 CO 0.25 0.09 -0.02 -0.72 0.00 0.00 0.00 175.10 174.70 2db9 s TYR 76 N -1.16 1.18 0.36 5.22 -0.85 -0.86 -4.98 117.35 116.26 2db9 s TYR 76 Ca 0.18 -0.98 -0.25 0.00 -0.52 0.00 0.00 57.07 55.49 2db9 s TYR 76 Cb -0.10 -0.67 -0.09 0.00 0.38 0.00 0.00 41.96 41.48 2db9 s TYR 76 CO 0.10 -0.17 1.04 -1.14 -1.52 0.00 0.00 175.55 173.85 2db9 s GLN 77 N -3.89 4.34 -0.43 -3.49 0.74 -1.26 -1.88 119.66 113.79 2db9 s GLN 77 Ca 0.22 1.53 0.08 0.00 0.05 0.00 0.00 55.36 57.24 2db9 s GLN 77 Cb 0.06 -2.71 0.28 0.00 1.10 0.00 0.00 33.01 31.73 2db9 s GLN 77 CO 0.03 0.01 0.61 -0.11 -0.55 0.00 0.00 175.29 175.28 2db9 n LEU 78 N 0.29 0.97 -1.41 3.68 7.94 0.60 -4.67 117.00 124.39 2db9 n LEU 78 Ca 0.03 -4.90 -0.12 0.00 -1.11 0.00 0.00 56.01 49.91 2db9 n LEU 78 Cb 0.49 0.44 0.00 0.00 0.53 0.00 0.00 43.42 44.88 2db9 n LEU 78 CO 0.46 2.13 -0.11 0.61 -1.11 0.00 0.00 177.39 179.37 2db9 n GLY 79 N 1.01 -0.08 0.00 -3.96 0.00 -1.26 -3.31 105.19 97.60 2db9 n GLY 79 Ca 0.23 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.88 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 -1.05 3.48 3.79 -0.02 0.00 -1.26 -5.08 105.19 105.05 2db9 n GLY 80 Ca -0.12 -0.99 -0.38 0.00 0.00 0.00 0.00 46.02 44.53 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 4.37 -0.34 2.61 -1.32 -1.21 -5.00 115.64 114.76 2db9 s THR 81 Ca 0.00 1.63 -0.10 0.00 -1.21 0.00 0.00 61.69 62.01 2db9 s THR 81 Cb 0.00 -4.04 0.01 0.00 -1.51 0.00 0.00 72.50 66.96 2db9 s THR 81 CO 0.00 0.34 0.18 -0.13 -2.21 0.00 0.00 174.62 172.80 2db9 s ARG 82 N -1.60 3.16 0.40 7.08 0.52 -1.26 0.22 118.95 127.46 2db9 s ARG 82 Ca 0.41 -0.85 0.08 0.00 -0.52 0.00 0.00 55.73 54.85 2db9 s ARG 82 Cb -0.20 -3.64 -0.04 0.00 0.52 0.00 0.00 34.95 31.59 2db9 s ARG 82 CO 0.25 -0.52 0.21 -0.08 0.02 0.00 0.00 175.30 175.18 2db9 s THR 83 N 1.60 2.56 -0.00 0.02 -1.32 -0.79 -4.88 115.64 112.83 2db9 s THR 83 Ca 0.04 -1.62 0.00 0.00 -1.21 0.00 0.00 61.69 58.90 2db9 s THR 83 Cb -0.18 -2.99 0.01 0.00 -1.51 0.00 0.00 72.50 67.83 2db9 s THR 83 CO 0.07 -0.05 0.82 -0.46 -2.21 0.00 0.00 174.62 172.79 2db9 n ASN 84 N -1.28 0.08 -4.58 8.08 6.94 -1.26 -2.03 115.26 121.20 2db9 n ASN 84 Ca -0.01 -1.66 -0.42 0.00 -0.02 0.00 0.00 54.58 52.47 2db9 n ASN 84 Cb 0.63 -0.13 -0.06 0.00 -2.36 0.00 0.00 39.78 37.86 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 -0.07 3.73 -0.38 -3.83 1.02 -1.26 -1.51 119.74 117.43 2db9 s LYS 85 Ca 0.01 0.19 -0.24 0.00 0.02 0.00 0.00 55.97 55.95 2db9 s LYS 85 Cb 0.01 -3.80 0.01 0.00 -0.52 0.00 0.00 37.83 33.53 2db9 s LYS 85 CO 0.00 -0.78 0.82 0.20 -0.92 0.00 0.00 175.35 174.68 2db9 s GLY 86 N 1.80 1.62 -0.20 -3.33 0.00 -0.82 -4.59 107.32 101.80 2db9 s GLY 86 Ca 0.28 -0.65 -0.29 0.00 0.00 0.00 0.00 44.72 44.06 2db9 s GLY 86 CO 0.15 1.83 1.73 1.08 0.00 0.00 0.00 173.10 177.90 2db9 s LEU 87 N 3.24 3.89 -0.83 0.66 1.43 -0.61 -0.86 118.68 125.61 2db9 s LEU 87 Ca 0.33 1.75 -0.25 0.00 -1.03 0.00 0.00 54.13 54.93 2db9 s LEU 87 Cb -0.13 -3.53 0.02 0.00 0.03 0.00 0.00 46.19 42.58 2db9 s LEU 87 CO 0.18 -1.33 1.50 -1.58 0.23 0.00 0.00 176.35 175.35 2db9 s GLN 88 N 4.88 3.15 -0.07 1.70 0.74 -0.19 -1.87 119.66 128.01 2db9 s GLN 88 Ca 0.77 -0.39 -0.05 0.00 0.05 0.00 0.00 55.36 55.74 2db9 s GLN 88 Cb -0.28 -4.68 -0.04 0.00 1.10 0.00 0.00 33.01 29.11 2db9 s GLN 88 CO 0.31 -2.40 0.16 -0.51 -0.55 0.00 0.00 175.29 172.30 2db9 s LEU 89 N 6.52 4.38 -0.11 3.68 1.43 -0.94 0.12 118.68 133.76 2db9 s LEU 89 Ca 0.47 0.42 0.02 0.00 -1.03 0.00 0.00 54.13 54.02 2db9 s LEU 89 Cb -0.06 -2.33 -0.01 0.00 0.03 0.00 0.00 46.19 43.82 2db9 s LEU 89 CO 0.06 0.34 -0.19 -0.60 0.23 0.00 0.00 176.35 176.19 2db9 s ARG 90 N -1.46 3.11 -0.34 1.70 3.52 -0.45 0.12 118.95 125.15 2db9 s ARG 90 Ca 0.21 -0.79 0.01 0.00 -0.13 0.00 0.00 55.73 55.03 2db9 s ARG 90 Cb -0.12 -2.43 0.09 0.00 -1.56 0.00 0.00 34.95 30.93 2db9 s ARG 90 CO 0.11 0.23 0.07 -1.58 -0.81 0.00 0.00 175.30 173.32 2db9 s HIS 91 N 0.24 3.61 0.00 5.12 5.65 0.24 -3.30 115.29 126.85 2db9 s HIS 91 Ca -0.13 -2.65 0.00 0.00 0.25 0.00 0.00 55.06 52.53 2db9 s HIS 91 Cb -0.16 -2.80 0.00 0.00 -1.18 0.00 0.00 32.58 28.44 2db9 s HIS 91 CO 0.07 -0.93 0.00 0.41 -0.65 0.00 0.00 174.74 173.64 2db9 n GLY 92 N 4.40 2.74 1.05 1.59 0.00 -1.26 -1.33 105.19 112.38 2db9 n GLY 92 Ca -0.02 -0.26 0.05 0.00 0.00 0.00 0.00 46.02 45.79 2db9 n GLY 92 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2db9 n ASN 93 N 5.57 2.99 -4.18 1.61 2.85 -1.26 -4.82 115.26 118.01 2db9 n ASN 93 Ca 0.00 -2.30 -0.23 0.00 -0.11 0.00 0.00 54.58 51.94 2db9 n ASN 93 Cb 0.00 -0.47 -0.14 0.00 1.24 0.00 0.00 39.78 40.41 2db9 n ASN 93 CO 0.00 0.00 0.00 -1.81 -2.11 0.00 0.00 177.26 173.34 2db9 s ASP 94 N -0.65 2.02 0.22 1.20 1.11 -0.44 -5.15 116.67 114.98 2db9 s ASP 94 Ca 0.28 -0.42 0.05 0.00 0.18 0.00 0.00 52.55 52.65 2db9 s ASP 94 Cb 0.19 -0.18 -0.03 0.00 1.07 0.00 0.00 42.92 43.97 2db9 s ASP 94 CO 0.13 0.14 0.32 -1.10 1.18 0.00 0.00 175.17 175.83 2db9 s GLN 95 N -0.86 3.36 0.35 8.23 -0.21 -1.26 0.81 119.66 130.09 2db9 s GLN 95 Ca 0.05 -0.77 -0.01 0.00 0.02 0.00 0.00 55.36 54.66 2db9 s GLN 95 Cb -0.08 -2.86 0.00 0.00 1.00 0.00 0.00 33.01 31.08 2db9 s GLN 95 CO 0.01 0.45 0.47 1.03 -2.12 0.00 0.00 175.29 175.12 2db9 s ARG 96 N -3.79 1.94 -0.27 2.91 0.52 0.32 -4.79 118.95 115.79 2db9 s ARG 96 Ca 0.34 -1.82 -0.01 0.00 -0.52 0.00 0.00 55.73 53.72 2db9 s ARG 96 Cb -0.09 0.44 0.16 0.00 0.52 0.00 0.00 34.95 35.97 2db9 s ARG 96 CO 0.28 -0.80 0.45 0.08 0.02 0.00 0.00 175.30 175.33 2db9 s VAL 97 N -3.00 -0.73 0.06 3.52 1.01 -1.26 -2.22 120.40 117.78 2db9 s VAL 97 Ca 0.32 -0.09 0.00 0.00 0.00 0.00 0.00 61.98 62.21 2db9 s VAL 97 Cb -0.00 -0.91 0.00 0.00 0.00 0.00 0.00 36.38 35.48 2db9 s VAL 97 CO 0.22 -0.12 0.03 0.49 0.00 0.00 0.00 175.10 175.73 2db9 n PHE 98 N 5.38 -1.07 -4.46 5.22 3.01 -0.78 -4.93 117.46 119.82 2db9 n PHE 98 Ca -0.02 -0.26 -0.24 0.00 1.01 0.00 0.00 57.45 57.94 2db9 n PHE 98 Cb 0.50 -0.05 -0.10 0.00 -0.01 0.00 0.00 39.48 39.83 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 -2.24 1.67 0.34 -1.08 0.52 -1.26 -1.57 118.95 115.34 2db9 s ARG 99 Ca 0.03 -1.73 0.02 0.00 -0.52 0.00 0.00 55.73 53.53 2db9 s ARG 99 Cb -0.00 -1.79 0.62 0.00 0.52 0.00 0.00 34.95 34.30 2db9 s ARG 99 CO 0.02 0.34 1.99 -0.07 0.02 0.00 0.00 175.30 177.60 2db9 h LEU 100 N 2.39 0.76 -1.79 2.53 4.07 -1.93 0.32 115.31 121.67 2db9 h LEU 100 Ca -0.41 -0.01 0.07 0.00 0.08 0.00 0.00 57.88 57.61 2db9 h LEU 100 Cb 1.25 -0.18 -0.02 0.00 1.08 0.00 0.00 40.66 42.79 2db9 h LEU 100 CO 0.58 0.54 0.29 1.05 -1.08 0.00 0.00 178.44 179.82 2db9 h GLU 101 N 0.89 0.25 0.00 1.13 4.11 -1.96 0.16 114.58 119.17 2db9 h GLU 101 Ca 0.27 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.68 2db9 h GLU 101 Cb -0.02 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.17 2db9 h GLU 101 CO -0.07 0.16 -0.71 1.19 0.07 0.00 0.00 179.01 179.66 2db9 n PHE 102 N -4.47 0.35 -2.27 2.06 3.72 -0.04 -4.76 117.46 112.05 2db9 n PHE 102 Ca 0.06 0.10 -0.39 0.00 -0.05 0.00 0.00 57.45 57.17 2db9 n PHE 102 Cb 0.31 -0.50 -0.03 0.00 -0.94 0.00 0.00 39.48 38.31 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 -3.14 3.52 0.96 -4.37 1.01 0.57 -3.27 120.40 115.69 2db9 s VAL 103 Ca 0.07 0.28 -0.13 0.00 0.00 0.00 0.00 61.98 62.19 2db9 s VAL 103 Cb 0.15 -4.38 0.05 0.00 0.00 0.00 0.00 36.38 32.19 2db9 s VAL 103 CO 0.74 -1.34 0.44 -0.24 0.00 0.00 0.00 175.10 174.70 2db9 n SER 104 N 11.25 -1.93 -1.72 3.32 2.88 0.43 -4.20 113.62 123.65 2db9 n SER 104 Ca 0.13 0.31 -0.11 0.00 -1.33 0.00 0.00 58.87 57.86 2db9 n SER 104 Cb 0.51 -1.21 0.07 0.00 -0.75 0.00 0.00 64.21 62.83 2db9 n SER 104 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 2db9 n ASN 105 N -1.59 3.39 -4.74 -3.46 6.94 -1.26 -3.95 115.26 110.60 2db9 n ASN 105 Ca 0.07 -3.45 -0.23 0.00 -0.02 0.00 0.00 54.58 50.94 2db9 n ASN 105 Cb 0.54 -0.41 -0.06 0.00 -2.36 0.00 0.00 39.78 37.49 2db9 n ASN 105 CO 0.00 0.00 0.00 -1.10 -1.03 0.00 0.00 177.26 175.13 2db9 s GLN 106 N -3.30 2.34 0.15 -3.83 1.11 -1.26 -4.93 119.66 109.94 2db9 s GLN 106 Ca 0.43 -1.61 -0.23 0.00 0.01 0.00 0.00 55.36 53.97 2db9 s GLN 106 Cb 0.39 -2.14 -0.08 0.00 -1.01 0.00 0.00 33.01 30.17 2db9 s GLN 106 CO -0.01 0.05 0.72 -1.21 0.01 0.00 0.00 175.29 174.85 2db9 s GLU 107 N -3.87 4.43 0.05 2.91 2.02 -1.26 -4.81 118.70 118.17 2db9 s GLU 107 Ca 0.39 1.01 -0.32 0.00 0.02 0.00 0.00 54.97 56.07 2db9 s GLU 107 Cb -0.01 -3.20 -0.11 0.00 0.10 0.00 0.00 34.13 30.91 2db9 s GLU 107 CO 0.23 0.56 1.86 1.19 0.02 0.00 0.00 175.26 179.12 2db9 n PHE 108 N 1.48 2.48 -1.75 1.61 3.72 -1.26 -4.97 117.46 118.78 2db9 n PHE 108 Ca -0.06 -0.13 -0.30 0.00 -0.05 0.00 0.00 57.45 56.91 2db9 n PHE 108 Cb 0.50 -2.72 0.17 0.00 -0.94 0.00 0.00 39.48 36.49 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 3.40 1.94 -0.03 4.37 -4.23 -1.26 -4.79 115.64 115.03 2db9 s THR 109 Ca 0.87 0.00 0.20 0.00 -1.18 0.00 0.00 61.69 61.58 2db9 s THR 109 Cb -0.55 -2.89 0.18 0.00 1.34 0.00 0.00 72.50 70.58 2db9 s THR 109 CO 0.43 0.00 1.66 -0.08 -0.54 0.00 0.00 174.62 176.09 2db9 h GLU 110 N -1.68 0.00 0.00 3.99 4.81 -1.99 -3.03 114.58 116.68 2db9 h GLU 110 Ca -0.45 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.78 2db9 h GLU 110 Cb 1.27 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.65 2db9 h GLU 110 CO 0.45 0.31 0.00 0.43 -0.73 0.00 0.00 179.01 179.47 2db9 n SER 111 N -3.30 0.00 -0.29 1.04 7.64 -1.26 -3.54 113.62 113.91 2db9 n SER 111 Ca 0.01 0.52 -0.08 0.00 1.01 0.00 0.00 58.87 60.34 2db9 n SER 111 Cb 0.55 -0.50 -0.07 0.00 -1.01 0.00 0.00 64.21 63.19 2db9 n SER 111 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2db9 n GLU 112 N -1.99 -0.30 -0.31 1.43 -0.58 -1.26 0.12 120.64 117.75 2db9 n GLU 112 Ca 0.00 1.24 0.20 0.00 -0.42 0.00 0.00 57.16 58.18 2db9 n GLU 112 Cb 0.00 -1.83 0.38 0.00 -0.57 0.00 0.00 31.44 29.42 2db9 n GLU 112 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 2db9 n PHE 113 N -4.59 0.78 0.03 -0.32 7.35 -1.14 0.14 117.46 119.70 2db9 n PHE 113 Ca 0.01 1.11 -0.19 0.00 -0.76 0.00 0.00 57.45 57.62 2db9 n PHE 113 Cb 0.18 -1.31 -0.11 0.00 0.35 0.00 0.00 39.48 38.58 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 0.56 -0.60 -4.13 2.86 0.90 -1.11 114.93 113.42 2db9 h MET 114 Ca 0.65 -0.63 0.01 0.00 -2.06 0.00 0.00 59.70 57.68 2db9 h MET 114 Cb 1.51 0.18 -0.03 0.00 0.06 0.00 0.00 31.60 33.32 2db9 h MET 114 CO -0.81 1.24 0.39 0.87 1.06 0.00 0.00 176.91 179.65 2db9 h LYS 115 N 0.15 0.75 -0.12 1.72 1.79 0.60 -1.06 116.57 120.41 2db9 h LYS 115 Ca -0.11 -0.05 -0.02 0.00 -2.18 0.00 0.00 60.65 58.29 2db9 h LYS 115 Cb 1.56 -0.17 -0.00 0.00 -1.58 0.00 0.00 32.23 32.03 2db9 h LYS 115 CO 0.17 0.50 -0.01 2.35 -1.08 0.00 0.00 179.45 181.38 2db9 h TRP 116 N 0.78 0.25 -0.82 -1.35 7.01 0.12 -2.91 115.95 119.02 2db9 h TRP 116 Ca 0.23 -0.05 0.19 0.00 2.11 0.00 0.00 58.89 61.37 2db9 h TRP 116 Cb -0.05 -0.06 -0.15 0.00 -2.10 0.00 0.00 29.16 26.80 2db9 h TRP 116 CO -0.04 0.49 -0.04 0.87 -2.79 0.00 0.00 178.44 176.93 2db9 h LYS 117 N -0.06 0.06 -0.90 2.65 1.57 -0.66 0.35 116.57 119.59 2db9 h LYS 117 Ca 0.03 -0.00 0.17 0.00 -1.87 0.00 0.00 60.65 58.98 2db9 h LYS 117 Cb 0.40 -0.01 -0.17 0.00 0.08 0.00 0.00 32.23 32.53 2db9 h LYS 117 CO 0.01 0.04 -0.26 0.93 -0.57 0.00 0.00 179.45 179.60 2db9 h GLU 118 N 0.06 -0.01 -0.61 3.15 4.39 -1.00 1.19 114.58 121.76 2db9 h GLU 118 Ca 0.45 0.00 0.09 0.00 0.34 0.00 0.00 59.36 60.24 2db9 h GLU 118 Cb 0.80 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 29.39 2db9 h GLU 118 CO -0.76 -0.01 0.23 0.00 -1.16 0.00 0.00 179.01 177.31 2db9 h ALA 119 N 1.74 0.79 -0.55 3.43 0.00 -0.37 1.21 119.26 125.52 2db9 h ALA 119 Ca 0.40 0.08 -0.09 0.00 0.00 0.00 0.00 54.91 55.31 2db9 h ALA 119 Cb 0.64 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 2db9 h ALA 119 CO -0.92 -0.19 -0.01 0.52 0.00 0.00 0.00 179.25 178.65 2db9 h MET 120 N 0.41 0.97 -0.26 0.00 2.86 0.12 0.12 114.93 119.16 2db9 h MET 120 Ca 0.31 -0.31 -0.12 0.00 -2.06 0.00 0.00 59.70 57.51 2db9 h MET 120 Cb 0.38 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.94 2db9 h MET 120 CO -0.30 0.98 -0.35 0.74 1.06 0.00 0.00 176.91 179.03 2db9 h PHE 121 N 0.85 0.67 -0.18 -0.22 -1.00 0.20 0.85 116.94 118.12 2db9 h PHE 121 Ca 0.15 -0.18 -0.20 0.00 2.81 0.00 0.00 57.97 60.56 2db9 h PHE 121 Cb 0.55 -0.15 0.00 0.00 3.61 0.00 0.00 35.95 39.96 2db9 h PHE 121 CO 0.04 0.85 -0.67 1.03 -1.61 0.00 0.00 178.31 177.95 2db9 h SER 122 N 0.48 0.80 -0.20 2.17 0.87 0.16 -2.63 113.55 115.21 2db9 h SER 122 Ca 0.05 -0.48 0.00 0.00 -1.23 0.00 0.00 61.79 60.13 2db9 h SER 122 Cb 0.84 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 62.57 2db9 h SER 122 CO 0.07 1.26 0.00 0.00 -0.53 0.00 0.00 176.83 177.63 2db9 n ALA 123 N -2.56 2.48 -4.02 6.23 0.00 0.40 -4.88 120.51 118.15 2db9 n ALA 123 Ca -0.05 -0.36 -0.33 0.00 0.00 0.00 0.00 53.44 52.69 2db9 n ALA 123 Cb 0.69 -1.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.12 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 0.85 -0.46 0.61 0.00 0.00 -0.40 -4.94 105.19 100.85 2db9 n GLY 124 Ca 0.08 0.13 -0.04 0.00 0.00 0.00 0.00 46.02 46.20 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 -4.28 0.58 -4.60 1.61 2.81 0.28 -5.00 117.12 108.51 2db9 n MET 125 Ca 0.06 -0.44 -0.23 0.00 -1.81 0.00 0.00 57.70 55.28 2db9 n MET 125 Cb 0.50 -0.09 -0.14 0.00 -0.71 0.00 0.00 33.22 32.77 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 -2.74 1.20 0.77 0.03 -0.21 -1.26 -4.71 119.66 112.73 2db9 s GLN 126 Ca 0.10 -0.71 -0.05 0.00 0.02 0.00 0.00 55.36 54.72 2db9 s GLN 126 Cb -0.01 -1.21 0.16 0.00 1.00 0.00 0.00 33.01 32.96 2db9 s GLN 126 CO 0.07 0.32 1.05 1.28 -2.12 0.00 0.00 175.29 175.89 2db9 n LEU 127 N 2.24 0.00 -4.72 2.90 4.77 -1.26 -5.03 117.00 115.90 2db9 n LEU 127 Ca -0.16 -1.84 -0.42 0.00 -0.03 0.00 0.00 56.01 53.56 2db9 n LEU 127 Cb 0.54 -0.72 -0.03 0.00 -2.33 0.00 0.00 43.42 40.88 2db9 n LEU 127 CO 0.23 -1.10 0.85 -2.16 -1.33 0.00 0.00 177.39 173.89 2db9 s PRO 128 N -5.23 4.46 0.24 3.23 0.04 -1.26 -4.76 135.00 131.73 2db9 s PRO 128 Ca 0.66 1.73 -0.30 0.00 0.04 0.00 0.00 61.00 63.13 2db9 s PRO 128 Cb -0.03 -3.35 -0.09 0.00 0.04 0.00 0.00 34.50 31.07 2db9 s PRO 128 CO 0.45 -0.20 0.94 0.95 0.04 0.00 0.00 177.00 179.18 2db9 s THR 129 N 0.91 4.06 0.49 1.26 -4.23 -1.26 0.10 115.64 116.97 2db9 s THR 129 Ca 0.57 2.07 0.42 0.00 -1.18 0.00 0.00 61.69 63.57 2db9 s THR 129 Cb -0.28 -4.31 0.63 0.00 1.34 0.00 0.00 72.50 69.87 2db9 s THR 129 CO 0.30 0.48 1.46 0.18 -0.54 0.00 0.00 174.62 176.50 2db9 n LEU 130 N 1.44 0.06 0.22 4.79 7.99 -0.20 0.19 117.00 131.49 2db9 n LEU 130 Ca -0.02 1.04 -0.13 0.00 -0.01 0.00 0.00 56.01 56.89 2db9 n LEU 130 Cb 0.47 -0.52 -0.07 0.00 -0.11 0.00 0.00 43.42 43.19 2db9 n LEU 130 CO 0.50 -1.08 0.48 -0.78 -1.51 0.00 0.00 177.39 175.00 2db9 h ASP 131 N 0.00 -0.49 -0.36 -1.43 1.82 -1.90 -0.72 116.42 113.34 2db9 h ASP 131 Ca 0.87 -0.11 0.10 0.00 -0.39 0.00 0.00 57.03 57.50 2db9 h ASP 131 Cb 3.28 0.13 -0.01 0.00 0.68 0.00 0.00 39.33 43.40 2db9 h ASP 131 CO -0.14 -0.12 0.28 -0.33 -1.61 0.00 0.00 179.24 177.32 2db9 h GLU 132 N -0.92 0.00 0.18 0.28 5.08 0.17 0.66 114.58 120.03 2db9 h GLU 132 Ca -0.06 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 2db9 h GLU 132 Cb 0.57 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.82 2db9 h GLU 132 CO 0.10 0.00 -0.09 0.82 -1.00 0.00 0.00 179.01 178.84 2db9 h ILE 133 N 0.00 0.91 0.34 3.13 1.08 -0.69 0.14 117.51 122.41 2db9 h ILE 133 Ca 0.17 -0.90 -0.02 0.00 -0.39 0.00 0.00 64.86 63.73 2db9 h ILE 133 Cb 0.72 1.41 0.00 0.00 -3.07 0.00 0.00 36.82 35.88 2db9 h ILE 133 CO -0.00 0.19 -0.16 -1.13 -0.69 0.00 0.00 178.15 176.36 2db9 h ASN 134 N -0.72 -0.38 -0.89 1.72 -0.73 -0.03 1.50 115.58 116.05 2db9 h ASN 134 Ca -0.03 -0.08 0.15 0.00 1.87 0.00 0.00 56.30 58.21 2db9 h ASN 134 Cb 0.50 0.10 -0.09 0.00 0.27 0.00 0.00 38.32 39.10 2db9 h ASN 134 CO 0.04 -0.15 0.49 0.07 -0.37 0.00 0.00 177.43 177.51 2db9 h LYS 135 N -0.60 0.68 0.09 6.67 5.09 0.19 -0.04 116.57 128.64 2db9 h LYS 135 Ca -0.05 -0.04 -0.00 0.00 0.09 0.00 0.00 60.65 60.65 2db9 h LYS 135 Cb 0.44 -0.15 0.00 0.00 0.10 0.00 0.00 32.23 32.62 2db9 h LYS 135 CO 0.08 0.45 -0.04 -0.22 -2.09 0.00 0.00 179.45 177.63 2db9 h LYS 136 N 0.70 -0.11 -0.76 0.07 1.63 -0.39 -3.05 116.57 114.66 2db9 h LYS 136 Ca 0.48 0.01 0.07 0.00 -0.85 0.00 0.00 60.65 60.36 2db9 h LYS 136 Cb 0.65 0.03 -0.11 0.00 -0.60 0.00 0.00 32.23 32.20 2db9 h LYS 136 CO -0.34 0.37 -0.58 1.49 -3.45 0.00 0.00 179.45 176.94 2db9 h GLU 137 N -0.66 -0.15 -0.74 1.90 4.81 0.31 0.44 114.58 120.49 2db9 h GLU 137 Ca -0.01 0.01 0.16 0.00 -0.13 0.00 0.00 59.36 59.39 2db9 h GLU 137 Cb 0.53 0.03 -0.13 0.00 0.63 0.00 0.00 28.75 29.82 2db9 h GLU 137 CO 0.02 -0.10 -0.07 -0.07 -0.73 0.00 0.00 179.01 178.05 2db9 h LEU 138 N -0.16 -0.48 -0.84 1.64 -0.00 -1.12 0.70 115.31 115.05 2db9 h LEU 138 Ca 0.13 0.20 0.18 0.00 -0.00 0.00 0.00 57.88 58.39 2db9 h LEU 138 Cb 0.49 0.39 -0.11 0.00 -0.00 0.00 0.00 40.66 41.42 2db9 h LEU 138 CO -0.80 -0.21 0.35 -1.28 -0.00 0.00 0.00 178.44 176.50 2db9 h SER 139 N 0.06 0.32 0.28 -0.43 0.87 -0.05 0.21 113.55 114.81 2db9 h SER 139 Ca 0.38 0.13 -0.01 0.00 -1.23 0.00 0.00 61.79 61.06 2db9 h SER 139 Cb 0.65 0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.72 2db9 h SER 139 CO -0.70 0.06 -0.13 0.40 -0.53 0.00 0.00 176.83 175.93 2db9 h ILE 140 N 0.44 0.77 -0.56 2.23 5.03 0.15 -1.76 117.51 123.81 2db9 h ILE 140 Ca 0.49 -0.37 0.11 0.00 -0.12 0.00 0.00 64.86 64.97 2db9 h ILE 140 Cb 0.84 0.97 -0.11 0.00 -3.03 0.00 0.00 36.82 35.49 2db9 h ILE 140 CO -0.47 0.08 -0.20 0.11 -0.68 0.00 0.00 178.15 177.00 2db9 h LYS 141 N -0.56 -0.06 -0.15 2.37 6.56 0.58 -0.18 116.57 125.12 2db9 h LYS 141 Ca -0.04 0.00 0.05 0.00 -1.06 0.00 0.00 60.65 59.61 2db9 h LYS 141 Cb 0.41 0.01 -0.06 0.00 -0.57 0.00 0.00 32.23 32.02 2db9 h LYS 141 CO 0.06 -0.04 -0.26 0.93 -2.06 0.00 0.00 179.45 178.08 2db9 h GLU 142 N -0.06 -0.31 -0.84 3.15 5.08 -0.51 -1.52 114.58 119.56 2db9 h GLU 142 Ca 0.26 0.02 0.15 0.00 -1.00 0.00 0.00 59.36 58.80 2db9 h GLU 142 Cb 0.47 0.07 -0.15 0.00 0.50 0.00 0.00 28.75 29.64 2db9 h GLU 142 CO -0.61 -0.21 -0.30 0.00 -1.00 0.00 0.00 179.01 176.90 2db9 h ALA 143 N 0.60 0.31 -1.71 3.43 0.00 -0.13 -3.45 119.26 118.31 2db9 h ALA 143 Ca 0.10 0.28 0.27 0.00 0.00 0.00 0.00 54.91 55.56 2db9 h ALA 143 Cb 0.48 0.79 -0.13 0.00 0.00 0.00 0.00 17.79 18.94 2db9 h ALA 143 CO -0.33 -0.53 0.72 -1.12 0.00 0.00 0.00 179.25 178.00 2db9 s SER 144 N -5.26 -0.12 0.00 0.00 0.01 -0.57 -5.09 113.70 102.66 2db9 s SER 144 Ca -0.14 -0.16 0.00 0.00 1.31 0.00 0.00 55.95 56.95 2db9 s SER 144 Cb 0.21 0.25 0.00 0.00 0.21 0.00 0.00 66.02 66.69 2db9 s SER 144 CO 0.73 -0.45 0.00 0.61 0.41 0.00 0.00 173.24 174.55 2db9 n GLY 145 N -0.40 -1.55 3.55 3.44 0.00 -1.25 -4.12 105.19 104.86 2db9 n GLY 145 Ca -0.06 -0.26 -0.38 0.00 0.00 0.00 0.00 46.02 45.32 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 -0.46 2.96 0.08 1.61 0.04 -1.26 -4.76 135.00 133.20 2db9 s PRO 146 Ca 0.00 -0.09 0.07 0.00 0.04 0.00 0.00 61.00 61.02 2db9 s PRO 146 Cb 0.00 -4.56 -0.03 0.00 0.04 0.00 0.00 34.50 29.95 2db9 s PRO 146 CO 0.00 -2.55 -0.18 0.45 0.04 0.00 0.00 177.00 174.77 2db9 s SER 147 N 6.08 2.11 -0.05 6.66 0.15 -1.26 -5.06 113.70 122.33 2db9 s SER 147 Ca 0.53 -0.63 -0.07 0.00 0.70 0.00 0.00 55.95 56.48 2db9 s SER 147 Cb -0.08 -0.10 -0.03 0.00 -1.71 0.00 0.00 66.02 64.09 2db9 s SER 147 CO 0.11 0.01 -0.15 -0.24 1.20 0.00 0.00 173.24 174.17 2db9 n SER 148 N 1.28 1.25 0.00 5.45 2.88 -1.26 -5.11 113.62 118.10 2db9 n SER 148 Ca -0.20 0.19 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2db9 n SER 148 Cb 0.54 -0.45 0.00 0.00 -0.75 0.00 0.00 64.21 63.54 2db9 n SER 148 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42