#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 -1.54 -4.24 1.61 2.88 -1.26 -4.92 113.62 106.15 2cqv n SER 2 Ca 0.00 -1.16 -0.19 0.00 -1.33 0.00 0.00 58.87 56.19 2cqv n SER 2 Cb 0.00 -2.07 -0.11 0.00 -0.75 0.00 0.00 64.21 61.28 2cqv n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2cqv s SER 3 N -3.60 2.01 0.00 -3.46 0.01 -1.26 -5.09 113.70 102.31 2cqv s SER 3 Ca 0.56 -0.78 0.00 0.00 1.31 0.00 0.00 55.95 57.05 2cqv s SER 3 Cb -0.32 -0.07 0.00 0.00 0.21 0.00 0.00 66.02 65.84 2cqv s SER 3 CO 0.98 -0.12 0.00 0.61 0.41 0.00 0.00 173.24 175.12 2cqv n GLY 4 N 0.67 -1.98 3.53 3.44 0.00 -1.26 -5.09 105.19 104.50 2cqv n GLY 4 Ca -0.16 0.94 -0.42 0.00 0.00 0.00 0.00 46.02 46.37 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 6.67 -0.15 1.61 0.01 -1.26 -4.76 113.70 115.82 2cqv s SER 5 Ca 0.00 -1.98 -0.12 0.00 1.31 0.00 0.00 55.95 55.16 2cqv s SER 5 Cb 0.00 -2.51 -0.04 0.00 0.21 0.00 0.00 66.02 63.68 2cqv s SER 5 CO 0.00 -1.24 -0.20 -1.20 0.41 0.00 0.00 173.24 171.01 2cqv n SER 6 N 7.83 1.84 0.00 2.44 7.64 -1.26 -5.06 113.62 127.05 2cqv n SER 6 Ca 0.35 0.56 0.00 0.00 1.01 0.00 0.00 58.87 60.78 2cqv n SER 6 Cb 0.49 -0.85 0.00 0.00 -1.01 0.00 0.00 64.21 62.84 2cqv n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2cqv n GLY 7 N 1.57 0.31 3.75 0.23 0.00 -1.26 -4.52 105.19 105.26 2cqv n GLY 7 Ca -0.10 -1.12 -0.41 0.00 0.00 0.00 0.00 46.02 44.39 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 4.41 0.02 1.61 0.04 -1.25 -4.36 135.00 133.48 2cqv s PRO 8 Ca 0.00 2.05 -0.08 0.00 0.04 0.00 0.00 61.00 63.01 2cqv s PRO 8 Cb 0.00 -3.17 0.00 0.00 0.04 0.00 0.00 34.50 31.37 2cqv s PRO 8 CO 0.00 -0.19 0.17 1.14 0.04 0.00 0.00 177.00 178.16 2cqv s GLN 9 N -0.55 0.61 -0.56 4.56 -2.07 -0.67 -4.40 119.66 116.57 2cqv s GLN 9 Ca 0.54 -0.54 -0.09 0.00 -1.82 0.00 0.00 55.36 53.44 2cqv s GLN 9 Cb -0.36 0.25 0.14 0.00 -1.09 0.00 0.00 33.01 31.95 2cqv s GLN 9 CO 0.41 -0.16 0.43 0.42 -1.32 0.00 0.00 175.29 175.07 2cqv s ILE 10 N -2.10 4.36 -0.10 3.63 1.01 -1.26 -1.76 121.20 124.97 2cqv s ILE 10 Ca -0.09 -2.11 0.14 0.00 0.00 0.00 0.00 60.65 58.59 2cqv s ILE 10 Cb -0.04 -3.83 -0.01 0.00 0.01 0.00 0.00 42.46 38.59 2cqv s ILE 10 CO -0.02 -0.84 1.32 0.16 0.00 0.00 0.00 174.94 175.57 2cqv h ILE 11 N 5.75 0.96 -3.35 2.92 -2.65 -1.91 -3.44 117.51 115.79 2cqv h ILE 11 Ca -0.13 -2.40 -0.60 0.00 1.03 0.00 0.00 64.86 62.76 2cqv h ILE 11 Cb 1.05 2.44 -0.33 0.00 -2.05 0.00 0.00 36.82 37.92 2cqv h ILE 11 CO 0.82 0.55 -0.85 -1.10 0.03 0.00 0.00 178.15 177.60 2cqv s GLN 12 N -2.91 2.42 -0.28 0.16 -0.21 -1.24 -5.03 119.66 112.57 2cqv s GLN 12 Ca 0.02 -0.65 -0.25 0.00 0.02 0.00 0.00 55.36 54.50 2cqv s GLN 12 Cb 0.08 -1.91 0.10 0.00 1.00 0.00 0.00 33.01 32.28 2cqv s GLN 12 CO 0.77 0.08 0.89 0.12 -2.12 0.00 0.00 175.29 175.02 2cqv s PHE 13 N 0.58 -0.63 0.21 0.91 5.36 -1.26 -1.92 117.98 121.23 2cqv s PHE 13 Ca -0.15 1.52 -0.30 0.00 -0.96 0.00 0.00 56.93 57.04 2cqv s PHE 13 Cb -0.17 0.33 -0.09 0.00 -0.34 0.00 0.00 43.02 42.75 2cqv s PHE 13 CO 0.05 -0.30 1.29 -1.25 -1.46 0.00 0.00 175.22 173.55 2cqv s PRO 14 N 0.34 4.40 0.59 10.12 0.04 -1.26 -5.04 135.00 144.19 2cqv s PRO 14 Ca 0.01 2.05 -0.01 0.00 0.04 0.00 0.00 61.00 63.09 2cqv s PRO 14 Cb -0.05 -3.19 0.12 0.00 0.04 0.00 0.00 34.50 31.42 2cqv s PRO 14 CO -0.03 -0.22 0.81 -0.85 0.04 0.00 0.00 177.00 176.75 2cqv n GLU 15 N 2.43 -0.04 -1.53 4.56 0.28 -1.26 -4.64 120.64 120.44 2cqv n GLU 15 Ca 0.05 -2.11 -0.56 0.00 -0.16 0.00 0.00 57.16 54.38 2cqv n GLU 15 Cb 0.43 -0.57 -0.08 0.00 1.43 0.00 0.00 31.44 32.65 2cqv n GLU 15 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 2cqv n ASP 16 N -2.98 1.91 -4.22 -1.84 5.75 -1.26 -4.66 116.55 109.23 2cqv n ASP 16 Ca 0.13 0.78 -0.13 0.00 -0.01 0.00 0.00 54.79 55.56 2cqv n ASP 16 Cb 0.47 -1.12 -0.10 0.00 -1.03 0.00 0.00 41.12 39.34 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 4.92 1.17 0.41 0.11 -2.07 -0.77 -4.98 119.66 118.45 2cqv s GLN 17 Ca 1.07 -1.60 0.07 0.00 -1.82 0.00 0.00 55.36 53.08 2cqv s GLN 17 Cb -1.11 0.04 -0.05 0.00 -1.09 0.00 0.00 33.01 30.80 2cqv s GLN 17 CO 0.61 -0.29 0.19 0.21 -1.32 0.00 0.00 175.29 174.69 2cqv s LYS 18 N -4.06 2.24 -0.28 9.60 2.20 -1.26 -2.61 119.74 125.57 2cqv s LYS 18 Ca 0.33 -1.82 -0.16 0.00 -0.36 0.00 0.00 55.97 53.95 2cqv s LYS 18 Cb 0.07 -2.01 0.11 0.00 -1.51 0.00 0.00 37.83 34.49 2cqv s LYS 18 CO 0.09 -0.12 0.79 0.54 -0.36 0.00 0.00 175.35 176.29 2cqv s VAL 19 N -2.59 -0.07 0.19 4.02 0.11 -0.20 -4.88 120.40 116.99 2cqv s VAL 19 Ca 0.42 0.00 -0.31 0.00 -2.93 0.00 0.00 61.98 59.16 2cqv s VAL 19 Cb 0.03 -1.00 -0.10 0.00 -1.53 0.00 0.00 36.38 33.78 2cqv s VAL 19 CO 0.23 0.00 1.52 -0.13 -3.33 0.00 0.00 175.10 173.39 2cqv s ARG 20 N 1.63 4.23 -0.33 1.54 1.81 -1.26 -1.82 118.95 124.75 2cqv s ARG 20 Ca -0.09 2.34 -0.36 0.00 -1.72 0.00 0.00 55.73 55.89 2cqv s ARG 20 Cb -0.05 -3.14 -0.12 0.00 -0.45 0.00 0.00 34.95 31.19 2cqv s ARG 20 CO -0.18 -0.54 2.12 0.00 -0.68 0.00 0.00 175.30 176.02 2cqv n ALA 21 N 3.37 0.89 0.00 2.13 0.00 0.71 -0.15 120.51 127.46 2cqv n ALA 21 Ca 0.11 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.58 2cqv n ALA 21 Cb 0.39 -2.49 0.00 0.00 0.00 0.00 0.00 19.45 17.36 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 6.21 1.88 2.34 0.00 0.00 0.13 -4.83 105.19 110.92 2cqv n GLY 22 Ca 0.39 0.00 -0.22 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 -0.29 -3.71 -4.49 1.61 -0.58 0.79 -3.09 120.64 110.88 2cqv n GLU 23 Ca 0.00 -1.10 -0.30 0.00 -0.42 0.00 0.00 57.16 55.34 2cqv n GLU 23 Cb 0.00 -1.32 -0.17 0.00 -0.57 0.00 0.00 31.44 29.39 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 -3.00 2.65 0.16 1.62 1.04 -1.26 -1.74 113.70 113.18 2cqv s SER 24 Ca 0.49 -0.48 0.08 0.00 0.48 0.00 0.00 55.95 56.51 2cqv s SER 24 Cb -0.08 -1.20 -0.04 0.00 0.10 0.00 0.00 66.02 64.80 2cqv s SER 24 CO 0.40 0.03 -0.07 0.54 0.98 0.00 0.00 173.24 175.12 2cqv s VAL 25 N 0.97 3.38 -0.40 5.02 0.11 -1.09 -4.97 120.40 123.42 2cqv s VAL 25 Ca -0.06 -1.48 0.01 0.00 -2.93 0.00 0.00 61.98 57.52 2cqv s VAL 25 Cb -0.15 -2.65 0.14 0.00 -1.53 0.00 0.00 36.38 32.19 2cqv s VAL 25 CO -0.02 -0.04 0.23 -1.61 -3.33 0.00 0.00 175.10 170.32 2cqv s GLU 26 N -2.67 0.94 -0.57 1.54 2.02 -1.26 -1.61 118.70 117.10 2cqv s GLU 26 Ca 0.24 -1.69 -0.23 0.00 0.02 0.00 0.00 54.97 53.31 2cqv s GLU 26 Cb -0.10 -1.85 0.05 0.00 0.10 0.00 0.00 34.13 32.33 2cqv s GLU 26 CO 0.16 -1.18 0.89 -0.51 0.02 0.00 0.00 175.26 174.63 2cqv s LEU 27 N 0.69 4.31 -0.17 1.80 1.43 -1.15 -4.90 118.68 120.69 2cqv s LEU 27 Ca 0.18 -0.59 -0.01 0.00 -1.03 0.00 0.00 54.13 52.68 2cqv s LEU 27 Cb -0.24 -2.67 -0.01 0.00 0.03 0.00 0.00 46.19 43.30 2cqv s LEU 27 CO 0.01 -1.21 -0.11 0.12 0.23 0.00 0.00 176.35 175.38 2cqv s PHE 28 N 3.74 2.86 -0.59 0.29 5.36 -1.26 -1.83 117.98 126.55 2cqv s PHE 28 Ca 0.26 -0.93 -0.05 0.00 -0.96 0.00 0.00 56.93 55.25 2cqv s PHE 28 Cb -0.15 -1.95 0.15 0.00 -0.34 0.00 0.00 43.02 40.73 2cqv s PHE 28 CO 0.16 -0.44 0.42 0.20 -1.46 0.00 0.00 175.22 174.10 2cqv s GLY 29 N 0.93 2.37 -0.02 13.12 0.00 -1.16 -4.45 107.32 118.11 2cqv s GLY 29 Ca -0.02 -3.05 -0.36 0.00 0.00 0.00 0.00 44.72 41.29 2cqv s GLY 29 CO -0.01 1.11 1.65 1.17 0.00 0.00 0.00 173.10 177.01 2cqv n LYS 30 N 3.91 1.72 -5.09 2.90 4.81 -0.81 -4.19 118.16 121.42 2cqv n LYS 30 Ca 0.05 0.63 -0.31 0.00 -0.87 0.00 0.00 58.31 57.80 2cqv n LYS 30 Cb 0.40 -2.37 -0.15 0.00 0.02 0.00 0.00 35.03 32.93 2cqv n LYS 30 CO 0.00 0.00 0.00 0.14 1.17 0.00 0.00 177.40 178.71 2cqv s VAL 31 N 2.27 2.28 0.10 3.15 -7.23 0.82 -2.96 120.40 118.83 2cqv s VAL 31 Ca 0.88 -1.13 0.05 0.00 -1.81 0.00 0.00 61.98 59.97 2cqv s VAL 31 Cb -0.83 -1.85 -0.03 0.00 0.56 0.00 0.00 36.38 34.23 2cqv s VAL 31 CO 0.50 0.51 -0.13 0.28 -0.31 0.00 0.00 175.10 175.94 2cqv s THR 32 N -0.71 1.16 0.00 5.32 -1.32 -0.73 -4.59 115.64 114.78 2cqv s THR 32 Ca 0.11 -1.55 0.00 0.00 -1.21 0.00 0.00 61.69 59.04 2cqv s THR 32 Cb -0.10 -1.33 0.00 0.00 -1.51 0.00 0.00 72.50 69.56 2cqv s THR 32 CO 0.01 -0.38 0.00 0.61 -2.21 0.00 0.00 174.62 172.64 2cqv n GLY 33 N 0.80 -0.71 2.72 6.08 0.00 -1.26 -1.67 105.19 111.15 2cqv n GLY 33 Ca -0.18 0.24 -0.20 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.31 0.68 2.61 2.01 -1.26 -4.95 115.64 114.42 2cqv s THR 34 Ca 0.00 -0.32 -0.15 0.00 0.31 0.00 0.00 61.69 61.53 2cqv s THR 34 Cb 0.00 -0.81 0.01 0.00 0.01 0.00 0.00 72.50 71.71 2cqv s THR 34 CO 0.00 -0.36 1.13 -1.10 -0.69 0.00 0.00 174.62 173.60 2cqv s GLN 35 N 2.30 2.61 0.80 4.92 -1.52 -1.26 -4.43 119.66 123.08 2cqv s GLN 35 Ca 0.08 1.47 -0.11 0.00 -1.95 0.00 0.00 55.36 54.85 2cqv s GLN 35 Cb -0.15 -1.92 0.07 0.00 -0.22 0.00 0.00 33.01 30.79 2cqv s GLN 35 CO -0.22 -1.41 1.09 -1.25 -0.25 0.00 0.00 175.29 173.25 2cqv s PRO 36 N -4.08 2.06 -0.01 2.91 0.04 -1.26 -5.08 135.00 129.58 2cqv s PRO 36 Ca 0.68 1.11 0.00 0.00 0.04 0.00 0.00 61.00 62.83 2cqv s PRO 36 Cb -0.22 -1.88 0.01 0.00 0.04 0.00 0.00 34.50 32.45 2cqv s PRO 36 CO 0.43 -1.76 0.01 0.42 0.04 0.00 0.00 177.00 176.13 2cqv s ILE 37 N -2.91 0.01 0.44 0.56 1.01 -1.26 -4.60 121.20 114.45 2cqv s ILE 37 Ca 0.62 0.06 -0.15 0.00 0.00 0.00 0.00 60.65 61.17 2cqv s ILE 37 Cb -0.17 -0.05 -0.08 0.00 0.01 0.00 0.00 42.46 42.16 2cqv s ILE 37 CO 0.56 0.04 0.88 -0.89 0.00 0.00 0.00 174.94 175.53 2cqv s THR 38 N 0.35 4.60 -0.28 2.92 2.01 0.91 -4.96 115.64 121.19 2cqv s THR 38 Ca -0.03 1.06 0.01 0.00 0.31 0.00 0.00 61.69 63.04 2cqv s THR 38 Cb -0.04 -3.69 0.16 0.00 0.01 0.00 0.00 72.50 68.94 2cqv s THR 38 CO -0.01 -0.51 0.47 0.00 -0.69 0.00 0.00 174.62 173.88 2cqv s THR 40 N 2.66 2.53 -0.23 0.00 2.01 0.10 -4.97 115.64 117.74 2cqv s THR 40 Ca 0.13 -0.91 -0.10 0.00 0.31 0.00 0.00 61.69 61.12 2cqv s THR 40 Cb -0.13 -1.95 -0.05 0.00 0.01 0.00 0.00 72.50 70.38 2cqv s THR 40 CO -0.23 0.58 0.13 0.26 -0.69 0.00 0.00 174.62 174.67 2cqv s TRP 41 N -0.46 3.30 0.09 4.92 0.52 -1.26 -0.34 118.94 125.71 2cqv s TRP 41 Ca 0.05 0.16 0.02 0.00 0.02 0.00 0.00 56.10 56.36 2cqv s TRP 41 Cb -0.12 -2.22 -0.04 0.00 -1.15 0.00 0.00 33.47 29.94 2cqv s TRP 41 CO 0.01 0.08 -0.08 -1.64 0.02 0.00 0.00 176.95 175.34 2cqv s MET 42 N 0.90 0.77 -0.14 4.98 -1.94 0.35 -1.49 119.30 122.73 2cqv s MET 42 Ca 0.07 -1.18 -0.01 0.00 -1.71 0.00 0.00 55.69 52.86 2cqv s MET 42 Cb -0.13 -0.29 0.04 0.00 2.01 0.00 0.00 34.83 36.46 2cqv s MET 42 CO 0.03 0.02 -0.03 0.21 -0.01 0.00 0.00 175.02 175.24 2cqv s LYS 43 N -3.14 1.10 -1.24 2.03 2.20 0.44 0.18 119.74 121.31 2cqv s LYS 43 Ca 0.06 -0.31 -0.02 0.00 -0.36 0.00 0.00 55.97 55.34 2cqv s LYS 43 Cb 0.00 -1.71 0.00 0.00 -1.51 0.00 0.00 37.83 34.61 2cqv s LYS 43 CO -0.03 -0.42 1.05 1.19 -0.36 0.00 0.00 175.35 176.78 2cqv n PHE 44 N 4.98 -2.37 -2.68 4.03 3.72 -1.16 -2.06 117.46 121.92 2cqv n PHE 44 Ca -0.10 0.96 -0.18 0.00 -0.05 0.00 0.00 57.45 58.07 2cqv n PHE 44 Cb 0.48 -5.06 0.02 0.00 -0.94 0.00 0.00 39.48 33.98 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 -4.36 -3.11 -3.76 -1.08 5.12 -1.26 -4.99 116.66 103.22 2cqv n ARG 45 Ca -0.21 0.81 -0.27 0.00 -1.93 0.00 0.00 57.85 56.25 2cqv n ARG 45 Cb 0.64 -5.34 -0.17 0.00 -1.16 0.00 0.00 32.46 26.43 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 -5.27 0.72 0.10 5.56 2.47 -0.87 -5.11 119.74 117.34 2cqv s LYS 46 Ca 0.16 -0.31 -0.32 0.00 -1.56 0.00 0.00 55.97 53.93 2cqv s LYS 46 Cb -0.07 -1.85 -0.12 0.00 -1.46 0.00 0.00 37.83 34.34 2cqv s LYS 46 CO 0.20 -0.54 1.78 0.94 0.16 0.00 0.00 175.35 177.89 2cqv n GLN 47 N 5.05 2.55 -2.41 4.03 7.27 -1.26 -0.42 117.38 132.20 2cqv n GLN 47 Ca -0.09 0.93 -0.39 0.00 0.07 0.00 0.00 57.00 57.52 2cqv n GLN 47 Cb 0.48 -2.79 -0.03 0.00 2.41 0.00 0.00 30.24 30.31 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 2.49 3.37 -0.34 1.69 1.01 -0.55 -4.90 121.20 123.96 2cqv s ILE 48 Ca 0.83 1.26 -0.11 0.00 0.00 0.00 0.00 60.65 62.63 2cqv s ILE 48 Cb -0.56 -3.76 0.00 0.00 0.01 0.00 0.00 42.46 38.15 2cqv s ILE 48 CO 0.40 0.22 0.19 -1.10 0.00 0.00 0.00 174.94 174.64 2cqv s GLN 49 N -1.86 3.19 0.20 2.79 -0.21 -1.26 -4.93 119.66 117.57 2cqv s GLN 49 Ca 0.50 -0.83 -0.31 0.00 0.02 0.00 0.00 55.36 54.74 2cqv s GLN 49 Cb -0.31 -3.66 -0.16 0.00 1.00 0.00 0.00 33.01 29.88 2cqv s GLN 49 CO 0.39 -0.52 0.93 0.39 -2.12 0.00 0.00 175.29 174.37 2cqv n GLU 50 N 5.01 0.79 -2.76 2.91 1.02 -1.26 -4.75 120.64 121.60 2cqv n GLU 50 Ca -0.13 0.28 -0.01 0.00 -0.02 0.00 0.00 57.16 57.28 2cqv n GLU 50 Cb 0.48 -1.60 0.01 0.00 -0.02 0.00 0.00 31.44 30.31 2cqv n GLU 50 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2cqv n SER 51 N 1.74 -0.83 0.19 1.62 2.88 0.15 -4.95 113.62 114.41 2cqv n SER 51 Ca 0.15 -1.39 0.14 0.00 -1.33 0.00 0.00 58.87 56.44 2cqv n SER 51 Cb 0.25 1.34 0.55 0.00 -0.75 0.00 0.00 64.21 65.60 2cqv n SER 51 CO 0.00 0.00 0.00 1.05 -1.23 0.00 0.00 175.04 174.86 2cqv h GLU 52 N 0.00 0.00 0.06 -1.46 4.11 -1.98 -2.92 114.58 112.39 2cqv h GLU 52 Ca -0.13 0.00 -0.35 0.00 0.07 0.00 0.00 59.36 58.95 2cqv h GLU 52 Cb 0.62 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.83 2cqv h GLU 52 CO 0.18 0.00 -2.04 0.72 0.07 0.00 0.00 179.01 177.94 2cqv n HIS 53 N -2.59 0.88 -3.76 2.06 8.25 -1.26 -4.33 115.22 114.46 2cqv n HIS 53 Ca 0.02 0.22 -0.29 0.00 -0.26 0.00 0.00 57.72 57.42 2cqv n HIS 53 Cb 0.28 -1.13 -0.16 0.00 1.12 0.00 0.00 29.99 30.10 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 0.82 0.54 -0.41 -1.94 -1.11 0.13 119.30 114.76 2cqv s MET 54 Ca -0.19 -0.70 0.08 0.00 -1.71 0.00 0.00 55.69 53.18 2cqv s MET 54 Cb 0.07 -2.14 0.06 0.00 2.01 0.00 0.00 34.83 34.83 2cqv s MET 54 CO 0.76 -0.74 0.63 0.15 -0.01 0.00 0.00 175.02 175.82 2cqv s LYS 55 N 1.72 2.37 -0.11 2.03 1.02 0.73 0.31 119.74 127.81 2cqv s LYS 55 Ca 0.01 -1.68 -0.09 0.00 0.02 0.00 0.00 55.97 54.24 2cqv s LYS 55 Cb -0.17 -2.50 0.03 0.00 -0.52 0.00 0.00 37.83 34.67 2cqv s LYS 55 CO -0.13 -0.67 0.28 0.08 -0.92 0.00 0.00 175.35 173.98 2cqv s VAL 56 N -2.64 -0.01 -0.55 3.17 1.01 -1.26 -2.69 120.40 117.43 2cqv s VAL 56 Ca 0.53 0.03 0.04 0.00 0.00 0.00 0.00 61.98 62.58 2cqv s VAL 56 Cb -0.05 -0.40 0.15 0.00 0.00 0.00 0.00 36.38 36.07 2cqv s VAL 56 CO 0.33 0.01 0.34 -1.61 0.00 0.00 0.00 175.10 174.17 2cqv s GLU 57 N 0.44 1.88 0.19 2.72 2.02 0.11 -4.98 118.70 121.08 2cqv s GLU 57 Ca -0.02 -2.67 -0.31 0.00 0.02 0.00 0.00 54.97 51.99 2cqv s GLU 57 Cb -0.04 -2.96 -0.10 0.00 0.10 0.00 0.00 34.13 31.13 2cqv s GLU 57 CO -0.02 -1.20 1.53 -0.80 0.02 0.00 0.00 175.26 174.78 2cqv s ASN 58 N -0.49 6.61 0.25 -0.19 -0.87 -1.26 -2.84 114.94 116.15 2cqv s ASN 58 Ca 0.21 2.62 -0.13 0.00 -1.57 0.00 0.00 52.86 53.99 2cqv s ASN 58 Cb -0.16 -2.60 -0.00 0.00 -0.02 0.00 0.00 41.25 38.47 2cqv s ASN 58 CO -0.07 -0.79 0.50 -0.44 -2.57 0.00 0.00 177.10 173.74 2cqv s SER 59 N 0.93 -0.09 0.06 -1.22 0.01 -0.28 -5.01 113.70 108.08 2cqv s SER 59 Ca 0.67 -0.91 -0.36 0.00 1.31 0.00 0.00 55.95 56.66 2cqv s SER 59 Cb -0.43 0.60 -0.20 0.00 0.21 0.00 0.00 66.02 66.20 2cqv s SER 59 CO 0.35 -1.17 1.53 -0.08 0.41 0.00 0.00 173.24 174.28 2cqv h GLU 60 N 2.23 -1.20 -1.15 12.44 4.81 -1.98 -2.73 114.58 127.00 2cqv h GLU 60 Ca -0.25 0.08 0.35 0.00 -0.13 0.00 0.00 59.36 59.41 2cqv h GLU 60 Cb 1.25 0.27 -0.12 0.00 0.63 0.00 0.00 28.75 30.78 2cqv h GLU 60 CO 0.34 -0.80 0.72 -0.91 -0.73 0.00 0.00 179.01 177.63 2cqv h ASN 61 N -1.28 0.38 0.00 1.04 4.21 -1.98 -3.45 115.58 114.49 2cqv h ASN 61 Ca -0.13 0.13 0.00 0.00 1.21 0.00 0.00 56.30 57.52 2cqv h ASN 61 Cb 0.96 0.09 0.00 0.00 -1.12 0.00 0.00 38.32 38.25 2cqv h ASN 61 CO 0.21 -0.08 0.00 0.61 -1.29 0.00 0.00 177.43 176.88 2cqv n GLY 62 N -1.45 -0.67 2.84 2.83 0.00 -1.03 -0.13 105.19 107.58 2cqv n GLY 62 Ca 0.32 -0.16 -0.13 0.00 0.00 0.00 0.00 46.02 46.04 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 0.07 -0.09 1.61 0.15 -1.26 -1.13 113.70 109.05 2cqv s SER 63 Ca 0.00 0.01 0.01 0.00 0.70 0.00 0.00 55.95 56.67 2cqv s SER 63 Cb 0.00 -0.04 -0.02 0.00 -1.71 0.00 0.00 66.02 64.25 2cqv s SER 63 CO 0.00 -0.05 -0.11 -0.75 1.20 0.00 0.00 173.24 173.53 2cqv s LYS 64 N 0.41 2.92 -0.42 5.44 2.20 -1.13 -3.01 119.74 126.14 2cqv s LYS 64 Ca -0.03 -0.64 0.01 0.00 -0.36 0.00 0.00 55.97 54.95 2cqv s LYS 64 Cb -0.05 -2.55 0.11 0.00 -1.51 0.00 0.00 37.83 33.83 2cqv s LYS 64 CO -0.01 0.49 0.18 -1.17 -0.36 0.00 0.00 175.35 174.48 2cqv s LEU 65 N -0.36 4.91 -0.10 5.43 2.96 -0.76 -0.71 118.68 130.04 2cqv s LEU 65 Ca 0.04 -2.34 -0.27 0.00 -0.22 0.00 0.00 54.13 51.35 2cqv s LEU 65 Cb -0.12 -1.72 -0.02 0.00 0.50 0.00 0.00 46.19 44.82 2cqv s LEU 65 CO 0.02 -0.41 0.87 -0.89 -1.32 0.00 0.00 176.35 174.63 2cqv s THR 66 N 0.68 4.89 -0.35 3.68 2.01 -1.10 -2.95 115.64 122.50 2cqv s THR 66 Ca 0.12 1.77 -0.05 0.00 0.31 0.00 0.00 61.69 63.84 2cqv s THR 66 Cb -0.21 -4.19 0.06 0.00 0.01 0.00 0.00 72.50 68.16 2cqv s THR 66 CO -0.05 0.09 0.12 -0.63 -0.69 0.00 0.00 174.62 173.46 2cqv s ILE 67 N 1.63 3.58 0.21 1.82 1.01 -0.63 -0.20 121.20 128.62 2cqv s ILE 67 Ca 0.43 -1.40 -0.15 0.00 0.00 0.00 0.00 60.65 59.53 2cqv s ILE 67 Cb -0.18 -3.14 -0.08 0.00 0.01 0.00 0.00 42.46 39.08 2cqv s ILE 67 CO 0.18 -0.31 0.62 -0.76 0.00 0.00 0.00 174.94 174.67 2cqv s LEU 68 N 1.32 4.27 -1.30 2.97 2.01 0.12 -2.68 118.68 125.39 2cqv s LEU 68 Ca -0.00 1.17 -0.07 0.00 0.01 0.00 0.00 54.13 55.24 2cqv s LEU 68 Cb -0.21 -3.54 -0.00 0.00 0.01 0.00 0.00 46.19 42.45 2cqv s LEU 68 CO 0.01 0.01 0.58 0.00 1.01 0.00 0.00 176.35 177.96 2cqv n ALA 69 N 0.45 -2.19 -1.03 4.21 0.00 -1.18 -4.53 120.51 116.24 2cqv n ALA 69 Ca -0.02 -0.25 -0.21 0.00 0.00 0.00 0.00 53.44 52.96 2cqv n ALA 69 Cb 0.52 -2.40 -0.13 0.00 0.00 0.00 0.00 19.45 17.43 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 -4.32 0.52 -2.00 0.00 0.00 -0.71 -4.18 120.51 109.81 2cqv n ALA 70 Ca -0.24 -0.40 -0.32 0.00 0.00 0.00 0.00 53.44 52.49 2cqv n ALA 70 Cb 0.65 -1.60 -0.05 0.00 0.00 0.00 0.00 19.45 18.46 2cqv n ALA 70 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2cqv s ARG 71 N 5.40 3.96 0.29 0.00 3.52 -1.26 0.19 118.95 131.05 2cqv s ARG 71 Ca 0.92 0.78 0.04 0.00 -0.13 0.00 0.00 55.73 57.33 2cqv s ARG 71 Cb -0.71 -2.28 0.75 0.00 -1.56 0.00 0.00 34.95 31.16 2cqv s ARG 71 CO 0.37 -0.07 1.65 0.37 -0.81 0.00 0.00 175.30 176.81 2cqv h GLN 72 N 1.48 0.24 -0.68 5.12 5.75 -1.95 0.27 115.11 125.35 2cqv h GLN 72 Ca -0.48 -0.01 0.10 0.00 -0.15 0.00 0.00 58.65 58.11 2cqv h GLN 72 Cb 1.18 -0.05 -0.07 0.00 1.07 0.00 0.00 27.48 29.60 2cqv h GLN 72 CO 0.63 0.16 0.30 1.05 -2.65 0.00 0.00 178.83 178.32 2cqv h GLU 73 N 0.25 0.50 -1.21 1.69 4.11 -1.98 0.27 114.58 118.21 2cqv h GLU 73 Ca 0.57 -0.03 0.38 0.00 0.07 0.00 0.00 59.36 60.35 2cqv h GLU 73 Cb 1.17 -0.11 -0.12 0.00 0.50 0.00 0.00 28.75 30.18 2cqv h GLU 73 CO -0.63 0.33 0.77 0.45 0.07 0.00 0.00 179.01 180.00 2cqv h HIS 74 N 0.51 0.59 -1.38 2.06 3.86 -0.82 -3.40 115.15 116.58 2cqv h HIS 74 Ca 0.34 0.02 -0.77 0.00 -1.16 0.00 0.00 60.37 58.81 2cqv h HIS 74 Cb 0.40 -0.15 0.03 0.00 1.06 0.00 0.00 27.41 28.74 2cqv h HIS 74 CO -0.13 -0.14 0.66 0.00 0.86 0.00 0.00 177.93 179.18 2cqv n GLY 76 N 3.50 1.27 3.82 0.00 0.00 0.07 -4.98 105.19 108.88 2cqv n GLY 76 Ca 0.25 -1.60 -0.38 0.00 0.00 0.00 0.00 46.02 44.29 2cqv n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cqv n TYR 78 N 1.60 -1.19 -3.60 0.00 4.02 0.84 -2.99 117.16 115.85 2cqv n TYR 78 Ca -0.10 -1.52 -0.02 0.00 -0.01 0.00 0.00 57.90 56.25 2cqv n TYR 78 Cb 0.51 -0.31 -0.04 0.00 -0.02 0.00 0.00 39.34 39.48 2cqv n TYR 78 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 2cqv s THR 79 N -1.74 -0.95 -0.51 -0.72 2.01 0.48 -2.80 115.64 111.41 2cqv s THR 79 Ca 0.24 0.02 -0.17 0.00 0.31 0.00 0.00 61.69 62.10 2cqv s THR 79 Cb -0.02 -0.96 0.09 0.00 0.01 0.00 0.00 72.50 71.62 2cqv s THR 79 CO 0.15 0.01 0.50 -0.22 -0.69 0.00 0.00 174.62 174.37 2cqv s LEU 80 N 2.86 5.63 0.03 4.42 2.96 -1.24 -0.50 118.68 132.84 2cqv s LEU 80 Ca -0.03 -1.39 -0.20 0.00 -0.22 0.00 0.00 54.13 52.29 2cqv s LEU 80 Cb -0.12 -2.25 -0.06 0.00 0.50 0.00 0.00 46.19 44.26 2cqv s LEU 80 CO -0.18 -0.80 0.58 -0.22 -1.32 0.00 0.00 176.35 174.40 2cqv s LEU 81 N 1.92 4.46 -0.23 -0.68 2.96 0.54 -2.25 118.68 125.40 2cqv s LEU 81 Ca 0.06 1.19 -0.03 0.00 -0.22 0.00 0.00 54.13 55.13 2cqv s LEU 81 Cb -0.25 -2.90 0.08 0.00 0.50 0.00 0.00 46.19 43.62 2cqv s LEU 81 CO 0.07 0.18 0.08 0.68 -1.32 0.00 0.00 176.35 176.04 2cqv s VAL 82 N -0.58 0.28 -0.00 1.68 -7.23 0.76 0.01 120.40 115.32 2cqv s VAL 82 Ca 0.30 -0.64 0.04 0.00 -1.81 0.00 0.00 61.98 59.86 2cqv s VAL 82 Cb -0.19 -1.00 -0.03 0.00 0.56 0.00 0.00 36.38 35.72 2cqv s VAL 82 CO 0.18 -0.43 -0.10 -1.61 -0.31 0.00 0.00 175.10 172.83 2cqv s GLU 83 N 1.95 2.48 0.36 4.82 2.02 -1.15 -0.43 118.70 128.75 2cqv s GLU 83 Ca 0.04 -0.75 -0.02 0.00 0.02 0.00 0.00 54.97 54.26 2cqv s GLU 83 Cb -0.17 -2.44 0.01 0.00 0.10 0.00 0.00 34.13 31.63 2cqv s GLU 83 CO -0.18 0.60 0.51 0.27 0.02 0.00 0.00 175.26 176.48 2cqv n ASN 84 N 1.72 -1.42 -0.33 -0.19 6.94 0.42 -0.06 115.26 122.33 2cqv n ASN 84 Ca -0.16 -2.93 0.10 0.00 -0.02 0.00 0.00 54.58 51.58 2cqv n ASN 84 Cb 0.52 2.64 0.31 0.00 -2.36 0.00 0.00 39.78 40.89 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 0.81 0.00 -3.83 3.64 -1.86 -3.18 116.57 112.15 2cqv h LYS 85 Ca -0.28 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 2cqv h LYS 85 Cb 1.22 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.85 2cqv h LYS 85 CO 0.38 0.54 0.00 1.28 -2.27 0.00 0.00 179.45 179.38 2cqv n LEU 86 N -4.64 0.57 0.00 5.20 4.77 -1.26 -5.05 117.00 116.59 2cqv n LEU 86 Ca 0.20 0.56 0.00 0.00 -0.03 0.00 0.00 56.01 56.74 2cqv n LEU 86 Cb 0.45 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 2cqv n LEU 86 CO 0.26 -0.26 0.00 0.61 -1.33 0.00 0.00 177.39 176.67 2cqv n GLY 87 N 0.43 4.72 3.57 -0.72 0.00 -1.20 -4.98 105.19 107.00 2cqv n GLY 87 Ca 0.00 -0.55 -0.10 0.00 0.00 0.00 0.00 46.02 45.37 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 1.37 -0.39 0.08 1.61 1.04 -1.26 -0.44 113.70 115.72 2cqv s SER 88 Ca 0.00 -0.31 -0.16 0.00 0.48 0.00 0.00 55.95 55.96 2cqv s SER 88 Cb 0.00 0.63 0.03 0.00 0.10 0.00 0.00 66.02 66.78 2cqv s SER 88 CO 0.00 -1.10 0.39 -0.60 0.98 0.00 0.00 173.24 172.91 2cqv s ARG 89 N -3.83 0.97 -0.10 4.02 6.06 0.43 -4.83 118.95 121.67 2cqv s ARG 89 Ca 0.06 -0.56 -0.05 0.00 -2.50 0.00 0.00 55.73 52.68 2cqv s ARG 89 Cb -0.02 0.43 0.04 0.00 0.06 0.00 0.00 34.95 35.46 2cqv s ARG 89 CO -0.05 -0.35 0.23 1.14 -2.50 0.00 0.00 175.30 173.77 2cqv s GLN 90 N -3.15 0.19 0.39 5.12 -2.07 -1.26 -0.17 119.66 118.71 2cqv s GLN 90 Ca -0.01 0.50 0.04 0.00 -1.82 0.00 0.00 55.36 54.07 2cqv s GLN 90 Cb 0.01 -0.12 0.04 0.00 -1.09 0.00 0.00 33.01 31.85 2cqv s GLN 90 CO -0.07 -0.16 0.36 0.00 -1.32 0.00 0.00 175.29 174.10 2cqv n ALA 91 N 4.16 0.66 -3.60 2.60 0.00 -0.96 -4.93 120.51 118.44 2cqv n ALA 91 Ca -0.25 -1.51 -0.10 0.00 0.00 0.00 0.00 53.44 51.58 2cqv n ALA 91 Cb 0.53 0.57 -0.09 0.00 0.00 0.00 0.00 19.45 20.46 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 -3.63 0.59 -0.08 0.00 -0.21 -1.26 -3.58 119.66 111.49 2cqv s GLN 92 Ca 0.27 0.93 -0.03 0.00 0.02 0.00 0.00 55.36 56.55 2cqv s GLN 92 Cb -0.02 0.15 0.04 0.00 1.00 0.00 0.00 33.01 34.19 2cqv s GLN 92 CO 0.17 -0.13 0.16 0.54 -2.12 0.00 0.00 175.29 173.92 2cqv s VAL 93 N 1.08 -0.16 0.04 1.09 0.11 -1.12 -4.92 120.40 116.51 2cqv s VAL 93 Ca -0.06 0.26 -0.23 0.00 -2.93 0.00 0.00 61.98 59.02 2cqv s VAL 93 Cb -0.06 -0.28 -0.06 0.00 -1.53 0.00 0.00 36.38 34.45 2cqv s VAL 93 CO -0.10 0.11 0.71 0.20 -3.33 0.00 0.00 175.10 172.68 2cqv s ASN 94 N 1.75 7.15 0.03 3.54 0.01 -1.26 -0.11 114.94 126.05 2cqv s ASN 94 Ca -0.03 1.37 0.05 0.00 -0.71 0.00 0.00 52.86 53.53 2cqv s ASN 94 Cb -0.12 -2.43 -0.02 0.00 0.41 0.00 0.00 41.25 39.09 2cqv s ASN 94 CO -0.06 0.07 -0.14 -0.22 -1.51 0.00 0.00 177.10 175.23 2cqv s LEU 95 N -0.21 2.16 -0.04 0.60 2.96 -0.37 -1.85 118.68 121.93 2cqv s LEU 95 Ca 0.36 -0.44 0.02 0.00 -0.22 0.00 0.00 54.13 53.84 2cqv s LEU 95 Cb -0.20 -0.63 0.01 0.00 0.50 0.00 0.00 46.19 45.88 2cqv s LEU 95 CO 0.21 0.05 -0.07 -0.89 -1.32 0.00 0.00 176.35 174.33 2cqv s THR 96 N -0.80 0.72 -0.16 3.68 2.01 -1.07 -0.75 115.64 119.27 2cqv s THR 96 Ca 0.02 -0.26 -0.08 0.00 0.31 0.00 0.00 61.69 61.68 2cqv s THR 96 Cb -0.08 -0.68 -0.04 0.00 0.01 0.00 0.00 72.50 71.71 2cqv s THR 96 CO 0.01 0.25 0.12 -0.69 -0.69 0.00 0.00 174.62 173.62 2cqv s VAL 97 N 0.61 5.32 -0.13 3.82 1.01 -1.26 -1.03 120.40 128.74 2cqv s VAL 97 Ca -0.09 0.15 -0.01 0.00 0.00 0.00 0.00 61.98 62.03 2cqv s VAL 97 Cb -0.13 -3.37 0.03 0.00 0.00 0.00 0.00 36.38 32.91 2cqv s VAL 97 CO 0.01 0.52 -0.05 0.68 0.00 0.00 0.00 175.10 176.26 2cqv s VAL 98 N -0.23 0.92 -1.43 2.92 -7.23 -0.76 -4.84 120.40 109.75 2cqv s VAL 98 Ca 0.10 -0.34 0.12 0.00 -1.81 0.00 0.00 61.98 60.05 2cqv s VAL 98 Cb -0.12 -1.03 0.45 0.00 0.56 0.00 0.00 36.38 36.24 2cqv s VAL 98 CO 0.01 0.24 1.32 -0.67 -0.31 0.00 0.00 175.10 175.69 2cqv n ASP 99 N 4.96 3.08 -4.93 4.85 2.03 -1.26 -0.21 116.55 125.07 2cqv n ASP 99 Ca -0.11 -2.23 -0.28 0.00 0.52 0.00 0.00 54.79 52.69 2cqv n ASP 99 Cb 0.49 -0.43 -0.03 0.00 -0.72 0.00 0.00 41.12 40.43 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 -1.66 3.45 1.05 -0.67 -2.85 -1.26 -4.93 119.74 112.86 2cqv s LYS 100 Ca 0.32 -0.52 -0.14 0.00 -1.00 0.00 0.00 55.97 54.64 2cqv s LYS 100 Cb 0.20 -2.99 0.21 0.00 -2.06 0.00 0.00 37.83 33.19 2cqv s LYS 100 CO 0.17 0.55 1.10 -1.25 0.10 0.00 0.00 175.35 176.02 2cqv s PRO 101 N -2.93 0.02 0.46 1.78 0.04 -1.26 -4.96 135.00 128.15 2cqv s PRO 101 Ca 0.35 0.38 -0.24 0.00 0.04 0.00 0.00 61.00 61.53 2cqv s PRO 101 Cb -0.12 -1.70 -0.08 0.00 0.04 0.00 0.00 34.50 32.63 2cqv s PRO 101 CO 0.28 -2.97 1.23 -0.40 0.04 0.00 0.00 177.00 175.18 2cqv n ASP 102 N -4.32 2.29 -4.77 6.66 5.68 -1.26 -4.96 116.55 115.87 2cqv n ASP 102 Ca 0.06 1.05 -0.34 0.00 -0.50 0.00 0.00 54.79 55.06 2cqv n ASP 102 Cb 0.58 -1.49 0.02 0.00 -1.14 0.00 0.00 41.12 39.08 2cqv n ASP 102 CO 0.00 0.00 0.00 -2.16 -1.33 0.00 0.00 177.20 173.71 2cqv s PRO 103 N -2.37 3.19 0.69 0.11 0.04 -1.26 -5.02 135.00 130.38 2cqv s PRO 103 Ca 0.64 1.54 -0.14 0.00 0.04 0.00 0.00 61.00 63.09 2cqv s PRO 103 Cb -0.49 -1.99 0.02 0.00 0.04 0.00 0.00 34.50 32.08 2cqv s PRO 103 CO 0.55 -0.97 1.11 -1.25 0.04 0.00 0.00 177.00 176.48 2cqv s PRO 104 N -3.53 2.65 -0.10 0.56 0.04 -1.26 -5.07 135.00 128.28 2cqv s PRO 104 Ca 0.71 1.33 -0.05 0.00 0.04 0.00 0.00 61.00 63.03 2cqv s PRO 104 Cb -0.23 -1.94 0.04 0.00 0.04 0.00 0.00 34.50 32.42 2cqv s PRO 104 CO 0.31 -1.36 0.24 0.00 0.04 0.00 0.00 177.00 176.23 2cqv s ALA 105 N -2.49 -0.55 0.80 8.56 0.00 -1.26 -5.17 121.76 121.65 2cqv s ALA 105 Ca 0.65 0.97 -0.05 0.00 0.00 0.00 0.00 51.96 53.53 2cqv s ALA 105 Cb -0.20 -0.61 0.13 0.00 0.00 0.00 0.00 23.12 22.44 2cqv s ALA 105 CO 0.45 -0.19 0.83 0.41 0.00 0.00 0.00 175.76 177.26 2cqv n GLY 106 N 4.15 -0.22 3.20 0.00 0.00 -1.26 -5.09 105.19 105.98 2cqv n GLY 106 Ca -0.25 -1.88 -0.33 0.00 0.00 0.00 0.00 46.02 43.57 2cqv n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2cqv s THR 107 N -2.57 2.38 0.12 2.61 2.01 -1.26 -5.00 115.64 113.93 2cqv s THR 107 Ca 0.51 -0.86 0.34 0.00 0.31 0.00 0.00 61.69 61.99 2cqv s THR 107 Cb -0.02 -1.99 0.39 0.00 0.01 0.00 0.00 72.50 70.89 2cqv s THR 107 CO 0.35 0.52 2.00 1.55 -0.69 0.00 0.00 174.62 178.35 2cqv h PRO 108 N 7.54 0.00 -5.66 4.92 0.13 -2.09 -3.43 132.00 133.41 2cqv h PRO 108 Ca -0.37 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.16 2cqv h PRO 108 Cb 1.17 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.22 2cqv h PRO 108 CO 0.58 0.00 -0.31 -1.54 -0.23 0.00 0.00 178.00 176.50 2cqv s SER 109 N -5.64 6.53 0.70 1.44 1.04 -1.26 -5.09 113.70 111.43 2cqv s SER 109 Ca 0.01 0.63 -0.07 0.00 0.48 0.00 0.00 55.95 57.00 2cqv s SER 109 Cb 0.09 -2.18 0.06 0.00 0.10 0.00 0.00 66.02 64.09 2cqv s SER 109 CO 0.53 0.21 1.02 -0.83 0.98 0.00 0.00 173.24 175.15 2cqv s GLY 110 N -0.19 1.69 0.34 7.32 0.00 -1.26 -5.04 107.32 110.17 2cqv s GLY 110 Ca 0.18 -0.93 -0.28 0.00 0.00 0.00 0.00 44.72 43.70 2cqv s GLY 110 CO 0.07 -0.52 1.21 2.56 0.00 0.00 0.00 173.10 176.42 2cqv s PRO 111 N -5.25 4.31 0.31 2.90 0.04 -1.26 -5.02 135.00 131.03 2cqv s PRO 111 Ca 0.60 2.00 -0.21 0.00 0.04 0.00 0.00 61.00 63.43 2cqv s PRO 111 Cb -0.11 -2.96 -0.09 0.00 0.04 0.00 0.00 34.50 31.38 2cqv s PRO 111 CO 0.45 -0.15 0.83 -1.54 0.04 0.00 0.00 177.00 176.63 2cqv s SER 112 N -0.79 7.06 0.17 6.66 1.04 -1.26 -4.98 113.70 121.60 2cqv s SER 112 Ca 0.51 1.56 -0.31 0.00 0.48 0.00 0.00 55.95 58.19 2cqv s SER 112 Cb -0.35 -2.48 -0.17 0.00 0.10 0.00 0.00 66.02 63.12 2cqv s SER 112 CO 0.45 -0.12 0.77 -1.20 0.98 0.00 0.00 173.24 174.13 2cqv n SER 113 N 0.20 -0.35 -0.32 7.02 7.64 -1.26 -5.35 113.62 121.20 2cqv n SER 113 Ca 0.02 1.14 0.04 0.00 1.01 0.00 0.00 58.87 61.08 2cqv n SER 113 Cb 0.52 -1.02 0.03 0.00 -1.01 0.00 0.00 64.21 62.73 2cqv n SER 113 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64