#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cqv s SER 2 N 0.00 0.02 0.35 1.61 0.01 -1.26 -5.16 113.70 109.28 2cqv s SER 2 Ca 0.00 0.05 0.09 0.00 1.31 0.00 0.00 55.95 57.39 2cqv s SER 2 Cb 0.00 -0.02 -0.07 0.00 0.21 0.00 0.00 66.02 66.15 2cqv s SER 2 CO 0.00 -0.08 -0.07 -0.55 0.41 0.00 0.00 173.24 172.96 2cqv s SER 3 N 0.62 3.67 0.00 2.44 0.15 -1.26 -4.87 113.70 114.46 2cqv s SER 3 Ca -0.05 -1.24 0.00 0.00 0.70 0.00 0.00 55.95 55.36 2cqv s SER 3 Cb -0.07 -0.34 0.00 0.00 -1.71 0.00 0.00 66.02 63.89 2cqv s SER 3 CO -0.02 -0.27 0.00 0.61 1.20 0.00 0.00 173.24 174.76 2cqv n GLY 4 N -0.81 3.10 2.99 9.45 0.00 -1.26 -4.98 105.19 113.67 2cqv n GLY 4 Ca -0.05 -0.81 -0.31 0.00 0.00 0.00 0.00 46.02 44.85 2cqv n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cqv s SER 5 N 0.00 5.19 -0.48 1.61 0.01 -1.26 -4.82 113.70 113.95 2cqv s SER 5 Ca 0.00 -3.67 0.05 0.00 1.31 0.00 0.00 55.95 53.64 2cqv s SER 5 Cb 0.00 -1.74 0.19 0.00 0.21 0.00 0.00 66.02 64.68 2cqv s SER 5 CO 0.00 -0.15 0.42 -0.24 0.41 0.00 0.00 173.24 173.68 2cqv n SER 6 N 2.30 0.53 -1.61 2.44 2.88 -1.26 -5.06 113.62 113.84 2cqv n SER 6 Ca 0.18 -2.64 0.00 0.00 -1.33 0.00 0.00 58.87 55.08 2cqv n SER 6 Cb 0.36 -0.61 0.00 0.00 -0.75 0.00 0.00 64.21 63.20 2cqv n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2cqv n GLY 7 N 2.33 -4.03 3.77 0.46 0.00 -1.26 -4.89 105.19 101.57 2cqv n GLY 7 Ca 0.27 -0.79 -0.32 0.00 0.00 0.00 0.00 46.02 45.17 2cqv n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cqv s PRO 8 N -5.24 2.64 0.01 1.61 0.04 -1.26 -4.51 135.00 128.29 2cqv s PRO 8 Ca 0.00 1.33 -0.12 0.00 0.04 0.00 0.00 61.00 62.25 2cqv s PRO 8 Cb 0.00 -1.94 0.01 0.00 0.04 0.00 0.00 34.50 32.62 2cqv s PRO 8 CO 0.00 -1.36 0.24 1.14 0.04 0.00 0.00 177.00 177.06 2cqv s GLN 9 N -4.33 0.66 -0.52 4.56 -2.07 -1.26 -4.27 119.66 112.43 2cqv s GLN 9 Ca 0.65 -0.40 -0.09 0.00 -1.82 0.00 0.00 55.36 53.70 2cqv s GLN 9 Cb -0.20 0.28 0.13 0.00 -1.09 0.00 0.00 33.01 32.14 2cqv s GLN 9 CO 0.46 -0.18 0.40 0.42 -1.32 0.00 0.00 175.29 175.07 2cqv s ILE 10 N -1.84 4.35 -0.29 3.63 1.01 -1.26 -2.73 121.20 124.07 2cqv s ILE 10 Ca -0.10 -1.94 0.19 0.00 0.00 0.00 0.00 60.65 58.79 2cqv s ILE 10 Cb -0.04 -3.84 0.18 0.00 0.01 0.00 0.00 42.46 38.77 2cqv s ILE 10 CO 0.00 -0.82 1.48 0.16 0.00 0.00 0.00 174.94 175.77 2cqv h ILE 11 N 5.92 0.44 -3.28 2.92 -2.65 -1.92 -3.44 117.51 115.49 2cqv h ILE 11 Ca -0.17 -1.62 -0.60 0.00 1.03 0.00 0.00 64.86 63.49 2cqv h ILE 11 Cb 1.06 2.19 -0.34 0.00 -2.05 0.00 0.00 36.82 37.68 2cqv h ILE 11 CO 0.85 0.25 -0.84 -1.10 0.03 0.00 0.00 178.15 177.33 2cqv s GLN 12 N -3.08 2.39 -0.28 0.16 -0.21 -1.25 -5.01 119.66 112.37 2cqv s GLN 12 Ca 0.05 -0.63 -0.24 0.00 0.02 0.00 0.00 55.36 54.56 2cqv s GLN 12 Cb 0.06 -1.97 0.10 0.00 1.00 0.00 0.00 33.01 32.21 2cqv s GLN 12 CO 0.72 -0.01 0.91 0.12 -2.12 0.00 0.00 175.29 174.90 2cqv s PHE 13 N 0.84 -0.61 -0.03 0.91 5.36 -1.26 -1.87 117.98 121.32 2cqv s PHE 13 Ca -0.09 1.47 -0.30 0.00 -0.96 0.00 0.00 56.93 57.05 2cqv s PHE 13 Cb -0.15 0.34 -0.05 0.00 -0.34 0.00 0.00 43.02 42.81 2cqv s PHE 13 CO 0.00 -0.30 1.47 -1.25 -1.46 0.00 0.00 175.22 173.69 2cqv s PRO 14 N 0.38 4.24 0.82 10.12 0.04 -1.26 -5.02 135.00 144.32 2cqv s PRO 14 Ca 0.01 2.02 -0.10 0.00 0.04 0.00 0.00 61.00 62.97 2cqv s PRO 14 Cb -0.05 -3.70 0.12 0.00 0.04 0.00 0.00 34.50 30.92 2cqv s PRO 14 CO -0.04 -0.67 1.15 -1.21 0.04 0.00 0.00 177.00 176.26 2cqv s GLU 15 N 2.94 1.54 -0.45 4.56 8.01 -1.26 -4.64 118.70 129.41 2cqv s GLU 15 Ca 0.66 -0.36 -0.41 0.00 0.01 0.00 0.00 54.97 54.87 2cqv s GLU 15 Cb -0.32 -2.04 -0.17 0.00 -4.31 0.00 0.00 34.13 27.29 2cqv s GLU 15 CO 0.26 -1.74 1.62 -3.47 0.01 0.00 0.00 175.26 171.94 2cqv n ASP 16 N -3.28 0.92 -3.83 -0.19 -0.08 -1.26 -4.77 116.55 104.06 2cqv n ASP 16 Ca 0.12 0.88 -0.18 0.00 -1.51 0.00 0.00 54.79 54.09 2cqv n ASP 16 Cb 0.60 -0.79 -0.09 0.00 2.34 0.00 0.00 41.12 43.18 2cqv n ASP 16 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2cqv s GLN 17 N 3.75 1.60 0.37 -0.67 -2.07 -0.81 -4.98 119.66 116.85 2cqv s GLN 17 Ca 0.99 -1.92 0.06 0.00 -1.82 0.00 0.00 55.36 52.68 2cqv s GLN 17 Cb -1.34 0.06 -0.07 0.00 -1.09 0.00 0.00 33.01 30.57 2cqv s GLN 17 CO 0.67 -0.51 0.01 0.21 -1.32 0.00 0.00 175.29 174.36 2cqv s LYS 18 N -3.75 1.82 -0.28 9.60 2.20 -1.26 -2.63 119.74 125.44 2cqv s LYS 18 Ca 0.37 -2.01 -0.22 0.00 -0.36 0.00 0.00 55.97 53.76 2cqv s LYS 18 Cb 0.04 -1.37 0.09 0.00 -1.51 0.00 0.00 37.83 35.08 2cqv s LYS 18 CO 0.20 -0.06 0.77 0.54 -0.36 0.00 0.00 175.35 176.44 2cqv s VAL 19 N -2.90 0.00 0.26 4.02 0.11 -0.25 -4.89 120.40 116.75 2cqv s VAL 19 Ca 0.35 0.00 -0.29 0.00 -2.93 0.00 0.00 61.98 59.10 2cqv s VAL 19 Cb 0.08 -1.00 -0.09 0.00 -1.53 0.00 0.00 36.38 33.84 2cqv s VAL 19 CO 0.17 0.00 1.17 -0.13 -3.33 0.00 0.00 175.10 172.97 2cqv s ARG 20 N 0.82 4.54 -0.28 1.54 1.81 -1.26 -1.56 118.95 124.56 2cqv s ARG 20 Ca -0.03 1.91 -0.32 0.00 -1.72 0.00 0.00 55.73 55.56 2cqv s ARG 20 Cb -0.05 -3.18 -0.09 0.00 -0.45 0.00 0.00 34.95 31.18 2cqv s ARG 20 CO -0.08 0.05 2.19 0.00 -0.68 0.00 0.00 175.30 176.78 2cqv n ALA 21 N 1.51 1.37 0.00 2.13 0.00 0.78 -0.47 120.51 125.83 2cqv n ALA 21 Ca 0.01 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.32 2cqv n ALA 21 Cb 0.44 -2.70 0.00 0.00 0.00 0.00 0.00 19.45 17.19 2cqv n ALA 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cqv n GLY 22 N 6.12 2.58 1.80 0.00 0.00 0.11 -4.86 105.19 110.94 2cqv n GLY 22 Ca 0.36 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.22 2cqv n GLY 22 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2cqv n GLU 23 N -0.58 -2.21 -4.73 1.61 -0.58 0.38 -3.63 120.64 110.90 2cqv n GLU 23 Ca 0.00 -0.90 -0.26 0.00 -0.42 0.00 0.00 57.16 55.59 2cqv n GLU 23 Cb 0.00 -0.86 -0.16 0.00 -0.57 0.00 0.00 31.44 29.85 2cqv n GLU 23 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 2cqv s SER 24 N -3.00 2.03 0.19 1.62 0.01 -1.26 -1.60 113.70 111.68 2cqv s SER 24 Ca 0.37 -0.34 0.10 0.00 1.31 0.00 0.00 55.95 57.38 2cqv s SER 24 Cb -0.04 -0.83 -0.04 0.00 0.21 0.00 0.00 66.02 65.32 2cqv s SER 24 CO 0.28 0.08 -0.16 0.54 0.41 0.00 0.00 173.24 174.39 2cqv s VAL 25 N 0.44 2.80 -0.30 3.43 0.11 -1.00 -4.96 120.40 120.92 2cqv s VAL 25 Ca -0.12 -1.83 -0.02 0.00 -2.93 0.00 0.00 61.98 57.08 2cqv s VAL 25 Cb -0.15 -2.37 0.10 0.00 -1.53 0.00 0.00 36.38 32.43 2cqv s VAL 25 CO 0.04 -0.11 0.10 -1.61 -3.33 0.00 0.00 175.10 170.19 2cqv s GLU 26 N -2.75 0.54 -0.42 1.54 2.02 -1.26 -1.25 118.70 117.12 2cqv s GLU 26 Ca 0.23 -0.86 -0.15 0.00 0.02 0.00 0.00 54.97 54.21 2cqv s GLU 26 Cb -0.08 -1.74 0.03 0.00 0.10 0.00 0.00 34.13 32.44 2cqv s GLU 26 CO 0.13 -0.98 0.31 -0.51 0.02 0.00 0.00 175.26 174.23 2cqv s LEU 27 N 1.78 5.19 -0.14 1.80 1.43 -1.01 -4.89 118.68 122.85 2cqv s LEU 27 Ca 0.09 -1.00 0.02 0.00 -1.03 0.00 0.00 54.13 52.21 2cqv s LEU 27 Cb -0.17 -2.15 0.00 0.00 0.03 0.00 0.00 46.19 43.90 2cqv s LEU 27 CO -0.28 -0.49 -0.19 0.12 0.23 0.00 0.00 176.35 175.74 2cqv s PHE 28 N 1.66 2.70 -0.47 0.29 5.36 -1.26 0.21 117.98 126.47 2cqv s PHE 28 Ca 0.05 -1.09 -0.05 0.00 -0.96 0.00 0.00 56.93 54.88 2cqv s PHE 28 Cb -0.20 -1.82 0.12 0.00 -0.34 0.00 0.00 43.02 40.78 2cqv s PHE 28 CO 0.09 -0.47 0.30 0.20 -1.46 0.00 0.00 175.22 173.88 2cqv s GLY 29 N 0.65 2.11 0.30 13.12 0.00 -0.46 -4.32 107.32 118.72 2cqv s GLY 29 Ca -0.10 -2.67 -0.29 0.00 0.00 0.00 0.00 44.72 41.66 2cqv s GLY 29 CO 0.02 1.07 1.48 1.25 0.00 0.00 0.00 173.10 176.92 2cqv s LYS 30 N 0.99 4.20 0.02 2.90 2.20 -0.78 -3.66 119.74 125.61 2cqv s LYS 30 Ca 0.09 2.44 0.06 0.00 -0.36 0.00 0.00 55.97 58.19 2cqv s LYS 30 Cb -0.23 -3.05 -0.02 0.00 -1.51 0.00 0.00 37.83 33.02 2cqv s LYS 30 CO -0.03 -0.48 -0.17 0.14 -0.36 0.00 0.00 175.35 174.45 2cqv s VAL 31 N -0.39 1.35 0.00 4.02 -7.23 0.47 -2.98 120.40 115.64 2cqv s VAL 31 Ca 0.58 -0.94 0.00 0.00 -1.81 0.00 0.00 61.98 59.81 2cqv s VAL 31 Cb -0.44 -1.17 0.00 0.00 0.56 0.00 0.00 36.38 35.33 2cqv s VAL 31 CO 0.50 0.21 0.00 1.07 -0.31 0.00 0.00 175.10 176.57 2cqv n THR 32 N 2.20 0.00 0.00 5.32 5.66 -1.11 -4.71 114.28 121.64 2cqv n THR 32 Ca -0.16 0.11 0.00 0.00 -3.05 0.00 0.00 64.05 60.94 2cqv n THR 32 Cb 0.54 -1.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.32 2cqv n THR 32 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2cqv n GLY 33 N 2.70 0.95 2.89 1.09 0.00 -1.26 -3.99 105.19 107.57 2cqv n GLY 33 Ca 0.00 -0.10 -0.30 0.00 0.00 0.00 0.00 46.02 45.62 2cqv n GLY 33 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2cqv s THR 34 N 0.00 1.72 0.66 2.61 2.01 -1.26 -4.93 115.64 116.46 2cqv s THR 34 Ca 0.00 -2.04 -0.17 0.00 0.31 0.00 0.00 61.69 59.79 2cqv s THR 34 Cb 0.00 -2.28 0.00 0.00 0.01 0.00 0.00 72.50 70.23 2cqv s THR 34 CO 0.00 -0.65 1.23 -1.10 -0.69 0.00 0.00 174.62 173.41 2cqv s GLN 35 N 1.09 2.53 0.63 4.92 -1.52 -1.26 -4.36 119.66 121.70 2cqv s GLN 35 Ca 0.11 1.85 -0.16 0.00 -1.95 0.00 0.00 55.36 55.21 2cqv s GLN 35 Cb -0.19 -1.87 -0.01 0.00 -0.22 0.00 0.00 33.01 30.72 2cqv s GLN 35 CO -0.14 -1.56 1.11 -1.25 -0.25 0.00 0.00 175.29 173.21 2cqv s PRO 36 N -3.59 2.93 -0.05 2.91 0.04 -1.26 -5.11 135.00 130.87 2cqv s PRO 36 Ca 0.77 1.44 0.02 0.00 0.04 0.00 0.00 61.00 63.27 2cqv s PRO 36 Cb -0.32 -1.96 0.01 0.00 0.04 0.00 0.00 34.50 32.28 2cqv s PRO 36 CO 0.40 -1.16 -0.08 0.42 0.04 0.00 0.00 177.00 176.62 2cqv s ILE 37 N -2.21 0.81 0.58 0.56 1.01 -1.26 -4.66 121.20 116.02 2cqv s ILE 37 Ca 0.68 -0.31 -0.16 0.00 0.00 0.00 0.00 60.65 60.86 2cqv s ILE 37 Cb -0.21 -0.76 -0.04 0.00 0.01 0.00 0.00 42.46 41.45 2cqv s ILE 37 CO 0.38 0.27 1.05 -0.89 0.00 0.00 0.00 174.94 175.76 2cqv s THR 38 N 0.63 3.81 -0.09 2.92 2.01 0.32 -4.85 115.64 120.40 2cqv s THR 38 Ca -0.11 0.90 -0.06 0.00 0.31 0.00 0.00 61.69 62.73 2cqv s THR 38 Cb -0.13 -3.40 0.03 0.00 0.01 0.00 0.00 72.50 69.01 2cqv s THR 38 CO 0.02 -0.47 0.21 0.00 -0.69 0.00 0.00 174.62 173.69 2cqv s THR 40 N 0.68 0.01 -0.16 0.00 2.01 0.18 -4.98 115.64 113.38 2cqv s THR 40 Ca -0.05 -0.05 -0.04 0.00 0.31 0.00 0.00 61.69 61.87 2cqv s THR 40 Cb -0.06 -0.10 -0.03 0.00 0.01 0.00 0.00 72.50 72.32 2cqv s THR 40 CO -0.04 -0.03 -0.03 0.26 -0.69 0.00 0.00 174.62 174.09 2cqv s TRP 41 N -0.05 3.03 0.06 4.92 0.52 -1.26 0.15 118.94 126.30 2cqv s TRP 41 Ca -0.01 -0.31 0.01 0.00 0.02 0.00 0.00 56.10 55.81 2cqv s TRP 41 Cb -0.01 -1.97 -0.03 0.00 -1.15 0.00 0.00 33.47 30.31 2cqv s TRP 41 CO 0.00 -0.05 -0.05 -1.64 0.02 0.00 0.00 176.95 175.23 2cqv s MET 42 N 0.42 0.63 -0.04 4.98 -1.94 -0.46 -0.23 119.30 122.65 2cqv s MET 42 Ca -0.04 -1.07 -0.00 0.00 -1.71 0.00 0.00 55.69 52.87 2cqv s MET 42 Cb -0.14 -0.06 0.03 0.00 2.01 0.00 0.00 34.83 36.67 2cqv s MET 42 CO 0.03 -0.03 -0.00 0.21 -0.01 0.00 0.00 175.02 175.21 2cqv s LYS 43 N -3.02 0.43 -1.26 2.03 2.20 -0.19 -0.15 119.74 119.77 2cqv s LYS 43 Ca 0.02 0.08 -0.01 0.00 -0.36 0.00 0.00 55.97 55.70 2cqv s LYS 43 Cb 0.01 -0.67 -0.00 0.00 -1.51 0.00 0.00 37.83 35.65 2cqv s LYS 43 CO -0.05 -0.19 0.79 1.19 -0.36 0.00 0.00 175.35 176.74 2cqv n PHE 44 N 4.49 -2.01 -3.77 4.03 3.01 -1.15 -1.87 117.46 120.19 2cqv n PHE 44 Ca -0.19 0.86 -0.27 0.00 1.01 0.00 0.00 57.45 58.86 2cqv n PHE 44 Cb 0.50 -4.56 0.05 0.00 -0.01 0.00 0.00 39.48 35.46 2cqv n PHE 44 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 2cqv n ARG 45 N -4.19 -6.30 -3.32 -1.08 5.12 -1.26 -4.97 116.66 100.67 2cqv n ARG 45 Ca -0.28 0.68 -0.08 0.00 -1.93 0.00 0.00 57.85 56.24 2cqv n ARG 45 Cb 0.67 -5.60 -0.07 0.00 -1.16 0.00 0.00 32.46 26.30 2cqv n ARG 45 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 2cqv s LYS 46 N -6.41 0.39 0.16 5.56 2.20 -0.78 -5.13 119.74 115.73 2cqv s LYS 46 Ca 0.54 0.36 -0.32 0.00 -0.36 0.00 0.00 55.97 56.19 2cqv s LYS 46 Cb -0.26 -0.34 -0.17 0.00 -1.51 0.00 0.00 37.83 35.55 2cqv s LYS 46 CO 0.79 -0.84 0.90 0.94 -0.36 0.00 0.00 175.35 176.78 2cqv n GLN 47 N 5.36 0.52 -2.55 4.03 7.27 -1.26 -1.03 117.38 129.73 2cqv n GLN 47 Ca -0.01 0.18 -0.33 0.00 0.07 0.00 0.00 57.00 56.91 2cqv n GLN 47 Cb 0.50 -1.49 -0.04 0.00 2.41 0.00 0.00 30.24 31.62 2cqv n GLN 47 CO 0.00 0.00 0.00 0.42 0.07 0.00 0.00 177.06 177.55 2cqv s ILE 48 N -0.54 4.08 -0.19 1.69 1.01 0.68 -4.76 121.20 123.16 2cqv s ILE 48 Ca 0.72 1.21 -0.03 0.00 0.00 0.00 0.00 60.65 62.55 2cqv s ILE 48 Cb -0.95 -3.52 -0.01 0.00 0.01 0.00 0.00 42.46 37.98 2cqv s ILE 48 CO 0.55 -0.36 -0.06 0.00 0.00 0.00 0.00 174.94 175.07 2cqv s GLN 49 N -3.44 3.41 0.28 2.79 -2.07 -1.26 -4.92 119.66 114.45 2cqv s GLN 49 Ca 0.64 -0.63 -0.30 0.00 -1.82 0.00 0.00 55.36 53.26 2cqv s GLN 49 Cb -0.13 -2.91 -0.13 0.00 -1.09 0.00 0.00 33.01 28.75 2cqv s GLN 49 CO 0.21 -0.06 1.36 0.39 -1.32 0.00 0.00 175.29 175.88 2cqv n GLU 50 N 4.37 2.09 -3.76 9.60 1.02 -1.26 -4.66 120.64 128.05 2cqv n GLU 50 Ca -0.18 0.74 0.00 0.00 -0.02 0.00 0.00 57.16 57.70 2cqv n GLU 50 Cb 0.51 -2.37 0.00 0.00 -0.02 0.00 0.00 31.44 29.57 2cqv n GLU 50 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2cqv s SER 51 N 0.04 -0.05 0.00 1.62 1.04 0.17 -4.93 113.70 111.59 2cqv s SER 51 Ca 0.63 -0.27 0.05 0.00 0.48 0.00 0.00 55.95 56.84 2cqv s SER 51 Cb -0.61 0.26 0.28 0.00 0.10 0.00 0.00 66.02 66.04 2cqv s SER 51 CO 0.55 -0.49 0.97 -1.84 0.98 0.00 0.00 173.24 173.41 2cqv n GLU 52 N -0.62 0.09 -0.09 4.02 0.28 -1.26 -1.48 120.64 121.59 2cqv n GLU 52 Ca -0.05 0.19 -0.11 0.00 -0.16 0.00 0.00 57.16 57.04 2cqv n GLU 52 Cb 0.61 -1.50 -0.10 0.00 1.43 0.00 0.00 31.44 31.88 2cqv n GLU 52 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 2cqv n HIS 53 N -1.23 0.00 -3.72 -1.84 8.25 -1.26 -4.46 115.22 110.96 2cqv n HIS 53 Ca 0.03 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.22 2cqv n HIS 53 Cb 0.04 -0.74 -0.17 0.00 1.12 0.00 0.00 29.99 30.24 2cqv n HIS 53 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 2cqv s MET 54 N -2.37 0.55 0.47 -0.41 -1.94 -0.55 -0.73 119.30 114.31 2cqv s MET 54 Ca -0.17 -0.34 0.02 0.00 -1.71 0.00 0.00 55.69 53.48 2cqv s MET 54 Cb 0.06 -2.02 0.09 0.00 2.01 0.00 0.00 34.83 34.97 2cqv s MET 54 CO 0.52 -0.63 0.64 1.63 -0.01 0.00 0.00 175.02 177.17 2cqv n LYS 55 N 5.09 0.32 -3.62 2.03 4.76 0.29 0.41 118.16 127.45 2cqv n LYS 55 Ca -0.09 -1.95 -0.02 0.00 -2.87 0.00 0.00 58.31 53.38 2cqv n LYS 55 Cb 0.48 -0.36 -0.05 0.00 -1.84 0.00 0.00 35.03 33.26 2cqv n LYS 55 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2cqv s VAL 56 N -1.85 -0.67 -0.89 -0.18 1.01 -1.26 -3.78 120.40 112.77 2cqv s VAL 56 Ca 0.44 0.00 -0.01 0.00 0.00 0.00 0.00 61.98 62.41 2cqv s VAL 56 Cb -0.03 -1.00 0.23 0.00 0.00 0.00 0.00 36.38 35.58 2cqv s VAL 56 CO 0.29 0.00 0.84 1.21 0.00 0.00 0.00 175.10 177.44 2cqv n GLU 57 N 5.06 2.77 -2.56 2.72 2.13 0.77 -4.92 120.64 126.61 2cqv n GLU 57 Ca -0.14 -4.50 -0.42 0.00 0.66 0.00 0.00 57.16 52.75 2cqv n GLU 57 Cb 0.52 -2.41 -0.03 0.00 0.27 0.00 0.00 31.44 29.80 2cqv n GLU 57 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 2cqv s ASN 58 N -0.50 7.14 0.30 4.31 2.20 -1.26 -1.71 114.94 125.42 2cqv s ASN 58 Ca 0.29 1.69 -0.08 0.00 -0.94 0.00 0.00 52.86 53.83 2cqv s ASN 58 Cb -0.04 -2.56 0.03 0.00 -2.00 0.00 0.00 41.25 36.68 2cqv s ASN 58 CO -0.10 -0.52 0.54 -1.20 -2.94 0.00 0.00 177.10 172.88 2cqv n SER 59 N 5.06 -1.55 0.02 3.54 7.64 0.76 -4.99 113.62 124.09 2cqv n SER 59 Ca 0.10 -2.36 -0.01 0.00 1.01 0.00 0.00 58.87 57.62 2cqv n SER 59 Cb 0.47 2.66 -0.00 0.00 -1.01 0.00 0.00 64.21 66.33 2cqv n SER 59 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 2cqv h GLU 60 N 0.00 -0.04 -1.16 1.43 4.81 -1.94 -2.66 114.58 115.02 2cqv h GLU 60 Ca -0.25 0.00 0.40 0.00 -0.13 0.00 0.00 59.36 59.39 2cqv h GLU 60 Cb 0.97 0.01 -0.12 0.00 0.63 0.00 0.00 28.75 30.24 2cqv h GLU 60 CO 0.32 -0.03 0.74 0.09 -0.73 0.00 0.00 179.01 179.41 2cqv n ASN 61 N -2.22 0.18 0.00 1.04 4.13 -1.26 -4.74 115.26 112.39 2cqv n ASN 61 Ca -0.01 1.18 0.00 0.00 1.68 0.00 0.00 54.58 57.43 2cqv n ASN 61 Cb 0.02 -0.58 0.00 0.00 -1.54 0.00 0.00 39.78 37.68 2cqv n ASN 61 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2cqv n GLY 62 N -1.44 -0.55 3.32 7.41 0.00 -1.00 -0.39 105.19 112.54 2cqv n GLY 62 Ca 0.34 -0.14 -0.14 0.00 0.00 0.00 0.00 46.02 46.09 2cqv n GLY 62 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2cqv s SER 63 N -4.00 -0.39 0.20 1.61 0.15 -1.24 -0.17 113.70 109.86 2cqv s SER 63 Ca 0.00 0.59 0.11 0.00 0.70 0.00 0.00 55.95 57.35 2cqv s SER 63 Cb 0.00 0.65 -0.04 0.00 -1.71 0.00 0.00 66.02 64.92 2cqv s SER 63 CO 0.00 -0.31 -0.23 -0.75 1.20 0.00 0.00 173.24 173.15 2cqv s LYS 64 N -0.47 1.51 -0.37 5.44 2.20 -0.70 -1.36 119.74 126.00 2cqv s LYS 64 Ca -0.06 -1.54 0.01 0.00 -0.36 0.00 0.00 55.97 54.02 2cqv s LYS 64 Cb -0.03 -1.79 0.12 0.00 -1.51 0.00 0.00 37.83 34.61 2cqv s LYS 64 CO 0.03 0.38 0.18 -1.17 -0.36 0.00 0.00 175.35 174.41 2cqv s LEU 65 N -2.75 2.26 -0.36 5.43 2.96 0.13 -0.16 118.68 126.19 2cqv s LEU 65 Ca 0.21 -2.15 -0.25 0.00 -0.22 0.00 0.00 54.13 51.72 2cqv s LEU 65 Cb -0.07 -0.88 0.01 0.00 0.50 0.00 0.00 46.19 45.75 2cqv s LEU 65 CO 0.10 -0.33 0.86 -0.89 -1.32 0.00 0.00 176.35 174.76 2cqv s THR 66 N 0.98 4.66 -0.27 3.68 2.01 -1.25 -2.42 115.64 123.04 2cqv s THR 66 Ca 0.14 1.06 -0.13 0.00 0.31 0.00 0.00 61.69 63.08 2cqv s THR 66 Cb -0.21 -4.27 -0.04 0.00 0.01 0.00 0.00 72.50 67.98 2cqv s THR 66 CO -0.10 -0.48 0.27 -0.63 -0.69 0.00 0.00 174.62 173.00 2cqv s ILE 67 N 3.28 5.25 0.06 1.82 1.01 -0.38 -0.54 121.20 131.70 2cqv s ILE 67 Ca 0.35 0.37 -0.05 0.00 0.00 0.00 0.00 60.65 61.32 2cqv s ILE 67 Cb -0.13 -3.61 -0.05 0.00 0.01 0.00 0.00 42.46 38.69 2cqv s ILE 67 CO 0.17 0.22 0.29 -0.76 0.00 0.00 0.00 174.94 174.87 2cqv s LEU 68 N 1.79 4.34 -1.33 2.97 2.01 0.09 -2.37 118.68 126.17 2cqv s LEU 68 Ca 0.11 0.51 -0.08 0.00 0.01 0.00 0.00 54.13 54.67 2cqv s LEU 68 Cb -0.16 -2.94 0.00 0.00 0.01 0.00 0.00 46.19 43.11 2cqv s LEU 68 CO 0.10 0.17 0.50 0.00 1.01 0.00 0.00 176.35 178.13 2cqv n ALA 69 N 0.61 -2.20 -0.91 4.21 0.00 -1.16 -4.60 120.51 116.46 2cqv n ALA 69 Ca -0.07 -0.31 -0.41 0.00 0.00 0.00 0.00 53.44 52.66 2cqv n ALA 69 Cb 0.52 -2.17 -0.09 0.00 0.00 0.00 0.00 19.45 17.72 2cqv n ALA 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2cqv n ALA 70 N -4.43 0.16 -2.49 0.00 0.00 -0.62 -4.24 120.51 108.89 2cqv n ALA 70 Ca -0.24 0.09 -0.31 0.00 0.00 0.00 0.00 53.44 52.98 2cqv n ALA 70 Cb 0.65 -1.49 -0.05 0.00 0.00 0.00 0.00 19.45 18.57 2cqv n ALA 70 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2cqv s ARG 71 N 4.51 3.72 0.58 0.00 0.52 -1.26 0.05 118.95 127.07 2cqv s ARG 71 Ca 0.86 0.13 0.28 0.00 -0.52 0.00 0.00 55.73 56.49 2cqv s ARG 71 Cb -1.04 -2.69 1.50 0.00 0.52 0.00 0.00 34.95 33.24 2cqv s ARG 71 CO 0.45 0.32 1.95 0.37 0.02 0.00 0.00 175.30 178.41 2cqv h GLN 72 N 2.36 0.00 -0.17 3.54 4.15 -1.93 0.12 115.11 123.18 2cqv h GLN 72 Ca -0.47 0.00 -0.20 0.00 0.77 0.00 0.00 58.65 58.75 2cqv h GLN 72 Cb 1.17 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.87 2cqv h GLN 72 CO 0.69 0.00 -0.69 1.05 -1.93 0.00 0.00 178.83 177.95 2cqv h GLU 73 N 0.00 0.70 -1.38 1.69 -0.00 -1.98 -3.03 114.58 110.58 2cqv h GLU 73 Ca 0.21 -0.52 0.40 0.00 -0.00 0.00 0.00 59.36 59.45 2cqv h GLU 73 Cb 1.06 0.09 -0.07 0.00 -0.00 0.00 0.00 28.75 29.83 2cqv h GLU 73 CO -0.00 1.14 0.97 0.45 -0.00 0.00 0.00 179.01 181.57 2cqv h HIS 74 N 0.50 0.17 -1.40 2.06 3.86 -1.13 -3.39 115.15 115.82 2cqv h HIS 74 Ca -0.02 0.01 -0.68 0.00 -1.16 0.00 0.00 60.37 58.51 2cqv h HIS 74 Cb 1.29 -0.05 -0.00 0.00 1.06 0.00 0.00 27.41 29.71 2cqv h HIS 74 CO 0.07 -0.03 1.21 0.00 0.86 0.00 0.00 177.93 180.04 2cqv n GLY 76 N 5.46 -0.76 3.04 0.00 0.00 -1.01 -4.98 105.19 106.94 2cqv n GLY 76 Ca 0.33 -0.34 -0.27 0.00 0.00 0.00 0.00 46.02 45.74 2cqv n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cqv s TYR 78 N 0.91 2.87 -0.19 0.00 1.51 -0.96 -2.93 117.35 118.56 2cqv s TYR 78 Ca -0.09 -0.37 -0.06 0.00 -1.01 0.00 0.00 57.07 55.55 2cqv s TYR 78 Cb -0.15 -2.15 0.09 0.00 -0.11 0.00 0.00 41.96 39.64 2cqv s TYR 78 CO 0.00 -0.16 0.38 0.99 -1.11 0.00 0.00 175.55 175.65 2cqv s THR 79 N -2.33 -0.60 -0.38 -0.71 2.01 0.79 -2.65 115.64 111.77 2cqv s THR 79 Ca 0.49 0.16 -0.16 0.00 0.31 0.00 0.00 61.69 62.49 2cqv s THR 79 Cb -0.08 -0.64 0.01 0.00 0.01 0.00 0.00 72.50 71.80 2cqv s THR 79 CO 0.30 0.06 0.40 -0.22 -0.69 0.00 0.00 174.62 174.47 2cqv s LEU 80 N 2.57 4.68 -0.27 4.42 2.96 -1.23 -1.35 118.68 130.46 2cqv s LEU 80 Ca 0.00 -0.48 -0.13 0.00 -0.22 0.00 0.00 54.13 53.30 2cqv s LEU 80 Cb -0.12 -2.36 -0.04 0.00 0.50 0.00 0.00 46.19 44.17 2cqv s LEU 80 CO -0.12 -0.46 0.29 -0.22 -1.32 0.00 0.00 176.35 174.51 2cqv s LEU 81 N 2.06 4.04 -0.39 -0.68 2.96 0.12 -2.14 118.68 124.66 2cqv s LEU 81 Ca 0.12 0.17 0.00 0.00 -0.22 0.00 0.00 54.13 54.20 2cqv s LEU 81 Cb -0.17 -2.29 0.11 0.00 0.50 0.00 0.00 46.19 44.34 2cqv s LEU 81 CO 0.13 -0.11 0.14 0.68 -1.32 0.00 0.00 176.35 175.87 2cqv s VAL 82 N 1.84 2.83 0.15 1.68 -7.23 0.68 0.52 120.40 120.87 2cqv s VAL 82 Ca 0.12 -2.25 -0.00 0.00 -1.81 0.00 0.00 61.98 58.03 2cqv s VAL 82 Cb -0.16 -2.99 -0.04 0.00 0.56 0.00 0.00 36.38 33.75 2cqv s VAL 82 CO 0.10 -0.66 0.32 -1.61 -0.31 0.00 0.00 175.10 172.94 2cqv s GLU 83 N 0.96 3.50 0.20 4.82 2.02 -0.90 -0.77 118.70 128.53 2cqv s GLU 83 Ca 0.10 -0.38 -0.05 0.00 0.02 0.00 0.00 54.97 54.66 2cqv s GLU 83 Cb -0.21 -2.91 0.02 0.00 0.10 0.00 0.00 34.13 31.12 2cqv s GLU 83 CO -0.06 0.49 0.34 0.27 0.02 0.00 0.00 175.26 176.32 2cqv n ASN 84 N -0.31 -0.99 -0.21 -0.19 6.94 0.14 0.12 115.26 120.76 2cqv n ASN 84 Ca -0.05 -1.89 -0.03 0.00 -0.02 0.00 0.00 54.58 52.60 2cqv n ASN 84 Cb 0.53 1.71 0.08 0.00 -2.36 0.00 0.00 39.78 39.74 2cqv n ASN 84 CO 0.00 0.00 0.00 0.50 -1.03 0.00 0.00 177.26 176.73 2cqv h LYS 85 N 0.00 0.65 0.00 -3.83 1.63 -1.86 -3.28 116.57 109.88 2cqv h LYS 85 Ca -0.16 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.60 2cqv h LYS 85 Cb 0.63 -0.15 0.00 0.00 -0.60 0.00 0.00 32.23 32.11 2cqv h LYS 85 CO 0.21 0.43 0.00 1.28 -3.45 0.00 0.00 179.45 177.92 2cqv n LEU 86 N -4.79 0.29 0.00 5.20 4.77 -1.26 -5.05 117.00 116.16 2cqv n LEU 86 Ca 0.07 0.68 0.00 0.00 -0.03 0.00 0.00 56.01 56.73 2cqv n LEU 86 Cb 0.14 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 40.85 2cqv n LEU 86 CO 0.30 -0.38 0.00 0.61 -1.33 0.00 0.00 177.39 176.59 2cqv n GLY 87 N 0.29 4.57 3.49 -0.72 0.00 -1.24 -4.82 105.19 106.77 2cqv n GLY 87 Ca 0.00 -0.50 -0.14 0.00 0.00 0.00 0.00 46.02 45.38 2cqv n GLY 87 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cqv s SER 88 N 1.41 -0.56 0.14 1.61 1.04 -1.26 0.26 113.70 116.35 2cqv s SER 88 Ca 0.00 0.35 0.04 0.00 0.48 0.00 0.00 55.95 56.82 2cqv s SER 88 Cb 0.00 0.52 -0.04 0.00 0.10 0.00 0.00 66.02 66.59 2cqv s SER 88 CO 0.00 -0.71 -0.08 -0.60 0.98 0.00 0.00 173.24 172.83 2cqv s ARG 89 N -2.29 1.03 -0.05 4.02 6.06 0.05 -4.75 118.95 123.03 2cqv s ARG 89 Ca -0.04 -1.45 -0.04 0.00 -2.50 0.00 0.00 55.73 51.70 2cqv s ARG 89 Cb -0.01 -0.50 0.02 0.00 0.06 0.00 0.00 34.95 34.52 2cqv s ARG 89 CO -0.01 0.03 0.13 1.14 -2.50 0.00 0.00 175.30 174.09 2cqv s GLN 90 N -3.79 0.14 0.45 5.12 -2.07 -1.26 -0.23 119.66 118.03 2cqv s GLN 90 Ca 0.17 0.22 0.01 0.00 -1.82 0.00 0.00 55.36 53.94 2cqv s GLN 90 Cb 0.04 0.03 0.01 0.00 -1.09 0.00 0.00 33.01 31.99 2cqv s GLN 90 CO 0.00 -0.05 0.07 0.00 -1.32 0.00 0.00 175.29 174.00 2cqv n ALA 91 N 3.23 0.45 -3.61 2.60 0.00 -0.91 -4.93 120.51 117.34 2cqv n ALA 91 Ca -0.15 -1.97 -0.10 0.00 0.00 0.00 0.00 53.44 51.22 2cqv n ALA 91 Cb 0.58 1.02 -0.09 0.00 0.00 0.00 0.00 19.45 20.96 2cqv n ALA 91 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2cqv s GLN 92 N -3.66 0.58 -0.07 0.00 -0.21 -1.26 -3.51 119.66 111.52 2cqv s GLN 92 Ca 0.05 0.93 -0.03 0.00 0.02 0.00 0.00 55.36 56.34 2cqv s GLN 92 Cb -0.00 0.13 0.04 0.00 1.00 0.00 0.00 33.01 34.18 2cqv s GLN 92 CO 0.03 -0.13 0.12 0.54 -2.12 0.00 0.00 175.29 173.73 2cqv s VAL 93 N 1.15 -0.19 0.11 1.09 0.11 -1.08 -4.88 120.40 116.70 2cqv s VAL 93 Ca -0.07 0.34 -0.30 0.00 -2.93 0.00 0.00 61.98 59.03 2cqv s VAL 93 Cb -0.06 -0.26 -0.06 0.00 -1.53 0.00 0.00 36.38 34.47 2cqv s VAL 93 CO -0.11 0.13 0.95 0.20 -3.33 0.00 0.00 175.10 172.93 2cqv s ASN 94 N 2.23 7.48 0.14 3.54 0.01 -1.26 -2.26 114.94 124.82 2cqv s ASN 94 Ca 0.04 1.77 0.09 0.00 -0.71 0.00 0.00 52.86 54.05 2cqv s ASN 94 Cb -0.12 -2.58 -0.04 0.00 0.41 0.00 0.00 41.25 38.92 2cqv s ASN 94 CO -0.05 -0.06 -0.22 -0.22 -1.51 0.00 0.00 177.10 175.04 2cqv s LEU 95 N -0.01 2.36 -0.03 0.60 2.96 0.65 -1.92 118.68 123.30 2cqv s LEU 95 Ca 0.46 -0.77 0.01 0.00 -0.22 0.00 0.00 54.13 53.60 2cqv s LEU 95 Cb -0.23 -0.98 0.02 0.00 0.50 0.00 0.00 46.19 45.50 2cqv s LEU 95 CO 0.29 0.07 -0.01 -0.89 -1.32 0.00 0.00 176.35 174.49 2cqv s THR 96 N -1.45 0.23 -0.17 3.68 2.01 -1.08 -2.41 115.64 116.44 2cqv s THR 96 Ca 0.13 0.03 -0.08 0.00 0.31 0.00 0.00 61.69 62.08 2cqv s THR 96 Cb -0.09 -0.29 -0.04 0.00 0.01 0.00 0.00 72.50 72.08 2cqv s THR 96 CO 0.06 0.14 0.11 -0.69 -0.69 0.00 0.00 174.62 173.55 2cqv s VAL 97 N 0.85 5.24 -0.10 3.82 1.01 -1.26 -1.09 120.40 128.88 2cqv s VAL 97 Ca -0.09 0.12 -0.00 0.00 0.00 0.00 0.00 61.98 62.01 2cqv s VAL 97 Cb -0.12 -3.35 0.02 0.00 0.00 0.00 0.00 36.38 32.93 2cqv s VAL 97 CO -0.01 0.50 -0.06 0.68 0.00 0.00 0.00 175.10 176.21 2cqv s VAL 98 N -0.03 0.84 -1.30 2.92 -7.23 -0.60 -4.89 120.40 110.10 2cqv s VAL 98 Ca 0.09 -0.18 0.14 0.00 -1.81 0.00 0.00 61.98 60.22 2cqv s VAL 98 Cb -0.12 -0.89 0.54 0.00 0.56 0.00 0.00 36.38 36.48 2cqv s VAL 98 CO 0.00 0.33 1.42 -0.67 -0.31 0.00 0.00 175.10 175.87 2cqv n ASP 99 N 4.90 3.67 -4.77 4.85 2.03 -1.26 -0.15 116.55 125.80 2cqv n ASP 99 Ca -0.12 -2.31 -0.38 0.00 0.52 0.00 0.00 54.79 52.50 2cqv n ASP 99 Cb 0.50 -0.49 -0.02 0.00 -0.72 0.00 0.00 41.12 40.39 2cqv n ASP 99 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2cqv s LYS 100 N -1.73 4.05 0.76 -0.67 1.02 -1.26 -4.92 119.74 116.99 2cqv s LYS 100 Ca 0.39 1.74 -0.11 0.00 0.02 0.00 0.00 55.97 58.01 2cqv s LYS 100 Cb 0.25 -2.61 0.05 0.00 -0.52 0.00 0.00 37.83 34.99 2cqv s LYS 100 CO 0.19 -0.29 1.09 -1.25 -0.92 0.00 0.00 175.35 174.17 2cqv s PRO 101 N -2.39 2.30 0.00 -1.68 0.04 -1.26 -4.96 135.00 127.06 2cqv s PRO 101 Ca 0.58 1.19 -0.01 0.00 0.04 0.00 0.00 61.00 62.79 2cqv s PRO 101 Cb -0.28 -1.90 -0.01 0.00 0.04 0.00 0.00 34.50 32.35 2cqv s PRO 101 CO 0.35 -1.61 0.01 0.34 0.04 0.00 0.00 177.00 176.13 2cqv s ASP 102 N -3.33 0.09 0.50 6.66 -1.08 -1.26 -5.15 116.67 113.10 2cqv s ASP 102 Ca 0.62 -0.21 -0.21 0.00 -0.52 0.00 0.00 52.55 52.22 2cqv s ASP 102 Cb -0.17 0.09 -0.07 0.00 -1.46 0.00 0.00 42.92 41.31 2cqv s ASP 102 CO 0.55 -0.17 1.15 -2.16 0.52 0.00 0.00 175.17 175.05 2cqv s PRO 103 N -0.77 3.57 -0.82 4.34 0.04 -1.26 -4.92 135.00 135.18 2cqv s PRO 103 Ca -0.08 1.69 -0.25 0.00 0.04 0.00 0.00 61.00 62.40 2cqv s PRO 103 Cb -0.05 -2.22 -0.04 0.00 0.04 0.00 0.00 34.50 32.23 2cqv s PRO 103 CO -0.00 -0.69 1.92 -1.25 0.04 0.00 0.00 177.00 177.02 2cqv s PRO 104 N -2.98 2.58 -0.91 0.56 0.04 -1.26 -4.88 135.00 128.16 2cqv s PRO 104 Ca 0.68 -0.04 -0.29 0.00 0.04 0.00 0.00 61.00 61.38 2cqv s PRO 104 Cb -0.26 -4.88 -0.20 0.00 0.04 0.00 0.00 34.50 29.20 2cqv s PRO 104 CO 0.31 -3.20 2.63 0.00 0.04 0.00 0.00 177.00 176.78 2cqv n ALA 105 N 13.64 0.41 -3.33 8.56 0.00 -1.26 -4.85 120.51 133.67 2cqv n ALA 105 Ca 0.35 -0.43 -0.15 0.00 0.00 0.00 0.00 53.44 53.21 2cqv n ALA 105 Cb 0.48 -2.45 -0.08 0.00 0.00 0.00 0.00 19.45 17.40 2cqv n ALA 105 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2cqv s GLY 106 N 9.34 -0.29 0.13 0.00 0.00 -1.26 -5.13 107.32 110.10 2cqv s GLY 106 Ca 1.29 0.67 -0.24 0.00 0.00 0.00 0.00 44.72 46.43 2cqv s GLY 106 CO 0.45 0.41 0.51 -0.37 0.00 0.00 0.00 173.10 174.10 2cqv n THR 107 N 1.20 1.29 -1.25 0.90 5.66 -1.26 -4.88 114.28 115.93 2cqv n THR 107 Ca -0.21 -0.32 -0.31 0.00 -3.05 0.00 0.00 64.05 60.16 2cqv n THR 107 Cb 0.56 0.00 0.09 0.00 -1.55 0.00 0.00 70.33 69.44 2cqv n THR 107 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 2cqv s PRO 108 N -0.65 2.19 -0.72 1.09 0.04 -1.26 -4.85 135.00 130.84 2cqv s PRO 108 Ca 0.56 1.15 -0.25 0.00 0.04 0.00 0.00 61.00 62.50 2cqv s PRO 108 Cb -0.80 -1.89 -0.14 0.00 0.04 0.00 0.00 34.50 31.71 2cqv s PRO 108 CO 0.45 -1.69 2.41 0.43 0.04 0.00 0.00 177.00 178.65 2cqv n SER 109 N -3.55 1.67 0.00 6.66 7.64 -1.26 -4.63 113.62 120.15 2cqv n SER 109 Ca 0.09 -1.08 0.00 0.00 1.01 0.00 0.00 58.87 58.89 2cqv n SER 109 Cb 0.53 -1.53 0.00 0.00 -1.01 0.00 0.00 64.21 62.20 2cqv n SER 109 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2cqv n GLY 110 N 6.47 -1.08 3.72 0.23 0.00 -1.26 -4.88 105.19 108.40 2cqv n GLY 110 Ca 0.46 -1.43 -0.42 0.00 0.00 0.00 0.00 46.02 44.64 2cqv n GLY 110 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cqv s PRO 111 N 0.00 4.35 -0.02 1.61 0.04 -1.26 -4.96 135.00 134.76 2cqv s PRO 111 Ca 0.00 2.04 -0.24 0.00 0.04 0.00 0.00 61.00 62.83 2cqv s PRO 111 Cb 0.00 -3.24 -0.18 0.00 0.04 0.00 0.00 34.50 31.12 2cqv s PRO 111 CO 0.00 -0.37 1.14 1.03 0.04 0.00 0.00 177.00 178.84 2cqv h SER 112 N 6.43 -0.15 -4.10 6.66 0.87 -1.89 -3.45 113.55 117.92 2cqv h SER 112 Ca -0.43 -0.36 -0.51 0.00 -1.23 0.00 0.00 61.79 59.26 2cqv h SER 112 Cb 1.21 0.04 0.20 0.00 -0.44 0.00 0.00 62.40 63.41 2cqv h SER 112 CO 0.84 0.32 0.16 -1.20 -0.53 0.00 0.00 176.83 176.41 2cqv n SER 113 N -4.95 -0.02 -0.85 6.23 7.64 -1.26 -5.17 113.62 115.24 2cqv n SER 113 Ca -0.09 0.34 0.12 0.00 1.01 0.00 0.00 58.87 60.26 2cqv n SER 113 Cb 0.26 -1.44 0.20 0.00 -1.01 0.00 0.00 64.21 62.22 2cqv n SER 113 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64