#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cqv n SER 2 N 0.00 0.13 -4.14 1.61 3.41 -1.26 -4.90 113.62 108.47 2cqv n SER 2 Ca 0.00 1.15 -0.38 0.00 -0.26 0.00 0.00 58.87 59.38 2cqv n SER 2 Cb 0.00 -1.02 -0.07 0.00 -0.26 0.00 0.00 64.21 62.86 2cqv n SER 2 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2cqv s SER 3 N -0.24 5.82 0.00 4.04 0.15 -1.26 -4.93 113.70 117.29 2cqv s SER 3 Ca 0.79 -3.27 0.00 0.00 0.70 0.00 0.00 55.95 54.17 2cqv s SER 3 Cb -1.05 -1.93 0.00 0.00 -1.71 0.00 0.00 66.02 61.33 2cqv s SER 3 CO 0.55 -0.30 0.00 0.61 1.20 0.00 0.00 173.24 175.30 2cqv n GLY 4 N 2.97 -0.57 3.55 9.45 0.00 -1.26 -5.06 105.19 114.27 2cqv n GLY 4 Ca 0.15 0.09 -0.37 0.00 0.00 0.00 0.00 46.02 45.90 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 -4.00 5.32 -0.14 1.61 0.01 -1.26 -4.96 113.70 110.28 2cqv s SER 5 Ca 0.00 0.09 -0.08 0.00 1.31 0.00 0.00 55.95 57.27 2cqv s SER 5 Cb 0.00 -2.54 -0.04 0.00 0.21 0.00 0.00 66.02 63.65 2cqv s SER 5 CO 0.00 -2.39 0.14 -0.44 0.41 0.00 0.00 173.24 170.96 2cqv s SER 6 N 7.77 6.35 1.08 2.44 0.01 -1.26 -5.07 113.70 125.02 2cqv s SER 6 Ca 0.65 0.42 -0.18 0.00 1.31 0.00 0.00 55.95 58.16 2cqv s SER 6 Cb -0.11 -2.08 0.11 0.00 0.21 0.00 0.00 66.02 64.15 2cqv s SER 6 CO 0.16 0.35 -0.01 0.61 0.41 0.00 0.00 173.24 174.76 2cqv n GLY 7 N 2.35 -2.57 3.77 3.44 0.00 -1.26 -4.07 105.19 106.85 2cqv n GLY 7 Ca -0.19 -0.75 -0.40 0.00 0.00 0.00 0.00 46.02 44.67 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 -3.35 4.44 -0.01 1.61 0.04 -1.26 -4.40 135.00 132.07 2cqv s PRO 8 Ca 0.47 2.05 -0.12 0.00 0.04 0.00 0.00 61.00 63.44 2cqv s PRO 8 Cb -0.07 -3.09 0.01 0.00 0.04 0.00 0.00 34.50 31.39 2cqv s PRO 8 CO 0.54 -0.05 0.24 1.14 0.04 0.00 0.00 177.00 178.91 2cqv s GLN 9 N -1.70 0.60 -0.56 4.56 -2.07 -0.45 -4.37 119.66 115.67 2cqv s GLN 9 Ca 0.48 -0.27 -0.12 0.00 -1.82 0.00 0.00 55.36 53.63 2cqv s GLN 9 Cb -0.36 0.26 0.14 0.00 -1.09 0.00 0.00 33.01 31.95 2cqv s GLN 9 CO 0.48 -0.16 0.47 0.42 -1.32 0.00 0.00 175.29 175.19 2cqv s ILE 10 N -1.34 4.78 -0.18 3.63 1.01 -1.26 -1.27 121.20 126.57 2cqv s ILE 10 Ca -0.14 -1.84 0.16 0.00 0.00 0.00 0.00 60.65 58.84 2cqv s ILE 10 Cb -0.06 -4.08 0.05 0.00 0.01 0.00 0.00 42.46 38.38 2cqv s ILE 10 CO 0.03 -0.86 1.33 0.16 0.00 0.00 0.00 174.94 175.60 2cqv h ILE 11 N 5.80 0.68 -3.37 2.92 -2.65 -1.90 -3.45 117.51 115.54 2cqv h ILE 11 Ca -0.19 -2.02 -0.60 0.00 1.03 0.00 0.00 64.86 63.08 2cqv h ILE 11 Cb 1.07 2.27 -0.33 0.00 -2.05 0.00 0.00 36.82 37.78 2cqv h ILE 11 CO 0.91 0.39 -0.85 -1.10 0.03 0.00 0.00 178.15 177.53 2cqv s GLN 12 N -2.99 2.39 -0.28 0.16 -0.21 -1.24 -5.02 119.66 112.47 2cqv s GLN 12 Ca 0.03 -0.65 -0.25 0.00 0.02 0.00 0.00 55.36 54.51 2cqv s GLN 12 Cb 0.08 -1.87 0.10 0.00 1.00 0.00 0.00 33.01 32.32 2cqv s GLN 12 CO 0.75 0.10 0.92 0.12 -2.12 0.00 0.00 175.29 175.07 2cqv s PHE 13 N 0.51 -0.59 0.28 0.91 5.36 -1.26 -1.88 117.98 121.31 2cqv s PHE 13 Ca -0.17 1.43 -0.29 0.00 -0.96 0.00 0.00 56.93 56.94 2cqv s PHE 13 Cb -0.17 0.33 -0.10 0.00 -0.34 0.00 0.00 43.02 42.75 2cqv s PHE 13 CO 0.06 -0.28 1.25 -1.25 -1.46 0.00 0.00 175.22 173.54 2cqv s PRO 14 N 0.32 4.44 0.63 10.12 0.04 -1.26 -5.04 135.00 144.25 2cqv s PRO 14 Ca 0.02 2.05 0.01 0.00 0.04 0.00 0.00 61.00 63.12 2cqv s PRO 14 Cb -0.05 -3.14 0.08 0.00 0.04 0.00 0.00 34.50 31.43 2cqv s PRO 14 CO -0.04 -0.10 0.88 -1.83 0.04 0.00 0.00 177.00 175.95 2cqv s GLU 15 N -1.18 2.13 -0.49 4.56 -1.05 -1.26 -4.65 118.70 116.75 2cqv s GLU 15 Ca 0.50 -1.00 -0.46 0.00 -0.15 0.00 0.00 54.97 53.87 2cqv s GLU 15 Cb -0.37 -2.43 -0.19 0.00 -0.44 0.00 0.00 34.13 30.70 2cqv s GLU 15 CO 0.45 -1.06 1.82 -0.40 0.95 0.00 0.00 175.26 177.02 2cqv n ASP 16 N -2.56 1.06 -4.03 0.83 5.75 -1.26 -4.72 116.55 111.62 2cqv n ASP 16 Ca 0.12 0.98 -0.20 0.00 -0.01 0.00 0.00 54.79 55.67 2cqv n ASP 16 Cb 0.60 -0.90 -0.09 0.00 -1.03 0.00 0.00 41.12 39.70 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 4.24 1.66 0.28 0.11 -2.07 -0.85 -4.96 119.66 118.07 2cqv s GLN 17 Ca 1.11 -1.96 0.08 0.00 -1.82 0.00 0.00 55.36 52.77 2cqv s GLN 17 Cb -1.48 -0.24 -0.06 0.00 -1.09 0.00 0.00 33.01 30.14 2cqv s GLN 17 CO 0.75 -0.44 -0.10 0.21 -1.32 0.00 0.00 175.29 174.39 2cqv s LYS 18 N -3.80 1.58 -0.20 9.60 2.20 -1.26 -2.81 119.74 125.04 2cqv s LYS 18 Ca 0.34 -1.78 -0.18 0.00 -0.36 0.00 0.00 55.97 53.99 2cqv s LYS 18 Cb 0.05 -1.33 0.05 0.00 -1.51 0.00 0.00 37.83 35.09 2cqv s LYS 18 CO 0.17 0.12 0.54 0.54 -0.36 0.00 0.00 175.35 176.36 2cqv s VAL 19 N -2.87 -0.00 0.15 4.02 0.11 -0.25 -4.91 120.40 116.65 2cqv s VAL 19 Ca 0.29 0.01 -0.30 0.00 -2.93 0.00 0.00 61.98 59.04 2cqv s VAL 19 Cb 0.02 -0.76 -0.08 0.00 -1.53 0.00 0.00 36.38 34.03 2cqv s VAL 19 CO 0.12 0.00 1.24 -0.13 -3.33 0.00 0.00 175.10 173.01 2cqv s ARG 20 N 0.41 4.44 -0.31 1.54 1.81 -1.26 -1.14 118.95 124.43 2cqv s ARG 20 Ca -0.01 1.91 -0.35 0.00 -1.72 0.00 0.00 55.73 55.57 2cqv s ARG 20 Cb -0.04 -3.26 -0.11 0.00 -0.45 0.00 0.00 34.95 31.09 2cqv s ARG 20 CO -0.01 -0.20 2.14 0.00 -0.68 0.00 0.00 175.30 176.55 2cqv n ALA 21 N 3.03 1.08 0.00 2.13 0.00 0.93 -0.30 120.51 127.38 2cqv n ALA 21 Ca 0.07 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2cqv n ALA 21 Cb 0.44 -2.57 0.00 0.00 0.00 0.00 0.00 19.45 17.32 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 6.15 2.48 2.48 0.00 0.00 -0.06 -4.85 105.19 111.39 2cqv n GLY 22 Ca 0.38 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.19 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 -0.50 -2.18 -4.57 1.61 -0.58 0.59 -3.56 120.64 111.45 2cqv n GLU 23 Ca 0.00 -1.25 -0.29 0.00 -0.42 0.00 0.00 57.16 55.20 2cqv n GLU 23 Cb 0.00 -1.10 -0.17 0.00 -0.57 0.00 0.00 31.44 29.60 2cqv n GLU 23 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 2cqv s SER 24 N -3.71 2.48 0.17 1.62 1.04 -1.26 -1.49 113.70 112.54 2cqv s SER 24 Ca 0.50 -0.44 0.08 0.00 0.48 0.00 0.00 55.95 56.57 2cqv s SER 24 Cb -0.04 -1.12 -0.04 0.00 0.10 0.00 0.00 66.02 64.92 2cqv s SER 24 CO 0.38 0.04 -0.03 0.54 0.98 0.00 0.00 173.24 175.14 2cqv s VAL 25 N 0.87 3.58 -0.30 5.02 0.11 -1.10 -4.95 120.40 123.63 2cqv s VAL 25 Ca -0.09 -1.47 -0.02 0.00 -2.93 0.00 0.00 61.98 57.48 2cqv s VAL 25 Cb -0.15 -2.78 0.10 0.00 -1.53 0.00 0.00 36.38 32.01 2cqv s VAL 25 CO 0.00 -0.10 0.10 -1.61 -3.33 0.00 0.00 175.10 170.16 2cqv s GLU 26 N -2.87 0.60 -0.46 1.54 8.01 -1.26 -1.58 118.70 122.69 2cqv s GLU 26 Ca 0.26 -0.92 -0.16 0.00 0.01 0.00 0.00 54.97 54.17 2cqv s GLU 26 Cb -0.09 -1.83 0.06 0.00 -4.31 0.00 0.00 34.13 27.96 2cqv s GLU 26 CO 0.17 -0.97 0.38 -0.51 0.01 0.00 0.00 175.26 174.35 2cqv s LEU 27 N 1.73 5.46 -0.11 1.80 1.43 -1.08 -4.91 118.68 123.01 2cqv s LEU 27 Ca 0.09 -1.19 0.01 0.00 -1.03 0.00 0.00 54.13 52.01 2cqv s LEU 27 Cb -0.17 -2.19 -0.02 0.00 0.03 0.00 0.00 46.19 43.84 2cqv s LEU 27 CO -0.26 -0.61 -0.15 0.12 0.23 0.00 0.00 176.35 175.68 2cqv s PHE 28 N 1.71 2.75 -0.33 0.29 5.36 -1.26 -1.10 117.98 125.39 2cqv s PHE 28 Ca 0.05 -0.59 0.02 0.00 -0.96 0.00 0.00 56.93 55.45 2cqv s PHE 28 Cb -0.23 -1.78 0.09 0.00 -0.34 0.00 0.00 43.02 40.77 2cqv s PHE 28 CO 0.08 -0.15 0.04 0.20 -1.46 0.00 0.00 175.22 173.93 2cqv s GLY 29 N 0.11 1.89 0.15 13.12 0.00 -1.00 -4.39 107.32 117.20 2cqv s GLY 29 Ca -0.07 -2.35 -0.31 0.00 0.00 0.00 0.00 44.72 41.98 2cqv s GLY 29 CO 0.05 0.88 1.75 1.25 0.00 0.00 0.00 173.10 177.03 2cqv s LYS 30 N 0.99 4.15 0.01 2.90 2.20 -0.79 -3.78 119.74 125.42 2cqv s LYS 30 Ca 0.06 2.55 0.08 0.00 -0.36 0.00 0.00 55.97 58.30 2cqv s LYS 30 Cb -0.20 -3.39 -0.03 0.00 -1.51 0.00 0.00 37.83 32.71 2cqv s LYS 30 CO -0.06 -0.78 -0.24 0.14 -0.36 0.00 0.00 175.35 174.05 2cqv s VAL 31 N 2.08 2.27 0.11 4.02 -7.23 0.71 -2.76 120.40 119.60 2cqv s VAL 31 Ca 0.77 -1.18 0.05 0.00 -1.81 0.00 0.00 61.98 59.81 2cqv s VAL 31 Cb -0.46 -1.85 -0.04 0.00 0.56 0.00 0.00 36.38 34.59 2cqv s VAL 31 CO 0.34 0.48 -0.12 0.28 -0.31 0.00 0.00 175.10 175.77 2cqv s THR 32 N -0.73 1.15 0.00 5.32 -1.32 -0.40 -4.65 115.64 115.01 2cqv s THR 32 Ca 0.11 -1.68 0.00 0.00 -1.21 0.00 0.00 61.69 58.92 2cqv s THR 32 Cb -0.10 -1.44 0.00 0.00 -1.51 0.00 0.00 72.50 69.44 2cqv s THR 32 CO 0.01 -0.48 0.00 0.61 -2.21 0.00 0.00 174.62 172.55 2cqv n GLY 33 N 0.55 -0.58 3.03 6.08 0.00 -1.26 -1.34 105.19 111.67 2cqv n GLY 33 Ca -0.16 0.22 -0.05 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.74 0.62 2.61 2.01 -1.26 -4.64 115.64 114.25 2cqv s THR 34 Ca 0.00 -0.03 -0.15 0.00 0.31 0.00 0.00 61.69 61.82 2cqv s THR 34 Cb 0.00 -0.86 -0.02 0.00 0.01 0.00 0.00 72.50 71.63 2cqv s THR 34 CO 0.00 -0.07 1.07 -1.10 -0.69 0.00 0.00 174.62 173.84 2cqv s GLN 35 N 2.66 3.11 0.80 4.92 -1.52 -1.26 -4.38 119.66 123.98 2cqv s GLN 35 Ca 0.14 1.25 -0.11 0.00 -1.95 0.00 0.00 55.36 54.69 2cqv s GLN 35 Cb -0.15 -2.00 0.07 0.00 -0.22 0.00 0.00 33.01 30.71 2cqv s GLN 35 CO -0.17 -0.99 1.09 -1.25 -0.25 0.00 0.00 175.29 173.72 2cqv s PRO 36 N -4.16 2.01 -0.04 2.91 0.04 -1.26 -5.10 135.00 129.40 2cqv s PRO 36 Ca 0.64 1.09 -0.00 0.00 0.04 0.00 0.00 61.00 62.77 2cqv s PRO 36 Cb -0.17 -1.87 0.03 0.00 0.04 0.00 0.00 34.50 32.52 2cqv s PRO 36 CO 0.40 -1.79 0.00 0.42 0.04 0.00 0.00 177.00 176.07 2cqv s ILE 37 N -2.91 0.24 0.54 0.56 1.01 -1.26 -4.68 121.20 114.70 2cqv s ILE 37 Ca 0.62 0.11 -0.19 0.00 0.00 0.00 0.00 60.65 61.20 2cqv s ILE 37 Cb -0.17 -0.37 -0.06 0.00 0.01 0.00 0.00 42.46 41.87 2cqv s ILE 37 CO 0.56 0.19 1.07 -0.89 0.00 0.00 0.00 174.94 175.88 2cqv s THR 38 N 1.43 3.56 -0.19 2.92 2.01 0.11 -4.94 115.64 120.55 2cqv s THR 38 Ca -0.04 0.90 -0.05 0.00 0.31 0.00 0.00 61.69 62.81 2cqv s THR 38 Cb -0.13 -3.36 0.09 0.00 0.01 0.00 0.00 72.50 69.11 2cqv s THR 38 CO -0.03 -0.28 0.35 0.00 -0.69 0.00 0.00 174.62 173.97 2cqv s THR 40 N 2.52 1.09 -0.27 0.00 2.01 0.10 -4.98 115.64 116.11 2cqv s THR 40 Ca 0.03 -0.57 -0.08 0.00 0.31 0.00 0.00 61.69 61.38 2cqv s THR 40 Cb -0.13 -0.92 -0.02 0.00 0.01 0.00 0.00 72.50 71.44 2cqv s THR 40 CO -0.12 0.31 0.09 0.26 -0.69 0.00 0.00 174.62 174.47 2cqv s TRP 41 N -0.19 3.11 -0.02 4.92 0.52 -1.26 -0.30 118.94 125.72 2cqv s TRP 41 Ca 0.03 -0.56 0.04 0.00 0.02 0.00 0.00 56.10 55.63 2cqv s TRP 41 Cb -0.07 -2.26 -0.01 0.00 -1.15 0.00 0.00 33.47 29.98 2cqv s TRP 41 CO -0.00 -0.42 -0.14 -1.64 0.02 0.00 0.00 176.95 174.77 2cqv s MET 42 N 1.59 1.31 -0.19 4.98 -1.94 0.22 -1.25 119.30 124.02 2cqv s MET 42 Ca 0.05 -0.50 -0.02 0.00 -1.71 0.00 0.00 55.69 53.52 2cqv s MET 42 Cb -0.16 -1.21 -0.00 0.00 2.01 0.00 0.00 34.83 35.47 2cqv s MET 42 CO 0.04 0.25 -0.09 0.21 -0.01 0.00 0.00 175.02 175.41 2cqv s LYS 43 N -0.10 3.30 -1.28 2.03 2.20 0.27 0.14 119.74 126.29 2cqv s LYS 43 Ca 0.01 -0.68 -0.03 0.00 -0.36 0.00 0.00 55.97 54.91 2cqv s LYS 43 Cb -0.08 -2.84 0.01 0.00 -1.51 0.00 0.00 37.83 33.41 2cqv s LYS 43 CO 0.00 -0.12 0.97 1.19 -0.36 0.00 0.00 175.35 177.03 2cqv n PHE 44 N 4.50 -2.27 -2.37 4.03 3.72 -0.96 -1.50 117.46 122.61 2cqv n PHE 44 Ca -0.19 0.93 -0.20 0.00 -0.05 0.00 0.00 57.45 57.95 2cqv n PHE 44 Cb 0.51 -4.83 -0.01 0.00 -0.94 0.00 0.00 39.48 34.21 2cqv n PHE 44 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2cqv n ARG 45 N -4.38 -1.57 -3.90 -1.08 5.12 -1.26 -4.98 116.66 104.61 2cqv n ARG 45 Ca -0.21 0.96 -0.28 0.00 -1.93 0.00 0.00 57.85 56.38 2cqv n ARG 45 Cb 0.64 -5.55 -0.16 0.00 -1.16 0.00 0.00 32.46 26.23 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 -4.97 1.48 0.01 5.56 2.47 -0.56 -5.10 119.74 118.63 2cqv s LYS 46 Ca 0.00 -0.56 -0.32 0.00 -1.56 0.00 0.00 55.97 53.53 2cqv s LYS 46 Cb 0.00 -2.06 -0.11 0.00 -1.46 0.00 0.00 37.83 34.20 2cqv s LYS 46 CO 0.00 -0.44 1.88 0.94 0.16 0.00 0.00 175.35 177.90 2cqv n GLN 47 N 4.85 2.52 -2.35 4.03 7.27 -1.26 -0.57 117.38 131.87 2cqv n GLN 47 Ca -0.12 0.92 -0.39 0.00 0.07 0.00 0.00 57.00 57.48 2cqv n GLN 47 Cb 0.47 -2.81 -0.03 0.00 2.41 0.00 0.00 30.24 30.29 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 3.75 3.27 -0.25 1.69 1.01 -0.38 -4.90 121.20 125.38 2cqv s ILE 48 Ca 0.89 1.11 -0.07 0.00 0.00 0.00 0.00 60.65 62.57 2cqv s ILE 48 Cb -0.57 -3.64 -0.03 0.00 0.01 0.00 0.00 42.46 38.23 2cqv s ILE 48 CO 0.45 0.14 0.07 -1.10 0.00 0.00 0.00 174.94 174.50 2cqv s GLN 49 N -2.10 3.62 0.22 2.79 -0.21 -1.26 -4.91 119.66 117.80 2cqv s GLN 49 Ca 0.54 -0.50 -0.32 0.00 0.02 0.00 0.00 55.36 55.10 2cqv s GLN 49 Cb -0.30 -3.31 -0.14 0.00 1.00 0.00 0.00 33.01 30.25 2cqv s GLN 49 CO 0.39 -0.20 1.40 0.39 -2.12 0.00 0.00 175.29 175.15 2cqv n GLU 50 N 4.92 1.92 -3.94 2.91 1.02 -1.26 -4.63 120.64 121.57 2cqv n GLU 50 Ca -0.16 0.68 0.01 0.00 -0.02 0.00 0.00 57.16 57.67 2cqv n GLU 50 Cb 0.51 -2.34 0.01 0.00 -0.02 0.00 0.00 31.44 29.61 2cqv n GLU 50 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2cqv s SER 51 N 0.35 0.00 0.36 1.62 0.01 0.12 -4.94 113.70 111.22 2cqv s SER 51 Ca 0.71 -0.32 0.26 0.00 1.31 0.00 0.00 55.95 57.91 2cqv s SER 51 Cb -0.69 0.23 1.29 0.00 0.21 0.00 0.00 66.02 67.07 2cqv s SER 51 CO 0.48 -0.47 1.79 -0.33 0.41 0.00 0.00 173.24 175.13 2cqv h GLU 52 N 2.00 0.00 0.09 12.44 4.39 -1.98 -1.92 114.58 129.60 2cqv h GLU 52 Ca -0.24 0.00 -0.35 0.00 0.34 0.00 0.00 59.36 59.11 2cqv h GLU 52 Cb 1.19 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.82 2cqv h GLU 52 CO 0.32 0.00 -1.97 0.72 -1.16 0.00 0.00 179.01 176.92 2cqv n HIS 53 N -2.42 1.14 -3.66 4.33 8.25 -1.26 -4.33 115.22 117.27 2cqv n HIS 53 Ca -0.00 0.27 -0.28 0.00 -0.26 0.00 0.00 57.72 57.45 2cqv n HIS 53 Cb 0.12 -1.16 -0.16 0.00 1.12 0.00 0.00 29.99 29.91 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 -2.56 0.39 0.38 -0.41 -1.94 -0.73 -1.05 119.30 113.37 2cqv s MET 54 Ca -0.19 -0.43 0.07 0.00 -1.71 0.00 0.00 55.69 53.43 2cqv s MET 54 Cb 0.07 -1.81 -0.01 0.00 2.01 0.00 0.00 34.83 35.09 2cqv s MET 54 CO 0.77 -0.77 0.47 0.15 -0.01 0.00 0.00 175.02 175.62 2cqv s LYS 55 N 1.96 2.87 -0.08 2.03 1.02 0.18 0.12 119.74 127.85 2cqv s LYS 55 Ca 0.03 -1.21 -0.04 0.00 0.02 0.00 0.00 55.97 54.77 2cqv s LYS 55 Cb -0.17 -2.68 0.04 0.00 -0.52 0.00 0.00 37.83 34.50 2cqv s LYS 55 CO -0.17 -0.09 0.18 0.08 -0.92 0.00 0.00 175.35 174.43 2cqv s VAL 56 N -2.30 -0.04 -0.78 3.17 1.01 -1.26 -2.15 120.40 118.05 2cqv s VAL 56 Ca 0.48 0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.60 2cqv s VAL 56 Cb -0.08 -0.28 0.19 0.00 0.00 0.00 0.00 36.38 36.21 2cqv s VAL 56 CO 0.31 0.05 0.62 -1.61 0.00 0.00 0.00 175.10 174.47 2cqv s GLU 57 N 0.96 2.87 -0.10 2.72 2.02 -0.65 -4.95 118.70 121.56 2cqv s GLU 57 Ca -0.07 -3.17 -0.29 0.00 0.02 0.00 0.00 54.97 51.45 2cqv s GLU 57 Cb -0.09 -3.73 -0.05 0.00 0.10 0.00 0.00 34.13 30.36 2cqv s GLU 57 CO -0.05 -1.25 1.65 -0.80 0.02 0.00 0.00 175.26 174.83 2cqv s ASN 58 N -0.44 6.57 0.37 -0.19 -0.87 -1.26 -2.90 114.94 116.22 2cqv s ASN 58 Ca 0.25 2.06 0.06 0.00 -1.57 0.00 0.00 52.86 53.66 2cqv s ASN 58 Cb -0.09 -2.53 -0.02 0.00 -0.02 0.00 0.00 41.25 38.58 2cqv s ASN 58 CO -0.12 -1.03 0.23 -1.20 -2.57 0.00 0.00 177.10 172.41 2cqv n SER 59 N 7.58 0.03 0.36 -1.22 7.64 0.30 -5.02 113.62 123.28 2cqv n SER 59 Ca 0.18 -3.23 -0.15 0.00 1.01 0.00 0.00 58.87 56.69 2cqv n SER 59 Cb 0.43 1.46 -0.07 0.00 -1.01 0.00 0.00 64.21 65.02 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 -0.91 -1.06 1.43 4.81 -1.97 -3.10 114.58 113.78 2cqv h GLU 60 Ca -0.27 0.06 0.31 0.00 -0.13 0.00 0.00 59.36 59.33 2cqv h GLU 60 Cb 1.23 0.21 -0.13 0.00 0.63 0.00 0.00 28.75 30.69 2cqv h GLU 60 CO 0.41 -0.61 0.64 -0.91 -0.73 0.00 0.00 179.01 177.81 2cqv h ASN 61 N -1.21 0.49 0.00 1.04 4.21 -1.98 -3.45 115.58 114.68 2cqv h ASN 61 Ca -0.10 0.15 0.00 0.00 1.21 0.00 0.00 56.30 57.56 2cqv h ASN 61 Cb 0.73 0.09 0.00 0.00 -1.12 0.00 0.00 38.32 38.02 2cqv h ASN 61 CO 0.16 -0.05 0.00 0.61 -1.29 0.00 0.00 177.43 176.86 2cqv n GLY 62 N -1.37 -0.82 2.88 2.83 0.00 -1.17 -0.20 105.19 107.34 2cqv n GLY 62 Ca 0.30 -0.19 -0.13 0.00 0.00 0.00 0.00 46.02 46.00 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 0.11 0.16 1.61 0.15 -1.25 -0.54 113.70 109.94 2cqv s SER 63 Ca 0.00 -0.01 0.08 0.00 0.70 0.00 0.00 55.95 56.71 2cqv s SER 63 Cb 0.00 -0.02 -0.04 0.00 -1.71 0.00 0.00 66.02 64.25 2cqv s SER 63 CO 0.00 0.00 -0.06 -0.75 1.20 0.00 0.00 173.24 173.64 2cqv s LYS 64 N 0.05 2.22 -0.35 5.44 2.20 -1.14 -2.38 119.74 125.77 2cqv s LYS 64 Ca -0.00 -1.14 -0.00 0.00 -0.36 0.00 0.00 55.97 54.46 2cqv s LYS 64 Cb -0.01 -2.28 0.12 0.00 -1.51 0.00 0.00 37.83 34.15 2cqv s LYS 64 CO -0.00 0.46 0.16 -1.17 -0.36 0.00 0.00 175.35 174.43 2cqv s LEU 65 N -2.73 2.11 -0.11 5.43 2.96 -0.26 -1.64 118.68 124.44 2cqv s LEU 65 Ca 0.25 -1.98 -0.24 0.00 -0.22 0.00 0.00 54.13 51.95 2cqv s LEU 65 Cb -0.10 -0.82 -0.03 0.00 0.50 0.00 0.00 46.19 45.74 2cqv s LEU 65 CO 0.16 -0.36 0.73 -0.89 -1.32 0.00 0.00 176.35 174.67 2cqv s THR 66 N 1.21 5.00 -0.28 3.68 2.01 -0.91 -2.64 115.64 123.70 2cqv s THR 66 Ca 0.13 1.47 -0.05 0.00 0.31 0.00 0.00 61.69 63.55 2cqv s THR 66 Cb -0.20 -4.06 0.02 0.00 0.01 0.00 0.00 72.50 68.27 2cqv s THR 66 CO -0.15 0.17 0.04 -0.63 -0.69 0.00 0.00 174.62 173.36 2cqv s ILE 67 N 1.32 3.61 0.25 1.82 1.01 -0.62 -0.64 121.20 127.96 2cqv s ILE 67 Ca 0.37 -0.82 -0.12 0.00 0.00 0.00 0.00 60.65 60.08 2cqv s ILE 67 Cb -0.17 -2.87 -0.08 0.00 0.01 0.00 0.00 42.46 39.35 2cqv s ILE 67 CO 0.16 0.10 0.61 -0.76 0.00 0.00 0.00 174.94 175.05 2cqv s LEU 68 N 1.44 4.15 -1.38 2.97 2.01 -0.22 -2.69 118.68 124.95 2cqv s LEU 68 Ca 0.02 1.04 -0.11 0.00 0.01 0.00 0.00 54.13 55.08 2cqv s LEU 68 Cb -0.17 -3.78 0.01 0.00 0.01 0.00 0.00 46.19 42.26 2cqv s LEU 68 CO 0.00 -0.10 0.36 0.00 1.01 0.00 0.00 176.35 177.63 2cqv n ALA 69 N -0.14 -2.23 -1.02 4.21 0.00 -1.18 -4.45 120.51 115.69 2cqv n ALA 69 Ca 0.01 -0.41 -0.19 0.00 0.00 0.00 0.00 53.44 52.85 2cqv n ALA 69 Cb 0.53 -1.80 -0.14 0.00 0.00 0.00 0.00 19.45 18.04 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 -4.63 0.58 -1.79 0.00 0.00 -0.56 -4.24 120.51 109.89 2cqv n ALA 70 Ca -0.24 -0.44 -0.33 0.00 0.00 0.00 0.00 53.44 52.43 2cqv n ALA 70 Cb 0.65 -1.61 -0.03 0.00 0.00 0.00 0.00 19.45 18.46 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 5.22 3.82 0.50 0.00 0.52 -1.26 -0.88 118.95 126.88 2cqv s ARG 71 Ca 0.91 1.14 0.22 0.00 -0.52 0.00 0.00 55.73 57.48 2cqv s ARG 71 Cb -0.67 -2.11 1.21 0.00 0.52 0.00 0.00 34.95 33.90 2cqv s ARG 71 CO 0.37 -0.39 1.64 0.37 0.02 0.00 0.00 175.30 177.31 2cqv h GLN 72 N 1.13 0.00 0.09 3.54 5.75 -1.93 0.38 115.11 124.07 2cqv h GLN 72 Ca -0.48 0.00 -0.26 0.00 -0.15 0.00 0.00 58.65 57.76 2cqv h GLN 72 Cb 1.20 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.74 2cqv h GLN 72 CO 0.60 0.00 -1.20 1.05 -2.65 0.00 0.00 178.83 176.63 2cqv h GLU 73 N 0.00 0.19 -0.90 1.69 4.11 -1.97 -3.23 114.58 114.47 2cqv h GLU 73 Ca 0.00 -0.32 0.23 0.00 0.07 0.00 0.00 59.36 59.34 2cqv h GLU 73 Cb 0.61 0.12 -0.05 0.00 0.50 0.00 0.00 28.75 29.92 2cqv h GLU 73 CO 0.00 1.14 0.62 0.45 0.07 0.00 0.00 179.01 181.29 2cqv h HIS 74 N 0.05 0.27 -1.44 2.06 3.86 -0.58 -3.41 115.15 115.96 2cqv h HIS 74 Ca -0.11 0.01 -0.74 0.00 -1.16 0.00 0.00 60.37 58.37 2cqv h HIS 74 Cb 1.92 -0.08 0.03 0.00 1.06 0.00 0.00 27.41 30.34 2cqv h HIS 74 CO 0.04 0.06 0.59 0.00 0.86 0.00 0.00 177.93 179.49 2cqv n GLY 76 N 3.19 0.08 3.80 0.00 0.00 0.01 -4.97 105.19 107.31 2cqv n GLY 76 Ca 0.23 -1.55 -0.37 0.00 0.00 0.00 0.00 46.02 44.34 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 -0.33 1.94 -0.22 0.00 1.51 0.02 -2.26 117.35 118.02 2cqv s TYR 78 Ca 0.18 -0.64 -0.07 0.00 -1.01 0.00 0.00 57.07 55.53 2cqv s TYR 78 Cb -0.14 -2.19 0.10 0.00 -0.11 0.00 0.00 41.96 39.62 2cqv s TYR 78 CO 0.06 -0.73 0.45 0.99 -1.11 0.00 0.00 175.55 175.21 2cqv s THR 79 N -2.59 -0.70 -0.44 -0.71 2.01 0.36 -2.46 115.64 111.10 2cqv s THR 79 Ca 0.54 0.13 -0.17 0.00 0.31 0.00 0.00 61.69 62.49 2cqv s THR 79 Cb -0.06 -0.73 0.04 0.00 0.01 0.00 0.00 72.50 71.76 2cqv s THR 79 CO 0.33 0.05 0.43 -0.22 -0.69 0.00 0.00 174.62 174.51 2cqv s LEU 80 N 2.65 5.08 -0.24 4.42 2.96 -1.23 -0.61 118.68 131.72 2cqv s LEU 80 Ca -0.01 -0.88 -0.13 0.00 -0.22 0.00 0.00 54.13 52.89 2cqv s LEU 80 Cb -0.12 -2.31 -0.04 0.00 0.50 0.00 0.00 46.19 44.21 2cqv s LEU 80 CO -0.14 -0.61 0.30 -0.22 -1.32 0.00 0.00 176.35 174.36 2cqv s LEU 81 N 2.02 4.10 -0.30 -0.68 2.96 0.59 -2.02 118.68 125.35 2cqv s LEU 81 Ca 0.09 0.28 0.02 0.00 -0.22 0.00 0.00 54.13 54.31 2cqv s LEU 81 Cb -0.19 -2.33 0.08 0.00 0.50 0.00 0.00 46.19 44.26 2cqv s LEU 81 CO 0.11 -0.06 0.00 0.68 -1.32 0.00 0.00 176.35 175.77 2cqv s VAL 82 N 1.46 1.91 0.14 1.68 -7.23 0.57 0.01 120.40 118.94 2cqv s VAL 82 Ca 0.13 -1.84 0.05 0.00 -1.81 0.00 0.00 61.98 58.51 2cqv s VAL 82 Cb -0.15 -2.28 -0.04 0.00 0.56 0.00 0.00 36.38 34.47 2cqv s VAL 82 CO 0.08 -0.40 0.06 -1.61 -0.31 0.00 0.00 175.10 172.92 2cqv s GLU 83 N 1.14 2.67 0.28 4.82 2.02 -1.16 -0.64 118.70 127.84 2cqv s GLU 83 Ca 0.03 -0.92 -0.20 0.00 0.02 0.00 0.00 54.97 53.91 2cqv s GLU 83 Cb -0.19 -2.54 0.05 0.00 0.10 0.00 0.00 34.13 31.54 2cqv s GLU 83 CO -0.09 0.50 0.83 0.54 0.02 0.00 0.00 175.26 177.05 2cqv s ASN 84 N -2.81 -0.12 0.23 -0.19 4.22 0.13 0.07 114.94 116.47 2cqv s ASN 84 Ca 0.29 -0.77 -0.12 0.00 -2.14 0.00 0.00 52.86 50.12 2cqv s ASN 84 Cb -0.10 0.70 0.31 0.00 1.28 0.00 0.00 41.25 43.43 2cqv s ASN 84 CO 0.21 -1.35 1.61 0.50 -2.04 0.00 0.00 177.10 176.03 2cqv h LYS 85 N 2.00 0.01 0.00 3.55 3.64 -1.89 -3.01 116.57 120.87 2cqv h LYS 85 Ca -0.26 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.12 2cqv h LYS 85 Cb 1.24 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.06 2cqv h LYS 85 CO 0.31 0.01 0.00 1.28 -2.27 0.00 0.00 179.45 178.78 2cqv n LEU 86 N -5.47 0.01 0.00 5.20 4.32 -1.26 -5.02 117.00 114.78 2cqv n LEU 86 Ca 0.10 0.69 0.00 0.00 -0.02 0.00 0.00 56.01 56.78 2cqv n LEU 86 Cb 0.38 -0.19 0.00 0.00 -1.62 0.00 0.00 43.42 41.99 2cqv n LEU 86 CO 0.01 -0.19 0.00 0.61 -1.22 0.00 0.00 177.39 176.59 2cqv n GLY 87 N -0.68 4.82 3.64 -0.72 0.00 -1.14 -4.94 105.19 106.17 2cqv n GLY 87 Ca 0.00 -0.69 -0.09 0.00 0.00 0.00 0.00 46.02 45.25 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 1.40 -0.13 0.14 1.61 1.04 -1.26 0.17 113.70 116.67 2cqv s SER 88 Ca 0.00 -0.85 -0.19 0.00 0.48 0.00 0.00 55.95 55.40 2cqv s SER 88 Cb 0.00 0.61 0.05 0.00 0.10 0.00 0.00 66.02 66.78 2cqv s SER 88 CO 0.00 -1.18 0.47 -0.60 0.98 0.00 0.00 173.24 172.92 2cqv s ARG 89 N -3.99 1.14 -0.10 4.02 6.06 0.18 -4.77 118.95 121.49 2cqv s ARG 89 Ca 0.20 -0.61 -0.09 0.00 -2.50 0.00 0.00 55.73 52.72 2cqv s ARG 89 Cb -0.02 0.51 0.03 0.00 0.06 0.00 0.00 34.95 35.54 2cqv s ARG 89 CO 0.08 -0.47 0.27 1.14 -2.50 0.00 0.00 175.30 173.83 2cqv s GLN 90 N -3.76 0.30 0.47 5.12 -2.07 -1.26 -0.32 119.66 118.15 2cqv s GLN 90 Ca 0.02 0.41 0.02 0.00 -1.82 0.00 0.00 55.36 53.99 2cqv s GLN 90 Cb 0.01 0.11 0.02 0.00 -1.09 0.00 0.00 33.01 32.05 2cqv s GLN 90 CO -0.12 -0.06 0.14 0.00 -1.32 0.00 0.00 175.29 173.93 2cqv n ALA 91 N 3.17 0.53 -3.66 2.60 0.00 -0.86 -4.93 120.51 117.36 2cqv n ALA 91 Ca -0.15 -2.00 -0.07 0.00 0.00 0.00 0.00 53.44 51.22 2cqv n ALA 91 Cb 0.57 0.99 -0.08 0.00 0.00 0.00 0.00 19.45 20.93 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 -3.77 0.41 -0.09 0.00 -0.21 -1.26 -3.52 119.66 111.21 2cqv s GLN 92 Ca 0.11 1.10 -0.01 0.00 0.02 0.00 0.00 55.36 56.57 2cqv s GLN 92 Cb -0.01 0.37 0.03 0.00 1.00 0.00 0.00 33.01 34.40 2cqv s GLN 92 CO 0.07 -0.22 -0.02 0.54 -2.12 0.00 0.00 175.29 173.54 2cqv s VAL 93 N 2.40 0.61 0.40 1.09 0.11 -1.03 -4.89 120.40 119.09 2cqv s VAL 93 Ca -0.04 -0.07 -0.24 0.00 -2.93 0.00 0.00 61.98 58.70 2cqv s VAL 93 Cb -0.11 -0.75 -0.09 0.00 -1.53 0.00 0.00 36.38 33.90 2cqv s VAL 93 CO -0.15 0.26 1.02 0.20 -3.33 0.00 0.00 175.10 173.11 2cqv s ASN 94 N 1.87 6.84 0.01 3.54 0.01 -1.26 -0.80 114.94 125.16 2cqv s ASN 94 Ca 0.05 1.95 -0.05 0.00 -0.71 0.00 0.00 52.86 54.10 2cqv s ASN 94 Cb -0.13 -2.58 -0.01 0.00 0.41 0.00 0.00 41.25 38.95 2cqv s ASN 94 CO -0.06 -0.43 0.08 -0.22 -1.51 0.00 0.00 177.10 174.96 2cqv s LEU 95 N -2.68 1.79 -0.01 0.60 2.96 0.14 -2.00 118.68 119.47 2cqv s LEU 95 Ca 0.58 -0.36 -0.03 0.00 -0.22 0.00 0.00 54.13 54.10 2cqv s LEU 95 Cb -0.19 0.51 -0.00 0.00 0.50 0.00 0.00 46.19 47.01 2cqv s LEU 95 CO 0.24 -0.38 0.07 -0.89 -1.32 0.00 0.00 176.35 174.07 2cqv s THR 96 N -1.67 0.04 -0.14 3.68 2.01 -1.12 -0.81 115.64 117.63 2cqv s THR 96 Ca -0.13 -0.35 -0.02 0.00 0.31 0.00 0.00 61.69 61.49 2cqv s THR 96 Cb -0.07 -0.22 -0.02 0.00 0.01 0.00 0.00 72.50 72.20 2cqv s THR 96 CO -0.00 -0.19 -0.07 -0.69 -0.69 0.00 0.00 174.62 172.98 2cqv s VAL 97 N -0.60 3.65 -0.15 3.82 1.01 -1.26 -1.09 120.40 125.78 2cqv s VAL 97 Ca -0.07 -0.45 0.00 0.00 0.00 0.00 0.00 61.98 61.46 2cqv s VAL 97 Cb -0.04 -2.57 0.03 0.00 0.00 0.00 0.00 36.38 33.80 2cqv s VAL 97 CO 0.00 0.51 -0.11 0.68 0.00 0.00 0.00 175.10 176.19 2cqv s VAL 98 N 0.22 1.35 -1.91 2.92 -7.23 -0.29 -4.83 120.40 110.63 2cqv s VAL 98 Ca -0.04 -0.57 0.11 0.00 -1.81 0.00 0.00 61.98 59.67 2cqv s VAL 98 Cb -0.14 -1.34 0.33 0.00 0.56 0.00 0.00 36.38 35.78 2cqv s VAL 98 CO 0.04 0.36 1.26 -0.67 -0.31 0.00 0.00 175.10 175.77 2cqv n ASP 99 N 4.83 2.04 -4.14 4.85 2.03 -1.26 -0.05 116.55 124.85 2cqv n ASP 99 Ca -0.15 -2.03 -0.15 0.00 0.52 0.00 0.00 54.79 52.99 2cqv n ASP 99 Cb 0.49 -0.27 -0.11 0.00 -0.72 0.00 0.00 41.12 40.52 2cqv n ASP 99 CO 0.00 0.00 0.00 -1.59 -1.92 0.00 0.00 177.20 173.69 2cqv s LYS 100 N -1.54 0.74 0.53 -0.67 -2.85 -1.26 -4.91 119.74 109.79 2cqv s LYS 100 Ca 0.24 -1.00 -0.20 0.00 -1.00 0.00 0.00 55.97 54.02 2cqv s LYS 100 Cb 0.13 -0.52 -0.06 0.00 -2.06 0.00 0.00 37.83 35.32 2cqv s LYS 100 CO 0.16 0.09 1.13 -1.25 0.10 0.00 0.00 175.35 175.59 2cqv s PRO 101 N -2.21 3.41 -0.01 1.78 0.04 -1.26 -5.01 135.00 131.74 2cqv s PRO 101 Ca -0.01 1.63 0.05 0.00 0.04 0.00 0.00 61.00 62.72 2cqv s PRO 101 Cb -0.06 -2.06 -0.01 0.00 0.04 0.00 0.00 34.50 32.40 2cqv s PRO 101 CO 0.00 -0.81 -0.17 0.34 0.04 0.00 0.00 177.00 176.41 2cqv s ASP 102 N -1.72 1.94 0.96 6.66 -1.08 -1.26 -5.15 116.67 117.03 2cqv s ASP 102 Ca 0.72 -0.31 -0.12 0.00 -0.52 0.00 0.00 52.55 52.31 2cqv s ASP 102 Cb -0.24 -0.21 0.17 0.00 -1.46 0.00 0.00 42.92 41.17 2cqv s ASP 102 CO 0.28 0.19 1.09 -2.16 0.52 0.00 0.00 175.17 175.10 2cqv s PRO 103 N -0.45 0.75 -0.08 4.34 0.04 -1.26 -4.96 135.00 133.38 2cqv s PRO 103 Ca 0.06 0.64 -0.30 0.00 0.04 0.00 0.00 61.00 61.45 2cqv s PRO 103 Cb -0.06 -1.76 -0.04 0.00 0.04 0.00 0.00 34.50 32.67 2cqv s PRO 103 CO -0.00 -2.55 1.51 -1.25 0.04 0.00 0.00 177.00 174.75 2cqv s PRO 104 N -4.95 4.21 -0.59 0.56 0.04 -1.26 -4.98 135.00 128.03 2cqv s PRO 104 Ca 0.65 2.01 -0.09 0.00 0.04 0.00 0.00 61.00 63.61 2cqv s PRO 104 Cb -0.18 -3.86 0.15 0.00 0.04 0.00 0.00 34.50 30.64 2cqv s PRO 104 CO 0.57 -0.77 0.46 0.00 0.04 0.00 0.00 177.00 177.31 2cqv s ALA 105 N 3.65 3.59 0.00 8.56 0.00 -1.26 -4.97 121.76 131.34 2cqv s ALA 105 Ca 0.67 -2.87 0.00 0.00 0.00 0.00 0.00 51.96 49.76 2cqv s ALA 105 Cb -0.30 -2.95 0.00 0.00 0.00 0.00 0.00 23.12 19.87 2cqv s ALA 105 CO 0.25 -2.04 0.00 0.41 0.00 0.00 0.00 175.76 174.38 2cqv n GLY 106 N 4.40 -0.66 3.51 0.00 0.00 -1.26 -5.13 105.19 106.05 2cqv n GLY 106 Ca 0.00 -0.50 -0.35 0.00 0.00 0.00 0.00 46.02 45.17 2cqv n GLY 106 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2cqv s THR 107 N -4.00 4.22 -0.53 2.61 -4.23 -1.26 -5.05 115.64 107.40 2cqv s THR 107 Ca 0.00 -0.22 -0.27 0.00 -1.18 0.00 0.00 61.69 60.01 2cqv s THR 107 Cb 0.00 -2.91 -0.02 0.00 1.34 0.00 0.00 72.50 70.91 2cqv s THR 107 CO 0.00 0.43 1.81 -2.16 -0.54 0.00 0.00 174.62 174.17 2cqv s PRO 108 N 0.82 2.86 -0.21 3.99 0.04 -1.26 -4.92 135.00 136.33 2cqv s PRO 108 Ca 0.02 0.82 -0.28 0.00 0.04 0.00 0.00 61.00 61.60 2cqv s PRO 108 Cb -0.14 -4.32 0.13 0.00 0.04 0.00 0.00 34.50 30.21 2cqv s PRO 108 CO 0.02 -2.44 1.02 -1.54 0.04 0.00 0.00 177.00 174.09 2cqv s SER 109 N 7.33 -0.40 0.00 6.66 1.04 -1.26 -5.18 113.70 121.89 2cqv s SER 109 Ca 0.70 0.59 0.00 0.00 0.48 0.00 0.00 55.95 57.72 2cqv s SER 109 Cb -0.15 0.54 0.00 0.00 0.10 0.00 0.00 66.02 66.51 2cqv s SER 109 CO 0.25 -0.26 0.00 0.61 0.98 0.00 0.00 173.24 174.82 2cqv n GLY 110 N 1.36 5.61 3.77 7.32 0.00 -1.26 -5.15 105.19 116.84 2cqv n GLY 110 Ca -0.11 -1.03 -0.33 0.00 0.00 0.00 0.00 46.02 44.55 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 4.93 2.68 -0.40 1.61 0.04 -1.26 -5.02 135.00 137.58 2cqv s PRO 111 Ca 0.00 1.34 -0.10 0.00 0.04 0.00 0.00 61.00 62.28 2cqv s PRO 111 Cb 0.00 -1.94 0.06 0.00 0.04 0.00 0.00 34.50 32.66 2cqv s PRO 111 CO 0.00 -1.34 0.24 0.45 0.04 0.00 0.00 177.00 176.39 2cqv s SER 112 N -2.78 5.67 -0.39 6.66 0.15 -1.26 -5.05 113.70 116.70 2cqv s SER 112 Ca 0.66 -1.30 -0.29 0.00 0.70 0.00 0.00 55.95 55.72 2cqv s SER 112 Cb -0.20 -2.00 0.00 0.00 -1.71 0.00 0.00 66.02 62.12 2cqv s SER 112 CO 0.45 -0.48 1.53 -0.55 1.20 0.00 0.00 173.24 175.39 2cqv s SER 113 N 1.90 6.20 0.00 5.45 0.15 -1.26 -5.37 113.70 120.77 2cqv s SER 113 Ca 0.02 0.94 0.00 0.00 0.70 0.00 0.00 55.95 57.61 2cqv s SER 113 Cb -0.22 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.56 2cqv s SER 113 CO 0.04 -1.53 0.00 0.61 1.20 0.00 0.00 173.24 173.56