#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 1.32 0.06 1.61 3.41 -1.26 -5.01 113.62 113.74 2cqv n SER 2 Ca 0.00 0.20 0.00 0.00 -0.26 0.00 0.00 58.87 58.81 2cqv n SER 2 Cb 0.00 -0.48 0.00 0.00 -0.26 0.00 0.00 64.21 63.47 2cqv n SER 2 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2cqv n SER 3 N -3.83 0.66 0.00 4.04 2.88 -1.26 -5.08 113.62 111.04 2cqv n SER 3 Ca -0.11 0.17 0.00 0.00 -1.33 0.00 0.00 58.87 57.60 2cqv n SER 3 Cb 0.36 -0.14 0.00 0.00 -0.75 0.00 0.00 64.21 63.68 2cqv n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2cqv n GLY 4 N 3.07 2.00 3.55 0.46 0.00 -1.26 -4.81 105.19 108.21 2cqv n GLY 4 Ca 0.00 -0.16 -0.28 0.00 0.00 0.00 0.00 46.02 45.58 2cqv n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cqv s SER 5 N -4.00 4.23 0.03 1.61 1.04 -1.26 -4.64 113.70 110.71 2cqv s SER 5 Ca 0.00 0.73 -0.04 0.00 0.48 0.00 0.00 55.95 57.12 2cqv s SER 5 Cb 0.00 -2.52 -0.01 0.00 0.10 0.00 0.00 66.02 63.59 2cqv s SER 5 CO 0.00 -3.24 -0.07 -0.24 0.98 0.00 0.00 173.24 170.67 2cqv n SER 6 N 16.92 1.15 0.00 7.02 2.88 -1.26 -5.09 113.62 135.23 2cqv n SER 6 Ca 0.40 0.16 0.00 0.00 -1.33 0.00 0.00 58.87 58.10 2cqv n SER 6 Cb 0.51 -0.39 0.00 0.00 -0.75 0.00 0.00 64.21 63.58 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 3.04 0.98 3.76 0.46 0.00 -1.26 -4.21 105.19 107.94 2cqv n GLY 7 Ca -0.03 -0.83 -0.41 0.00 0.00 0.00 0.00 46.02 44.76 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 4.45 0.01 1.61 0.04 -1.26 -4.54 135.00 133.31 2cqv s PRO 8 Ca 0.00 2.05 -0.07 0.00 0.04 0.00 0.00 61.00 63.03 2cqv s PRO 8 Cb 0.00 -3.14 -0.00 0.00 0.04 0.00 0.00 34.50 31.40 2cqv s PRO 8 CO 0.00 -0.09 0.12 1.14 0.04 0.00 0.00 177.00 178.21 2cqv s GLN 9 N -1.21 0.49 -0.50 4.56 -2.07 -0.66 -4.17 119.66 116.10 2cqv s GLN 9 Ca 0.50 -0.47 -0.10 0.00 -1.82 0.00 0.00 55.36 53.47 2cqv s GLN 9 Cb -0.37 0.20 0.13 0.00 -1.09 0.00 0.00 33.01 31.88 2cqv s GLN 9 CO 0.45 -0.12 0.38 0.42 -1.32 0.00 0.00 175.29 175.11 2cqv s ILE 10 N -1.60 4.33 -0.10 3.63 1.01 -1.26 -1.21 121.20 126.01 2cqv s ILE 10 Ca -0.13 -1.87 0.14 0.00 0.00 0.00 0.00 60.65 58.79 2cqv s ILE 10 Cb -0.07 -3.84 -0.05 0.00 0.01 0.00 0.00 42.46 38.52 2cqv s ILE 10 CO 0.00 -0.80 1.23 0.16 0.00 0.00 0.00 174.94 175.53 2cqv h ILE 11 N 6.00 0.92 -3.11 2.92 -2.65 -1.92 -3.44 117.51 116.24 2cqv h ILE 11 Ca -0.19 -2.39 -0.65 0.00 1.03 0.00 0.00 64.86 62.65 2cqv h ILE 11 Cb 1.07 2.40 -0.35 0.00 -2.05 0.00 0.00 36.82 37.89 2cqv h ILE 11 CO 0.86 0.53 -0.86 -1.10 0.03 0.00 0.00 178.15 177.61 2cqv s GLN 12 N -2.89 2.81 -0.24 0.16 -0.21 -1.24 -5.03 119.66 113.02 2cqv s GLN 12 Ca 0.01 -0.76 -0.22 0.00 0.02 0.00 0.00 55.36 54.41 2cqv s GLN 12 Cb 0.08 -2.41 0.06 0.00 1.00 0.00 0.00 33.01 31.75 2cqv s GLN 12 CO 0.78 -0.17 0.64 0.12 -2.12 0.00 0.00 175.29 174.54 2cqv s PHE 13 N 1.21 -0.71 0.16 0.91 5.36 -1.26 -1.47 117.98 122.18 2cqv s PHE 13 Ca 0.02 1.72 -0.31 0.00 -0.96 0.00 0.00 56.93 57.40 2cqv s PHE 13 Cb -0.14 0.25 -0.08 0.00 -0.34 0.00 0.00 43.02 42.71 2cqv s PHE 13 CO -0.10 -0.34 1.33 -1.25 -1.46 0.00 0.00 175.22 173.40 2cqv s PRO 14 N 0.39 4.36 0.76 10.12 0.04 -1.26 -5.03 135.00 144.38 2cqv s PRO 14 Ca -0.00 2.04 -0.04 0.00 0.04 0.00 0.00 61.00 63.03 2cqv s PRO 14 Cb -0.04 -3.23 0.13 0.00 0.04 0.00 0.00 34.50 31.40 2cqv s PRO 14 CO 0.00 -0.33 1.06 -1.83 0.04 0.00 0.00 177.00 175.94 2cqv s GLU 15 N 0.45 1.55 -0.46 4.56 -1.05 -1.26 -4.71 118.70 117.78 2cqv s GLU 15 Ca 0.60 -0.86 -0.46 0.00 -0.15 0.00 0.00 54.97 54.10 2cqv s GLU 15 Cb -0.36 -2.22 -0.19 0.00 -0.44 0.00 0.00 34.13 30.92 2cqv s GLU 15 CO 0.34 -1.60 1.66 -3.47 0.95 0.00 0.00 175.26 173.14 2cqv n ASP 16 N -3.02 1.38 -3.94 0.83 2.03 -1.26 -4.79 116.55 107.79 2cqv n ASP 16 Ca 0.14 1.14 -0.15 0.00 0.52 0.00 0.00 54.79 56.44 2cqv n ASP 16 Cb 0.60 -0.93 -0.09 0.00 -0.72 0.00 0.00 41.12 39.98 2cqv n ASP 16 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2cqv s GLN 17 N 3.27 1.41 0.35 -0.67 -2.07 -0.96 -4.99 119.66 116.01 2cqv s GLN 17 Ca 1.05 -1.78 0.08 0.00 -1.82 0.00 0.00 55.36 52.89 2cqv s GLN 17 Cb -1.43 0.23 -0.07 0.00 -1.09 0.00 0.00 33.01 30.65 2cqv s GLN 17 CO 0.78 -0.47 -0.05 0.21 -1.32 0.00 0.00 175.29 174.44 2cqv s LYS 18 N -3.92 1.81 -0.22 9.60 2.20 -1.26 -2.88 119.74 125.06 2cqv s LYS 18 Ca 0.39 -1.96 -0.23 0.00 -0.36 0.00 0.00 55.97 53.81 2cqv s LYS 18 Cb 0.05 -1.56 0.06 0.00 -1.51 0.00 0.00 37.83 34.88 2cqv s LYS 18 CO 0.17 0.05 0.65 0.54 -0.36 0.00 0.00 175.35 176.40 2cqv s VAL 19 N -2.74 0.00 0.17 4.02 0.11 -0.26 -4.91 120.40 116.79 2cqv s VAL 19 Ca 0.33 -0.01 -0.30 0.00 -2.93 0.00 0.00 61.98 59.07 2cqv s VAL 19 Cb 0.05 -0.91 -0.07 0.00 -1.53 0.00 0.00 36.38 33.92 2cqv s VAL 19 CO 0.16 -0.01 1.10 -0.13 -3.33 0.00 0.00 175.10 172.89 2cqv s ARG 20 N 0.18 4.59 -0.28 1.54 1.81 -1.26 -0.99 118.95 124.54 2cqv s ARG 20 Ca -0.01 1.71 -0.33 0.00 -1.72 0.00 0.00 55.73 55.38 2cqv s ARG 20 Cb -0.04 -3.28 -0.10 0.00 -0.45 0.00 0.00 34.95 31.08 2cqv s ARG 20 CO 0.02 0.07 2.16 0.00 -0.68 0.00 0.00 175.30 176.87 2cqv n ALA 21 N 2.44 1.25 0.00 2.13 0.00 0.11 -0.43 120.51 126.02 2cqv n ALA 21 Ca 0.03 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2cqv n ALA 21 Cb 0.46 -2.65 0.00 0.00 0.00 0.00 0.00 19.45 17.26 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 6.07 2.17 1.87 0.00 0.00 0.14 -4.85 105.19 110.60 2cqv n GLY 22 Ca 0.36 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.23 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 -0.57 -1.42 -4.59 1.61 -0.58 0.43 -3.80 120.64 111.71 2cqv n GLU 23 Ca 0.00 -0.97 -0.24 0.00 -0.42 0.00 0.00 57.16 55.54 2cqv n GLU 23 Cb 0.00 -0.77 -0.16 0.00 -0.57 0.00 0.00 31.44 29.94 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 -3.23 1.72 0.15 1.62 0.01 -1.26 -1.29 113.70 111.43 2cqv s SER 24 Ca 0.37 -0.28 0.10 0.00 1.31 0.00 0.00 55.95 57.45 2cqv s SER 24 Cb -0.02 -0.66 -0.04 0.00 0.21 0.00 0.00 66.02 65.51 2cqv s SER 24 CO 0.27 0.06 -0.18 0.54 0.41 0.00 0.00 173.24 174.35 2cqv s VAL 25 N 0.43 2.75 -0.47 3.43 0.11 -1.16 -4.96 120.40 120.53 2cqv s VAL 25 Ca -0.10 -1.70 0.03 0.00 -2.93 0.00 0.00 61.98 57.28 2cqv s VAL 25 Cb -0.13 -2.30 0.14 0.00 -1.53 0.00 0.00 36.38 32.55 2cqv s VAL 25 CO 0.03 -0.01 0.26 -1.61 -3.33 0.00 0.00 175.10 170.44 2cqv s GLU 26 N -2.44 1.50 -0.64 1.54 2.02 -1.26 -1.83 118.70 117.59 2cqv s GLU 26 Ca 0.20 -2.23 -0.23 0.00 0.02 0.00 0.00 54.97 52.73 2cqv s GLU 26 Cb -0.09 -2.59 0.07 0.00 0.10 0.00 0.00 34.13 31.61 2cqv s GLU 26 CO 0.11 -1.17 0.96 -0.51 0.02 0.00 0.00 175.26 174.67 2cqv s LEU 27 N 0.08 4.34 -0.14 1.80 1.43 -1.11 -4.88 118.68 120.21 2cqv s LEU 27 Ca 0.18 -0.89 -0.02 0.00 -1.03 0.00 0.00 54.13 52.37 2cqv s LEU 27 Cb -0.22 -2.48 -0.02 0.00 0.03 0.00 0.00 46.19 43.50 2cqv s LEU 27 CO -0.02 -1.41 -0.07 0.12 0.23 0.00 0.00 176.35 175.20 2cqv s PHE 28 N 4.04 2.94 -0.36 0.29 5.36 -1.26 -1.00 117.98 128.00 2cqv s PHE 28 Ca 0.23 -0.38 0.02 0.00 -0.96 0.00 0.00 56.93 55.84 2cqv s PHE 28 Cb -0.16 -1.89 0.10 0.00 -0.34 0.00 0.00 43.02 40.73 2cqv s PHE 28 CO 0.11 -0.06 0.09 0.20 -1.46 0.00 0.00 175.22 174.11 2cqv s GLY 29 N 0.22 1.95 0.14 13.12 0.00 -0.72 -4.37 107.32 117.67 2cqv s GLY 29 Ca -0.05 -2.53 -0.31 0.00 0.00 0.00 0.00 44.72 41.83 2cqv s GLY 29 CO 0.04 0.96 1.80 1.25 0.00 0.00 0.00 173.10 177.15 2cqv s LYS 30 N 0.97 4.14 -0.02 2.90 2.20 -0.54 -3.62 119.74 125.77 2cqv s LYS 30 Ca 0.10 2.59 0.07 0.00 -0.36 0.00 0.00 55.97 58.36 2cqv s LYS 30 Cb -0.20 -3.48 -0.02 0.00 -1.51 0.00 0.00 37.83 32.61 2cqv s LYS 30 CO -0.07 -0.82 -0.21 0.14 -0.36 0.00 0.00 175.35 174.03 2cqv s VAL 31 N 2.40 2.47 0.11 4.02 -7.23 0.85 -2.90 120.40 120.12 2cqv s VAL 31 Ca 0.79 -1.02 0.07 0.00 -1.81 0.00 0.00 61.98 60.02 2cqv s VAL 31 Cb -0.46 -1.93 -0.03 0.00 0.56 0.00 0.00 36.38 34.52 2cqv s VAL 31 CO 0.35 0.54 -0.18 0.28 -0.31 0.00 0.00 175.10 175.78 2cqv s THR 32 N -0.70 1.52 0.00 5.32 -1.32 -0.35 -4.61 115.64 115.50 2cqv s THR 32 Ca 0.11 -1.56 0.00 0.00 -1.21 0.00 0.00 61.69 59.03 2cqv s THR 32 Cb -0.10 -1.47 0.00 0.00 -1.51 0.00 0.00 72.50 69.42 2cqv s THR 32 CO 0.00 -0.19 0.00 0.61 -2.21 0.00 0.00 174.62 172.83 2cqv n GLY 33 N 0.94 -0.35 2.70 6.08 0.00 -1.26 -1.65 105.19 111.65 2cqv n GLY 33 Ca -0.18 0.02 -0.29 0.00 0.00 0.00 0.00 46.02 45.57 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 0.54 0.65 2.61 2.01 -1.26 -4.99 115.64 115.19 2cqv s THR 34 Ca 0.00 -0.91 -0.16 0.00 0.31 0.00 0.00 61.69 60.93 2cqv s THR 34 Cb 0.00 -1.26 -0.00 0.00 0.01 0.00 0.00 72.50 71.25 2cqv s THR 34 CO 0.00 -0.48 1.12 -1.10 -0.69 0.00 0.00 174.62 173.46 2cqv s GLN 35 N 1.82 2.82 0.79 4.92 -1.52 -1.26 -4.40 119.66 122.83 2cqv s GLN 35 Ca 0.05 1.44 -0.11 0.00 -1.95 0.00 0.00 55.36 54.80 2cqv s GLN 35 Cb -0.17 -1.95 0.06 0.00 -0.22 0.00 0.00 33.01 30.74 2cqv s GLN 35 CO -0.20 -1.24 1.09 -1.25 -0.25 0.00 0.00 175.29 173.44 2cqv s PRO 36 N -3.98 2.14 -0.05 2.91 0.04 -1.26 -5.10 135.00 129.70 2cqv s PRO 36 Ca 0.68 1.13 -0.01 0.00 0.04 0.00 0.00 61.00 62.84 2cqv s PRO 36 Cb -0.22 -1.89 0.03 0.00 0.04 0.00 0.00 34.50 32.47 2cqv s PRO 36 CO 0.40 -1.71 0.02 0.42 0.04 0.00 0.00 177.00 176.17 2cqv s ILE 37 N -2.91 0.16 0.54 0.56 1.01 -1.26 -4.66 121.20 114.64 2cqv s ILE 37 Ca 0.61 0.21 -0.21 0.00 0.00 0.00 0.00 60.65 61.27 2cqv s ILE 37 Cb -0.17 -0.33 -0.05 0.00 0.01 0.00 0.00 42.46 41.92 2cqv s ILE 37 CO 0.56 0.20 1.24 -0.89 0.00 0.00 0.00 174.94 176.05 2cqv s THR 38 N 1.74 2.61 -0.22 2.92 2.01 0.21 -4.91 115.64 120.00 2cqv s THR 38 Ca 0.00 0.42 -0.04 0.00 0.31 0.00 0.00 61.69 62.39 2cqv s THR 38 Cb -0.13 -3.19 0.10 0.00 0.01 0.00 0.00 72.50 69.30 2cqv s THR 38 CO -0.03 -0.04 0.26 0.00 -0.69 0.00 0.00 174.62 174.12 2cqv s THR 40 N 2.38 1.67 -0.22 0.00 2.01 0.55 -4.99 115.64 117.03 2cqv s THR 40 Ca 0.08 -0.90 -0.06 0.00 0.31 0.00 0.00 61.69 61.12 2cqv s THR 40 Cb -0.16 -1.38 -0.02 0.00 0.01 0.00 0.00 72.50 70.95 2cqv s THR 40 CO -0.14 0.47 0.02 0.26 -0.69 0.00 0.00 174.62 174.55 2cqv s TRP 41 N -0.49 3.04 0.26 4.92 0.52 -1.26 -0.28 118.94 125.66 2cqv s TRP 41 Ca 0.08 -0.53 0.05 0.00 0.02 0.00 0.00 56.10 55.72 2cqv s TRP 41 Cb -0.08 -2.15 -0.06 0.00 -1.15 0.00 0.00 33.47 30.03 2cqv s TRP 41 CO -0.01 -0.35 -0.03 -1.64 0.02 0.00 0.00 176.95 174.95 2cqv s MET 42 N 1.35 1.46 -0.13 4.98 -1.94 0.66 -1.58 119.30 124.10 2cqv s MET 42 Ca 0.05 -1.74 -0.04 0.00 -1.71 0.00 0.00 55.69 52.25 2cqv s MET 42 Cb -0.15 -0.90 0.06 0.00 2.01 0.00 0.00 34.83 35.86 2cqv s MET 42 CO 0.01 -0.03 0.19 0.21 -0.01 0.00 0.00 175.02 175.39 2cqv s LYS 43 N -3.80 0.10 -1.12 2.03 2.20 0.17 0.14 119.74 119.47 2cqv s LYS 43 Ca 0.29 0.44 -0.07 0.00 -0.36 0.00 0.00 55.97 56.26 2cqv s LYS 43 Cb 0.05 -0.63 0.01 0.00 -1.51 0.00 0.00 37.83 35.75 2cqv s LYS 43 CO 0.11 -0.44 0.98 1.19 -0.36 0.00 0.00 175.35 176.83 2cqv n PHE 44 N 5.32 -2.39 -3.06 4.03 3.72 -1.01 -2.75 117.46 121.33 2cqv n PHE 44 Ca -0.05 0.84 -0.13 0.00 -0.05 0.00 0.00 57.45 58.06 2cqv n PHE 44 Cb 0.50 -4.34 0.05 0.00 -0.94 0.00 0.00 39.48 34.75 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 -4.22 -4.56 -3.71 -1.08 5.12 -1.26 -5.03 116.66 101.91 2cqv n ARG 45 Ca 0.01 0.51 -0.14 0.00 -1.93 0.00 0.00 57.85 56.29 2cqv n ARG 45 Cb 0.55 -4.55 -0.14 0.00 -1.16 0.00 0.00 32.46 27.16 2cqv n ARG 45 CO 0.00 0.00 0.00 -1.59 -1.93 0.00 0.00 177.63 174.11 2cqv s LYS 46 N -5.47 0.11 -0.23 5.56 -2.85 -1.11 -5.11 119.74 110.64 2cqv s LYS 46 Ca 0.24 0.52 -0.29 0.00 -1.00 0.00 0.00 55.97 55.44 2cqv s LYS 46 Cb -0.10 -0.17 -0.03 0.00 -2.06 0.00 0.00 37.83 35.47 2cqv s LYS 46 CO 0.44 -0.22 1.69 -1.14 0.10 0.00 0.00 175.35 176.21 2cqv s GLN 47 N 1.71 3.69 0.42 1.78 0.74 -1.26 -0.65 119.66 126.08 2cqv s GLN 47 Ca -0.04 1.66 -0.26 0.00 0.05 0.00 0.00 55.36 56.77 2cqv s GLN 47 Cb -0.11 -4.09 -0.10 0.00 1.10 0.00 0.00 33.01 29.81 2cqv s GLN 47 CO -0.07 -1.43 1.38 -0.89 -0.55 0.00 0.00 175.29 173.73 2cqv n ILE 48 N 6.64 2.53 -3.69 -2.34 5.41 -0.61 -4.96 119.36 122.32 2cqv n ILE 48 Ca 0.20 -0.50 -0.36 0.00 1.00 0.00 0.00 62.75 63.09 2cqv n ILE 48 Cb 0.45 -1.76 -0.10 0.00 -0.71 0.00 0.00 39.64 37.53 2cqv n ILE 48 CO 0.00 0.00 0.00 -1.10 0.00 0.00 0.00 176.55 175.45 2cqv s GLN 49 N -2.27 4.01 0.15 0.38 -1.52 -1.26 -4.94 119.66 114.20 2cqv s GLN 49 Ca 0.59 -0.30 -0.31 0.00 -1.95 0.00 0.00 55.36 53.39 2cqv s GLN 49 Cb -0.48 -3.51 -0.11 0.00 -0.22 0.00 0.00 33.01 28.70 2cqv s GLN 49 CO 0.59 0.03 1.75 -1.21 -0.25 0.00 0.00 175.29 176.20 2cqv s GLU 50 N 1.12 4.15 0.25 2.91 2.02 -1.26 -4.63 118.70 123.27 2cqv s GLU 50 Ca 0.07 2.54 -0.21 0.00 0.02 0.00 0.00 54.97 57.39 2cqv s GLU 50 Cb -0.14 -3.39 0.06 0.00 0.10 0.00 0.00 34.13 30.76 2cqv s GLU 50 CO 0.05 -0.78 0.90 -1.54 0.02 0.00 0.00 175.26 173.92 2cqv s SER 51 N 2.04 -0.07 0.00 -0.19 1.04 0.44 -4.96 113.70 112.01 2cqv s SER 51 Ca 0.77 -0.75 0.05 0.00 0.48 0.00 0.00 55.95 56.50 2cqv s SER 51 Cb -0.46 0.64 0.26 0.00 0.10 0.00 0.00 66.02 66.55 2cqv s SER 51 CO 0.34 -1.24 1.02 -1.84 0.98 0.00 0.00 173.24 172.50 2cqv n GLU 52 N -0.57 0.07 -0.11 4.02 0.28 -1.26 -1.49 120.64 121.57 2cqv n GLU 52 Ca -0.05 0.26 -0.14 0.00 -0.16 0.00 0.00 57.16 57.06 2cqv n GLU 52 Cb 0.60 -1.50 -0.13 0.00 1.43 0.00 0.00 31.44 31.84 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 -1.31 0.00 -3.68 -1.84 8.25 -1.26 -4.46 115.22 110.93 2cqv n HIS 53 Ca 0.02 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.20 2cqv n HIS 53 Cb 0.04 -0.94 -0.16 0.00 1.12 0.00 0.00 29.99 30.06 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 -2.48 0.49 0.35 -0.41 -1.94 -0.56 0.40 119.30 115.15 2cqv s MET 54 Ca -0.25 -0.57 0.07 0.00 -1.71 0.00 0.00 55.69 53.23 2cqv s MET 54 Cb 0.07 -1.83 -0.02 0.00 2.01 0.00 0.00 34.83 35.07 2cqv s MET 54 CO 0.64 -0.82 0.39 0.15 -0.01 0.00 0.00 175.02 175.37 2cqv s LYS 55 N 1.88 2.89 -0.04 2.03 1.02 0.13 -0.42 119.74 127.25 2cqv s LYS 55 Ca 0.04 -1.18 -0.01 0.00 0.02 0.00 0.00 55.97 54.84 2cqv s LYS 55 Cb -0.17 -2.64 0.03 0.00 -0.52 0.00 0.00 37.83 34.53 2cqv s LYS 55 CO -0.19 0.04 0.07 0.08 -0.92 0.00 0.00 175.35 174.43 2cqv s VAL 56 N -2.26 -0.08 -0.85 3.17 1.01 -1.26 -2.01 120.40 118.12 2cqv s VAL 56 Ca 0.44 0.25 -0.02 0.00 0.00 0.00 0.00 61.98 62.65 2cqv s VAL 56 Cb -0.08 -0.14 0.21 0.00 0.00 0.00 0.00 36.38 36.38 2cqv s VAL 56 CO 0.29 0.10 0.73 -0.70 0.00 0.00 0.00 175.10 175.52 2cqv s GLU 57 N 1.34 3.17 -0.08 2.72 2.56 -0.20 -4.95 118.70 123.26 2cqv s GLU 57 Ca -0.06 -3.16 -0.29 0.00 0.00 0.00 0.00 54.97 51.45 2cqv s GLU 57 Cb -0.12 -3.93 -0.05 0.00 2.00 0.00 0.00 34.13 32.03 2cqv s GLU 57 CO -0.04 -1.25 1.71 -0.80 -0.56 0.00 0.00 175.26 174.32 2cqv s ASN 58 N -0.00 6.54 0.33 -1.70 -0.87 -1.26 -3.01 114.94 114.97 2cqv s ASN 58 Ca 0.26 2.16 0.05 0.00 -1.57 0.00 0.00 52.86 53.75 2cqv s ASN 58 Cb -0.09 -2.53 -0.03 0.00 -0.02 0.00 0.00 41.25 38.58 2cqv s ASN 58 CO -0.11 -1.04 0.20 -0.44 -2.57 0.00 0.00 177.10 173.14 2cqv s SER 59 N 3.84 1.76 0.02 -1.22 0.01 0.04 -5.02 113.70 113.13 2cqv s SER 59 Ca 0.76 -1.66 -0.26 0.00 1.31 0.00 0.00 55.95 56.10 2cqv s SER 59 Cb -0.33 0.49 -0.14 0.00 0.21 0.00 0.00 66.02 66.25 2cqv s SER 59 CO 0.31 -0.97 1.14 -0.08 0.41 0.00 0.00 173.24 174.04 2cqv h GLU 60 N 2.12 -0.91 -1.11 12.44 4.81 -1.96 -3.07 114.58 126.90 2cqv h GLU 60 Ca -0.30 0.06 0.33 0.00 -0.13 0.00 0.00 59.36 59.32 2cqv h GLU 60 Cb 1.25 0.21 -0.12 0.00 0.63 0.00 0.00 28.75 30.71 2cqv h GLU 60 CO 0.46 -0.60 0.69 -0.91 -0.73 0.00 0.00 179.01 177.92 2cqv h ASN 61 N -1.18 0.42 0.00 1.04 2.35 -1.98 -3.45 115.58 112.78 2cqv h ASN 61 Ca -0.10 0.13 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 2cqv h ASN 61 Cb 0.72 0.08 0.00 0.00 0.05 0.00 0.00 38.32 39.17 2cqv h ASN 61 CO 0.16 -0.06 0.00 0.61 -1.65 0.00 0.00 177.43 176.49 2cqv n GLY 62 N -1.43 -0.79 3.05 2.83 0.00 -1.16 -0.11 105.19 107.58 2cqv n GLY 62 Ca 0.31 -0.08 -0.11 0.00 0.00 0.00 0.00 46.02 46.13 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 -0.02 -0.02 1.61 0.15 -1.24 -0.78 113.70 109.40 2cqv s SER 63 Ca 0.00 -0.04 0.08 0.00 0.70 0.00 0.00 55.95 56.68 2cqv s SER 63 Cb 0.00 0.22 -0.02 0.00 -1.71 0.00 0.00 66.02 64.51 2cqv s SER 63 CO 0.00 -0.22 -0.25 -0.75 1.20 0.00 0.00 173.24 173.22 2cqv s LYS 64 N -0.76 2.09 -0.43 5.44 2.20 -1.16 -1.75 119.74 125.36 2cqv s LYS 64 Ca -0.08 -0.89 0.03 0.00 -0.36 0.00 0.00 55.97 54.67 2cqv s LYS 64 Cb -0.05 -1.98 0.12 0.00 -1.51 0.00 0.00 37.83 34.40 2cqv s LYS 64 CO 0.01 0.52 0.16 -1.17 -0.36 0.00 0.00 175.35 174.51 2cqv s LEU 65 N -0.53 4.60 -0.18 5.43 2.96 -0.17 -1.03 118.68 129.76 2cqv s LEU 65 Ca 0.08 -2.56 -0.26 0.00 -0.22 0.00 0.00 54.13 51.17 2cqv s LEU 65 Cb -0.10 -1.65 -0.01 0.00 0.50 0.00 0.00 46.19 44.93 2cqv s LEU 65 CO -0.00 -0.32 0.86 -0.89 -1.32 0.00 0.00 176.35 174.68 2cqv s THR 66 N 0.34 4.85 -0.45 3.68 2.01 -0.85 -2.76 115.64 122.46 2cqv s THR 66 Ca 0.14 1.69 -0.10 0.00 0.31 0.00 0.00 61.69 63.73 2cqv s THR 66 Cb -0.22 -4.16 0.10 0.00 0.01 0.00 0.00 72.50 68.22 2cqv s THR 66 CO -0.04 -0.01 0.31 -0.63 -0.69 0.00 0.00 174.62 173.55 2cqv s ILE 67 N 2.37 4.28 0.27 1.82 1.01 -0.76 -0.69 121.20 129.50 2cqv s ILE 67 Ca 0.39 -1.55 -0.23 0.00 0.00 0.00 0.00 60.65 59.25 2cqv s ILE 67 Cb -0.16 -3.70 -0.09 0.00 0.01 0.00 0.00 42.46 38.51 2cqv s ILE 67 CO 0.11 -0.63 0.85 -0.76 0.00 0.00 0.00 174.94 174.51 2cqv s LEU 68 N 1.41 4.35 -1.33 2.97 2.01 0.16 -3.01 118.68 125.25 2cqv s LEU 68 Ca 0.04 1.65 -0.04 0.00 0.01 0.00 0.00 54.13 55.80 2cqv s LEU 68 Cb -0.25 -3.81 -0.00 0.00 0.01 0.00 0.00 46.19 42.15 2cqv s LEU 68 CO 0.01 -0.01 0.56 0.00 1.01 0.00 0.00 176.35 177.91 2cqv n ALA 69 N 0.68 -2.11 -1.17 4.21 0.00 -1.16 -4.64 120.51 116.31 2cqv n ALA 69 Ca -0.00 -0.24 -0.48 0.00 0.00 0.00 0.00 53.44 52.72 2cqv n ALA 69 Cb 0.50 -2.08 -0.11 0.00 0.00 0.00 0.00 19.45 17.76 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 -4.33 0.21 -1.97 0.00 0.00 -0.41 -4.33 120.51 109.70 2cqv n ALA 70 Ca -0.27 0.04 -0.26 0.00 0.00 0.00 0.00 53.44 52.95 2cqv n ALA 70 Cb 0.67 -1.88 0.13 0.00 0.00 0.00 0.00 19.45 18.37 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 6.08 1.33 0.23 0.00 0.52 -1.26 0.28 118.95 126.13 2cqv s ARG 71 Ca 1.10 -0.80 0.05 0.00 -0.52 0.00 0.00 55.73 55.57 2cqv s ARG 71 Cb -1.26 -2.14 0.24 0.00 0.52 0.00 0.00 34.95 32.31 2cqv s ARG 71 CO 0.54 -1.79 1.55 0.37 0.02 0.00 0.00 175.30 175.98 2cqv h GLN 72 N -0.95 0.18 -0.34 3.54 5.75 -1.94 -3.21 115.11 118.15 2cqv h GLN 72 Ca -0.40 -0.13 -0.06 0.00 -0.15 0.00 0.00 58.65 57.90 2cqv h GLN 72 Cb 1.26 0.02 -0.01 0.00 1.07 0.00 0.00 27.48 29.82 2cqv h GLN 72 CO 0.41 0.76 -0.04 1.05 -2.65 0.00 0.00 178.83 178.36 2cqv h GLU 73 N 0.13 0.62 -1.82 1.69 -0.00 -1.99 -2.72 114.58 110.49 2cqv h GLU 73 Ca -0.01 -0.21 0.55 0.00 -0.00 0.00 0.00 59.36 59.68 2cqv h GLU 73 Cb 1.16 -0.05 -0.10 0.00 -0.00 0.00 0.00 28.75 29.77 2cqv h GLU 73 CO 0.10 0.76 1.28 0.45 -0.00 0.00 0.00 179.01 181.60 2cqv h HIS 74 N 0.41 0.14 -1.18 2.06 3.86 -1.95 -3.38 115.15 115.11 2cqv h HIS 74 Ca 0.09 0.01 -0.68 0.00 -1.16 0.00 0.00 60.37 58.63 2cqv h HIS 74 Cb 0.51 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 28.93 2cqv h HIS 74 CO 0.04 -0.07 1.34 0.00 0.86 0.00 0.00 177.93 180.10 2cqv n GLY 76 N 6.18 -1.20 3.49 0.00 0.00 -1.06 -4.97 105.19 107.63 2cqv n GLY 76 Ca 0.39 -0.97 -0.36 0.00 0.00 0.00 0.00 46.02 45.08 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 1.33 1.89 -0.25 0.00 1.51 -0.30 -2.40 117.35 119.13 2cqv s TYR 78 Ca 0.05 -0.22 -0.10 0.00 -1.01 0.00 0.00 57.07 55.80 2cqv s TYR 78 Cb -0.15 -2.91 0.11 0.00 -0.11 0.00 0.00 41.96 38.90 2cqv s TYR 78 CO 0.03 -1.50 0.56 0.99 -1.11 0.00 0.00 175.55 174.53 2cqv s THR 79 N -3.04 -0.71 -0.47 -0.71 2.01 0.38 -2.55 115.64 110.54 2cqv s THR 79 Ca 0.64 0.06 -0.16 0.00 0.31 0.00 0.00 61.69 62.54 2cqv s THR 79 Cb -0.07 -0.86 0.07 0.00 0.01 0.00 0.00 72.50 71.65 2cqv s THR 79 CO 0.43 0.03 0.43 -0.22 -0.69 0.00 0.00 174.62 174.59 2cqv s LEU 80 N 2.57 5.49 -0.26 4.42 2.96 -1.24 -0.25 118.68 132.38 2cqv s LEU 80 Ca -0.05 -1.24 -0.16 0.00 -0.22 0.00 0.00 54.13 52.46 2cqv s LEU 80 Cb -0.11 -2.22 -0.03 0.00 0.50 0.00 0.00 46.19 44.32 2cqv s LEU 80 CO -0.17 -0.67 0.44 -0.22 -1.32 0.00 0.00 176.35 174.41 2cqv s LEU 81 N 1.80 4.06 -0.29 -0.68 2.96 0.62 -2.37 118.68 124.77 2cqv s LEU 81 Ca 0.06 0.42 0.03 0.00 -0.22 0.00 0.00 54.13 54.42 2cqv s LEU 81 Cb -0.23 -2.54 0.07 0.00 0.50 0.00 0.00 46.19 43.99 2cqv s LEU 81 CO 0.08 -0.22 -0.06 0.68 -1.32 0.00 0.00 176.35 175.51 2cqv s VAL 82 N 2.08 2.21 0.05 1.68 -7.23 0.30 -0.33 120.40 119.16 2cqv s VAL 82 Ca 0.18 -1.88 0.02 0.00 -1.81 0.00 0.00 61.98 58.49 2cqv s VAL 82 Cb -0.16 -2.42 -0.04 0.00 0.56 0.00 0.00 36.38 34.33 2cqv s VAL 82 CO 0.09 -0.22 0.07 -1.61 -0.31 0.00 0.00 175.10 173.12 2cqv s GLU 83 N 1.03 2.91 0.06 4.82 2.02 -1.09 -0.45 118.70 128.00 2cqv s GLU 83 Ca -0.02 -0.63 -0.19 0.00 0.02 0.00 0.00 54.97 54.15 2cqv s GLU 83 Cb -0.20 -2.75 0.04 0.00 0.10 0.00 0.00 34.13 31.32 2cqv s GLU 83 CO -0.06 0.60 0.44 1.21 0.02 0.00 0.00 175.26 177.46 2cqv s ASN 84 N -2.10 -0.32 0.31 -0.19 2.47 0.79 0.64 114.94 116.54 2cqv s ASN 84 Ca 0.26 -0.00 0.19 0.00 0.42 0.00 0.00 52.86 53.74 2cqv s ASN 84 Cb -0.12 0.45 1.10 0.00 -1.45 0.00 0.00 41.25 41.22 2cqv s ASN 84 CO 0.18 -0.70 1.23 1.17 -3.72 0.00 0.00 177.10 175.26 2cqv n LYS 85 N 0.38 -0.04 0.00 0.43 3.00 -1.26 -1.36 118.16 119.31 2cqv n LYS 85 Ca -0.18 1.05 0.00 0.00 -0.00 0.00 0.00 58.31 59.18 2cqv n LYS 85 Cb 0.60 -1.94 0.00 0.00 0.00 0.00 0.00 35.03 33.69 2cqv n LYS 85 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 2cqv n LEU 86 N -4.60 0.58 0.00 3.14 4.77 -1.26 -5.05 117.00 114.57 2cqv n LEU 86 Ca 0.30 0.56 0.00 0.00 -0.03 0.00 0.00 56.01 56.85 2cqv n LEU 86 Cb 1.08 -0.29 0.00 0.00 -2.33 0.00 0.00 43.42 41.89 2cqv n LEU 86 CO 0.05 -0.29 0.00 0.61 -1.33 0.00 0.00 177.39 176.43 2cqv n GLY 87 N 0.57 4.82 3.50 -0.72 0.00 -0.47 -4.94 105.19 107.96 2cqv n GLY 87 Ca 0.00 -0.60 -0.09 0.00 0.00 0.00 0.00 46.02 45.33 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 1.26 -0.38 0.08 1.61 1.04 -1.26 -0.15 113.70 115.90 2cqv s SER 88 Ca 0.00 0.03 -0.06 0.00 0.48 0.00 0.00 55.95 56.40 2cqv s SER 88 Cb 0.00 0.40 -0.02 0.00 0.10 0.00 0.00 66.02 66.50 2cqv s SER 88 CO 0.00 -0.63 0.12 -0.60 0.98 0.00 0.00 173.24 173.10 2cqv s ARG 89 N -3.05 0.79 -0.05 4.02 6.06 0.41 -4.80 118.95 122.33 2cqv s ARG 89 Ca 0.04 -1.08 -0.07 0.00 -2.50 0.00 0.00 55.73 52.12 2cqv s ARG 89 Cb -0.01 0.30 0.01 0.00 0.06 0.00 0.00 34.95 35.31 2cqv s ARG 89 CO -0.09 -0.23 0.17 1.14 -2.50 0.00 0.00 175.30 173.80 2cqv s GLN 90 N -3.90 0.26 0.49 5.12 -2.07 -1.26 -0.54 119.66 117.77 2cqv s GLN 90 Ca 0.07 0.13 0.00 0.00 -1.82 0.00 0.00 55.36 53.74 2cqv s GLN 90 Cb 0.06 0.12 0.00 0.00 -1.09 0.00 0.00 33.01 32.10 2cqv s GLN 90 CO -0.09 -0.04 0.02 0.00 -1.32 0.00 0.00 175.29 173.86 2cqv n ALA 91 N 2.69 0.43 -3.65 2.60 0.00 -1.00 -4.93 120.51 116.65 2cqv n ALA 91 Ca -0.14 -2.17 -0.03 0.00 0.00 0.00 0.00 53.44 51.10 2cqv n ALA 91 Cb 0.58 1.17 -0.05 0.00 0.00 0.00 0.00 19.45 21.15 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 -3.76 0.57 -0.07 0.00 -0.21 -1.26 -3.67 119.66 111.26 2cqv s GLN 92 Ca 0.02 1.37 -0.00 0.00 0.02 0.00 0.00 55.36 56.76 2cqv s GLN 92 Cb -0.00 0.69 0.03 0.00 1.00 0.00 0.00 33.01 34.72 2cqv s GLN 92 CO 0.01 -0.20 -0.02 0.54 -2.12 0.00 0.00 175.29 173.50 2cqv s VAL 93 N 2.64 0.50 0.23 1.09 0.11 -1.06 -4.91 120.40 119.00 2cqv s VAL 93 Ca -0.06 -0.00 -0.28 0.00 -2.93 0.00 0.00 61.98 58.70 2cqv s VAL 93 Cb -0.11 -0.60 -0.09 0.00 -1.53 0.00 0.00 36.38 34.06 2cqv s VAL 93 CO -0.18 0.26 0.90 0.20 -3.33 0.00 0.00 175.10 172.95 2cqv s ASN 94 N 1.59 7.56 0.14 3.54 0.01 -1.26 -1.15 114.94 125.37 2cqv s ASN 94 Ca -0.00 1.86 0.05 0.00 -0.71 0.00 0.00 52.86 54.06 2cqv s ASN 94 Cb -0.13 -2.58 -0.04 0.00 0.41 0.00 0.00 41.25 38.91 2cqv s ASN 94 CO -0.04 0.15 -0.12 -0.22 -1.51 0.00 0.00 177.10 175.37 2cqv s LEU 95 N -1.25 2.47 -0.09 0.60 2.96 0.11 -2.27 118.68 121.22 2cqv s LEU 95 Ca 0.40 -0.92 -0.06 0.00 -0.22 0.00 0.00 54.13 53.34 2cqv s LEU 95 Cb -0.25 -0.43 0.03 0.00 0.50 0.00 0.00 46.19 46.05 2cqv s LEU 95 CO 0.30 -0.25 0.21 -0.89 -1.32 0.00 0.00 176.35 174.40 2cqv s THR 96 N -2.78 -0.02 -0.14 3.68 2.01 -1.14 -2.55 115.64 114.69 2cqv s THR 96 Ca 0.13 0.09 -0.06 0.00 0.31 0.00 0.00 61.69 62.16 2cqv s THR 96 Cb -0.01 -0.32 -0.04 0.00 0.01 0.00 0.00 72.50 72.14 2cqv s THR 96 CO 0.02 0.04 0.08 -0.69 -0.69 0.00 0.00 174.62 173.37 2cqv s VAL 97 N 0.76 4.95 -0.17 3.82 1.01 -1.26 -1.10 120.40 128.41 2cqv s VAL 97 Ca -0.05 0.01 -0.01 0.00 0.00 0.00 0.00 61.98 61.92 2cqv s VAL 97 Cb -0.07 -3.17 0.05 0.00 0.00 0.00 0.00 36.38 33.19 2cqv s VAL 97 CO -0.04 0.55 -0.01 0.68 0.00 0.00 0.00 175.10 176.27 2cqv s VAL 98 N -0.38 0.80 -1.50 2.92 -7.23 -0.16 -4.86 120.40 109.98 2cqv s VAL 98 Ca 0.10 -0.54 0.08 0.00 -1.81 0.00 0.00 61.98 59.81 2cqv s VAL 98 Cb -0.12 -1.11 0.30 0.00 0.56 0.00 0.00 36.38 36.00 2cqv s VAL 98 CO 0.02 -0.01 1.14 -0.67 -0.31 0.00 0.00 175.10 175.27 2cqv n ASP 99 N 4.97 2.14 -3.77 4.85 2.03 -1.26 -0.71 116.55 124.79 2cqv n ASP 99 Ca -0.10 -2.15 -0.13 0.00 0.52 0.00 0.00 54.79 52.94 2cqv n ASP 99 Cb 0.47 -0.35 -0.08 0.00 -0.72 0.00 0.00 41.12 40.44 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 -1.64 0.68 0.41 -0.67 1.02 -1.26 -4.90 119.74 113.38 2cqv s LYS 100 Ca 0.21 -0.29 -0.25 0.00 0.02 0.00 0.00 55.97 55.66 2cqv s LYS 100 Cb 0.13 0.30 -0.08 0.00 -0.52 0.00 0.00 37.83 37.66 2cqv s LYS 100 CO 0.11 -0.19 1.19 -1.25 -0.92 0.00 0.00 175.35 174.28 2cqv s PRO 101 N -1.63 3.99 -0.03 -1.68 0.04 -1.26 -5.04 135.00 129.39 2cqv s PRO 101 Ca -0.12 1.87 0.06 0.00 0.04 0.00 0.00 61.00 62.86 2cqv s PRO 101 Cb -0.04 -2.64 -0.02 0.00 0.04 0.00 0.00 34.50 31.83 2cqv s PRO 101 CO 0.02 -0.38 -0.22 0.34 0.04 0.00 0.00 177.00 176.81 2cqv s ASP 102 N -1.12 3.41 0.92 6.66 -1.08 -1.26 -5.13 116.67 119.07 2cqv s ASP 102 Ca 0.58 -0.37 -0.12 0.00 -0.52 0.00 0.00 52.55 52.13 2cqv s ASP 102 Cb -0.31 -0.53 0.14 0.00 -1.46 0.00 0.00 42.92 40.76 2cqv s ASP 102 CO 0.39 0.33 1.09 -2.16 0.52 0.00 0.00 175.17 175.34 2cqv s PRO 103 N -0.66 1.10 0.16 4.34 0.04 -1.26 -4.98 135.00 133.74 2cqv s PRO 103 Ca 0.11 0.76 -0.31 0.00 0.04 0.00 0.00 61.00 61.60 2cqv s PRO 103 Cb -0.10 -1.80 -0.08 0.00 0.04 0.00 0.00 34.50 32.56 2cqv s PRO 103 CO -0.00 -2.34 1.33 -1.25 0.04 0.00 0.00 177.00 174.78 2cqv s PRO 104 N -4.94 4.37 -0.18 0.56 0.04 -1.26 -5.02 135.00 128.56 2cqv s PRO 104 Ca 0.64 2.04 -0.09 0.00 0.04 0.00 0.00 61.00 63.63 2cqv s PRO 104 Cb -0.18 -3.22 -0.05 0.00 0.04 0.00 0.00 34.50 31.09 2cqv s PRO 104 CO 0.57 -0.32 0.12 0.00 0.04 0.00 0.00 177.00 177.41 2cqv s ALA 105 N 0.54 3.68 0.00 8.56 0.00 -1.26 -5.03 121.76 128.25 2cqv s ALA 105 Ca 0.60 -0.69 -0.39 0.00 0.00 0.00 0.00 51.96 51.48 2cqv s ALA 105 Cb -0.36 -2.10 -0.19 0.00 0.00 0.00 0.00 23.12 20.48 2cqv s ALA 105 CO 0.35 0.25 1.21 0.41 0.00 0.00 0.00 175.76 177.98 2cqv n GLY 106 N 3.24 0.05 2.77 0.00 0.00 -1.26 -4.96 105.19 105.03 2cqv n GLY 106 Ca -0.17 0.76 -0.18 0.00 0.00 0.00 0.00 46.02 46.43 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 0.42 0.10 -1.91 2.61 2.01 -1.26 -5.01 115.64 112.60 2cqv s THR 107 Ca 0.89 0.18 0.15 0.00 0.31 0.00 0.00 61.69 63.23 2cqv s THR 107 Cb -1.16 -0.24 0.41 0.00 0.01 0.00 0.00 72.50 71.52 2cqv s THR 107 CO 0.55 0.15 1.35 -0.81 -0.69 0.00 0.00 174.62 175.17 2cqv n PRO 108 N 4.49 0.44 -1.83 4.92 -0.04 -1.26 -4.78 135.00 136.94 2cqv n PRO 108 Ca -0.20 0.02 -0.29 0.00 -0.04 0.00 0.00 63.50 62.99 2cqv n PRO 108 Cb 0.50 -1.50 0.14 0.00 -0.04 0.00 0.00 33.50 32.60 2cqv n PRO 108 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2cqv s SER 109 N -2.09 3.73 -0.14 3.54 0.15 -1.26 -5.09 113.70 112.53 2cqv s SER 109 Ca 0.22 0.62 -0.05 0.00 0.70 0.00 0.00 55.95 57.43 2cqv s SER 109 Cb 0.11 -0.95 0.07 0.00 -1.71 0.00 0.00 66.02 63.54 2cqv s SER 109 CO 0.19 -2.38 0.29 -0.83 1.20 0.00 0.00 173.24 171.71 2cqv s GLY 110 N -4.59 -0.16 0.99 9.45 0.00 -1.26 -5.16 107.32 106.59 2cqv s GLY 110 Ca 0.67 1.05 -0.12 0.00 0.00 0.00 0.00 44.72 46.31 2cqv s GLY 110 CO 0.51 2.02 1.09 2.56 0.00 0.00 0.00 173.10 179.28 2cqv s PRO 111 N 2.40 0.49 0.18 2.90 0.04 -1.26 -5.09 135.00 134.66 2cqv s PRO 111 Ca 0.00 0.55 -0.11 0.00 0.04 0.00 0.00 61.00 61.48 2cqv s PRO 111 Cb -0.12 -1.74 -0.00 0.00 0.04 0.00 0.00 34.50 32.68 2cqv s PRO 111 CO -0.09 -2.70 0.34 0.45 0.04 0.00 0.00 177.00 175.04 2cqv s SER 112 N -3.45 -0.03 0.35 6.66 0.15 -1.26 -5.13 113.70 111.00 2cqv s SER 112 Ca 0.65 -0.81 -0.21 0.00 0.70 0.00 0.00 55.95 56.29 2cqv s SER 112 Cb -0.19 0.47 -0.15 0.00 -1.71 0.00 0.00 66.02 64.45 2cqv s SER 112 CO 0.58 -0.94 0.13 -0.24 1.20 0.00 0.00 173.24 173.97 2cqv n SER 113 N -0.25 -2.50 0.00 5.45 2.88 -1.26 -5.38 113.62 112.56 2cqv n SER 113 Ca -0.07 0.80 0.00 0.00 -1.33 0.00 0.00 58.87 58.27 2cqv n SER 113 Cb 0.63 -0.84 0.00 0.00 -0.75 0.00 0.00 64.21 63.25 2cqv n SER 113 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42