#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 -0.15 0.09 1.61 1.04 -1.26 -5.18 113.70 109.85 2cqv s SER 2 Ca 0.00 -0.79 0.06 0.00 0.48 0.00 0.00 55.95 55.70 2cqv s SER 2 Cb 0.00 0.62 -0.03 0.00 0.10 0.00 0.00 66.02 66.70 2cqv s SER 2 CO 0.00 -1.17 -0.15 -0.55 0.98 0.00 0.00 173.24 172.35 2cqv s SER 3 N -2.97 1.92 -0.23 7.02 0.15 -1.26 -5.14 113.70 113.18 2cqv s SER 3 Ca 0.18 -0.69 -0.08 0.00 0.70 0.00 0.00 55.95 56.05 2cqv s SER 3 Cb -0.02 -0.07 0.10 0.00 -1.71 0.00 0.00 66.02 64.32 2cqv s SER 3 CO 0.07 -0.08 0.50 -0.83 1.20 0.00 0.00 173.24 174.10 2cqv s GLY 4 N -2.01 -0.49 -0.57 9.45 0.00 -1.26 -5.04 107.32 107.39 2cqv s GLY 4 Ca 0.03 1.81 -0.03 0.00 0.00 0.00 0.00 44.72 46.53 2cqv s GLY 4 CO 0.03 2.58 2.36 -1.14 0.00 0.00 0.00 173.10 176.93 2cqv n SER 5 N 5.31 6.93 -0.10 1.64 3.41 -1.26 -4.32 113.62 125.22 2cqv n SER 5 Ca -0.11 -3.44 -0.15 0.00 -0.26 0.00 0.00 58.87 54.91 2cqv n SER 5 Cb 0.50 -1.13 -0.14 0.00 -0.26 0.00 0.00 64.21 63.18 2cqv n SER 5 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2cqv n SER 6 N 0.18 1.32 0.00 4.04 2.88 -1.26 -4.95 113.62 115.82 2cqv n SER 6 Ca 0.49 -0.04 0.00 0.00 -1.33 0.00 0.00 58.87 58.00 2cqv n SER 6 Cb 0.48 0.01 0.00 0.00 -0.75 0.00 0.00 64.21 63.94 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 2.04 1.01 3.77 0.46 0.00 -1.26 -3.79 105.19 107.42 2cqv n GLY 7 Ca -0.39 -0.89 -0.34 0.00 0.00 0.00 0.00 46.02 44.40 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 -2.00 3.17 -0.16 1.61 0.04 -1.26 -4.28 135.00 132.11 2cqv s PRO 8 Ca 0.00 1.53 -0.17 0.00 0.04 0.00 0.00 61.00 62.40 2cqv s PRO 8 Cb 0.00 -1.99 0.05 0.00 0.04 0.00 0.00 34.50 32.60 2cqv s PRO 8 CO 0.00 -0.98 0.48 1.14 0.04 0.00 0.00 177.00 177.68 2cqv s GLN 9 N -3.56 0.59 -0.57 4.56 -2.07 -1.26 -4.45 119.66 112.89 2cqv s GLN 9 Ca 0.71 0.59 -0.17 0.00 -1.82 0.00 0.00 55.36 54.67 2cqv s GLN 9 Cb -0.23 0.29 0.13 0.00 -1.09 0.00 0.00 33.01 32.11 2cqv s GLN 9 CO 0.32 -0.09 0.57 0.42 -1.32 0.00 0.00 175.29 175.19 2cqv s ILE 10 N 0.08 5.14 -0.23 3.63 1.01 -1.26 -2.78 121.20 126.79 2cqv s ILE 10 Ca -0.01 -1.44 0.17 0.00 0.00 0.00 0.00 60.65 59.37 2cqv s ILE 10 Cb -0.03 -4.39 0.13 0.00 0.01 0.00 0.00 42.46 38.18 2cqv s ILE 10 CO 0.01 -0.95 1.47 0.16 0.00 0.00 0.00 174.94 175.63 2cqv h ILE 11 N 5.83 0.61 -3.21 2.92 -2.65 -1.90 -3.44 117.51 115.67 2cqv h ILE 11 Ca -0.27 -1.87 -0.61 0.00 1.03 0.00 0.00 64.86 63.14 2cqv h ILE 11 Cb 1.09 2.29 -0.35 0.00 -2.05 0.00 0.00 36.82 37.81 2cqv h ILE 11 CO 1.04 0.35 -0.84 -1.10 0.03 0.00 0.00 178.15 177.62 2cqv s GLN 12 N -3.03 2.43 -0.26 0.16 -0.21 -1.24 -5.01 119.66 112.49 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 0.07 -2.07 0.07 0.00 1.00 0.00 0.00 33.01 32.07 2cqv s GLN 12 CO 0.73 -0.09 0.69 0.12 -2.12 0.00 0.00 175.29 174.61 2cqv s PHE 13 N 1.07 -0.76 0.02 0.91 5.36 -1.26 -1.63 117.98 121.69 2cqv s PHE 13 Ca -0.04 1.84 -0.30 0.00 -0.96 0.00 0.00 56.93 57.47 2cqv s PHE 13 Cb -0.15 0.26 -0.06 0.00 -0.34 0.00 0.00 43.02 42.74 2cqv s PHE 13 CO -0.04 -0.36 1.43 -1.25 -1.46 0.00 0.00 175.22 173.54 2cqv s PRO 14 N 0.38 4.28 0.80 10.12 0.04 -1.26 -5.02 135.00 144.33 2cqv s PRO 14 Ca -0.00 2.02 -0.09 0.00 0.04 0.00 0.00 61.00 62.97 2cqv s PRO 14 Cb -0.05 -3.53 0.12 0.00 0.04 0.00 0.00 34.50 31.08 2cqv s PRO 14 CO 0.01 -0.57 1.12 -1.83 0.04 0.00 0.00 177.00 175.77 2cqv s GLU 15 N 2.25 1.60 -0.48 4.56 -1.05 -1.26 -4.71 118.70 119.61 2cqv s GLU 15 Ca 0.65 -0.41 -0.45 0.00 -0.15 0.00 0.00 54.97 54.61 2cqv s GLU 15 Cb -0.33 -2.07 -0.19 0.00 -0.44 0.00 0.00 34.13 31.09 2cqv s GLU 15 CO 0.28 -1.68 1.56 -0.40 0.95 0.00 0.00 175.26 175.97 2cqv n ASP 16 N -3.21 1.14 -4.13 0.83 5.75 -1.26 -4.78 116.55 110.90 2cqv n ASP 16 Ca 0.11 1.12 -0.12 0.00 -0.01 0.00 0.00 54.79 55.89 2cqv n ASP 16 Cb 0.60 -0.85 -0.09 0.00 -1.03 0.00 0.00 41.12 39.75 2cqv n ASP 16 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2cqv s GLN 17 N 3.02 1.27 0.47 0.11 -2.07 -0.92 -4.99 119.66 116.54 2cqv s GLN 17 Ca 1.02 -1.62 0.06 0.00 -1.82 0.00 0.00 55.36 52.99 2cqv s GLN 17 Cb -1.44 0.29 -0.02 0.00 -1.09 0.00 0.00 33.01 30.75 2cqv s GLN 17 CO 0.78 -0.43 0.19 0.21 -1.32 0.00 0.00 175.29 174.72 2cqv s LYS 18 N -4.10 2.22 -0.28 9.60 2.20 -1.26 -2.64 119.74 125.47 2cqv s LYS 18 Ca 0.38 -2.02 -0.18 0.00 -0.36 0.00 0.00 55.97 53.79 2cqv s LYS 18 Cb 0.06 -1.90 0.10 0.00 -1.51 0.00 0.00 37.83 34.58 2cqv s LYS 18 CO 0.13 -0.29 0.79 0.54 -0.36 0.00 0.00 175.35 176.16 2cqv s VAL 19 N -2.71 0.00 -0.08 4.02 0.11 0.26 -4.85 120.40 117.16 2cqv s VAL 19 Ca 0.32 0.00 -0.30 0.00 -2.93 0.00 0.00 61.98 59.07 2cqv s VAL 19 Cb 0.02 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.84 2cqv s VAL 19 CO 0.18 0.00 1.33 -0.13 -3.33 0.00 0.00 175.10 173.15 2cqv s ARG 20 N 1.27 4.27 -0.41 1.54 1.81 -1.26 -1.08 118.95 125.09 2cqv s ARG 20 Ca -0.07 1.81 -0.41 0.00 -1.72 0.00 0.00 55.73 55.34 2cqv s ARG 20 Cb -0.05 -3.68 -0.16 0.00 -0.45 0.00 0.00 34.95 30.62 2cqv s ARG 20 CO -0.15 -0.61 2.04 0.00 -0.68 0.00 0.00 175.30 175.90 2cqv n ALA 21 N 5.92 0.29 0.00 2.13 0.00 0.14 0.29 120.51 129.27 2cqv n ALA 21 Ca 0.13 0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.74 2cqv n ALA 21 Cb 0.45 -2.25 0.00 0.00 0.00 0.00 0.00 19.45 17.65 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 6.28 0.74 2.40 0.00 0.00 0.15 -4.87 105.19 109.90 2cqv n GLY 22 Ca 0.43 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.28 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 -1.02 -0.56 -4.03 1.61 -0.58 0.14 -4.20 120.64 111.99 2cqv n GLU 23 Ca 0.00 -1.38 -0.31 0.00 -0.42 0.00 0.00 57.16 55.04 2cqv n GLU 23 Cb 0.00 -0.74 -0.15 0.00 -0.57 0.00 0.00 31.44 29.97 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 -3.90 3.93 0.38 1.62 0.01 -1.26 -2.65 113.70 111.82 2cqv s SER 24 Ca 0.45 -1.15 0.08 0.00 1.31 0.00 0.00 55.95 56.65 2cqv s SER 24 Cb -0.02 -1.39 -0.03 0.00 0.21 0.00 0.00 66.02 64.79 2cqv s SER 24 CO 0.31 -0.17 0.27 0.54 0.41 0.00 0.00 173.24 174.61 2cqv s VAL 25 N 1.25 2.87 -0.29 3.43 0.11 -0.98 -4.95 120.40 121.84 2cqv s VAL 25 Ca -0.05 -1.50 -0.10 0.00 -2.93 0.00 0.00 61.98 57.40 2cqv s VAL 25 Cb -0.18 -3.03 0.12 0.00 -1.53 0.00 0.00 36.38 31.76 2cqv s VAL 25 CO -0.07 -0.08 0.64 -1.83 -3.33 0.00 0.00 175.10 170.42 2cqv s GLU 26 N -3.99 0.57 -0.26 1.54 1.03 -1.26 -0.82 118.70 115.50 2cqv s GLU 26 Ca 0.43 1.42 -0.05 0.00 0.03 0.00 0.00 54.97 56.79 2cqv s GLU 26 Cb -0.02 0.80 0.00 0.00 -0.80 0.00 0.00 34.13 34.11 2cqv s GLU 26 CO 0.25 -0.20 0.03 -0.51 -1.33 0.00 0.00 175.26 173.50 2cqv s LEU 27 N 2.80 3.45 -0.14 1.83 1.43 -0.07 -4.88 118.68 123.11 2cqv s LEU 27 Ca -0.06 -0.57 0.02 0.00 -1.03 0.00 0.00 54.13 52.48 2cqv s LEU 27 Cb -0.12 -1.82 0.01 0.00 0.03 0.00 0.00 46.19 44.30 2cqv s LEU 27 CO -0.19 -0.12 -0.19 0.12 0.23 0.00 0.00 176.35 176.21 2cqv s PHE 28 N 1.49 2.42 -0.43 0.29 5.36 -1.26 -0.01 117.98 125.85 2cqv s PHE 28 Ca 0.04 -1.26 -0.07 0.00 -0.96 0.00 0.00 56.93 54.68 2cqv s PHE 28 Cb -0.16 -1.69 0.10 0.00 -0.34 0.00 0.00 43.02 40.93 2cqv s PHE 28 CO 0.00 -0.61 0.26 0.20 -1.46 0.00 0.00 175.22 173.61 2cqv s GLY 29 N 1.03 1.98 0.25 13.12 0.00 -0.69 -4.48 107.32 118.53 2cqv s GLY 29 Ca -0.03 -2.33 -0.31 0.00 0.00 0.00 0.00 44.72 42.05 2cqv s GLY 29 CO -0.05 1.01 1.59 1.25 0.00 0.00 0.00 173.10 176.90 2cqv s LYS 30 N 1.33 4.16 0.03 2.90 2.20 -0.65 -3.68 119.74 126.04 2cqv s LYS 30 Ca 0.04 2.51 0.07 0.00 -0.36 0.00 0.00 55.97 58.23 2cqv s LYS 30 Cb -0.24 -3.07 -0.02 0.00 -1.51 0.00 0.00 37.83 32.99 2cqv s LYS 30 CO -0.00 -0.62 -0.22 0.14 -0.36 0.00 0.00 175.35 174.29 2cqv s VAL 31 N 0.40 1.74 0.00 4.02 -7.23 0.60 -2.83 120.40 117.10 2cqv s VAL 31 Ca 0.66 -1.17 0.00 0.00 -1.81 0.00 0.00 61.98 59.66 2cqv s VAL 31 Cb -0.47 -1.50 0.00 0.00 0.56 0.00 0.00 36.38 34.98 2cqv s VAL 31 CO 0.41 0.29 0.00 1.07 -0.31 0.00 0.00 175.10 176.56 2cqv n THR 32 N 1.99 0.00 0.00 5.32 5.66 -1.12 -4.72 114.28 121.41 2cqv n THR 32 Ca -0.17 0.07 0.00 0.00 -3.05 0.00 0.00 64.05 60.90 2cqv n THR 32 Cb 0.53 -0.88 0.00 0.00 -1.55 0.00 0.00 70.33 68.43 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 3.13 1.21 3.09 1.09 0.00 -1.26 -4.20 105.19 108.25 2cqv n GLY 33 Ca 0.00 0.33 0.01 0.00 0.00 0.00 0.00 46.02 46.36 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 -0.90 0.64 2.61 2.01 -1.26 -4.81 115.64 113.93 2cqv s THR 34 Ca 0.00 -0.02 -0.16 0.00 0.31 0.00 0.00 61.69 61.82 2cqv s THR 34 Cb 0.00 -0.95 -0.01 0.00 0.01 0.00 0.00 72.50 71.55 2cqv s THR 34 CO 0.00 -0.03 1.14 -1.10 -0.69 0.00 0.00 174.62 173.94 2cqv s GLN 35 N 2.78 2.82 0.63 4.92 -1.52 -1.26 -4.33 119.66 123.70 2cqv s GLN 35 Ca 0.19 1.53 -0.16 0.00 -1.95 0.00 0.00 55.36 54.97 2cqv s GLN 35 Cb -0.15 -1.94 -0.01 0.00 -0.22 0.00 0.00 33.01 30.68 2cqv s GLN 35 CO -0.20 -1.26 1.11 -1.25 -0.25 0.00 0.00 175.29 173.45 2cqv s PRO 36 N -3.83 2.93 -0.03 2.91 0.04 -1.26 -5.10 135.00 130.66 2cqv s PRO 36 Ca 0.70 1.44 0.00 0.00 0.04 0.00 0.00 61.00 63.18 2cqv s PRO 36 Cb -0.23 -1.96 0.03 0.00 0.04 0.00 0.00 34.50 32.37 2cqv s PRO 36 CO 0.38 -1.15 0.01 0.42 0.04 0.00 0.00 177.00 176.70 2cqv s ILE 37 N -2.20 0.13 0.40 0.56 1.01 -1.26 -4.56 121.20 115.28 2cqv s ILE 37 Ca 0.68 0.14 -0.23 0.00 0.00 0.00 0.00 60.65 61.24 2cqv s ILE 37 Cb -0.21 -0.25 -0.09 0.00 0.01 0.00 0.00 42.46 41.92 2cqv s ILE 37 CO 0.38 0.15 1.02 -0.89 0.00 0.00 0.00 174.94 175.60 2cqv s THR 38 N 1.19 3.89 -0.05 2.92 2.01 0.24 -4.92 115.64 120.91 2cqv s THR 38 Ca -0.07 1.39 -0.02 0.00 0.31 0.00 0.00 61.69 63.29 2cqv s THR 38 Cb -0.13 -3.69 0.04 0.00 0.01 0.00 0.00 72.50 68.73 2cqv s THR 38 CO -0.02 -0.05 0.10 0.00 -0.69 0.00 0.00 174.62 173.96 2cqv s THR 40 N 1.82 1.32 -0.18 0.00 2.01 0.12 -5.00 115.64 115.74 2cqv s THR 40 Ca -0.01 -0.99 -0.02 0.00 0.31 0.00 0.00 61.69 60.99 2cqv s THR 40 Cb -0.12 -1.16 -0.01 0.00 0.01 0.00 0.00 72.50 71.22 2cqv s THR 40 CO -0.04 0.15 -0.09 0.26 -0.69 0.00 0.00 174.62 174.21 2cqv s TRP 41 N -0.72 2.90 0.24 4.92 0.52 -1.26 -0.62 118.94 124.92 2cqv s TRP 41 Ca 0.05 -0.80 0.04 0.00 0.02 0.00 0.00 56.10 55.40 2cqv s TRP 41 Cb -0.08 -1.98 -0.05 0.00 -1.15 0.00 0.00 33.47 30.21 2cqv s TRP 41 CO 0.01 -0.38 0.00 -1.64 0.02 0.00 0.00 176.95 174.96 2cqv s MET 42 N 0.92 1.36 -0.17 4.98 -1.94 -0.32 -0.41 119.30 123.72 2cqv s MET 42 Ca -0.02 -1.69 -0.04 0.00 -1.71 0.00 0.00 55.69 52.23 2cqv s MET 42 Cb -0.15 -0.63 0.08 0.00 2.01 0.00 0.00 34.83 36.15 2cqv s MET 42 CO 0.00 -0.10 0.27 0.21 -0.01 0.00 0.00 175.02 175.38 2cqv s LYS 43 N -3.87 0.19 -1.01 2.03 2.20 0.40 -0.67 119.74 119.00 2cqv s LYS 43 Ca 0.29 0.57 -0.03 0.00 -0.36 0.00 0.00 55.97 56.44 2cqv s LYS 43 Cb 0.06 -0.43 0.00 0.00 -1.51 0.00 0.00 37.83 35.95 2cqv s LYS 43 CO 0.09 -0.44 0.86 1.19 -0.36 0.00 0.00 175.35 176.70 2cqv n PHE 44 N 5.34 -1.97 -3.49 4.03 3.01 -1.18 -2.80 117.46 120.40 2cqv n PHE 44 Ca -0.06 0.78 -0.21 0.00 1.01 0.00 0.00 57.45 58.97 2cqv n PHE 44 Cb 0.50 -4.41 0.08 0.00 -0.01 0.00 0.00 39.48 35.63 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 -3.74 -7.23 -3.38 -1.08 5.12 -1.26 -5.00 116.66 100.10 2cqv n ARG 45 Ca -0.15 0.77 -0.06 0.00 -1.93 0.00 0.00 57.85 56.48 2cqv n ARG 45 Cb 0.61 -5.64 -0.07 0.00 -1.16 0.00 0.00 32.46 26.20 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 -6.08 0.39 0.13 5.56 2.20 -1.12 -5.13 119.74 115.69 2cqv s LYS 46 Ca 0.46 0.74 -0.35 0.00 -0.36 0.00 0.00 55.97 56.46 2cqv s LYS 46 Cb -0.20 -0.10 -0.15 0.00 -1.51 0.00 0.00 37.83 35.86 2cqv s LYS 46 CO 0.68 -0.55 1.50 0.94 -0.36 0.00 0.00 175.35 177.55 2cqv n GLN 47 N 5.38 1.79 -2.40 4.03 7.27 -1.26 -0.45 117.38 131.74 2cqv n GLN 47 Ca -0.04 0.64 -0.34 0.00 0.07 0.00 0.00 57.00 57.33 2cqv n GLN 47 Cb 0.50 -2.37 -0.02 0.00 2.41 0.00 0.00 30.24 30.76 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 0.82 3.61 -0.18 1.69 1.01 0.45 -4.84 121.20 123.77 2cqv s ILE 48 Ca 0.81 0.97 -0.05 0.00 0.00 0.00 0.00 60.65 62.38 2cqv s ILE 48 Cb -0.78 -3.39 -0.03 0.00 0.01 0.00 0.00 42.46 38.27 2cqv s ILE 48 CO 0.41 -0.25 0.01 0.00 0.00 0.00 0.00 174.94 175.12 2cqv s GLN 49 N -3.35 3.76 0.27 2.79 -2.07 -1.26 -4.91 119.66 114.89 2cqv s GLN 49 Ca 0.68 -0.46 -0.31 0.00 -1.82 0.00 0.00 55.36 53.46 2cqv s GLN 49 Cb -0.18 -3.07 -0.11 0.00 -1.09 0.00 0.00 33.01 28.56 2cqv s GLN 49 CO 0.24 0.19 1.63 -1.21 -1.32 0.00 0.00 175.29 174.82 2cqv s GLU 50 N 0.54 4.12 -0.00 9.60 2.02 -1.26 -4.64 118.70 129.08 2cqv s GLU 50 Ca -0.00 2.59 -0.29 0.00 0.02 0.00 0.00 54.97 57.28 2cqv s GLU 50 Cb -0.14 -3.04 0.11 0.00 0.10 0.00 0.00 34.13 31.17 2cqv s GLU 50 CO 0.02 -0.67 1.27 -1.54 0.02 0.00 0.00 175.26 174.36 2cqv s SER 51 N 0.69 -0.04 0.56 -0.19 1.04 0.16 -4.95 113.70 110.97 2cqv s SER 51 Ca 0.66 -0.18 0.26 0.00 0.48 0.00 0.00 55.95 57.17 2cqv s SER 51 Cb -0.48 0.18 1.50 0.00 0.10 0.00 0.00 66.02 67.32 2cqv s SER 51 CO 0.43 -0.35 2.06 -0.08 0.98 0.00 0.00 173.24 176.29 2cqv h GLU 52 N 2.00 0.00 0.13 4.02 4.81 -1.98 -0.34 114.58 123.23 2cqv h GLU 52 Ca -0.28 0.00 -0.28 0.00 -0.13 0.00 0.00 59.36 58.67 2cqv h GLU 52 Cb 1.20 0.00 0.03 0.00 0.63 0.00 0.00 28.75 30.61 2cqv h GLU 52 CO 0.29 0.00 -1.18 0.45 -0.73 0.00 0.00 179.01 177.85 2cqv h HIS 53 N 0.00 0.93 -3.09 0.92 3.86 -1.91 -3.35 115.15 112.50 2cqv h HIS 53 Ca 0.13 -0.60 -0.54 0.00 -1.16 0.00 0.00 60.37 58.21 2cqv h HIS 53 Cb 0.62 -0.07 -0.40 0.00 1.06 0.00 0.00 27.41 28.62 2cqv h HIS 53 CO 0.00 1.45 -0.76 -1.64 0.86 0.00 0.00 177.93 177.83 2cqv s MET 54 N -2.88 0.50 0.31 2.45 -1.94 -0.17 -0.51 119.30 117.06 2cqv s MET 54 Ca -0.10 -0.63 0.04 0.00 -1.71 0.00 0.00 55.69 53.29 2cqv s MET 54 Cb 0.05 -1.80 -0.02 0.00 2.01 0.00 0.00 34.83 35.06 2cqv s MET 54 CO 0.91 -0.85 0.46 0.15 -0.01 0.00 0.00 175.02 175.68 2cqv s LYS 55 N 1.87 3.34 -0.02 2.03 1.02 0.58 0.39 119.74 128.96 2cqv s LYS 55 Ca 0.05 -0.68 -0.00 0.00 0.02 0.00 0.00 55.97 55.36 2cqv s LYS 55 Cb -0.17 -2.79 0.03 0.00 -0.52 0.00 0.00 37.83 34.39 2cqv s LYS 55 CO -0.21 0.21 0.03 0.08 -0.92 0.00 0.00 175.35 174.54 2cqv s VAL 56 N -2.16 -0.06 -0.63 3.17 1.01 -1.26 -1.31 120.40 119.16 2cqv s VAL 56 Ca 0.39 0.22 0.03 0.00 0.00 0.00 0.00 61.98 62.63 2cqv s VAL 56 Cb -0.09 -0.08 0.16 0.00 0.00 0.00 0.00 36.38 36.36 2cqv s VAL 56 CO 0.32 0.09 0.41 -1.61 0.00 0.00 0.00 175.10 174.31 2cqv s GLU 57 N 1.10 2.33 0.18 2.72 2.02 -0.60 -4.96 118.70 121.49 2cqv s GLU 57 Ca -0.09 -2.93 -0.30 0.00 0.02 0.00 0.00 54.97 51.68 2cqv s GLU 57 Cb -0.13 -3.46 -0.08 0.00 0.10 0.00 0.00 34.13 30.56 2cqv s GLU 57 CO -0.03 -1.19 1.23 0.54 0.02 0.00 0.00 175.26 175.82 2cqv s ASN 58 N -0.58 7.04 0.25 -0.19 2.20 -1.26 -2.95 114.94 119.44 2cqv s ASN 58 Ca 0.21 2.26 -0.20 0.00 -0.94 0.00 0.00 52.86 54.19 2cqv s ASN 58 Cb -0.16 -2.61 0.03 0.00 -2.00 0.00 0.00 41.25 36.51 2cqv s ASN 58 CO -0.07 -0.42 0.65 -0.44 -2.94 0.00 0.00 177.10 173.88 2cqv s SER 59 N 0.24 -0.30 0.08 3.54 0.01 0.29 -5.02 113.70 112.54 2cqv s SER 59 Ca 0.54 -0.52 -0.22 0.00 1.31 0.00 0.00 55.95 57.06 2cqv s SER 59 Cb -0.33 0.68 -0.08 0.00 0.21 0.00 0.00 66.02 66.49 2cqv s SER 59 CO 0.37 -1.23 1.36 -0.08 0.41 0.00 0.00 173.24 174.07 2cqv h GLU 60 N 2.05 -0.34 -0.96 12.44 4.57 -1.95 -0.36 114.58 130.02 2cqv h GLU 60 Ca -0.23 0.02 0.37 0.00 -1.18 0.00 0.00 59.36 58.34 2cqv h GLU 60 Cb 1.26 0.08 -0.17 0.00 -0.16 0.00 0.00 28.75 29.76 2cqv h GLU 60 CO 0.29 -0.23 0.41 0.09 -1.18 0.00 0.00 179.01 178.39 2cqv n ASN 61 N -4.46 0.24 0.00 1.04 3.02 -1.26 -4.74 115.26 109.10 2cqv n ASN 61 Ca -0.04 1.60 0.00 0.00 -0.03 0.00 0.00 54.58 56.12 2cqv n ASN 61 Cb 0.24 -0.74 0.00 0.00 -0.61 0.00 0.00 39.78 38.68 2cqv n ASN 61 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2cqv n GLY 62 N -1.30 -0.60 3.16 7.41 0.00 -0.14 -0.29 105.19 113.43 2cqv n GLY 62 Ca 0.33 -0.50 -0.23 0.00 0.00 0.00 0.00 46.02 45.62 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 1.93 0.08 1.61 0.15 -1.24 -0.55 113.70 111.68 2cqv s SER 63 Ca 0.00 -0.38 0.09 0.00 0.70 0.00 0.00 55.95 56.36 2cqv s SER 63 Cb 0.00 -0.18 -0.03 0.00 -1.71 0.00 0.00 66.02 64.10 2cqv s SER 63 CO 0.00 0.14 -0.23 -0.75 1.20 0.00 0.00 173.24 173.60 2cqv s LYS 64 N -0.76 1.40 -0.26 5.44 2.20 -1.15 -1.71 119.74 124.90 2cqv s LYS 64 Ca 0.05 -1.14 -0.02 0.00 -0.36 0.00 0.00 55.97 54.50 2cqv s LYS 64 Cb -0.07 -1.66 0.08 0.00 -1.51 0.00 0.00 37.83 34.67 2cqv s LYS 64 CO 0.00 0.41 0.07 -1.17 -0.36 0.00 0.00 175.35 174.30 2cqv s LEU 65 N -1.62 1.67 -0.04 5.43 2.96 0.99 -1.55 118.68 126.52 2cqv s LEU 65 Ca 0.10 -1.26 -0.14 0.00 -0.22 0.00 0.00 54.13 52.60 2cqv s LEU 65 Cb -0.10 -0.72 -0.05 0.00 0.50 0.00 0.00 46.19 45.82 2cqv s LEU 65 CO 0.04 -0.37 0.38 -0.89 -1.32 0.00 0.00 176.35 174.19 2cqv s THR 66 N 1.75 5.11 -0.22 3.68 2.01 -0.42 -0.89 115.64 126.65 2cqv s THR 66 Ca 0.05 0.77 -0.00 0.00 0.31 0.00 0.00 61.69 62.82 2cqv s THR 66 Cb -0.17 -3.69 0.03 0.00 0.01 0.00 0.00 72.50 68.67 2cqv s THR 66 CO -0.19 0.54 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.53 2cqv s ILE 67 N -0.75 2.48 0.19 1.82 1.01 -0.00 -0.30 121.20 125.64 2cqv s ILE 67 Ca 0.23 -1.04 -0.09 0.00 0.00 0.00 0.00 60.65 59.74 2cqv s ILE 67 Cb -0.16 -2.20 -0.07 0.00 0.01 0.00 0.00 42.46 40.05 2cqv s ILE 67 CO 0.11 0.32 0.50 -0.76 0.00 0.00 0.00 174.94 175.11 2cqv s LEU 68 N 1.29 4.22 -1.58 2.97 2.01 0.33 -2.32 118.68 125.60 2cqv s LEU 68 Ca 0.01 0.86 -0.07 0.00 0.01 0.00 0.00 54.13 54.94 2cqv s LEU 68 Cb -0.16 -3.50 0.07 0.00 0.01 0.00 0.00 46.19 42.61 2cqv s LEU 68 CO -0.08 -0.01 0.41 0.00 1.01 0.00 0.00 176.35 177.68 2cqv n ALA 69 N 0.10 -1.73 -0.89 4.21 0.00 -1.14 -4.57 120.51 116.48 2cqv n ALA 69 Ca -0.01 -0.24 -0.34 0.00 0.00 0.00 0.00 53.44 52.84 2cqv n ALA 69 Cb 0.52 -1.89 -0.09 0.00 0.00 0.00 0.00 19.45 18.00 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 -4.41 0.16 -1.98 0.00 0.00 -1.09 -4.20 120.51 108.99 2cqv n ALA 70 Ca -0.17 -0.01 -0.26 0.00 0.00 0.00 0.00 53.44 53.00 2cqv n ALA 70 Cb 0.62 -1.42 0.05 0.00 0.00 0.00 0.00 19.45 18.70 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 4.79 2.48 0.51 0.00 0.52 -1.26 -0.67 118.95 125.31 2cqv s ARG 71 Ca 0.84 -0.16 0.22 0.00 -0.52 0.00 0.00 55.73 56.10 2cqv s ARG 71 Cb -0.92 -2.21 1.36 0.00 0.52 0.00 0.00 34.95 33.70 2cqv s ARG 71 CO 0.39 -1.03 2.09 0.37 0.02 0.00 0.00 175.30 177.14 2cqv h GLN 72 N -0.43 0.00 -0.14 3.54 5.75 -1.94 -2.43 115.11 119.45 2cqv h GLN 72 Ca -0.45 0.00 -0.21 0.00 -0.15 0.00 0.00 58.65 57.85 2cqv h GLN 72 Cb 1.29 0.00 0.01 0.00 1.07 0.00 0.00 27.48 29.85 2cqv h GLN 72 CO 0.60 0.10 -0.72 1.05 -2.65 0.00 0.00 178.83 177.21 2cqv h GLU 73 N 0.00 0.74 -0.97 1.69 4.11 -1.99 -3.18 114.58 114.98 2cqv h GLU 73 Ca -0.00 -0.61 0.37 0.00 0.07 0.00 0.00 59.36 59.19 2cqv h GLU 73 Cb 0.22 0.13 -0.18 0.00 0.50 0.00 0.00 28.75 29.42 2cqv h GLU 73 CO 0.01 1.22 0.38 0.72 0.07 0.00 0.00 179.01 181.41 2cqv n HIS 74 N -4.00 0.99 -1.55 2.06 8.25 -0.91 -4.46 115.22 115.59 2cqv n HIS 74 Ca -0.08 1.15 -0.54 0.00 -0.26 0.00 0.00 57.72 57.99 2cqv n HIS 74 Cb 0.72 -1.46 -0.07 0.00 1.12 0.00 0.00 29.99 30.30 2cqv n HIS 74 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2cqv n GLY 76 N 2.11 -0.57 2.83 0.00 0.00 -1.03 -5.01 105.19 103.52 2cqv n GLY 76 Ca 0.19 -0.27 -0.16 0.00 0.00 0.00 0.00 46.02 45.78 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 0.80 2.83 -0.12 0.00 1.51 -0.68 -3.12 117.35 118.57 2cqv s TYR 78 Ca -0.08 -0.30 -0.05 0.00 -1.01 0.00 0.00 57.07 55.63 2cqv s TYR 78 Cb -0.11 -1.60 0.06 0.00 -0.11 0.00 0.00 41.96 40.20 2cqv s TYR 78 CO -0.02 0.35 0.26 0.99 -1.11 0.00 0.00 175.55 176.02 2cqv s THR 79 N -2.33 -0.27 -0.46 -0.71 2.01 0.15 -2.44 115.64 111.59 2cqv s THR 79 Ca 0.37 0.23 -0.14 0.00 0.31 0.00 0.00 61.69 62.46 2cqv s THR 79 Cb -0.05 -0.42 0.07 0.00 0.01 0.00 0.00 72.50 72.12 2cqv s THR 79 CO 0.24 0.10 0.37 -0.22 -0.69 0.00 0.00 174.62 174.41 2cqv s LEU 80 N 1.98 5.52 -0.26 4.42 2.96 -1.23 -1.17 118.68 130.89 2cqv s LEU 80 Ca -0.03 -1.35 -0.16 0.00 -0.22 0.00 0.00 54.13 52.37 2cqv s LEU 80 Cb -0.11 -2.15 -0.03 0.00 0.50 0.00 0.00 46.19 44.40 2cqv s LEU 80 CO -0.08 -0.62 0.44 -0.22 -1.32 0.00 0.00 176.35 174.54 2cqv s LEU 81 N 1.60 4.04 -0.23 -0.68 2.96 0.21 -2.12 118.68 124.47 2cqv s LEU 81 Ca 0.04 0.40 0.00 0.00 -0.22 0.00 0.00 54.13 54.35 2cqv s LEU 81 Cb -0.24 -2.53 0.03 0.00 0.50 0.00 0.00 46.19 43.95 2cqv s LEU 81 CO 0.06 -0.23 -0.11 0.68 -1.32 0.00 0.00 176.35 175.43 2cqv s VAL 82 N 2.17 2.46 0.06 1.68 -7.23 0.60 0.13 120.40 120.27 2cqv s VAL 82 Ca 0.18 -1.16 0.08 0.00 -1.81 0.00 0.00 61.98 59.26 2cqv s VAL 82 Cb -0.16 -2.24 -0.03 0.00 0.56 0.00 0.00 36.38 34.51 2cqv s VAL 82 CO 0.10 0.23 -0.20 -1.61 -0.31 0.00 0.00 175.10 173.30 2cqv s GLU 83 N 1.25 1.91 0.24 4.82 2.02 -0.65 -0.18 118.70 128.11 2cqv s GLU 83 Ca -0.01 -1.07 -0.02 0.00 0.02 0.00 0.00 54.97 53.89 2cqv s GLU 83 Cb -0.16 -2.11 0.01 0.00 0.10 0.00 0.00 34.13 31.96 2cqv s GLU 83 CO -0.07 0.52 0.35 0.27 0.02 0.00 0.00 175.26 176.34 2cqv n ASN 84 N 1.41 -0.97 0.14 -0.19 6.94 -0.24 0.79 115.26 123.14 2cqv n ASN 84 Ca -0.16 -2.30 0.10 0.00 -0.02 0.00 0.00 54.58 52.19 2cqv n ASN 84 Cb 0.52 1.80 0.60 0.00 -2.36 0.00 0.00 39.78 40.35 2cqv n ASN 84 CO 0.00 0.00 0.00 0.07 -1.03 0.00 0.00 177.26 176.30 2cqv h LYS 85 N 0.00 0.12 0.00 -3.83 5.09 -1.88 -3.26 116.57 112.81 2cqv h LYS 85 Ca -0.19 -0.01 0.00 0.00 0.09 0.00 0.00 60.65 60.54 2cqv h LYS 85 Cb 0.82 -0.03 0.00 0.00 0.10 0.00 0.00 32.23 33.13 2cqv h LYS 85 CO 0.26 0.08 0.00 1.28 -2.09 0.00 0.00 179.45 178.98 2cqv n LEU 86 N -4.50 1.25 0.00 7.07 4.77 -1.26 -5.07 117.00 119.26 2cqv n LEU 86 Ca 0.01 0.34 0.00 0.00 -0.03 0.00 0.00 56.01 56.34 2cqv n LEU 86 Cb 0.20 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 2cqv n LEU 86 CO 0.35 -0.23 0.00 0.61 -1.33 0.00 0.00 177.39 176.79 2cqv n GLY 87 N 1.59 4.49 3.76 -0.72 0.00 -1.23 -4.84 105.19 108.25 2cqv n GLY 87 Ca 0.00 -0.51 -0.06 0.00 0.00 0.00 0.00 46.02 45.45 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 1.29 -0.25 0.12 1.61 1.04 -1.26 -1.08 113.70 115.16 2cqv s SER 88 Ca 0.00 -0.44 -0.20 0.00 0.48 0.00 0.00 55.95 55.79 2cqv s SER 88 Cb 0.00 0.60 0.05 0.00 0.10 0.00 0.00 66.02 66.77 2cqv s SER 88 CO 0.00 -1.09 0.49 -0.60 0.98 0.00 0.00 173.24 173.02 2cqv s ARG 89 N -3.59 1.13 -0.09 4.02 6.06 0.74 -4.60 118.95 122.62 2cqv s ARG 89 Ca 0.10 -0.53 -0.04 0.00 -2.50 0.00 0.00 55.73 52.76 2cqv s ARG 89 Cb -0.03 0.51 0.04 0.00 0.06 0.00 0.00 34.95 35.53 2cqv s ARG 89 CO 0.03 -0.45 0.21 1.14 -2.50 0.00 0.00 175.30 173.72 2cqv s GLN 90 N -3.48 0.16 0.52 5.12 -2.07 -1.26 -0.29 119.66 118.36 2cqv s GLN 90 Ca 0.00 0.48 0.06 0.00 -1.82 0.00 0.00 55.36 54.08 2cqv s GLN 90 Cb 0.00 -0.15 0.06 0.00 -1.09 0.00 0.00 33.01 31.84 2cqv s GLN 90 CO -0.10 -0.17 0.51 0.00 -1.32 0.00 0.00 175.29 174.21 2cqv n ALA 91 N 4.27 0.91 -3.64 2.60 0.00 -0.90 -4.93 120.51 118.83 2cqv n ALA 91 Ca -0.25 -2.00 -0.10 0.00 0.00 0.00 0.00 53.44 51.09 2cqv n ALA 91 Cb 0.52 0.73 -0.09 0.00 0.00 0.00 0.00 19.45 20.61 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 -4.21 0.55 -0.05 0.00 -0.21 -1.26 -3.55 119.66 110.94 2cqv s GLN 92 Ca 0.39 0.95 -0.02 0.00 0.02 0.00 0.00 55.36 56.70 2cqv s GLN 92 Cb -0.03 0.09 0.03 0.00 1.00 0.00 0.00 33.01 34.10 2cqv s GLN 92 CO 0.25 -0.14 0.10 0.54 -2.12 0.00 0.00 175.29 173.91 2cqv s VAL 93 N 1.33 -0.05 0.01 1.09 0.11 -1.02 -4.92 120.40 116.95 2cqv s VAL 93 Ca -0.08 0.17 -0.12 0.00 -2.93 0.00 0.00 61.98 59.01 2cqv s VAL 93 Cb -0.06 -0.17 -0.05 0.00 -1.53 0.00 0.00 36.38 34.56 2cqv s VAL 93 CO -0.13 0.07 0.37 0.20 -3.33 0.00 0.00 175.10 172.27 2cqv s ASN 94 N 0.97 6.70 0.06 3.54 0.01 -1.26 -1.69 114.94 123.27 2cqv s ASN 94 Ca -0.08 0.84 0.04 0.00 -0.71 0.00 0.00 52.86 52.95 2cqv s ASN 94 Cb -0.10 -2.20 -0.03 0.00 0.41 0.00 0.00 41.25 39.33 2cqv s ASN 94 CO -0.04 0.29 -0.11 -0.22 -1.51 0.00 0.00 177.10 175.50 2cqv s LEU 95 N -1.36 2.28 -0.02 0.60 2.96 -0.76 -2.17 118.68 120.21 2cqv s LEU 95 Ca 0.26 -0.60 0.01 0.00 -0.22 0.00 0.00 54.13 53.57 2cqv s LEU 95 Cb -0.15 -0.34 0.01 0.00 0.50 0.00 0.00 46.19 46.21 2cqv s LEU 95 CO 0.14 -0.15 -0.03 -0.89 -1.32 0.00 0.00 176.35 174.10 2cqv s THR 96 N -1.43 0.28 -0.14 3.68 2.01 -1.08 -2.48 115.64 116.48 2cqv s THR 96 Ca -0.05 -0.07 -0.07 0.00 0.31 0.00 0.00 61.69 61.81 2cqv s THR 96 Cb -0.09 -0.30 -0.04 0.00 0.01 0.00 0.00 72.50 72.08 2cqv s THR 96 CO 0.01 0.12 0.10 -0.69 -0.69 0.00 0.00 174.62 173.48 2cqv s VAL 97 N 0.42 5.19 -0.06 3.82 1.01 -1.26 -0.57 120.40 128.94 2cqv s VAL 97 Ca -0.04 0.10 0.01 0.00 0.00 0.00 0.00 61.98 62.04 2cqv s VAL 97 Cb -0.07 -3.29 0.02 0.00 0.00 0.00 0.00 36.38 33.04 2cqv s VAL 97 CO -0.01 0.55 -0.05 0.68 0.00 0.00 0.00 175.10 176.27 2cqv s VAL 98 N -0.47 0.67 -0.62 2.92 -7.23 -0.24 -4.85 120.40 110.58 2cqv s VAL 98 Ca 0.11 -0.15 0.16 0.00 -1.81 0.00 0.00 61.98 60.29 2cqv s VAL 98 Cb -0.12 -0.70 0.78 0.00 0.56 0.00 0.00 36.38 36.91 2cqv s VAL 98 CO 0.02 0.27 1.71 -0.67 -0.31 0.00 0.00 175.10 176.12 2cqv n ASP 99 N 4.36 5.35 -4.77 4.85 2.03 -1.26 0.25 116.55 127.37 2cqv n ASP 99 Ca -0.19 -2.74 -0.39 0.00 0.52 0.00 0.00 54.79 51.99 2cqv n ASP 99 Cb 0.51 -0.64 -0.00 0.00 -0.72 0.00 0.00 41.12 40.26 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 -2.39 3.88 0.34 -0.67 1.02 -1.26 -4.97 119.74 115.70 2cqv s LYS 100 Ca 0.53 2.14 -0.28 0.00 0.02 0.00 0.00 55.97 58.39 2cqv s LYS 100 Cb 0.38 -2.69 -0.09 0.00 -0.52 0.00 0.00 37.83 34.91 2cqv s LYS 100 CO 0.20 -0.56 1.21 -1.25 -0.92 0.00 0.00 175.35 174.03 2cqv s PRO 101 N -2.33 4.31 0.33 -1.68 0.04 -1.26 -5.00 135.00 129.41 2cqv s PRO 101 Ca 0.59 1.99 -0.08 0.00 0.04 0.00 0.00 61.00 63.54 2cqv s PRO 101 Cb -0.38 -2.96 -0.06 0.00 0.04 0.00 0.00 34.50 31.15 2cqv s PRO 101 CO 0.48 -0.15 0.65 0.16 0.04 0.00 0.00 177.00 178.18 2cqv s ASP 102 N -0.80 6.50 0.13 6.66 1.47 -1.26 -5.04 116.67 124.32 2cqv s ASP 102 Ca 0.51 0.92 -0.31 0.00 1.18 0.00 0.00 52.55 54.85 2cqv s ASP 102 Cb -0.35 -2.23 -0.08 0.00 -0.34 0.00 0.00 42.92 39.92 2cqv s ASP 102 CO 0.45 -0.27 1.35 -2.16 0.68 0.00 0.00 175.17 175.22 2cqv s PRO 103 N -3.60 4.35 -0.31 2.11 0.04 -1.26 -4.96 135.00 131.37 2cqv s PRO 103 Ca 0.48 2.03 -0.29 0.00 0.04 0.00 0.00 61.00 63.26 2cqv s PRO 103 Cb -0.11 -3.25 -0.01 0.00 0.04 0.00 0.00 34.50 31.17 2cqv s PRO 103 CO 0.29 -0.37 1.68 -1.25 0.04 0.00 0.00 177.00 177.39 2cqv s PRO 104 N 0.82 3.51 0.87 0.56 0.04 -1.26 -4.97 135.00 134.57 2cqv s PRO 104 Ca 0.62 1.40 -0.14 0.00 0.04 0.00 0.00 61.00 62.92 2cqv s PRO 104 Cb -0.36 -4.12 -0.01 0.00 0.04 0.00 0.00 34.50 30.05 2cqv s PRO 104 CO 0.32 -1.65 0.34 0.00 0.04 0.00 0.00 177.00 176.05 2cqv n ALA 105 N 9.50 -2.46 -3.15 8.56 0.00 -1.26 -5.02 120.51 126.68 2cqv n ALA 105 Ca 0.21 -0.48 0.05 0.00 0.00 0.00 0.00 53.44 53.22 2cqv n ALA 105 Cb 0.46 -1.76 -0.01 0.00 0.00 0.00 0.00 19.45 18.15 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 -1.72 -0.85 -0.12 0.00 0.00 -1.26 -5.15 107.32 98.22 2cqv s GLY 106 Ca 0.58 2.03 0.03 0.00 0.00 0.00 0.00 44.72 47.36 2cqv s GLY 106 CO 0.65 3.82 -0.21 -0.51 0.00 0.00 0.00 173.10 176.86 2cqv s THR 107 N 2.91 2.28 0.29 0.90 -4.23 -1.26 -5.11 115.64 111.42 2cqv s THR 107 Ca 0.14 -0.93 -0.29 0.00 -1.18 0.00 0.00 61.69 59.43 2cqv s THR 107 Cb -0.08 -1.90 -0.10 0.00 1.34 0.00 0.00 72.50 71.76 2cqv s THR 107 CO -0.20 0.55 1.24 -2.16 -0.54 0.00 0.00 174.62 173.51 2cqv s PRO 108 N 0.52 4.45 0.46 3.99 0.04 -1.26 -5.02 135.00 138.18 2cqv s PRO 108 Ca -0.13 2.05 -0.16 0.00 0.04 0.00 0.00 61.00 62.80 2cqv s PRO 108 Cb -0.17 -3.13 -0.08 0.00 0.04 0.00 0.00 34.50 31.16 2cqv s PRO 108 CO 0.05 -0.08 0.91 -1.54 0.04 0.00 0.00 177.00 176.38 2cqv s SER 109 N -0.44 6.67 0.00 6.66 1.04 -1.26 -4.61 113.70 121.76 2cqv s SER 109 Ca 0.49 1.47 0.00 0.00 0.48 0.00 0.00 55.95 58.39 2cqv s SER 109 Cb -0.37 -2.46 0.00 0.00 0.10 0.00 0.00 66.02 63.29 2cqv s SER 109 CO 0.46 -0.47 0.00 0.61 0.98 0.00 0.00 173.24 174.82 2cqv n GLY 110 N -1.25 1.98 3.56 7.32 0.00 -1.26 -5.05 105.19 110.49 2cqv n GLY 110 Ca 0.05 -0.45 -0.29 0.00 0.00 0.00 0.00 46.02 45.33 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 2.56 0.41 1.61 0.04 -1.26 -4.96 135.00 133.40 2cqv s PRO 111 Ca 0.00 -0.12 -0.23 0.00 0.04 0.00 0.00 61.00 60.69 2cqv s PRO 111 Cb 0.00 -4.94 -0.09 0.00 0.04 0.00 0.00 34.50 29.51 2cqv s PRO 111 CO 0.00 -3.26 1.03 -1.54 0.04 0.00 0.00 177.00 173.26 2cqv s SER 112 N 8.06 6.76 0.24 6.66 1.04 -1.26 -4.95 113.70 130.26 2cqv s SER 112 Ca 0.70 1.96 -0.05 0.00 0.48 0.00 0.00 55.95 59.03 2cqv s SER 112 Cb -0.08 -2.58 0.45 0.00 0.10 0.00 0.00 66.02 63.92 2cqv s SER 112 CO 0.03 -0.49 1.69 0.28 0.98 0.00 0.00 173.24 175.74 2cqv h SER 113 N 2.33 0.05 0.00 7.02 0.02 -2.04 -3.56 113.55 117.37 2cqv h SER 113 Ca -0.48 0.14 0.00 0.00 -0.84 0.00 0.00 61.79 60.61 2cqv h SER 113 Cb 1.21 0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.93 2cqv h SER 113 CO 0.62 -0.02 0.00 0.61 -1.14 0.00 0.00 176.83 176.90