#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 -5.11 -4.76 1.61 2.88 -1.26 -4.98 113.62 102.00 2cqv n SER 2 Ca 0.00 -0.42 -0.39 0.00 -1.33 0.00 0.00 58.87 56.73 2cqv n SER 2 Cb 0.00 -3.98 -0.05 0.00 -0.75 0.00 0.00 64.21 59.42 2cqv n SER 2 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2cqv s SER 3 N -3.31 7.17 0.00 -3.46 1.04 -1.26 -5.04 113.70 108.84 2cqv s SER 3 Ca 0.42 1.39 0.00 0.00 0.48 0.00 0.00 55.95 58.24 2cqv s SER 3 Cb -0.18 -2.44 0.00 0.00 0.10 0.00 0.00 66.02 63.50 2cqv s SER 3 CO 0.56 0.08 0.00 0.61 0.98 0.00 0.00 173.24 175.46 2cqv n GLY 4 N 2.26 1.12 2.92 7.32 0.00 -1.26 -5.12 105.19 112.44 2cqv n GLY 4 Ca -0.04 -0.21 -0.30 0.00 0.00 0.00 0.00 46.02 45.47 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 0.00 4.47 -0.25 1.61 1.04 -1.26 -4.94 113.70 114.37 2cqv s SER 5 Ca 0.00 -2.17 -0.14 0.00 0.48 0.00 0.00 55.95 54.12 2cqv s SER 5 Cb 0.00 -1.41 -0.10 0.00 0.10 0.00 0.00 66.02 64.60 2cqv s SER 5 CO 0.00 -0.36 -0.34 -1.54 0.98 0.00 0.00 173.24 171.98 2cqv n SER 6 N 4.20 1.86 0.00 7.02 3.41 -1.26 -5.05 113.62 123.81 2cqv n SER 6 Ca 0.03 0.32 0.00 0.00 -0.26 0.00 0.00 58.87 58.96 2cqv n SER 6 Cb 0.40 -0.77 0.00 0.00 -0.26 0.00 0.00 64.21 63.59 2cqv n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2cqv n GLY 7 N 1.38 2.57 3.77 5.00 0.00 -1.26 -4.42 105.19 112.23 2cqv n GLY 7 Ca -0.45 -1.39 -0.37 0.00 0.00 0.00 0.00 46.02 43.81 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 3.82 -0.05 1.61 0.04 -1.26 -4.40 135.00 132.78 2cqv s PRO 8 Ca 0.00 1.80 -0.13 0.00 0.04 0.00 0.00 61.00 62.71 2cqv s PRO 8 Cb 0.00 -2.47 0.03 0.00 0.04 0.00 0.00 34.50 32.09 2cqv s PRO 8 CO 0.00 -0.50 0.31 1.14 0.04 0.00 0.00 177.00 177.99 2cqv s GLN 9 N -2.60 0.57 -0.74 4.56 -2.07 -0.37 -4.47 119.66 114.54 2cqv s GLN 9 Ca 0.62 0.01 -0.14 0.00 -1.82 0.00 0.00 55.36 54.03 2cqv s GLN 9 Cb -0.29 0.26 0.19 0.00 -1.09 0.00 0.00 33.01 32.08 2cqv s GLN 9 CO 0.36 -0.14 0.67 0.42 -1.32 0.00 0.00 175.29 175.29 2cqv s ILE 10 N -0.85 5.36 -0.03 3.63 1.01 -1.26 -1.61 121.20 127.44 2cqv s ILE 10 Ca -0.09 -2.27 0.14 0.00 0.00 0.00 0.00 60.65 58.43 2cqv s ILE 10 Cb -0.04 -4.35 0.01 0.00 0.01 0.00 0.00 42.46 38.08 2cqv s ILE 10 CO 0.03 -0.98 1.45 0.16 0.00 0.00 0.00 174.94 175.61 2cqv h ILE 11 N 5.10 1.08 -3.23 2.92 -2.65 -1.91 -3.44 117.51 115.38 2cqv h ILE 11 Ca -0.00 -2.40 -0.62 0.00 1.03 0.00 0.00 64.86 62.86 2cqv h ILE 11 Cb 1.05 2.45 -0.34 0.00 -2.05 0.00 0.00 36.82 37.92 2cqv h ILE 11 CO 0.82 0.59 -0.85 -1.10 0.03 0.00 0.00 178.15 177.64 2cqv s GLN 12 N -3.01 2.55 -0.27 0.16 -0.21 -1.24 -5.02 119.66 112.62 2cqv s GLN 12 Ca 0.03 -0.68 -0.25 0.00 0.02 0.00 0.00 55.36 54.48 2cqv s GLN 12 Cb 0.09 -2.12 0.07 0.00 1.00 0.00 0.00 33.01 32.05 2cqv s GLN 12 CO 0.75 -0.05 0.73 0.12 -2.12 0.00 0.00 175.29 174.73 2cqv s PHE 13 N 0.93 -0.79 0.12 0.91 5.36 -1.26 -1.63 117.98 121.61 2cqv s PHE 13 Ca -0.06 1.91 -0.31 0.00 -0.96 0.00 0.00 56.93 57.51 2cqv s PHE 13 Cb -0.15 0.29 -0.08 0.00 -0.34 0.00 0.00 43.02 42.74 2cqv s PHE 13 CO -0.02 -0.38 1.36 -1.25 -1.46 0.00 0.00 175.22 173.46 2cqv s PRO 14 N 0.44 4.34 0.75 10.12 0.04 -1.26 -5.03 135.00 144.39 2cqv s PRO 14 Ca -0.00 2.03 -0.01 0.00 0.04 0.00 0.00 61.00 63.06 2cqv s PRO 14 Cb -0.05 -3.25 0.15 0.00 0.04 0.00 0.00 34.50 31.39 2cqv s PRO 14 CO -0.00 -0.40 1.02 0.39 0.04 0.00 0.00 177.00 178.05 2cqv n GLU 15 N 3.81 -0.18 -1.52 4.56 1.02 -1.26 -4.68 120.64 122.39 2cqv n GLU 15 Ca 0.11 -2.70 -0.62 0.00 -0.02 0.00 0.00 57.16 53.92 2cqv n GLU 15 Cb 0.43 -0.71 -0.10 0.00 -0.02 0.00 0.00 31.44 31.04 2cqv n GLU 15 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2cqv n ASP 16 N -2.96 1.02 -3.70 1.62 2.03 -1.26 -4.67 116.55 108.64 2cqv n ASP 16 Ca 0.17 0.99 -0.18 0.00 0.52 0.00 0.00 54.79 56.28 2cqv n ASP 16 Cb 0.59 -0.84 -0.09 0.00 -0.72 0.00 0.00 41.12 40.07 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 3.67 1.64 0.35 -0.67 -2.07 -0.53 -4.97 119.66 117.08 2cqv s GLN 17 Ca 1.04 -1.94 0.05 0.00 -1.82 0.00 0.00 55.36 52.68 2cqv s GLN 17 Cb -1.42 0.15 -0.07 0.00 -1.09 0.00 0.00 33.01 30.58 2cqv s GLN 17 CO 0.73 -0.55 0.05 0.21 -1.32 0.00 0.00 175.29 174.41 2cqv s LYS 18 N -3.67 1.73 -0.26 9.60 2.20 -1.26 -2.34 119.74 125.74 2cqv s LYS 18 Ca 0.38 -1.97 -0.18 0.00 -0.36 0.00 0.00 55.97 53.84 2cqv s LYS 18 Cb 0.04 -1.05 0.07 0.00 -1.51 0.00 0.00 37.83 35.38 2cqv s LYS 18 CO 0.22 -0.16 0.67 0.54 -0.36 0.00 0.00 175.35 176.25 2cqv s VAL 19 N -3.15 -0.00 -0.24 4.02 0.11 0.26 -4.87 120.40 116.52 2cqv s VAL 19 Ca 0.36 0.01 -0.29 0.00 -2.93 0.00 0.00 61.98 59.13 2cqv s VAL 19 Cb 0.09 -0.95 -0.01 0.00 -1.53 0.00 0.00 36.38 33.98 2cqv s VAL 19 CO 0.16 0.00 1.40 -0.13 -3.33 0.00 0.00 175.10 173.20 2cqv s ARG 20 N 1.17 3.95 -0.41 1.54 1.81 -1.26 -1.23 118.95 124.52 2cqv s ARG 20 Ca -0.06 1.47 -0.37 0.00 -1.72 0.00 0.00 55.73 55.05 2cqv s ARG 20 Cb -0.05 -3.91 -0.16 0.00 -0.45 0.00 0.00 34.95 30.38 2cqv s ARG 20 CO -0.12 -1.09 1.65 0.00 -0.68 0.00 0.00 175.30 175.06 2cqv n ALA 21 N 7.67 -0.15 0.00 2.13 0.00 0.20 -0.04 120.51 130.32 2cqv n ALA 21 Ca 0.16 0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.82 2cqv n ALA 21 Cb 0.46 -1.67 0.00 0.00 0.00 0.00 0.00 19.45 18.23 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 5.43 1.13 4.02 0.00 0.00 0.94 -4.85 105.19 111.86 2cqv n GLY 22 Ca 0.40 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.23 2cqv n GLY 22 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2cqv s GLU 23 N -0.70 2.44 -0.23 1.61 0.41 0.95 -4.49 118.70 118.70 2cqv s GLU 23 Ca 0.00 -1.56 -0.03 0.00 -0.41 0.00 0.00 54.97 52.98 2cqv s GLU 23 Cb 0.00 -2.65 0.01 0.00 -1.78 0.00 0.00 34.13 29.71 2cqv s GLU 23 CO 0.00 -0.69 -0.07 -1.54 -0.49 0.00 0.00 175.26 172.47 2cqv s SER 24 N -4.56 4.16 0.21 -0.19 1.04 -1.26 -2.32 113.70 110.78 2cqv s SER 24 Ca 0.59 -0.57 0.07 0.00 0.48 0.00 0.00 55.95 56.52 2cqv s SER 24 Cb -0.07 -1.69 -0.04 0.00 0.10 0.00 0.00 66.02 64.33 2cqv s SER 24 CO 0.37 -0.05 0.07 0.54 0.98 0.00 0.00 173.24 175.14 2cqv s VAL 25 N 1.41 3.98 -0.24 5.02 0.11 -1.14 -4.97 120.40 124.57 2cqv s VAL 25 Ca 0.04 -1.45 -0.03 0.00 -2.93 0.00 0.00 61.98 57.61 2cqv s VAL 25 Cb -0.15 -3.06 0.08 0.00 -1.53 0.00 0.00 36.38 31.72 2cqv s VAL 25 CO -0.05 -0.21 0.08 -1.61 -3.33 0.00 0.00 175.10 169.98 2cqv s GLU 26 N -3.31 0.44 -0.53 1.54 2.02 -1.26 -2.25 118.70 115.34 2cqv s GLU 26 Ca 0.30 -0.51 -0.12 0.00 0.02 0.00 0.00 54.97 54.66 2cqv s GLU 26 Cb -0.09 -1.80 0.13 0.00 0.10 0.00 0.00 34.13 32.48 2cqv s GLU 26 CO 0.21 -0.81 0.45 -0.51 0.02 0.00 0.00 175.26 174.62 2cqv s LEU 27 N 1.92 5.98 -0.13 1.80 1.43 -1.04 -4.91 118.68 123.73 2cqv s LEU 27 Ca 0.04 -1.95 -0.02 0.00 -1.03 0.00 0.00 54.13 51.17 2cqv s LEU 27 Cb -0.17 -2.11 -0.02 0.00 0.03 0.00 0.00 46.19 43.92 2cqv s LEU 27 CO -0.19 -0.75 -0.08 0.12 0.23 0.00 0.00 176.35 175.69 2cqv s PHE 28 N 1.32 2.93 -0.39 0.29 5.36 -1.26 -0.88 117.98 125.35 2cqv s PHE 28 Ca 0.06 -0.38 0.01 0.00 -0.96 0.00 0.00 56.93 55.66 2cqv s PHE 28 Cb -0.26 -1.88 0.11 0.00 -0.34 0.00 0.00 43.02 40.64 2cqv s PHE 28 CO 0.00 -0.05 0.13 0.20 -1.46 0.00 0.00 175.22 174.04 2cqv s GLY 29 N 0.21 2.02 0.14 13.12 0.00 -0.58 -4.38 107.32 117.85 2cqv s GLY 29 Ca -0.05 -2.63 -0.33 0.00 0.00 0.00 0.00 44.72 41.72 2cqv s GLY 29 CO 0.04 0.98 1.72 1.17 0.00 0.00 0.00 173.10 177.01 2cqv n LYS 30 N 4.24 2.51 -5.20 2.90 4.81 -0.65 -3.79 118.16 122.98 2cqv n LYS 30 Ca 0.02 0.91 -0.31 0.00 -0.87 0.00 0.00 58.31 58.06 2cqv n LYS 30 Cb 0.41 -2.74 -0.16 0.00 0.02 0.00 0.00 35.03 32.56 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 1.78 2.12 0.05 3.15 -7.23 0.63 -2.92 120.40 117.98 2cqv s VAL 31 Ca 0.80 -1.16 0.03 0.00 -1.81 0.00 0.00 61.98 59.84 2cqv s VAL 31 Cb -0.58 -1.75 -0.02 0.00 0.56 0.00 0.00 36.38 34.58 2cqv s VAL 31 CO 0.37 0.53 -0.11 0.28 -0.31 0.00 0.00 175.10 175.87 2cqv s THR 32 N -0.66 0.79 0.00 5.32 -1.32 -0.64 -4.64 115.64 114.49 2cqv s THR 32 Ca 0.11 -1.09 0.00 0.00 -1.21 0.00 0.00 61.69 59.49 2cqv s THR 32 Cb -0.10 -0.79 0.00 0.00 -1.51 0.00 0.00 72.50 70.09 2cqv s THR 32 CO -0.00 -0.25 0.00 0.61 -2.21 0.00 0.00 174.62 172.77 2cqv n GLY 33 N 1.54 -1.05 2.95 6.08 0.00 -1.26 -1.24 105.19 112.21 2cqv n GLY 33 Ca -0.21 0.39 -0.13 0.00 0.00 0.00 0.00 46.02 46.07 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 -0.46 0.54 2.61 2.01 -1.26 -4.94 115.64 114.13 2cqv s THR 34 Ca 0.00 0.08 -0.16 0.00 0.31 0.00 0.00 61.69 61.93 2cqv s THR 34 Cb 0.00 -0.62 -0.07 0.00 0.01 0.00 0.00 72.50 71.82 2cqv s THR 34 CO 0.00 -0.03 1.00 -1.10 -0.69 0.00 0.00 174.62 173.80 2cqv s GLN 35 N 2.45 3.82 0.77 4.92 -1.52 -1.26 -4.30 119.66 124.55 2cqv s GLN 35 Ca 0.05 0.95 -0.11 0.00 -1.95 0.00 0.00 55.36 54.31 2cqv s GLN 35 Cb -0.14 -2.12 0.06 0.00 -0.22 0.00 0.00 33.01 30.59 2cqv s GLN 35 CO -0.12 -0.38 1.09 -1.25 -0.25 0.00 0.00 175.29 174.39 2cqv s PRO 36 N -4.24 2.24 -0.07 2.91 0.04 -1.26 -5.06 135.00 129.56 2cqv s PRO 36 Ca 0.59 1.17 -0.00 0.00 0.04 0.00 0.00 61.00 62.80 2cqv s PRO 36 Cb -0.11 -1.89 0.02 0.00 0.04 0.00 0.00 34.50 32.56 2cqv s PRO 36 CO 0.35 -1.65 -0.04 0.42 0.04 0.00 0.00 177.00 176.12 2cqv s ILE 37 N -2.90 0.65 0.48 0.56 1.01 -1.26 -4.56 121.20 115.17 2cqv s ILE 37 Ca 0.61 -0.11 -0.21 0.00 0.00 0.00 0.00 60.65 60.94 2cqv s ILE 37 Cb -0.17 -0.70 -0.08 0.00 0.01 0.00 0.00 42.46 41.51 2cqv s ILE 37 CO 0.56 0.28 1.07 -0.89 0.00 0.00 0.00 174.94 175.96 2cqv s THR 38 N 1.44 3.59 -0.10 2.92 2.01 0.19 -4.94 115.64 120.74 2cqv s THR 38 Ca -0.02 1.05 -0.04 0.00 0.31 0.00 0.00 61.69 62.99 2cqv s THR 38 Cb -0.13 -3.46 0.05 0.00 0.01 0.00 0.00 72.50 68.97 2cqv s THR 38 CO -0.03 -0.15 0.21 0.00 -0.69 0.00 0.00 174.62 173.95 2cqv s THR 40 N 2.35 1.09 -0.34 0.00 2.01 0.94 -5.00 115.64 116.69 2cqv s THR 40 Ca 0.02 -0.51 -0.09 0.00 0.31 0.00 0.00 61.69 61.42 2cqv s THR 40 Cb -0.12 -0.96 0.02 0.00 0.01 0.00 0.00 72.50 71.45 2cqv s THR 40 CO -0.07 0.33 0.15 0.26 -0.69 0.00 0.00 174.62 174.60 2cqv s TRP 41 N 0.25 3.22 0.46 4.92 0.52 -1.26 -0.53 118.94 126.51 2cqv s TRP 41 Ca -0.06 -1.03 0.05 0.00 0.02 0.00 0.00 56.10 55.08 2cqv s TRP 41 Cb -0.11 -2.35 -0.04 0.00 -1.15 0.00 0.00 33.47 29.82 2cqv s TRP 41 CO 0.02 -0.63 0.06 -1.64 0.02 0.00 0.00 176.95 174.78 2cqv s MET 42 N 1.51 2.11 -0.20 4.98 -1.94 -0.19 -0.65 119.30 124.92 2cqv s MET 42 Ca 0.02 -2.17 -0.10 0.00 -1.71 0.00 0.00 55.69 51.72 2cqv s MET 42 Cb -0.19 -1.68 0.07 0.00 2.01 0.00 0.00 34.83 35.05 2cqv s MET 42 CO 0.05 -0.21 0.48 0.21 -0.01 0.00 0.00 175.02 175.53 2cqv s LYS 43 N -3.84 0.45 -1.35 2.03 2.20 0.84 -0.23 119.74 119.85 2cqv s LYS 43 Ca 0.25 0.94 -0.03 0.00 -0.36 0.00 0.00 55.97 56.77 2cqv s LYS 43 Cb 0.05 0.09 0.02 0.00 -1.51 0.00 0.00 37.83 36.48 2cqv s LYS 43 CO 0.13 -0.17 0.76 1.19 -0.36 0.00 0.00 175.35 176.90 2cqv n PHE 44 N 4.48 -2.01 -3.64 4.03 3.72 -1.11 -1.50 117.46 121.44 2cqv n PHE 44 Ca -0.20 0.86 -0.24 0.00 -0.05 0.00 0.00 57.45 57.81 2cqv n PHE 44 Cb 0.55 -4.35 0.07 0.00 -0.94 0.00 0.00 39.48 34.81 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 -7.42 -3.47 -1.08 5.12 -1.26 -4.98 116.66 99.20 2cqv n ARG 45 Ca -0.23 0.79 -0.08 0.00 -1.93 0.00 0.00 57.85 56.40 2cqv n ARG 45 Cb 0.65 -5.81 -0.08 0.00 -1.16 0.00 0.00 32.46 26.06 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 -6.29 0.36 0.34 5.56 2.20 -0.57 -5.14 119.74 116.20 2cqv s LYS 46 Ca 0.55 0.81 -0.27 0.00 -0.36 0.00 0.00 55.97 56.70 2cqv s LYS 46 Cb -0.25 -0.02 -0.13 0.00 -1.51 0.00 0.00 37.83 35.93 2cqv s LYS 46 CO 0.75 -0.46 1.04 0.94 -0.36 0.00 0.00 175.35 177.26 2cqv n GLN 47 N 5.38 1.46 -2.97 4.03 7.27 -1.26 -0.11 117.38 131.18 2cqv n GLN 47 Ca -0.06 0.52 -0.36 0.00 0.07 0.00 0.00 57.00 57.17 2cqv n GLN 47 Cb 0.50 -1.98 -0.06 0.00 2.41 0.00 0.00 30.24 31.11 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 -1.15 4.44 -0.27 1.69 1.01 0.18 -4.77 121.20 122.34 2cqv s ILE 48 Ca 0.60 1.44 -0.10 0.00 0.00 0.00 0.00 60.65 62.58 2cqv s ILE 48 Cb -0.63 -3.84 -0.05 0.00 0.01 0.00 0.00 42.46 37.95 2cqv s ILE 48 CO 0.59 0.07 0.16 -1.10 0.00 0.00 0.00 174.94 174.67 2cqv s GLN 49 N -2.28 3.92 0.17 2.79 -1.52 -1.26 -4.92 119.66 116.55 2cqv s GLN 49 Ca 0.49 -0.34 -0.33 0.00 -1.95 0.00 0.00 55.36 53.24 2cqv s GLN 49 Cb -0.15 -3.58 -0.12 0.00 -0.22 0.00 0.00 33.01 28.93 2cqv s GLN 49 CO 0.20 -0.14 1.70 0.39 -0.25 0.00 0.00 175.29 177.20 2cqv n GLU 50 N 4.90 2.57 -3.57 2.91 1.02 -1.26 -4.64 120.64 122.57 2cqv n GLU 50 Ca -0.15 0.93 -0.05 0.00 -0.02 0.00 0.00 57.16 57.87 2cqv n GLU 50 Cb 0.52 -2.76 -0.02 0.00 -0.02 0.00 0.00 31.44 29.16 2cqv n GLU 50 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2cqv s SER 51 N 1.45 -0.22 0.58 1.62 1.04 0.11 -4.95 113.70 113.33 2cqv s SER 51 Ca 0.78 -0.04 0.33 0.00 0.48 0.00 0.00 55.95 57.50 2cqv s SER 51 Cb -0.56 0.27 1.37 0.00 0.10 0.00 0.00 66.02 67.19 2cqv s SER 51 CO 0.35 -0.44 1.65 -0.08 0.98 0.00 0.00 173.24 175.70 2cqv h GLU 52 N 2.00 0.00 0.10 4.02 4.57 -1.97 1.01 114.58 124.32 2cqv h GLU 52 Ca -0.17 0.00 -0.25 0.00 -1.18 0.00 0.00 59.36 57.76 2cqv h GLU 52 Cb 1.20 0.00 0.03 0.00 -0.16 0.00 0.00 28.75 29.82 2cqv h GLU 52 CO 0.27 0.00 -1.03 0.45 -1.18 0.00 0.00 179.01 177.51 2cqv h HIS 53 N 0.00 0.84 -3.04 0.92 3.86 -1.90 -3.35 115.15 112.47 2cqv h HIS 53 Ca 0.49 -0.53 -0.56 0.00 -1.16 0.00 0.00 60.37 58.61 2cqv h HIS 53 Cb 2.34 -0.07 -0.40 0.00 1.06 0.00 0.00 27.41 30.35 2cqv h HIS 53 CO 0.00 1.38 -0.76 -1.64 0.86 0.00 0.00 177.93 177.77 2cqv s MET 54 N -2.90 0.52 0.36 2.45 -1.94 0.35 -0.41 119.30 117.72 2cqv s MET 54 Ca -0.11 -0.81 0.05 0.00 -1.71 0.00 0.00 55.69 53.11 2cqv s MET 54 Cb 0.04 -1.72 -0.01 0.00 2.01 0.00 0.00 34.83 35.15 2cqv s MET 54 CO 0.89 -0.96 0.51 0.15 -0.01 0.00 0.00 175.02 175.60 2cqv s LYS 55 N 1.81 3.10 0.00 2.03 1.02 0.11 0.06 119.74 127.87 2cqv s LYS 55 Ca 0.08 -0.92 0.00 0.00 0.02 0.00 0.00 55.97 55.16 2cqv s LYS 55 Cb -0.17 -2.77 -0.00 0.00 -0.52 0.00 0.00 37.83 34.37 2cqv s LYS 55 CO -0.27 -0.01 -0.01 0.08 -0.92 0.00 0.00 175.35 174.22 2cqv s VAL 56 N -2.25 0.10 -0.61 3.17 1.01 -1.26 -1.77 120.40 118.78 2cqv s VAL 56 Ca 0.46 -0.16 0.04 0.00 0.00 0.00 0.00 61.98 62.32 2cqv s VAL 56 Cb -0.10 -0.11 0.16 0.00 0.00 0.00 0.00 36.38 36.33 2cqv s VAL 56 CO 0.32 -0.04 0.42 -1.61 0.00 0.00 0.00 175.10 174.19 2cqv s GLU 57 N -0.21 2.08 -0.14 2.72 0.41 -0.54 -4.95 118.70 118.07 2cqv s GLU 57 Ca -0.02 -2.96 -0.29 0.00 -0.41 0.00 0.00 54.97 51.29 2cqv s GLU 57 Cb -0.02 -3.05 -0.02 0.00 -1.78 0.00 0.00 34.13 29.26 2cqv s GLU 57 CO -0.00 -1.26 1.36 0.54 -0.49 0.00 0.00 175.26 175.41 2cqv s ASN 58 N -0.92 6.86 0.33 -0.19 2.20 -1.26 -2.84 114.94 119.12 2cqv s ASN 58 Ca 0.24 1.81 0.03 0.00 -0.94 0.00 0.00 52.86 54.00 2cqv s ASN 58 Cb -0.08 -2.54 -0.02 0.00 -2.00 0.00 0.00 41.25 36.61 2cqv s ASN 58 CO -0.13 -0.82 0.34 -0.44 -2.94 0.00 0.00 177.10 173.11 2cqv s SER 59 N 2.36 1.33 0.03 3.54 0.01 0.94 -5.01 113.70 116.90 2cqv s SER 59 Ca 0.59 -1.64 -0.15 0.00 1.31 0.00 0.00 55.95 56.06 2cqv s SER 59 Cb -0.24 0.59 -0.07 0.00 0.21 0.00 0.00 66.02 66.50 2cqv s SER 59 CO 0.19 -1.14 1.23 -0.08 0.41 0.00 0.00 173.24 173.85 2cqv h GLU 60 N 2.15 -0.43 -1.01 12.44 4.57 -1.96 -2.52 114.58 127.82 2cqv h GLU 60 Ca -0.27 0.03 0.42 0.00 -1.18 0.00 0.00 59.36 58.36 2cqv h GLU 60 Cb 1.24 0.10 -0.18 0.00 -0.16 0.00 0.00 28.75 29.75 2cqv h GLU 60 CO 0.38 -0.29 0.55 -0.91 -1.18 0.00 0.00 179.01 177.57 2cqv h ASN 61 N -0.45 0.33 0.00 1.04 2.35 -1.99 -3.45 115.58 113.42 2cqv h ASN 61 Ca -0.03 0.25 0.00 0.00 -0.55 0.00 0.00 56.30 55.97 2cqv h ASN 61 Cb 0.37 0.26 0.00 0.00 0.05 0.00 0.00 38.32 39.00 2cqv h ASN 61 CO 0.01 -0.42 0.00 0.61 -1.65 0.00 0.00 177.43 175.97 2cqv n GLY 62 N -1.27 -0.65 3.00 2.83 0.00 -0.95 -0.27 105.19 107.88 2cqv n GLY 62 Ca 0.38 -0.20 -0.09 0.00 0.00 0.00 0.00 46.02 46.11 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 0.31 0.13 1.61 0.15 -1.25 -0.04 113.70 110.61 2cqv s SER 63 Ca 0.00 -0.54 0.07 0.00 0.70 0.00 0.00 55.95 56.18 2cqv s SER 63 Cb 0.00 0.10 -0.04 0.00 -1.71 0.00 0.00 66.02 64.37 2cqv s SER 63 CO 0.00 -0.31 -0.15 -0.75 1.20 0.00 0.00 173.24 173.22 2cqv s LYS 64 N -1.65 1.07 -0.34 5.44 2.20 -1.13 -1.53 119.74 123.81 2cqv s LYS 64 Ca -0.14 -1.25 0.00 0.00 -0.36 0.00 0.00 55.97 54.22 2cqv s LYS 64 Cb -0.09 -1.03 0.11 0.00 -1.51 0.00 0.00 37.83 35.31 2cqv s LYS 64 CO -0.02 0.21 0.13 -1.17 -0.36 0.00 0.00 175.35 174.14 2cqv s LEU 65 N -2.42 2.35 -0.27 5.43 2.96 -0.06 -1.47 118.68 125.21 2cqv s LEU 65 Ca 0.10 -1.90 -0.22 0.00 -0.22 0.00 0.00 54.13 51.89 2cqv s LEU 65 Cb -0.06 -0.90 -0.01 0.00 0.50 0.00 0.00 46.19 45.72 2cqv s LEU 65 CO 0.04 -0.38 0.70 -0.89 -1.32 0.00 0.00 176.35 174.50 2cqv s THR 66 N 1.28 4.92 -0.30 3.68 2.01 -0.73 -2.49 115.64 124.02 2cqv s THR 66 Ca 0.12 1.20 -0.10 0.00 0.31 0.00 0.00 61.69 63.22 2cqv s THR 66 Cb -0.19 -4.01 -0.02 0.00 0.01 0.00 0.00 72.50 68.28 2cqv s THR 66 CO -0.18 -0.06 0.16 -0.63 -0.69 0.00 0.00 174.62 173.23 2cqv s ILE 67 N 2.66 4.81 0.20 1.82 1.01 -0.95 -0.71 121.20 130.04 2cqv s ILE 67 Ca 0.29 -0.21 -0.11 0.00 0.00 0.00 0.00 60.65 60.62 2cqv s ILE 67 Cb -0.15 -3.39 -0.07 0.00 0.01 0.00 0.00 42.46 38.86 2cqv s ILE 67 CO 0.09 0.14 0.54 -0.76 0.00 0.00 0.00 174.94 174.96 2cqv s LEU 68 N 1.66 4.22 -1.53 2.97 2.01 0.45 -2.89 118.68 125.57 2cqv s LEU 68 Ca 0.06 0.96 -0.02 0.00 0.01 0.00 0.00 54.13 55.14 2cqv s LEU 68 Cb -0.17 -3.54 0.02 0.00 0.01 0.00 0.00 46.19 42.51 2cqv s LEU 68 CO 0.07 -0.02 0.17 0.00 1.01 0.00 0.00 176.35 177.58 2cqv n ALA 69 N 0.16 -1.95 -1.18 4.21 0.00 -1.22 -4.58 120.51 115.95 2cqv n ALA 69 Ca -0.01 -0.36 -0.45 0.00 0.00 0.00 0.00 53.44 52.62 2cqv n ALA 69 Cb 0.52 -1.13 -0.12 0.00 0.00 0.00 0.00 19.45 18.72 2cqv n ALA 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2cqv n ALA 70 N -4.51 0.22 -2.06 0.00 0.00 -0.98 -4.27 120.51 108.91 2cqv n ALA 70 Ca -0.29 -0.02 -0.26 0.00 0.00 0.00 0.00 53.44 52.87 2cqv n ALA 70 Cb 0.68 -1.87 0.04 0.00 0.00 0.00 0.00 19.45 18.29 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 6.35 2.76 0.65 0.00 0.52 -1.26 -0.04 118.95 127.92 2cqv s ARG 71 Ca 1.10 -0.14 0.39 0.00 -0.52 0.00 0.00 55.73 56.56 2cqv s ARG 71 Cb -1.21 -2.29 2.18 0.00 0.52 0.00 0.00 34.95 34.16 2cqv s ARG 71 CO 0.51 -0.78 2.28 0.37 0.02 0.00 0.00 175.30 177.69 2cqv h GLN 72 N -0.20 0.00 0.13 3.54 5.75 -1.94 -1.27 115.11 121.11 2cqv h GLN 72 Ca -0.45 0.00 -0.30 0.00 -0.15 0.00 0.00 58.65 57.75 2cqv h GLN 72 Cb 1.27 0.00 0.03 0.00 1.07 0.00 0.00 27.48 29.85 2cqv h GLN 72 CO 0.60 0.00 -1.27 1.05 -2.65 0.00 0.00 178.83 176.56 2cqv h GLU 73 N 0.00 0.63 -1.18 1.69 4.11 -1.98 -3.19 114.58 114.65 2cqv h GLU 73 Ca 0.01 -0.85 0.34 0.00 0.07 0.00 0.00 59.36 58.93 2cqv h GLU 73 Cb 0.13 0.28 -0.05 0.00 0.50 0.00 0.00 28.75 29.61 2cqv h GLU 73 CO -0.00 1.39 1.10 0.45 0.07 0.00 0.00 179.01 182.02 2cqv h HIS 74 N 0.28 0.00 -2.61 2.06 3.86 -1.59 -3.40 115.15 113.75 2cqv h HIS 74 Ca -0.20 0.00 -0.59 0.00 -1.16 0.00 0.00 60.37 58.43 2cqv h HIS 74 Cb 1.94 0.00 0.08 0.00 1.06 0.00 0.00 27.41 30.49 2cqv h HIS 74 CO 0.12 0.00 0.60 0.00 0.86 0.00 0.00 177.93 179.50 2cqv n GLY 76 N 2.20 -0.25 3.60 0.00 0.00 -1.14 -5.03 105.19 104.57 2cqv n GLY 76 Ca 0.12 -1.50 -0.34 0.00 0.00 0.00 0.00 46.02 44.30 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 -0.43 2.88 -0.13 0.00 1.51 -0.60 -2.73 117.35 117.85 2cqv s TYR 78 Ca 0.07 -0.20 -0.04 0.00 -1.01 0.00 0.00 57.07 55.89 2cqv s TYR 78 Cb -0.12 -1.38 0.05 0.00 -0.11 0.00 0.00 41.96 40.41 2cqv s TYR 78 CO 0.02 0.51 0.11 0.99 -1.11 0.00 0.00 175.55 176.08 2cqv s THR 79 N -2.26 -0.16 -0.36 -0.71 2.01 0.68 -2.44 115.64 112.40 2cqv s THR 79 Ca 0.33 0.09 -0.17 0.00 0.31 0.00 0.00 61.69 62.26 2cqv s THR 79 Cb -0.06 -0.43 -0.00 0.00 0.01 0.00 0.00 72.50 72.02 2cqv s THR 79 CO 0.23 -0.07 0.45 -0.22 -0.69 0.00 0.00 174.62 174.31 2cqv s LEU 80 N 2.20 4.46 -0.20 4.42 2.96 -0.95 -1.02 118.68 130.56 2cqv s LEU 80 Ca 0.04 -0.21 -0.08 0.00 -0.22 0.00 0.00 54.13 53.66 2cqv s LEU 80 Cb -0.14 -2.46 -0.04 0.00 0.50 0.00 0.00 46.19 44.04 2cqv s LEU 80 CO -0.07 -0.45 0.08 -0.22 -1.32 0.00 0.00 176.35 174.37 2cqv s LEU 81 N 2.22 3.82 -0.29 -0.68 2.96 0.31 -0.73 118.68 126.29 2cqv s LEU 81 Ca 0.15 0.05 0.01 0.00 -0.22 0.00 0.00 54.13 54.13 2cqv s LEU 81 Cb -0.16 -1.98 0.09 0.00 0.50 0.00 0.00 46.19 44.63 2cqv s LEU 81 CO 0.13 0.13 0.03 0.68 -1.32 0.00 0.00 176.35 176.00 2cqv s VAL 82 N 0.63 1.53 0.15 1.68 -7.23 0.78 -0.04 120.40 117.91 2cqv s VAL 82 Ca 0.04 -1.64 0.05 0.00 -1.81 0.00 0.00 61.98 58.62 2cqv s VAL 82 Cb -0.13 -2.03 -0.04 0.00 0.56 0.00 0.00 36.38 34.74 2cqv s VAL 82 CO 0.01 -0.46 0.11 -1.61 -0.31 0.00 0.00 175.10 172.84 2cqv s GLU 83 N 1.32 2.84 0.36 4.82 2.02 -1.09 -0.44 118.70 128.52 2cqv s GLU 83 Ca 0.05 -0.86 -0.12 0.00 0.02 0.00 0.00 54.97 54.05 2cqv s GLU 83 Cb -0.18 -2.63 0.05 0.00 0.10 0.00 0.00 34.13 31.47 2cqv s GLU 83 CO -0.13 0.50 0.70 0.27 0.02 0.00 0.00 175.26 176.61 2cqv n ASN 84 N -0.17 -2.04 -0.16 -0.19 6.94 0.10 0.52 115.26 120.27 2cqv n ASN 84 Ca -0.09 -2.50 -0.02 0.00 -0.02 0.00 0.00 54.58 51.95 2cqv n ASN 84 Cb 0.54 3.42 0.06 0.00 -2.36 0.00 0.00 39.78 41.44 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 0.18 0.00 -3.83 1.63 -1.86 -3.22 116.57 109.47 2cqv h LYS 85 Ca -0.30 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.48 2cqv h LYS 85 Cb 1.14 -0.04 0.00 0.00 -0.60 0.00 0.00 32.23 32.73 2cqv h LYS 85 CO 0.39 0.12 0.00 1.28 -3.45 0.00 0.00 179.45 177.79 2cqv n LEU 86 N -5.16 0.21 0.00 5.20 4.32 -1.26 -5.03 117.00 115.28 2cqv n LEU 86 Ca 0.06 0.68 0.00 0.00 -0.02 0.00 0.00 56.01 56.73 2cqv n LEU 86 Cb 0.26 -0.25 0.00 0.00 -1.62 0.00 0.00 43.42 41.81 2cqv n LEU 86 CO 0.18 -0.25 0.00 0.61 -1.22 0.00 0.00 177.39 176.71 2cqv n GLY 87 N -0.33 4.87 3.80 -0.72 0.00 -1.22 -4.95 105.19 106.64 2cqv n GLY 87 Ca 0.00 -0.61 -0.06 0.00 0.00 0.00 0.00 46.02 45.35 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 1.30 -0.25 0.11 1.61 1.04 -1.26 0.01 113.70 116.26 2cqv s SER 88 Ca 0.00 -0.51 -0.15 0.00 0.48 0.00 0.00 55.95 55.78 2cqv s SER 88 Cb 0.00 0.65 0.03 0.00 0.10 0.00 0.00 66.02 66.79 2cqv s SER 88 CO 0.00 -1.19 0.36 -0.60 0.98 0.00 0.00 173.24 172.79 2cqv s ARG 89 N -3.71 1.01 -0.10 4.02 6.06 0.41 -4.78 118.95 121.86 2cqv s ARG 89 Ca 0.11 -0.75 -0.04 0.00 -2.50 0.00 0.00 55.73 52.55 2cqv s ARG 89 Cb -0.04 0.44 0.05 0.00 0.06 0.00 0.00 34.95 35.46 2cqv s ARG 89 CO 0.04 -0.38 0.22 1.14 -2.50 0.00 0.00 175.30 173.82 2cqv s GLN 90 N -3.77 0.12 0.47 5.12 -2.07 -1.26 -0.15 119.66 118.12 2cqv s GLN 90 Ca 0.03 0.61 0.07 0.00 -1.82 0.00 0.00 55.36 54.25 2cqv s GLN 90 Cb 0.02 -0.14 0.00 0.00 -1.09 0.00 0.00 33.01 31.81 2cqv s GLN 90 CO -0.11 -0.25 0.38 0.00 -1.32 0.00 0.00 175.29 173.98 2cqv s ALA 91 N 1.99 4.16 0.04 2.60 0.00 0.09 -4.92 121.76 125.71 2cqv s ALA 91 Ca -0.02 -1.72 -0.09 0.00 0.00 0.00 0.00 51.96 50.13 2cqv s ALA 91 Cb -0.12 -0.85 0.00 0.00 0.00 0.00 0.00 23.12 22.15 2cqv s ALA 91 CO -0.07 -0.33 0.18 -0.65 0.00 0.00 0.00 175.76 174.89 2cqv s GLN 92 N -4.18 0.66 -0.21 0.00 -1.52 -1.26 -2.23 119.66 110.92 2cqv s GLN 92 Ca 0.43 -0.62 -0.25 0.00 -1.95 0.00 0.00 55.36 52.97 2cqv s GLN 92 Cb -0.02 0.27 0.07 0.00 -0.22 0.00 0.00 33.01 33.11 2cqv s GLN 92 CO 0.25 -0.19 0.67 0.54 -0.25 0.00 0.00 175.29 176.32 2cqv s VAL 93 N -2.46 0.00 -0.10 1.09 0.11 -1.02 -4.91 120.40 113.11 2cqv s VAL 93 Ca -0.06 -0.01 -0.08 0.00 -2.93 0.00 0.00 61.98 58.91 2cqv s VAL 93 Cb -0.02 -0.95 -0.04 0.00 -1.53 0.00 0.00 36.38 33.84 2cqv s VAL 93 CO -0.03 -0.01 0.17 0.20 -3.33 0.00 0.00 175.10 172.10 2cqv s ASN 94 N 0.05 6.43 0.07 3.54 0.01 -1.26 -1.56 114.94 122.22 2cqv s ASN 94 Ca -0.02 0.51 0.04 0.00 -0.71 0.00 0.00 52.86 52.68 2cqv s ASN 94 Cb -0.04 -2.08 -0.03 0.00 0.41 0.00 0.00 41.25 39.51 2cqv s ASN 94 CO 0.03 0.39 -0.11 -0.22 -1.51 0.00 0.00 177.10 175.67 2cqv s LEU 95 N -1.09 2.30 -0.01 0.60 2.96 -0.65 -1.45 118.68 121.33 2cqv s LEU 95 Ca 0.17 -0.64 -0.01 0.00 -0.22 0.00 0.00 54.13 53.43 2cqv s LEU 95 Cb -0.12 -0.36 0.01 0.00 0.50 0.00 0.00 46.19 46.22 2cqv s LEU 95 CO 0.06 -0.16 0.03 -0.89 -1.32 0.00 0.00 176.35 174.07 2cqv s THR 96 N -1.59 -0.02 -0.11 3.68 2.01 -0.99 -2.89 115.64 115.75 2cqv s THR 96 Ca -0.03 0.07 -0.04 0.00 0.31 0.00 0.00 61.69 62.01 2cqv s THR 96 Cb -0.08 -0.06 -0.04 0.00 0.01 0.00 0.00 72.50 72.34 2cqv s THR 96 CO 0.01 0.03 0.04 -0.69 -0.69 0.00 0.00 174.62 173.32 2cqv s VAL 97 N 0.36 4.67 -0.04 3.82 1.01 -1.26 -0.57 120.40 128.39 2cqv s VAL 97 Ca -0.03 -0.11 -0.00 0.00 0.00 0.00 0.00 61.98 61.84 2cqv s VAL 97 Cb -0.04 -3.00 0.03 0.00 0.00 0.00 0.00 36.38 33.36 2cqv s VAL 97 CO -0.01 0.59 0.00 0.68 0.00 0.00 0.00 175.10 176.37 2cqv s VAL 98 N -0.78 0.23 -0.81 2.92 -7.23 -0.36 -4.86 120.40 109.51 2cqv s VAL 98 Ca 0.12 0.11 0.17 0.00 -1.81 0.00 0.00 61.98 60.57 2cqv s VAL 98 Cb -0.12 -0.35 0.70 0.00 0.56 0.00 0.00 36.38 37.17 2cqv s VAL 98 CO 0.03 0.19 1.62 -0.67 -0.31 0.00 0.00 175.10 175.95 2cqv n ASP 99 N 4.50 4.81 -3.55 4.85 -0.08 -1.26 0.59 116.55 126.42 2cqv n ASP 99 Ca -0.19 -2.60 -0.11 0.00 -1.51 0.00 0.00 54.79 50.38 2cqv n ASP 99 Cb 0.50 -0.58 -0.04 0.00 2.34 0.00 0.00 41.12 43.34 2cqv n ASP 99 CO 0.00 0.00 0.00 -1.59 0.12 0.00 0.00 177.20 175.73 2cqv s LYS 100 N -2.12 0.73 0.17 -0.67 -2.85 -1.26 -4.96 119.74 108.78 2cqv s LYS 100 Ca 0.50 0.04 -0.30 0.00 -1.00 0.00 0.00 55.97 55.20 2cqv s LYS 100 Cb 0.34 0.34 -0.08 0.00 -2.06 0.00 0.00 37.83 36.37 2cqv s LYS 100 CO 0.21 -0.26 1.32 -1.25 0.10 0.00 0.00 175.35 175.47 2cqv s PRO 101 N -1.67 4.38 0.06 1.78 0.04 -1.26 -5.04 135.00 133.28 2cqv s PRO 101 Ca -0.01 2.04 0.09 0.00 0.04 0.00 0.00 61.00 63.16 2cqv s PRO 101 Cb -0.01 -3.21 -0.03 0.00 0.04 0.00 0.00 34.50 31.29 2cqv s PRO 101 CO -0.00 -0.29 -0.26 0.34 0.04 0.00 0.00 177.00 176.83 2cqv s ASP 102 N 0.54 3.17 0.29 6.66 -1.08 -1.26 -5.12 116.67 119.87 2cqv s ASP 102 Ca 0.58 -0.61 -0.29 0.00 -0.52 0.00 0.00 52.55 51.71 2cqv s ASP 102 Cb -0.36 -0.28 -0.10 0.00 -1.46 0.00 0.00 42.92 40.72 2cqv s ASP 102 CO 0.36 0.25 1.24 -2.16 0.52 0.00 0.00 175.17 175.38 2cqv s PRO 103 N -1.34 4.45 0.00 4.34 0.04 -1.26 -5.04 135.00 136.19 2cqv s PRO 103 Ca 0.12 2.06 0.00 0.00 0.04 0.00 0.00 61.00 63.22 2cqv s PRO 103 Cb -0.10 -3.13 0.00 0.00 0.04 0.00 0.00 34.50 31.31 2cqv s PRO 103 CO 0.03 -0.08 0.00 -0.35 0.04 0.00 0.00 177.00 176.64 2cqv n PRO 104 N 1.27 -0.42 -1.12 0.56 -0.04 -1.26 -4.83 135.00 129.15 2cqv n PRO 104 Ca 0.01 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.23 2cqv n PRO 104 Cb 0.43 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.78 2cqv n PRO 104 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2cqv n ALA 105 N -3.00 6.84 -2.09 0.55 0.00 -1.26 -4.89 120.51 116.66 2cqv n ALA 105 Ca 0.00 -2.54 -0.19 0.00 0.00 0.00 0.00 53.44 50.71 2cqv n ALA 105 Cb 0.00 -2.78 0.00 0.00 0.00 0.00 0.00 19.45 16.68 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 2.09 1.99 -0.23 0.00 0.00 -1.26 -5.13 107.32 104.78 2cqv s GLY 106 Ca 0.68 -1.78 -0.12 0.00 0.00 0.00 0.00 44.72 43.50 2cqv s GLY 106 CO -0.03 -1.60 0.55 -1.59 0.00 0.00 0.00 173.10 170.44 2cqv s THR 107 N -2.45 -0.21 -0.73 0.90 2.01 -1.26 -5.10 115.64 108.80 2cqv s THR 107 Ca 0.53 0.05 -0.26 0.00 0.31 0.00 0.00 61.69 62.33 2cqv s THR 107 Cb -0.07 -0.82 -0.03 0.00 0.01 0.00 0.00 72.50 71.59 2cqv s THR 107 CO 0.32 0.02 1.90 -2.16 -0.69 0.00 0.00 174.62 174.01 2cqv s PRO 108 N 1.83 2.59 0.24 4.92 0.04 -1.26 -4.86 135.00 138.50 2cqv s PRO 108 Ca -0.08 0.26 -0.13 0.00 0.04 0.00 0.00 61.00 61.08 2cqv s PRO 108 Cb -0.08 -4.65 0.31 0.00 0.04 0.00 0.00 34.50 30.12 2cqv s PRO 108 CO -0.16 -3.00 1.58 0.77 0.04 0.00 0.00 177.00 176.23 2cqv h SER 109 N 13.56 -1.01 -3.98 6.66 0.02 -2.07 -3.47 113.55 123.26 2cqv h SER 109 Ca -0.12 0.27 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 2cqv h SER 109 Cb 1.10 0.59 0.00 0.00 0.14 0.00 0.00 62.40 64.24 2cqv h SER 109 CO 1.21 -0.29 -0.16 0.61 -1.14 0.00 0.00 176.83 177.06 2cqv n GLY 110 N -1.52 -3.02 3.72 -3.77 0.00 -1.26 -4.90 105.19 94.44 2cqv n GLY 110 Ca 0.11 -1.22 -0.42 0.00 0.00 0.00 0.00 46.02 44.49 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 -4.30 4.35 -0.05 1.61 0.04 -1.26 -5.03 135.00 130.36 2cqv s PRO 111 Ca 0.00 2.03 0.04 0.00 0.04 0.00 0.00 61.00 63.12 2cqv s PRO 111 Cb 0.00 -3.25 -0.00 0.00 0.04 0.00 0.00 34.50 31.29 2cqv s PRO 111 CO 0.00 -0.37 -0.18 0.45 0.04 0.00 0.00 177.00 176.94 2cqv s SER 112 N 0.93 2.30 0.12 6.66 0.15 -1.26 -5.04 113.70 117.56 2cqv s SER 112 Ca 0.62 -0.38 -0.23 0.00 0.70 0.00 0.00 55.95 56.66 2cqv s SER 112 Cb -0.36 -0.72 -0.04 0.00 -1.71 0.00 0.00 66.02 63.19 2cqv s SER 112 CO 0.32 0.15 1.68 0.28 1.20 0.00 0.00 173.24 176.87 2cqv h SER 113 N 6.34 -0.41 0.00 5.45 0.02 -2.04 -3.57 113.55 119.34 2cqv h SER 113 Ca -0.31 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.71 2cqv h SER 113 Cb 1.18 0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.91 2cqv h SER 113 CO 0.48 -0.18 0.00 0.61 -1.14 0.00 0.00 176.83 176.59