#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cqv s SER 2 N 0.00 6.40 0.12 1.61 1.04 -1.26 -4.97 113.70 116.64 2cqv s SER 2 Ca 0.00 0.15 -0.33 0.00 0.48 0.00 0.00 55.95 56.25 2cqv s SER 2 Cb 0.00 -2.30 -0.11 0.00 0.10 0.00 0.00 66.02 63.70 2cqv s SER 2 CO 0.00 -0.52 1.56 0.28 0.98 0.00 0.00 173.24 175.54 2cqv h SER 3 N 8.39 -1.68 0.00 7.02 0.02 -2.07 -3.48 113.55 121.75 2cqv h SER 3 Ca -0.27 0.21 0.00 0.00 -0.84 0.00 0.00 61.79 60.89 2cqv h SER 3 Cb 1.12 0.66 0.00 0.00 0.14 0.00 0.00 62.40 64.32 2cqv h SER 3 CO 0.80 -0.47 0.00 0.61 -1.14 0.00 0.00 176.83 176.63 2cqv n GLY 4 N -1.43 2.90 3.67 -3.77 0.00 -1.26 -5.12 105.19 100.18 2cqv n GLY 4 Ca -0.05 -0.11 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 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 2.00 6.54 0.10 1.61 1.04 -1.26 -4.84 113.70 118.89 2cqv s SER 5 Ca 0.00 2.52 0.00 0.00 0.48 0.00 0.00 55.95 58.95 2cqv s SER 5 Cb 0.00 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.58 2cqv s SER 5 CO 0.00 -0.97 0.00 -0.24 0.98 0.00 0.00 173.24 173.01 2cqv n SER 6 N 6.75 0.49 0.00 7.02 2.88 -1.26 -5.14 113.62 124.36 2cqv n SER 6 Ca 0.18 0.15 0.00 0.00 -1.33 0.00 0.00 58.87 57.87 2cqv n SER 6 Cb 0.41 -0.09 0.00 0.00 -0.75 0.00 0.00 64.21 63.78 2cqv n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2cqv n GLY 7 N 2.97 0.73 3.74 0.46 0.00 -1.26 -4.44 105.19 107.39 2cqv n GLY 7 Ca 0.00 -0.81 -0.41 0.00 0.00 0.00 0.00 46.02 44.80 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 -1.26 -4.39 135.00 133.44 2cqv s PRO 8 Ca 0.00 2.05 -0.05 0.00 0.04 0.00 0.00 61.00 63.03 2cqv s PRO 8 Cb 0.00 -3.18 -0.01 0.00 0.04 0.00 0.00 34.50 31.36 2cqv s PRO 8 CO 0.00 -0.19 0.09 1.14 0.04 0.00 0.00 177.00 178.08 2cqv s GLN 9 N -0.52 0.48 -0.57 4.56 -2.07 -0.54 -4.41 119.66 116.59 2cqv s GLN 9 Ca 0.54 -0.54 -0.10 0.00 -1.82 0.00 0.00 55.36 53.43 2cqv s GLN 9 Cb -0.36 0.19 0.15 0.00 -1.09 0.00 0.00 33.01 31.89 2cqv s GLN 9 CO 0.41 -0.11 0.46 0.42 -1.32 0.00 0.00 175.29 175.15 2cqv s ILE 10 N -1.74 4.57 -0.02 3.63 1.01 -1.26 -1.50 121.20 125.89 2cqv s ILE 10 Ca -0.12 -2.02 0.11 0.00 0.00 0.00 0.00 60.65 58.62 2cqv s ILE 10 Cb -0.06 -3.95 -0.09 0.00 0.01 0.00 0.00 42.46 38.37 2cqv s ILE 10 CO -0.01 -0.85 1.32 0.16 0.00 0.00 0.00 174.94 175.56 2cqv h ILE 11 N 5.73 1.27 -3.31 2.92 -2.65 -1.92 -3.44 117.51 116.11 2cqv h ILE 11 Ca -0.14 -2.81 -0.67 0.00 1.03 0.00 0.00 64.86 62.26 2cqv h ILE 11 Cb 1.06 2.62 -0.33 0.00 -2.05 0.00 0.00 36.82 38.11 2cqv h ILE 11 CO 0.85 0.72 -0.87 -1.10 0.03 0.00 0.00 178.15 177.78 2cqv s GLN 12 N -2.83 2.98 -0.28 0.16 -0.21 -1.25 -5.02 119.66 113.21 2cqv s GLN 12 Ca 0.02 -0.85 -0.24 0.00 0.02 0.00 0.00 55.36 54.31 2cqv s GLN 12 Cb 0.09 -2.29 0.12 0.00 1.00 0.00 0.00 33.01 31.93 2cqv s GLN 12 CO 0.79 0.12 1.02 0.12 -2.12 0.00 0.00 175.29 175.21 2cqv s PHE 13 N 0.49 -0.49 0.48 0.91 5.36 -1.26 -1.83 117.98 121.63 2cqv s PHE 13 Ca -0.15 1.19 -0.22 0.00 -0.96 0.00 0.00 56.93 56.78 2cqv s PHE 13 Cb -0.17 0.36 -0.07 0.00 -0.34 0.00 0.00 43.02 42.80 2cqv s PHE 13 CO 0.06 -0.24 1.15 -1.25 -1.46 0.00 0.00 175.22 173.48 2cqv s PRO 14 N 0.31 3.64 0.50 10.12 0.04 -1.26 -5.06 135.00 143.29 2cqv s PRO 14 Ca 0.02 1.72 0.07 0.00 0.04 0.00 0.00 61.00 62.85 2cqv s PRO 14 Cb -0.05 -2.29 0.02 0.00 0.04 0.00 0.00 34.50 32.23 2cqv s PRO 14 CO -0.07 -0.64 0.44 -1.21 0.04 0.00 0.00 177.00 175.56 2cqv s GLU 15 N -2.87 2.35 -0.36 4.56 2.02 -1.26 -4.71 118.70 118.42 2cqv s GLU 15 Ca 0.66 -1.81 -0.32 0.00 0.02 0.00 0.00 54.97 53.52 2cqv s GLU 15 Cb -0.27 -2.25 -0.14 0.00 0.10 0.00 0.00 34.13 31.57 2cqv s GLU 15 CO 0.32 -0.49 1.50 -3.47 0.02 0.00 0.00 175.26 173.14 2cqv n ASP 16 N -1.73 0.59 -4.02 -0.19 2.03 -1.26 -4.77 116.55 107.20 2cqv n ASP 16 Ca 0.02 0.54 -0.21 0.00 0.52 0.00 0.00 54.79 55.66 2cqv n ASP 16 Cb 0.63 -0.65 -0.09 0.00 -0.72 0.00 0.00 41.12 40.29 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 4.08 1.71 0.26 -0.67 -2.07 -0.94 -4.99 119.66 117.04 2cqv s GLN 17 Ca 0.86 -2.00 0.07 0.00 -1.82 0.00 0.00 55.36 52.47 2cqv s GLN 17 Cb -1.09 -0.29 -0.05 0.00 -1.09 0.00 0.00 33.01 30.49 2cqv s GLN 17 CO 0.49 -0.45 -0.08 0.21 -1.32 0.00 0.00 175.29 174.14 2cqv s LYS 18 N -3.76 1.51 -0.21 9.60 2.20 -1.26 -2.64 119.74 125.17 2cqv s LYS 18 Ca 0.32 -1.74 -0.17 0.00 -0.36 0.00 0.00 55.97 54.02 2cqv s LYS 18 Cb 0.04 -1.16 0.06 0.00 -1.51 0.00 0.00 37.83 35.26 2cqv s LYS 18 CO 0.17 0.07 0.54 0.54 -0.36 0.00 0.00 175.35 176.32 2cqv s VAL 19 N -3.00 -0.00 0.15 4.02 0.11 -0.28 -4.91 120.40 116.48 2cqv s VAL 19 Ca 0.28 0.02 -0.30 0.00 -2.93 0.00 0.00 61.98 59.04 2cqv s VAL 19 Cb 0.03 -0.77 -0.08 0.00 -1.53 0.00 0.00 36.38 34.03 2cqv s VAL 19 CO 0.11 0.01 1.26 -0.13 -3.33 0.00 0.00 175.10 173.01 2cqv s ARG 20 N 0.63 4.42 -0.30 1.54 1.81 -1.26 -1.01 118.95 124.79 2cqv s ARG 20 Ca -0.03 1.93 -0.35 0.00 -1.72 0.00 0.00 55.73 55.56 2cqv s ARG 20 Cb -0.05 -3.25 -0.11 0.00 -0.45 0.00 0.00 34.95 31.09 2cqv s ARG 20 CO -0.04 -0.23 2.12 0.00 -0.68 0.00 0.00 175.30 176.48 2cqv n ALA 21 N 3.11 1.04 0.00 2.13 0.00 0.88 -0.30 120.51 127.36 2cqv n ALA 21 Ca 0.07 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2cqv n ALA 21 Cb 0.44 -2.56 0.00 0.00 0.00 0.00 0.00 19.45 17.33 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 6.05 2.31 1.89 0.00 0.00 0.29 -4.86 105.19 110.86 2cqv n GLY 22 Ca 0.37 0.00 -0.16 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 -0.47 -2.00 -4.82 1.61 -0.58 0.59 -3.55 120.64 111.42 2cqv n GLU 23 Ca 0.00 -0.95 -0.27 0.00 -0.42 0.00 0.00 57.16 55.52 2cqv n GLU 23 Cb 0.00 -0.86 -0.17 0.00 -0.57 0.00 0.00 31.44 29.85 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 -3.13 2.26 0.10 1.62 1.04 -1.26 -1.12 113.70 113.20 2cqv s SER 24 Ca 0.38 -0.39 0.07 0.00 0.48 0.00 0.00 55.95 56.49 2cqv s SER 24 Cb -0.03 -1.03 -0.04 0.00 0.10 0.00 0.00 66.02 65.02 2cqv s SER 24 CO 0.29 0.08 -0.11 0.54 0.98 0.00 0.00 173.24 175.02 2cqv s VAL 25 N 0.53 3.28 -0.38 5.02 0.11 -1.03 -4.96 120.40 122.97 2cqv s VAL 25 Ca -0.16 -1.28 0.01 0.00 -2.93 0.00 0.00 61.98 57.63 2cqv s VAL 25 Cb -0.16 -2.52 0.12 0.00 -1.53 0.00 0.00 36.38 32.28 2cqv s VAL 25 CO 0.06 0.13 0.16 -1.61 -3.33 0.00 0.00 175.10 170.51 2cqv s GLU 26 N -2.13 1.14 -0.46 1.54 2.02 -1.26 -1.44 118.70 118.11 2cqv s GLU 26 Ca 0.20 -1.68 -0.20 0.00 0.02 0.00 0.00 54.97 53.32 2cqv s GLU 26 Cb -0.11 -2.38 0.03 0.00 0.10 0.00 0.00 34.13 31.78 2cqv s GLU 26 CO 0.13 -1.07 0.60 -0.51 0.02 0.00 0.00 175.26 174.43 2cqv s LEU 27 N 0.86 4.70 -0.09 1.80 1.43 -0.97 -4.89 118.68 121.52 2cqv s LEU 27 Ca 0.14 -0.58 0.02 0.00 -1.03 0.00 0.00 54.13 52.69 2cqv s LEU 27 Cb -0.21 -2.58 -0.02 0.00 0.03 0.00 0.00 46.19 43.41 2cqv s LEU 27 CO -0.10 -0.78 -0.16 0.12 0.23 0.00 0.00 176.35 175.65 2cqv s PHE 28 N 2.65 2.69 -0.43 0.29 5.36 -1.26 0.10 117.98 127.38 2cqv s PHE 28 Ca 0.18 -0.54 0.03 0.00 -0.96 0.00 0.00 56.93 55.64 2cqv s PHE 28 Cb -0.16 -1.72 0.12 0.00 -0.34 0.00 0.00 43.02 40.91 2cqv s PHE 28 CO 0.16 -0.11 0.17 0.20 -1.46 0.00 0.00 175.22 174.18 2cqv s GLY 29 N -0.07 2.00 0.30 13.12 0.00 -0.62 -4.30 107.32 117.76 2cqv s GLY 29 Ca -0.04 -2.75 -0.29 0.00 0.00 0.00 0.00 44.72 41.64 2cqv s GLY 29 CO 0.04 1.15 1.35 1.17 0.00 0.00 0.00 173.10 176.81 2cqv n LYS 30 N 3.73 2.14 -4.52 2.90 4.81 -0.76 -3.67 118.16 122.79 2cqv n LYS 30 Ca 0.05 0.75 -0.23 0.00 -0.87 0.00 0.00 58.31 58.01 2cqv n LYS 30 Cb 0.37 -2.38 -0.14 0.00 0.02 0.00 0.00 35.03 32.90 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 -0.66 1.38 0.05 3.15 -7.23 0.48 -3.16 120.40 114.40 2cqv s VAL 31 Ca 0.60 -1.06 0.03 0.00 -1.81 0.00 0.00 61.98 59.74 2cqv s VAL 31 Cb -0.59 -1.21 -0.03 0.00 0.56 0.00 0.00 36.38 35.11 2cqv s VAL 31 CO 0.57 0.13 -0.09 0.28 -0.31 0.00 0.00 175.10 175.68 2cqv s THR 32 N -0.78 0.62 0.00 5.32 -1.32 -0.56 -4.70 115.64 114.22 2cqv s THR 32 Ca 0.05 -1.15 0.00 0.00 -1.21 0.00 0.00 61.69 59.38 2cqv s THR 32 Cb -0.08 -0.72 0.00 0.00 -1.51 0.00 0.00 72.50 70.19 2cqv s THR 32 CO 0.01 -0.38 0.00 0.61 -2.21 0.00 0.00 174.62 172.65 2cqv n GLY 33 N 1.37 -1.06 2.96 6.08 0.00 -1.26 -1.47 105.19 111.82 2cqv n GLY 33 Ca -0.22 0.39 -0.06 0.00 0.00 0.00 0.00 46.02 46.13 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 -0.69 0.66 2.61 2.01 -1.26 -4.86 115.64 114.10 2cqv s THR 34 Ca 0.00 -0.11 -0.15 0.00 0.31 0.00 0.00 61.69 61.74 2cqv s THR 34 Cb 0.00 -0.89 -0.00 0.00 0.01 0.00 0.00 72.50 71.61 2cqv s THR 34 CO 0.00 -0.14 1.11 -1.10 -0.69 0.00 0.00 174.62 173.81 2cqv s GLN 35 N 2.61 2.81 0.79 4.92 -1.52 -1.26 -4.41 119.66 123.60 2cqv s GLN 35 Ca 0.13 1.40 -0.11 0.00 -1.95 0.00 0.00 55.36 54.83 2cqv s GLN 35 Cb -0.14 -1.95 0.07 0.00 -0.22 0.00 0.00 33.01 30.76 2cqv s GLN 35 CO -0.21 -1.24 1.09 -1.25 -0.25 0.00 0.00 175.29 173.43 2cqv s PRO 36 N -4.08 2.11 -0.07 2.91 0.04 -1.26 -5.05 135.00 129.60 2cqv s PRO 36 Ca 0.67 1.12 -0.02 0.00 0.04 0.00 0.00 61.00 62.81 2cqv s PRO 36 Cb -0.21 -1.88 0.03 0.00 0.04 0.00 0.00 34.50 32.48 2cqv s PRO 36 CO 0.41 -1.74 0.03 0.42 0.04 0.00 0.00 177.00 176.17 2cqv s ILE 37 N -2.91 0.15 0.55 0.56 1.01 -1.26 -4.48 121.20 114.82 2cqv s ILE 37 Ca 0.61 0.19 -0.18 0.00 0.00 0.00 0.00 60.65 61.27 2cqv s ILE 37 Cb -0.17 -0.40 -0.05 0.00 0.01 0.00 0.00 42.46 41.84 2cqv s ILE 37 CO 0.56 0.17 1.09 -0.89 0.00 0.00 0.00 174.94 175.86 2cqv s THR 38 N 2.06 3.47 -0.18 2.92 2.01 0.26 -4.92 115.64 121.26 2cqv s THR 38 Ca 0.04 0.85 -0.07 0.00 0.31 0.00 0.00 61.69 62.82 2cqv s THR 38 Cb -0.13 -3.33 0.08 0.00 0.01 0.00 0.00 72.50 69.13 2cqv s THR 38 CO -0.05 -0.27 0.40 0.00 -0.69 0.00 0.00 174.62 174.01 2cqv s THR 40 N 2.23 0.86 -0.24 0.00 2.01 0.89 -4.99 115.64 116.41 2cqv s THR 40 Ca -0.04 -0.41 -0.10 0.00 0.31 0.00 0.00 61.69 61.45 2cqv s THR 40 Cb -0.11 -0.76 -0.05 0.00 0.01 0.00 0.00 72.50 71.59 2cqv s THR 40 CO -0.12 0.26 0.15 0.26 -0.69 0.00 0.00 174.62 174.48 2cqv s TRP 41 N 0.14 3.27 0.22 4.92 0.52 -1.26 -0.17 118.94 126.58 2cqv s TRP 41 Ca -0.03 0.14 0.05 0.00 0.02 0.00 0.00 56.10 56.28 2cqv s TRP 41 Cb -0.09 -2.27 -0.05 0.00 -1.15 0.00 0.00 33.47 29.92 2cqv s TRP 41 CO 0.01 -0.00 -0.06 -1.64 0.02 0.00 0.00 176.95 175.27 2cqv s MET 42 N 1.16 1.31 -0.08 4.98 -1.94 -0.14 -1.39 119.30 123.21 2cqv s MET 42 Ca 0.07 -1.63 -0.03 0.00 -1.71 0.00 0.00 55.69 52.39 2cqv s MET 42 Cb -0.14 -0.82 0.04 0.00 2.01 0.00 0.00 34.83 35.92 2cqv s MET 42 CO 0.05 0.02 0.09 0.21 -0.01 0.00 0.00 175.02 175.38 2cqv s LYS 43 N -3.77 -0.03 -1.02 2.03 2.20 0.97 0.85 119.74 120.97 2cqv s LYS 43 Ca 0.25 0.31 -0.05 0.00 -0.36 0.00 0.00 55.97 56.12 2cqv s LYS 43 Cb 0.03 -0.75 0.01 0.00 -1.51 0.00 0.00 37.83 35.60 2cqv s LYS 43 CO 0.07 -0.40 0.88 1.19 -0.36 0.00 0.00 175.35 176.72 2cqv n PHE 44 N 5.30 -2.07 -3.01 4.03 3.72 -1.21 -2.58 117.46 121.64 2cqv n PHE 44 Ca -0.04 0.77 -0.18 0.00 -0.05 0.00 0.00 57.45 57.95 2cqv n PHE 44 Cb 0.50 -4.24 0.04 0.00 -0.94 0.00 0.00 39.48 34.84 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 -3.82 -4.64 -3.77 -1.08 5.12 -1.26 -5.01 116.66 102.21 2cqv n ARG 45 Ca -0.07 0.72 -0.16 0.00 -1.93 0.00 0.00 57.85 56.41 2cqv n ARG 45 Cb 0.58 -5.23 -0.16 0.00 -1.16 0.00 0.00 32.46 26.48 2cqv n ARG 45 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2cqv s LYS 46 N -5.63 -0.02 0.06 5.56 3.01 -1.07 -5.12 119.74 116.53 2cqv s LYS 46 Ca 0.31 0.20 -0.31 0.00 -1.01 0.00 0.00 55.97 55.17 2cqv s LYS 46 Cb -0.14 -0.30 -0.08 0.00 -1.01 0.00 0.00 37.83 36.31 2cqv s LYS 46 CO 0.38 -0.19 1.63 -1.14 0.51 0.00 0.00 175.35 176.54 2cqv s GLN 47 N 1.21 4.21 0.55 1.68 0.74 -1.26 -0.02 119.66 126.76 2cqv s GLN 47 Ca -0.07 2.29 -0.19 0.00 0.05 0.00 0.00 55.36 57.44 2cqv s GLN 47 Cb -0.13 -3.60 -0.05 0.00 1.10 0.00 0.00 33.01 30.33 2cqv s GLN 47 CO -0.03 -0.72 1.11 0.42 -0.55 0.00 0.00 175.29 175.52 2cqv s ILE 48 N 2.61 3.32 -0.20 -2.34 1.01 -0.48 -4.89 121.20 120.22 2cqv s ILE 48 Ca 0.73 0.78 -0.05 0.00 0.00 0.00 0.00 60.65 62.10 2cqv s ILE 48 Cb -0.39 -3.29 -0.02 0.00 0.01 0.00 0.00 42.46 38.76 2cqv s ILE 48 CO 0.32 -0.22 -0.00 0.00 0.00 0.00 0.00 174.94 175.03 2cqv s GLN 49 N -3.44 3.60 0.21 2.79 -2.07 -1.26 -4.95 119.66 114.54 2cqv s GLN 49 Ca 0.70 -0.53 -0.31 0.00 -1.82 0.00 0.00 55.36 53.40 2cqv s GLN 49 Cb -0.22 -3.08 -0.11 0.00 -1.09 0.00 0.00 33.01 28.51 2cqv s GLN 49 CO 0.28 -0.01 1.65 -1.21 -1.32 0.00 0.00 175.29 174.68 2cqv s GLU 50 N 1.07 4.16 -0.06 9.60 2.02 -1.26 -4.60 118.70 129.62 2cqv s GLU 50 Ca 0.02 2.52 -0.32 0.00 0.02 0.00 0.00 54.97 57.22 2cqv s GLU 50 Cb -0.14 -3.09 0.12 0.00 0.10 0.00 0.00 34.13 31.12 2cqv s GLU 50 CO 0.01 -0.68 1.25 0.45 0.02 0.00 0.00 175.26 176.32 2cqv s SER 51 N 1.02 -0.09 0.61 -0.19 0.15 0.13 -4.94 113.70 110.40 2cqv s SER 51 Ca 0.71 -0.10 0.28 0.00 0.70 0.00 0.00 55.95 57.53 2cqv s SER 51 Cb -0.47 0.17 1.40 0.00 -1.71 0.00 0.00 66.02 65.40 2cqv s SER 51 CO 0.35 -0.30 1.81 -0.08 1.20 0.00 0.00 173.24 176.22 2cqv h GLU 52 N 2.00 0.00 0.24 5.44 4.81 -1.97 0.43 114.58 125.53 2cqv h GLU 52 Ca -0.24 0.00 -0.32 0.00 -0.13 0.00 0.00 59.36 58.68 2cqv h GLU 52 Cb 1.19 0.00 0.03 0.00 0.63 0.00 0.00 28.75 30.61 2cqv h GLU 52 CO 0.27 0.00 -1.40 0.45 -0.73 0.00 0.00 179.01 177.60 2cqv h HIS 53 N 0.00 0.91 -3.03 0.92 3.86 -1.91 -3.36 115.15 112.53 2cqv h HIS 53 Ca 0.18 -0.66 -0.51 0.00 -1.16 0.00 0.00 60.37 58.22 2cqv h HIS 53 Cb 1.26 -0.04 -0.40 0.00 1.06 0.00 0.00 27.41 29.29 2cqv h HIS 53 CO 0.00 1.54 -0.76 -1.64 0.86 0.00 0.00 177.93 177.92 2cqv s MET 54 N -2.57 0.33 0.42 2.45 -1.94 0.15 -0.71 119.30 117.43 2cqv s MET 54 Ca -0.10 -0.43 0.08 0.00 -1.71 0.00 0.00 55.69 53.53 2cqv s MET 54 Cb 0.04 -1.71 0.01 0.00 2.01 0.00 0.00 34.83 35.18 2cqv s MET 54 CO 0.92 -0.81 0.56 0.15 -0.01 0.00 0.00 175.02 175.83 2cqv s LYS 55 N 1.99 2.78 -0.11 2.03 1.02 0.12 0.22 119.74 127.79 2cqv s LYS 55 Ca 0.04 -1.29 -0.07 0.00 0.02 0.00 0.00 55.97 54.68 2cqv s LYS 55 Cb -0.16 -2.72 0.04 0.00 -0.52 0.00 0.00 37.83 34.47 2cqv s LYS 55 CO -0.20 -0.28 0.27 0.08 -0.92 0.00 0.00 175.35 174.31 2cqv s VAL 56 N -2.37 -0.03 -0.76 3.17 1.01 -1.26 -2.18 120.40 117.98 2cqv s VAL 56 Ca 0.54 0.09 -0.00 0.00 0.00 0.00 0.00 61.98 62.62 2cqv s VAL 56 Cb -0.09 -0.41 0.19 0.00 0.00 0.00 0.00 36.38 36.07 2cqv s VAL 56 CO 0.33 0.04 0.59 -1.61 0.00 0.00 0.00 175.10 174.45 2cqv s GLU 57 N 0.92 2.82 0.01 2.72 2.02 -0.88 -4.96 118.70 121.36 2cqv s GLU 57 Ca -0.06 -3.07 -0.30 0.00 0.02 0.00 0.00 54.97 51.55 2cqv s GLU 57 Cb -0.07 -3.73 -0.06 0.00 0.10 0.00 0.00 34.13 30.37 2cqv s GLU 57 CO -0.06 -1.24 1.42 0.54 0.02 0.00 0.00 175.26 175.94 2cqv s ASN 58 N -0.26 6.83 0.17 -0.19 2.20 -1.26 -3.29 114.94 119.14 2cqv s ASN 58 Ca 0.23 2.15 -0.17 0.00 -0.94 0.00 0.00 52.86 54.14 2cqv s ASN 58 Cb -0.11 -2.56 0.03 0.00 -2.00 0.00 0.00 41.25 36.61 2cqv s ASN 58 CO -0.10 -0.72 0.49 -0.44 -2.94 0.00 0.00 177.10 173.38 2cqv s SER 59 N 1.85 -0.27 0.13 3.54 0.01 -0.09 -5.03 113.70 113.84 2cqv s SER 59 Ca 0.65 -0.42 -0.33 0.00 1.31 0.00 0.00 55.95 57.16 2cqv s SER 59 Cb -0.32 0.55 -0.11 0.00 0.21 0.00 0.00 66.02 66.34 2cqv s SER 59 CO 0.27 -0.99 1.55 -0.08 0.41 0.00 0.00 173.24 174.40 2cqv h GLU 60 N 2.24 -0.39 -1.00 12.44 4.81 -1.94 0.11 114.58 130.85 2cqv h GLU 60 Ca -0.31 0.03 0.38 0.00 -0.13 0.00 0.00 59.36 59.33 2cqv h GLU 60 Cb 1.26 0.09 -0.18 0.00 0.63 0.00 0.00 28.75 30.56 2cqv h GLU 60 CO 0.40 -0.26 0.45 -0.91 -0.73 0.00 0.00 179.01 177.96 2cqv h ASN 61 N -0.41 0.20 0.00 1.04 4.21 -1.98 -3.44 115.58 115.21 2cqv h ASN 61 Ca 0.07 0.25 0.00 0.00 1.21 0.00 0.00 56.30 57.83 2cqv h ASN 61 Cb 0.60 0.29 0.00 0.00 -1.12 0.00 0.00 38.32 38.09 2cqv h ASN 61 CO -0.59 -0.38 0.00 0.61 -1.29 0.00 0.00 177.43 175.78 2cqv n GLY 62 N -1.31 -0.60 2.94 2.83 0.00 0.39 -0.39 105.19 109.05 2cqv n GLY 62 Ca 0.34 -0.38 -0.15 0.00 0.00 0.00 0.00 46.02 45.84 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 0.48 0.15 1.61 0.15 -1.24 -0.92 113.70 109.94 2cqv s SER 63 Ca 0.00 -0.08 0.11 0.00 0.70 0.00 0.00 55.95 56.68 2cqv s SER 63 Cb 0.00 -0.05 -0.04 0.00 -1.71 0.00 0.00 66.02 64.22 2cqv s SER 63 CO 0.00 0.04 -0.25 -0.75 1.20 0.00 0.00 173.24 173.48 2cqv s LYS 64 N -0.12 1.42 -0.33 5.44 2.20 -1.21 -1.59 119.74 125.55 2cqv s LYS 64 Ca 0.01 -1.41 0.01 0.00 -0.36 0.00 0.00 55.97 54.22 2cqv s LYS 64 Cb -0.02 -1.82 0.10 0.00 -1.51 0.00 0.00 37.83 34.59 2cqv s LYS 64 CO -0.00 0.41 0.10 -1.17 -0.36 0.00 0.00 175.35 174.34 2cqv s LEU 65 N -2.32 2.94 -0.31 5.43 2.96 0.11 -2.08 118.68 125.43 2cqv s LEU 65 Ca 0.16 -1.89 -0.21 0.00 -0.22 0.00 0.00 54.13 51.98 2cqv s LEU 65 Cb -0.09 -1.08 -0.01 0.00 0.50 0.00 0.00 46.19 45.51 2cqv s LEU 65 CO 0.07 -0.39 0.65 -0.89 -1.32 0.00 0.00 176.35 174.48 2cqv s THR 66 N 1.28 4.91 -0.26 3.68 2.01 -0.93 -2.29 115.64 124.05 2cqv s THR 66 Ca 0.11 0.86 -0.10 0.00 0.31 0.00 0.00 61.69 62.87 2cqv s THR 66 Cb -0.19 -4.03 -0.04 0.00 0.01 0.00 0.00 72.50 68.25 2cqv s THR 66 CO -0.18 -0.18 0.15 -0.63 -0.69 0.00 0.00 174.62 173.09 2cqv s ILE 67 N 2.67 5.05 0.24 1.82 1.01 -0.52 -0.71 121.20 130.77 2cqv s ILE 67 Ca 0.26 0.08 -0.03 0.00 0.00 0.00 0.00 60.65 60.96 2cqv s ILE 67 Cb -0.15 -3.38 -0.05 0.00 0.01 0.00 0.00 42.46 38.90 2cqv s ILE 67 CO 0.12 0.31 0.46 -0.76 0.00 0.00 0.00 174.94 175.07 2cqv s LEU 68 N 1.47 4.15 -1.37 2.97 2.01 0.11 -2.47 118.68 125.56 2cqv s LEU 68 Ca 0.07 0.55 -0.13 0.00 0.01 0.00 0.00 54.13 54.63 2cqv s LEU 68 Cb -0.15 -3.34 0.02 0.00 0.01 0.00 0.00 46.19 42.73 2cqv s LEU 68 CO 0.07 -0.11 0.25 0.00 1.01 0.00 0.00 176.35 177.57 2cqv n ALA 69 N -0.74 -2.19 -1.07 4.21 0.00 -1.19 -4.48 120.51 115.05 2cqv n ALA 69 Ca -0.03 -0.47 -0.33 0.00 0.00 0.00 0.00 53.44 52.61 2cqv n ALA 69 Cb 0.54 -1.40 -0.11 0.00 0.00 0.00 0.00 19.45 18.48 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 0.20 -2.08 0.00 0.00 -0.27 -4.22 120.51 109.51 2cqv n ALA 70 Ca -0.24 -0.14 -0.26 0.00 0.00 0.00 0.00 53.44 52.80 2cqv n ALA 70 Cb 0.62 -1.64 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 6.22 2.85 0.55 0.00 0.52 -1.26 0.10 118.95 127.94 2cqv s ARG 71 Ca 0.98 -0.07 0.36 0.00 -0.52 0.00 0.00 55.73 56.48 2cqv s ARG 71 Cb -0.96 -2.28 1.71 0.00 0.52 0.00 0.00 34.95 33.94 2cqv s ARG 71 CO 0.38 -0.73 2.08 0.37 0.02 0.00 0.00 175.30 177.42 2cqv h GLN 72 N -0.18 0.00 0.00 3.54 5.75 -1.93 -2.05 115.11 120.24 2cqv h GLN 72 Ca -0.45 0.00 -0.21 0.00 -0.15 0.00 0.00 58.65 57.84 2cqv h GLN 72 Cb 1.26 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 29.78 2cqv h GLN 72 CO 0.60 0.00 -1.07 1.05 -2.65 0.00 0.00 178.83 176.76 2cqv h GLU 73 N 0.00 0.00 -0.49 1.69 4.11 -1.98 -3.25 114.58 114.66 2cqv h GLU 73 Ca 0.00 0.00 0.09 0.00 0.07 0.00 0.00 59.36 59.52 2cqv h GLU 73 Cb 0.28 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.50 2cqv h GLU 73 CO 0.00 0.79 0.33 0.45 0.07 0.00 0.00 179.01 180.65 2cqv h HIS 74 N 0.00 0.29 -1.87 2.06 3.86 -1.74 -3.43 115.15 114.32 2cqv h HIS 74 Ca -0.07 0.01 -0.65 0.00 -1.16 0.00 0.00 60.37 58.50 2cqv h HIS 74 Cb 1.74 -0.09 0.09 0.00 1.06 0.00 0.00 27.41 30.21 2cqv h HIS 74 CO 0.00 0.14 0.08 0.00 0.86 0.00 0.00 177.93 179.01 2cqv n GLY 76 N 1.76 0.22 3.88 0.00 0.00 -0.14 -4.99 105.19 105.91 2cqv n GLY 76 Ca 0.14 -1.80 -0.36 0.00 0.00 0.00 0.00 46.02 44.01 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 -1.19 1.75 -0.26 0.00 1.51 -0.71 -3.31 117.35 115.14 2cqv s TYR 78 Ca 0.24 -0.82 -0.02 0.00 -1.01 0.00 0.00 57.07 55.45 2cqv s TYR 78 Cb -0.13 -1.90 0.14 0.00 -0.11 0.00 0.00 41.96 39.96 2cqv s TYR 78 CO 0.12 -0.36 0.41 0.99 -1.11 0.00 0.00 175.55 175.61 2cqv s THR 79 N -2.76 -0.65 -0.38 -0.71 2.01 0.25 -3.10 115.64 110.30 2cqv s THR 79 Ca 0.32 -0.09 -0.21 0.00 0.31 0.00 0.00 61.69 62.03 2cqv s THR 79 Cb -0.02 -0.86 0.01 0.00 0.01 0.00 0.00 72.50 71.65 2cqv s THR 79 CO 0.20 -0.13 0.64 -0.22 -0.69 0.00 0.00 174.62 174.42 2cqv s LEU 80 N 2.58 4.31 -0.11 4.42 2.96 -1.01 -0.96 118.68 130.86 2cqv s LEU 80 Ca 0.13 0.03 -0.09 0.00 -0.22 0.00 0.00 54.13 53.99 2cqv s LEU 80 Cb -0.15 -2.78 -0.04 0.00 0.50 0.00 0.00 46.19 43.72 2cqv s LEU 80 CO -0.18 -0.65 0.18 -0.22 -1.32 0.00 0.00 176.35 174.16 2cqv s LEU 81 N 2.76 4.38 -0.24 -0.68 2.96 0.76 -1.04 118.68 127.58 2cqv s LEU 81 Ca 0.24 0.52 -0.04 0.00 -0.22 0.00 0.00 54.13 54.64 2cqv s LEU 81 Cb -0.14 -2.16 0.08 0.00 0.50 0.00 0.00 46.19 44.47 2cqv s LEU 81 CO 0.16 0.37 0.09 0.68 -1.32 0.00 0.00 176.35 176.33 2cqv s VAL 82 N -0.87 0.18 0.09 1.68 -7.23 0.60 -0.08 120.40 114.78 2cqv s VAL 82 Ca 0.16 -0.63 0.06 0.00 -1.81 0.00 0.00 61.98 59.75 2cqv s VAL 82 Cb -0.13 -0.97 -0.04 0.00 0.56 0.00 0.00 36.38 35.80 2cqv s VAL 82 CO 0.05 -0.48 -0.05 -1.61 -0.31 0.00 0.00 175.10 172.70 2cqv s GLU 83 N 1.99 2.36 0.37 4.82 2.02 -0.89 -0.32 118.70 129.06 2cqv s GLU 83 Ca 0.05 -0.92 -0.10 0.00 0.02 0.00 0.00 54.97 54.03 2cqv s GLU 83 Cb -0.16 -2.44 0.03 0.00 0.10 0.00 0.00 34.13 31.66 2cqv s GLU 83 CO -0.21 0.53 0.65 0.54 0.02 0.00 0.00 175.26 176.79 2cqv s ASN 84 N -2.24 0.45 0.36 -0.19 4.22 -0.20 0.90 114.94 118.23 2cqv s ASN 84 Ca 0.24 -1.32 0.09 0.00 -2.14 0.00 0.00 52.86 49.73 2cqv s ASN 84 Cb -0.11 0.77 0.82 0.00 1.28 0.00 0.00 41.25 44.01 2cqv s ASN 84 CO 0.16 -1.53 1.88 0.50 -2.04 0.00 0.00 177.10 176.07 2cqv h LYS 85 N 2.04 0.67 0.00 3.55 3.64 -1.84 -3.19 116.57 121.44 2cqv h LYS 85 Ca -0.31 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.03 2cqv h LYS 85 Cb 1.25 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.91 2cqv h LYS 85 CO 0.40 0.44 0.00 1.28 -2.27 0.00 0.00 179.45 179.30 2cqv n LEU 86 N -4.55 0.66 0.00 5.20 4.77 -1.26 -5.05 117.00 116.77 2cqv n LEU 86 Ca 0.17 0.53 0.00 0.00 -0.03 0.00 0.00 56.01 56.67 2cqv n LEU 86 Cb 0.45 -0.24 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 2cqv n LEU 86 CO 0.30 -0.24 0.00 0.61 -1.33 0.00 0.00 177.39 176.73 2cqv n GLY 87 N 0.54 4.62 3.48 -0.72 0.00 -1.21 -4.96 105.19 106.93 2cqv n GLY 87 Ca 0.00 -0.54 -0.11 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 1.28 -0.48 0.15 1.61 1.04 -1.26 -1.04 113.70 115.01 2cqv s SER 88 Ca 0.00 0.09 -0.10 0.00 0.48 0.00 0.00 55.95 56.42 2cqv s SER 88 Cb 0.00 0.48 -0.00 0.00 0.10 0.00 0.00 66.02 66.60 2cqv s SER 88 CO 0.00 -0.74 0.29 -0.60 0.98 0.00 0.00 173.24 173.16 2cqv s ARG 89 N -3.06 1.09 -0.22 4.02 6.06 0.56 -4.84 118.95 122.57 2cqv s ARG 89 Ca 0.01 -1.06 -0.10 0.00 -2.50 0.00 0.00 55.73 52.08 2cqv s ARG 89 Cb -0.01 0.39 0.08 0.00 0.06 0.00 0.00 34.95 35.47 2cqv s ARG 89 CO -0.08 -0.40 0.50 1.14 -2.50 0.00 0.00 175.30 173.96 2cqv s GLN 90 N -3.92 0.46 0.56 5.12 -2.07 -1.26 -0.29 119.66 118.26 2cqv s GLN 90 Ca 0.13 1.03 0.05 0.00 -1.82 0.00 0.00 55.36 54.75 2cqv s GLN 90 Cb 0.03 0.22 0.05 0.00 -1.09 0.00 0.00 33.01 32.22 2cqv s GLN 90 CO -0.04 -0.19 0.41 0.00 -1.32 0.00 0.00 175.29 174.15 2cqv s ALA 91 N 1.98 4.50 -0.01 2.60 0.00 -0.21 -4.93 121.76 125.70 2cqv s ALA 91 Ca -0.07 -1.14 -0.16 0.00 0.00 0.00 0.00 51.96 50.59 2cqv s ALA 91 Cb -0.09 -0.71 0.03 0.00 0.00 0.00 0.00 23.12 22.34 2cqv s ALA 91 CO -0.15 -0.47 0.35 -0.65 0.00 0.00 0.00 175.76 174.84 2cqv s GLN 92 N -4.30 0.74 -0.24 0.00 1.11 -1.26 -2.40 119.66 113.30 2cqv s GLN 92 Ca 0.32 -0.21 -0.10 0.00 0.01 0.00 0.00 55.36 55.38 2cqv s GLN 92 Cb -0.02 0.33 0.10 0.00 -1.01 0.00 0.00 33.01 32.40 2cqv s GLN 92 CO 0.20 -0.21 0.54 0.54 0.01 0.00 0.00 175.29 176.37 2cqv s VAL 93 N -1.56 -0.55 0.29 1.09 0.11 -1.18 -4.94 120.40 113.67 2cqv s VAL 93 Ca -0.12 0.07 -0.28 0.00 -2.93 0.00 0.00 61.98 58.72 2cqv s VAL 93 Cb -0.04 -0.83 -0.09 0.00 -1.53 0.00 0.00 36.38 33.89 2cqv s VAL 93 CO 0.03 0.03 0.99 0.20 -3.33 0.00 0.00 175.10 173.03 2cqv s ASN 94 N 2.33 7.35 0.03 3.54 0.01 -1.26 -1.74 114.94 125.20 2cqv s ASN 94 Ca -0.06 2.01 0.02 0.00 -0.71 0.00 0.00 52.86 54.12 2cqv s ASN 94 Cb -0.10 -2.60 -0.02 0.00 0.41 0.00 0.00 41.25 38.94 2cqv s ASN 94 CO -0.16 -0.07 -0.06 -0.22 -1.51 0.00 0.00 177.10 175.08 2cqv s LEU 95 N -1.68 2.21 0.03 0.60 2.96 0.03 -2.23 118.68 120.59 2cqv s LEU 95 Ca 0.47 -0.45 0.02 0.00 -0.22 0.00 0.00 54.13 53.94 2cqv s LEU 95 Cb -0.25 -0.13 -0.02 0.00 0.50 0.00 0.00 46.19 46.29 2cqv s LEU 95 CO 0.31 -0.17 -0.07 -0.89 -1.32 0.00 0.00 176.35 174.22 2cqv s THR 96 N -1.15 0.46 -0.12 3.68 2.01 -1.08 -0.97 115.64 118.47 2cqv s THR 96 Ca -0.09 -0.84 0.01 0.00 0.31 0.00 0.00 61.69 61.08 2cqv s THR 96 Cb -0.08 -0.50 -0.01 0.00 0.01 0.00 0.00 72.50 71.91 2cqv s THR 96 CO 0.00 -0.27 -0.15 -0.69 -0.69 0.00 0.00 174.62 172.83 2cqv s VAL 97 N -1.06 2.92 -0.16 3.82 1.01 -1.26 -1.13 120.40 124.54 2cqv s VAL 97 Ca -0.07 -0.72 0.00 0.00 0.00 0.00 0.00 61.98 61.19 2cqv s VAL 97 Cb -0.08 -2.20 0.03 0.00 0.00 0.00 0.00 36.38 34.13 2cqv s VAL 97 CO 0.00 0.54 -0.12 0.68 0.00 0.00 0.00 175.10 176.20 2cqv s VAL 98 N 0.23 1.54 -1.08 2.92 -7.23 -0.18 -4.85 120.40 111.76 2cqv s VAL 98 Ca -0.10 -0.73 0.12 0.00 -1.81 0.00 0.00 61.98 59.46 2cqv s VAL 98 Cb -0.16 -1.52 0.52 0.00 0.56 0.00 0.00 36.38 35.78 2cqv s VAL 98 CO 0.06 0.35 1.36 -0.67 -0.31 0.00 0.00 175.10 175.89 2cqv n ASP 99 N 4.76 3.66 -4.55 4.85 2.03 -1.26 -0.08 116.55 125.95 2cqv n ASP 99 Ca -0.16 -2.39 -0.42 0.00 0.52 0.00 0.00 54.79 52.34 2cqv n ASP 99 Cb 0.49 -0.52 0.00 0.00 -0.72 0.00 0.00 41.12 40.37 2cqv n ASP 99 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2cqv n LYS 100 N 0.65 1.05 -1.19 -0.67 5.02 -1.26 -4.92 118.16 116.85 2cqv n LYS 100 Ca 0.18 0.38 -0.29 0.00 -2.02 0.00 0.00 58.31 56.56 2cqv n LYS 100 Cb 0.72 -1.79 0.15 0.00 -0.02 0.00 0.00 35.03 34.09 2cqv n LYS 100 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2cqv s PRO 101 N -1.74 0.91 0.59 1.97 0.04 -1.26 -4.98 135.00 130.54 2cqv s PRO 101 Ca 0.62 0.70 -0.15 0.00 0.04 0.00 0.00 61.00 62.21 2cqv s PRO 101 Cb -0.62 -1.78 -0.04 0.00 0.04 0.00 0.00 34.50 32.10 2cqv s PRO 101 CO 0.58 -2.44 1.04 0.16 0.04 0.00 0.00 177.00 176.37 2cqv s ASP 102 N -3.44 5.94 -0.08 6.66 1.47 -1.26 -4.98 116.67 120.98 2cqv s ASP 102 Ca 0.64 1.70 -0.30 0.00 1.18 0.00 0.00 52.55 55.78 2cqv s ASP 102 Cb -0.18 -2.52 -0.04 0.00 -0.34 0.00 0.00 42.92 39.84 2cqv s ASP 102 CO 0.57 -1.06 1.51 -2.16 0.68 0.00 0.00 175.17 174.71 2cqv s PRO 103 N -4.31 4.21 -0.19 2.11 0.04 -1.26 -4.96 135.00 130.64 2cqv s PRO 103 Ca 0.61 2.01 -0.29 0.00 0.04 0.00 0.00 61.00 63.37 2cqv s PRO 103 Cb -0.14 -3.87 -0.03 0.00 0.04 0.00 0.00 34.50 30.50 2cqv s PRO 103 CO 0.40 -0.77 1.59 -1.25 0.04 0.00 0.00 177.00 177.00 2cqv s PRO 104 N 3.68 3.91 0.26 0.56 0.04 -1.26 -5.00 135.00 137.19 2cqv s PRO 104 Ca 0.67 1.76 -0.26 0.00 0.04 0.00 0.00 61.00 63.21 2cqv s PRO 104 Cb -0.30 -4.00 -0.09 0.00 0.04 0.00 0.00 34.50 30.15 2cqv s PRO 104 CO 0.25 -1.16 0.87 0.00 0.04 0.00 0.00 177.00 177.00 2cqv s ALA 105 N 4.83 3.32 0.00 8.56 0.00 -1.26 -4.96 121.76 132.25 2cqv s ALA 105 Ca 0.70 0.45 0.00 0.00 0.00 0.00 0.00 51.96 53.11 2cqv s ALA 105 Cb -0.26 -3.08 0.00 0.00 0.00 0.00 0.00 23.12 19.78 2cqv s ALA 105 CO 0.28 0.23 0.00 0.41 0.00 0.00 0.00 175.76 176.68 2cqv n GLY 106 N 0.98 -0.16 3.48 0.00 0.00 -1.26 -5.10 105.19 103.12 2cqv n GLY 106 Ca -0.01 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.57 2cqv n GLY 106 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2cqv n THR 107 N -1.80 1.85 -1.79 2.61 5.66 -1.26 -4.91 114.28 114.63 2cqv n THR 107 Ca 0.00 -0.50 -0.33 0.00 -3.05 0.00 0.00 64.05 60.17 2cqv n THR 107 Cb 0.00 -0.52 0.04 0.00 -1.55 0.00 0.00 70.33 68.31 2cqv n THR 107 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 2cqv s PRO 108 N -1.39 2.84 0.29 1.09 0.04 -1.26 -4.95 135.00 131.66 2cqv s PRO 108 Ca 0.62 1.41 -0.02 0.00 0.04 0.00 0.00 61.00 63.05 2cqv s PRO 108 Cb -0.72 -1.95 0.43 0.00 0.04 0.00 0.00 34.50 32.29 2cqv s PRO 108 CO 0.58 -1.22 1.90 1.03 0.04 0.00 0.00 177.00 179.33 2cqv h SER 109 N 0.12 0.85 -1.88 6.66 0.87 -2.06 -3.38 113.55 114.74 2cqv h SER 109 Ca -0.47 -0.09 -0.38 0.00 -1.23 0.00 0.00 61.79 59.62 2cqv h SER 109 Cb 1.25 -0.22 -0.30 0.00 -0.44 0.00 0.00 62.40 62.69 2cqv h SER 109 CO 0.54 0.72 -0.72 -0.83 -0.53 0.00 0.00 176.83 176.01 2cqv s GLY 110 N -3.47 0.06 0.74 5.77 0.00 -1.26 -5.15 107.32 104.01 2cqv s GLY 110 Ca -0.11 -1.25 -0.12 0.00 0.00 0.00 0.00 44.72 43.25 2cqv s GLY 110 CO 0.80 2.75 1.10 2.56 0.00 0.00 0.00 173.10 180.30 2cqv s PRO 111 N 1.00 2.41 -0.06 2.90 0.04 -1.26 -5.07 135.00 134.96 2cqv s PRO 111 Ca 0.23 1.23 0.00 0.00 0.04 0.00 0.00 61.00 62.50 2cqv s PRO 111 Cb -0.08 -1.91 0.02 0.00 0.04 0.00 0.00 34.50 32.57 2cqv s PRO 111 CO -0.07 -1.54 -0.04 -1.12 0.04 0.00 0.00 177.00 174.27 2cqv s SER 112 N -3.17 1.30 -0.11 6.66 0.01 -1.26 -5.13 113.70 112.00 2cqv s SER 112 Ca 0.63 -0.15 -0.17 0.00 1.31 0.00 0.00 55.95 57.56 2cqv s SER 112 Cb -0.18 -0.52 -0.04 0.00 0.21 0.00 0.00 66.02 65.48 2cqv s SER 112 CO 0.52 -0.09 0.45 -0.94 0.41 0.00 0.00 173.24 173.59 2cqv s SER 113 N 1.22 6.67 0.00 2.44 1.04 -1.26 -5.28 113.70 118.53 2cqv s SER 113 Ca -0.06 0.79 0.00 0.00 0.48 0.00 0.00 55.95 57.16 2cqv s SER 113 Cb -0.14 -2.27 0.00 0.00 0.10 0.00 0.00 66.02 63.71 2cqv s SER 113 CO -0.02 0.05 0.00 0.61 0.98 0.00 0.00 173.24 174.86