#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cqo n SER -5 N 0.00 1.54 -4.92 1.61 2.88 -1.26 -4.91 113.62 108.57 2cqo n SER -5 Ca 0.00 -1.16 -0.26 0.00 -1.33 0.00 0.00 58.87 56.13 2cqo n SER -5 Cb 0.00 -1.52 -0.03 0.00 -0.75 0.00 0.00 64.21 61.91 2cqo n SER -5 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2cqo s SER -4 N 10.03 6.16 -0.19 -3.46 0.01 -1.26 -4.99 113.70 120.00 2cqo s SER -4 Ca 0.99 0.09 -0.08 0.00 1.31 0.00 0.00 55.95 58.26 2cqo s SER -4 Cb -0.25 -1.80 0.07 0.00 0.21 0.00 0.00 66.02 64.26 2cqo s SER -4 CO 0.18 0.04 0.42 -0.83 0.41 0.00 0.00 173.24 173.46 2cqo s GLY -3 N -3.29 -0.35 -0.09 3.44 0.00 -1.26 -5.04 107.32 100.72 2cqo s GLY -3 Ca 0.34 1.55 -0.25 0.00 0.00 0.00 0.00 44.72 46.35 2cqo s GLY -3 CO 0.27 2.01 0.90 0.23 0.00 0.00 0.00 173.10 176.52 2cqo h SER -2 N 7.56 -0.03 0.03 1.64 0.87 -2.02 -3.39 113.55 118.22 2cqo h SER -2 Ca -0.28 -0.69 -0.26 0.00 -1.23 0.00 0.00 61.79 59.33 2cqo h SER -2 Cb 1.15 0.01 -0.03 0.00 -0.44 0.00 0.00 62.40 63.09 2cqo h SER -2 CO 0.22 0.72 -1.43 -1.28 -0.53 0.00 0.00 176.83 174.52 2cqo h SER -1 N -0.82 0.11 -2.41 6.23 0.87 -2.03 -3.42 113.55 112.08 2cqo h SER -1 Ca -0.00 -0.62 -0.70 0.00 -1.23 0.00 0.00 61.79 59.23 2cqo h SER -1 Cb 0.72 -0.04 -0.18 0.00 -0.44 0.00 0.00 62.40 62.46 2cqo h SER -1 CO 0.01 1.58 0.88 -0.83 -0.53 0.00 0.00 176.83 177.93 2cqo s GLY 0 N -5.02 2.01 -0.61 5.77 0.00 -1.26 -4.98 107.32 103.22 2cqo s GLY 0 Ca -0.27 -2.85 -0.22 0.00 0.00 0.00 0.00 44.72 41.38 2cqo s GLY 0 CO 0.64 2.00 0.88 -0.29 0.00 0.00 0.00 173.10 176.33 2cqo s MET 1 N 2.49 3.15 -1.31 2.90 -2.45 -1.26 -4.22 119.30 118.59 2cqo s MET 1 Ca 0.33 -0.79 -0.05 0.00 -1.25 0.00 0.00 55.69 53.94 2cqo s MET 1 Cb -0.05 -4.18 0.01 0.00 1.25 0.00 0.00 34.83 31.87 2cqo s MET 1 CO -0.08 -1.64 1.00 0.09 1.05 0.00 0.00 175.02 175.43 2cqo n ASN 2 N 7.29 -3.54 -3.64 1.11 3.02 -1.26 -5.00 115.26 113.24 2cqo n ASN 2 Ca -0.04 -0.66 -0.21 0.00 -0.03 0.00 0.00 54.58 53.65 2cqo n ASN 2 Cb 0.45 -4.73 -0.17 0.00 -0.61 0.00 0.00 39.78 34.72 2cqo n ASN 2 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2cqo s SER 3 N -3.91 1.45 0.00 6.41 1.04 -1.26 -5.05 113.70 112.38 2cqo s SER 3 Ca 0.27 -0.10 0.00 0.00 0.48 0.00 0.00 55.95 56.59 2cqo s SER 3 Cb -0.12 -0.04 0.00 0.00 0.10 0.00 0.00 66.02 65.95 2cqo s SER 3 CO 0.76 -0.29 0.00 0.61 0.98 0.00 0.00 173.24 175.30 2cqo n GLY 4 N 5.30 2.28 2.93 7.32 0.00 -1.26 -4.90 105.19 116.86 2cqo n GLY 4 Ca -0.05 -0.53 -0.14 0.00 0.00 0.00 0.00 46.02 45.30 2cqo n GLY 4 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2cqo s ARG 5 N -0.60 0.25 0.46 1.61 3.52 -1.26 -5.15 118.95 117.78 2cqo s ARG 5 Ca 0.00 -0.15 -0.23 0.00 -0.13 0.00 0.00 55.73 55.23 2cqo s ARG 5 Cb 0.00 -0.22 -0.07 0.00 -1.56 0.00 0.00 34.95 33.10 2cqo s ARG 5 CO 0.00 0.06 1.16 -1.25 -0.81 0.00 0.00 175.30 174.46 2cqo s PRO 6 N -0.17 3.74 -0.89 5.12 0.04 -1.26 -5.00 135.00 136.58 2cqo s PRO 6 Ca 0.00 1.76 -0.01 0.00 0.04 0.00 0.00 61.00 62.80 2cqo s PRO 6 Cb -0.02 -2.39 0.24 0.00 0.04 0.00 0.00 34.50 32.38 2cqo s PRO 6 CO -0.00 -0.56 0.92 -0.85 0.04 0.00 0.00 177.00 176.54 2cqo n GLU 7 N -0.52 2.98 -3.38 4.56 0.00 -1.26 -5.02 120.64 118.00 2cqo n GLU 7 Ca 0.07 -4.53 -0.14 0.00 0.00 0.00 0.00 57.16 52.57 2cqo n GLU 7 Cb 0.48 -2.40 -0.04 0.00 0.00 0.00 0.00 31.44 29.47 2cqo n GLU 7 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 2cqo n THR 8 N 1.84 0.00 -1.37 3.84 -2.24 -1.26 -5.04 114.28 110.05 2cqo n THR 8 Ca 0.24 -1.42 -0.24 0.00 -2.27 0.00 0.00 64.05 60.36 2cqo n THR 8 Cb 0.37 0.60 -0.09 0.00 -2.10 0.00 0.00 70.33 69.11 2cqo n THR 8 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 2cqo n MET 9 N -0.47 2.46 -0.36 -0.78 2.81 -1.26 -4.68 117.12 114.84 2cqo n MET 9 Ca -0.00 -2.01 0.28 0.00 -1.81 0.00 0.00 57.70 54.16 2cqo n MET 9 Cb 0.36 -2.15 0.53 0.00 -0.71 0.00 0.00 33.22 31.25 2cqo n MET 9 CO 0.00 0.00 0.00 1.05 1.51 0.00 0.00 175.97 178.53 2cqo h GLU 10 N 3.16 0.23 -0.87 0.03 4.11 -1.96 0.13 114.58 119.41 2cqo h GLU 10 Ca 0.37 -0.01 0.20 0.00 0.07 0.00 0.00 59.36 59.98 2cqo h GLU 10 Cb 0.92 -0.05 -0.16 0.00 0.50 0.00 0.00 28.75 29.96 2cqo h GLU 10 CO 0.75 0.15 -0.12 0.09 0.07 0.00 0.00 179.01 179.94 2cqo n ASN 11 N -4.96 -0.23 -4.84 3.06 3.02 -1.26 -4.33 115.26 105.72 2cqo n ASN 11 Ca 0.33 1.49 -0.32 0.00 -0.03 0.00 0.00 54.58 56.05 2cqo n ASN 11 Cb 1.12 -0.49 -0.04 0.00 -0.61 0.00 0.00 39.78 39.76 2cqo n ASN 11 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2cqo s LEU 12 N -10.70 3.74 0.96 3.41 1.43 0.03 -4.65 118.68 112.91 2cqo s LEU 12 Ca -0.12 1.52 -0.12 0.00 -1.03 0.00 0.00 54.13 54.38 2cqo s LEU 12 Cb 0.24 -4.42 0.17 0.00 0.03 0.00 0.00 46.19 42.20 2cqo s LEU 12 CO 0.68 -0.49 1.09 -2.16 0.23 0.00 0.00 176.35 175.70 2cqo s PRO 13 N -3.79 0.74 0.92 1.29 0.04 -1.26 -5.00 135.00 127.94 2cqo s PRO 13 Ca 0.58 0.63 -0.14 0.00 0.04 0.00 0.00 61.00 62.11 2cqo s PRO 13 Cb -0.10 -1.76 0.18 0.00 0.04 0.00 0.00 34.50 32.86 2cqo s PRO 13 CO 0.27 -2.55 1.27 0.00 0.04 0.00 0.00 177.00 176.03 2cqo s ALA 14 N -2.95 2.43 0.42 8.56 0.00 -1.26 -4.98 121.76 123.98 2cqo s ALA 14 Ca 0.65 -1.18 -0.25 0.00 0.00 0.00 0.00 51.96 51.17 2cqo s ALA 14 Cb -0.18 -2.72 -0.08 0.00 0.00 0.00 0.00 23.12 20.13 2cqo s ALA 14 CO 0.57 -2.24 1.26 -1.17 0.00 0.00 0.00 175.76 174.18 2cqo s LEU 15 N -5.78 4.16 -1.76 0.00 2.96 -1.26 -2.58 118.68 114.42 2cqo s LEU 15 Ca 0.72 2.55 0.00 0.00 -0.22 0.00 0.00 54.13 57.17 2cqo s LEU 15 Cb -0.05 -4.00 0.00 0.00 0.50 0.00 0.00 46.19 42.64 2cqo s LEU 15 CO 0.52 -0.88 0.00 -1.22 -1.32 0.00 0.00 176.35 173.45 2cqo n TYR 16 N -0.05 -0.87 -3.25 5.38 4.01 -0.63 -4.95 117.16 116.79 2cqo n TYR 16 Ca 0.05 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.40 2cqo n TYR 16 Cb 0.45 -3.70 -0.06 0.00 -0.31 0.00 0.00 39.34 35.72 2cqo n TYR 16 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 2cqo s THR 17 N -2.91 4.83 -0.20 -0.72 2.01 -1.07 -4.77 115.64 112.81 2cqo s THR 17 Ca 0.00 1.22 -0.09 0.00 0.31 0.00 0.00 61.69 63.14 2cqo s THR 17 Cb 0.00 -3.91 -0.04 0.00 0.01 0.00 0.00 72.50 68.55 2cqo s THR 17 CO 0.00 0.49 0.10 -0.63 -0.69 0.00 0.00 174.62 173.89 2cqo s ILE 18 N -0.66 5.06 0.11 1.82 1.01 -1.26 -1.89 121.20 125.38 2cqo s ILE 18 Ca 0.30 0.06 -0.14 0.00 0.00 0.00 0.00 60.65 60.87 2cqo s ILE 18 Cb -0.19 -3.30 0.02 0.00 0.01 0.00 0.00 42.46 39.00 2cqo s ILE 18 CO 0.18 0.43 0.33 0.72 0.00 0.00 0.00 174.94 176.60 2cqo s PHE 19 N 0.51 -0.09 -0.19 3.97 -0.12 -0.85 -5.03 117.98 116.19 2cqo s PHE 19 Ca 0.05 -0.25 -0.12 0.00 -0.05 0.00 0.00 56.93 56.56 2cqo s PHE 19 Cb -0.12 0.16 -0.05 0.00 -0.63 0.00 0.00 43.02 42.38 2cqo s PHE 19 CO 0.00 -0.64 0.22 -1.14 -0.05 0.00 0.00 175.22 173.61 2cqo s GLN 20 N -3.77 4.20 0.15 1.99 0.74 -1.26 -2.05 119.66 119.66 2cqo s GLN 20 Ca 0.03 -0.07 0.01 0.00 0.05 0.00 0.00 55.36 55.38 2cqo s GLN 20 Cb 0.03 -3.45 -0.04 0.00 1.10 0.00 0.00 33.01 30.64 2cqo s GLN 20 CO -0.11 0.21 0.01 0.20 -0.55 0.00 0.00 175.29 175.04 2cqo s GLY 21 N 0.58 1.10 -0.08 2.59 0.00 -0.72 -4.17 107.32 106.61 2cqo s GLY 21 Ca 0.12 -1.53 0.00 0.00 0.00 0.00 0.00 44.72 43.31 2cqo s GLY 21 CO 0.02 -1.48 -0.07 1.85 0.00 0.00 0.00 173.10 173.42 2cqo s GLU 22 N -3.94 2.90 0.14 2.90 2.12 -1.15 -1.45 118.70 120.23 2cqo s GLU 22 Ca 0.22 -0.56 -0.31 0.00 0.36 0.00 0.00 54.97 54.68 2cqo s GLU 22 Cb 0.06 -2.63 -0.09 0.00 0.26 0.00 0.00 34.13 31.73 2cqo s GLU 22 CO 0.02 0.58 1.55 0.08 -0.54 0.00 0.00 175.26 176.95 2cqo s VAL 23 N -0.58 2.79 -0.02 3.70 1.01 -0.67 -1.49 120.40 125.14 2cqo s VAL 23 Ca 0.09 0.53 0.06 0.00 0.00 0.00 0.00 61.98 62.66 2cqo s VAL 23 Cb -0.12 -3.34 -0.09 0.00 0.00 0.00 0.00 36.38 32.83 2cqo s VAL 23 CO 0.02 0.04 0.11 0.00 0.00 0.00 0.00 175.10 175.26 2cqo n ALA 24 N 4.18 2.15 -3.24 5.51 0.00 -0.33 -1.64 120.51 127.14 2cqo n ALA 24 Ca 0.14 -0.19 -0.13 0.00 0.00 0.00 0.00 53.44 53.26 2cqo n ALA 24 Cb 0.39 -0.14 -0.12 0.00 0.00 0.00 0.00 19.45 19.59 2cqo n ALA 24 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 2cqo s MET 25 N -2.36 0.31 -0.14 0.00 1.75 -1.24 -4.88 119.30 112.74 2cqo s MET 25 Ca -0.02 0.41 0.02 0.00 -1.25 0.00 0.00 55.69 54.85 2cqo s MET 25 Cb 0.03 0.12 0.01 0.00 2.84 0.00 0.00 34.83 37.83 2cqo s MET 25 CO 0.25 -0.06 -0.20 0.08 -0.65 0.00 0.00 175.02 174.44 2cqo s VAL 26 N 0.31 1.95 0.22 10.11 1.01 -1.26 -0.41 120.40 132.33 2cqo s VAL 26 Ca -0.01 -0.90 0.08 0.00 0.00 0.00 0.00 61.98 61.14 2cqo s VAL 26 Cb -0.03 -1.74 -0.05 0.00 0.00 0.00 0.00 36.38 34.56 2cqo s VAL 26 CO -0.01 0.53 -0.13 0.42 0.00 0.00 0.00 175.10 175.90 2cqo s THR 27 N 0.96 1.74 -2.00 3.92 -4.23 0.10 -5.01 115.64 111.12 2cqo s THR 27 Ca -0.04 -2.21 0.16 0.00 -1.18 0.00 0.00 61.69 58.42 2cqo s THR 27 Cb -0.15 -2.12 0.46 0.00 1.34 0.00 0.00 72.50 72.04 2cqo s THR 27 CO -0.04 -0.54 1.41 0.47 -0.54 0.00 0.00 174.62 175.37 2cqo n ASP 28 N -0.42 0.00 -0.00 3.99 9.92 -1.26 -2.09 116.55 126.69 2cqo n ASP 28 Ca -0.07 -0.78 0.00 0.00 -0.53 0.00 0.00 54.79 53.40 2cqo n ASP 28 Cb 0.61 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.09 2cqo n ASP 28 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2cqo n TYR 29 N -0.89 0.00 -1.48 1.24 0.18 -1.26 -4.79 117.16 110.16 2cqo n TYR 29 Ca 0.12 -0.36 0.00 0.00 1.88 0.00 0.00 57.90 59.54 2cqo n TYR 29 Cb 0.06 -0.04 0.00 0.00 -0.38 0.00 0.00 39.34 38.98 2cqo n TYR 29 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2cqo n GLY 30 N -0.37 0.18 3.12 -7.48 0.00 -0.89 -2.50 105.19 97.26 2cqo n GLY 30 Ca 0.00 -1.65 -0.11 0.00 0.00 0.00 0.00 46.02 44.27 2cqo n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cqo s ALA 31 N -1.00 -0.31 -0.20 4.61 0.00 -0.73 0.00 121.76 124.13 2cqo s ALA 31 Ca 0.00 -0.19 -0.15 0.00 0.00 0.00 0.00 51.96 51.62 2cqo s ALA 31 Cb 0.00 0.15 -0.04 0.00 0.00 0.00 0.00 23.12 23.23 2cqo s ALA 31 CO 0.00 -0.24 0.35 -0.06 0.00 0.00 0.00 175.76 175.81 2cqo s PHE 32 N -1.70 3.38 -0.23 0.00 0.40 0.45 -0.45 117.98 119.84 2cqo s PHE 32 Ca -0.12 0.57 -0.04 0.00 -0.60 0.00 0.00 56.93 56.74 2cqo s PHE 32 Cb -0.06 -2.46 0.00 0.00 0.51 0.00 0.00 43.02 41.01 2cqo s PHE 32 CO 0.00 0.05 -0.04 0.42 0.70 0.00 0.00 175.22 176.35 2cqo s ILE 33 N 1.12 3.32 0.04 0.64 -1.09 -0.38 -1.19 121.20 123.65 2cqo s ILE 33 Ca 0.17 -0.61 -0.30 0.00 -2.23 0.00 0.00 60.65 57.68 2cqo s ILE 33 Cb -0.14 -2.56 -0.05 0.00 -1.58 0.00 0.00 42.46 38.13 2cqo s ILE 33 CO 0.07 0.35 1.07 -0.54 -1.23 0.00 0.00 174.94 174.66 2cqo s LYS 34 N 1.45 4.52 0.05 2.79 1.02 -0.55 -2.76 119.74 126.26 2cqo s LYS 34 Ca 0.05 1.58 -0.21 0.00 0.02 0.00 0.00 55.97 57.40 2cqo s LYS 34 Cb -0.15 -3.40 -0.06 0.00 -0.52 0.00 0.00 37.83 33.70 2cqo s LYS 34 CO -0.03 -0.10 0.62 0.42 -0.92 0.00 0.00 175.35 175.33 2cqo s ILE 35 N 0.88 4.76 0.07 2.17 1.01 -1.26 -2.92 121.20 125.91 2cqo s ILE 35 Ca 0.54 1.32 -0.31 0.00 0.00 0.00 0.00 60.65 62.20 2cqo s ILE 35 Cb -0.25 -3.96 -0.07 0.00 0.01 0.00 0.00 42.46 38.20 2cqo s ILE 35 CO 0.29 0.48 1.39 -2.16 0.00 0.00 0.00 174.94 174.95 2cqo s PRO 36 N -0.68 4.31 -0.64 2.79 0.04 -1.26 -3.05 135.00 136.51 2cqo s PRO 36 Ca 0.31 2.03 -0.02 0.00 0.04 0.00 0.00 61.00 63.36 2cqo s PRO 36 Cb -0.19 -3.38 0.00 0.00 0.04 0.00 0.00 34.50 30.97 2cqo s PRO 36 CO 0.19 -0.48 0.25 0.41 0.04 0.00 0.00 177.00 177.41 2cqo n GLY 37 N 3.55 0.18 3.28 0.56 0.00 -1.26 -5.03 105.19 106.47 2cqo n GLY 37 Ca 0.12 -0.41 -0.18 0.00 0.00 0.00 0.00 46.02 45.55 2cqo n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cqo n ARG 39 N -0.56 3.30 -3.68 0.00 0.63 -1.26 -4.94 116.66 110.14 2cqo n ARG 39 Ca 0.05 -0.00 -0.28 0.00 -0.92 0.00 0.00 57.85 56.70 2cqo n ARG 39 Cb 0.63 -1.09 -0.03 0.00 0.45 0.00 0.00 32.46 32.42 2cqo n ARG 39 CO 0.00 0.00 0.00 0.21 -2.51 0.00 0.00 177.63 175.33 2cqo s LYS 40 N -2.08 3.53 0.22 -0.14 2.47 -1.26 -5.06 119.74 117.42 2cqo s LYS 40 Ca -0.02 -0.31 0.11 0.00 -1.56 0.00 0.00 55.97 54.20 2cqo s LYS 40 Cb 0.01 -2.83 -0.05 0.00 -1.46 0.00 0.00 37.83 33.50 2cqo s LYS 40 CO 0.14 0.40 -0.22 -0.65 0.16 0.00 0.00 175.35 175.17 2cqo s GLN 41 N -3.27 1.56 0.27 4.03 -0.21 -1.26 -4.30 119.66 116.48 2cqo s GLN 41 Ca 0.39 -1.61 0.09 0.00 0.02 0.00 0.00 55.36 54.25 2cqo s GLN 41 Cb -0.11 -1.79 -0.04 0.00 1.00 0.00 0.00 33.01 32.07 2cqo s GLN 41 CO 0.29 0.37 0.06 0.20 -2.12 0.00 0.00 175.29 174.08 2cqo s GLY 42 N -2.97 1.60 -0.07 3.09 0.00 -1.11 -4.72 107.32 103.13 2cqo s GLY 42 Ca 0.24 -1.60 0.01 0.00 0.00 0.00 0.00 44.72 43.37 2cqo s GLY 42 CO 0.11 -1.65 -0.07 -2.27 0.00 0.00 0.00 173.10 169.22 2cqo s LEU 43 N -3.73 3.15 -0.32 0.66 2.96 -0.75 -1.25 118.68 119.40 2cqo s LEU 43 Ca 0.32 -0.04 -0.04 0.00 -0.22 0.00 0.00 54.13 54.15 2cqo s LEU 43 Cb -0.07 -1.69 0.04 0.00 0.50 0.00 0.00 46.19 44.98 2cqo s LEU 43 CO 0.21 0.35 0.05 -0.69 -1.32 0.00 0.00 176.35 174.95 2cqo s VAL 44 N -0.73 3.39 0.68 1.68 1.01 0.41 -1.13 120.40 125.70 2cqo s VAL 44 Ca 0.11 -1.23 -0.17 0.00 0.00 0.00 0.00 61.98 60.70 2cqo s VAL 44 Cb -0.11 -2.92 -0.03 0.00 0.00 0.00 0.00 36.38 33.33 2cqo s VAL 44 CO 0.02 -0.12 0.82 1.57 0.00 0.00 0.00 175.10 177.39 2cqo n HIS 45 N 4.72 0.23 -0.11 5.22 -0.00 -1.26 -1.77 115.22 122.25 2cqo n HIS 45 Ca -0.13 0.40 0.02 0.00 0.46 0.00 0.00 57.72 58.46 2cqo n HIS 45 Cb 0.44 -2.04 0.32 0.00 -0.12 0.00 0.00 29.99 28.58 2cqo n HIS 45 CO 0.00 0.00 0.00 0.07 0.46 0.00 0.00 176.34 176.87 2cqo h ARG 46 N -0.06 0.77 0.00 1.57 0.11 -1.84 0.92 114.38 115.84 2cqo h ARG 46 Ca -0.47 -0.06 -0.03 0.00 0.10 0.00 0.00 59.98 59.51 2cqo h ARG 46 Cb 1.35 -0.16 -0.00 0.00 1.11 0.00 0.00 29.97 32.26 2cqo h ARG 46 CO 0.47 0.54 -0.16 0.00 0.10 0.00 0.00 179.97 180.91 2cqo h THR 47 N 0.78 0.53 0.00 0.08 1.03 -1.89 -2.60 112.91 110.85 2cqo h THR 47 Ca 0.21 -0.79 0.00 0.00 -0.01 0.00 0.00 66.41 65.82 2cqo h THR 47 Cb -0.03 1.53 0.00 0.00 -1.07 0.00 0.00 68.15 68.58 2cqo h THR 47 CO -0.04 0.16 -1.48 1.41 -0.01 0.00 0.00 175.52 175.56 2cqo n HIS 48 N -3.50 0.46 0.29 0.00 8.25 -0.41 -4.11 115.22 116.21 2cqo n HIS 48 Ca -0.01 0.13 0.15 0.00 -0.26 0.00 0.00 57.72 57.73 2cqo n HIS 48 Cb 0.32 -0.70 0.90 0.00 1.12 0.00 0.00 29.99 31.63 2cqo n HIS 48 CO 0.00 0.00 0.00 0.52 0.64 0.00 0.00 176.34 177.50 2cqo h MET 49 N 0.00 0.00 -1.52 -0.41 2.07 -0.46 0.20 114.93 114.81 2cqo h MET 49 Ca 0.00 0.00 0.09 0.00 -2.07 0.00 0.00 59.70 57.72 2cqo h MET 49 Cb 0.98 0.00 -0.24 0.00 -1.87 0.00 0.00 31.60 30.46 2cqo h MET 49 CO 0.00 0.00 0.56 0.45 1.07 0.00 0.00 176.91 178.99 2cqo s SER 50 N -6.20 -0.36 -0.09 1.22 0.15 -1.24 -4.54 113.70 102.64 2cqo s SER 50 Ca -0.05 0.48 -0.25 0.00 0.70 0.00 0.00 55.95 56.83 2cqo s SER 50 Cb 0.15 0.42 -0.21 0.00 -1.71 0.00 0.00 66.02 64.67 2cqo s SER 50 CO 0.55 -0.27 0.88 -1.28 1.20 0.00 0.00 173.24 174.33 2cqo h SER 51 N 2.95 -0.03 -2.11 5.45 0.87 -1.85 -3.44 113.55 115.38 2cqo h SER 51 Ca -0.20 -0.68 -0.28 0.00 -1.23 0.00 0.00 61.79 59.40 2cqo h SER 51 Cb 1.17 0.01 0.15 0.00 -0.44 0.00 0.00 62.40 63.29 2cqo h SER 51 CO 0.25 0.71 -0.41 0.00 -0.53 0.00 0.00 176.83 176.85 2cqo s ARG 53 N -3.63 2.31 -0.75 0.00 3.52 -1.26 -4.88 118.95 114.26 2cqo s ARG 53 Ca 0.42 1.47 -0.26 0.00 -0.13 0.00 0.00 55.73 57.24 2cqo s ARG 53 Cb -0.08 -4.53 0.01 0.00 -1.56 0.00 0.00 34.95 28.79 2cqo s ARG 53 CO 0.41 -3.04 1.55 0.08 -0.81 0.00 0.00 175.30 173.49 2cqo s VAL 54 N 11.33 3.61 -0.08 7.11 1.01 -1.26 -4.83 120.40 137.29 2cqo s VAL 54 Ca 0.96 0.11 -0.25 0.00 0.00 0.00 0.00 61.98 62.81 2cqo s VAL 54 Cb -0.20 -4.55 -0.28 0.00 0.00 0.00 0.00 36.38 31.36 2cqo s VAL 54 CO 0.27 -1.49 0.88 -0.78 0.00 0.00 0.00 175.10 173.99 2cqo h ASP 55 N 11.65 0.27 -2.93 3.32 3.58 -1.97 -3.47 116.42 126.88 2cqo h ASP 55 Ca -0.17 -0.93 -0.10 0.00 0.42 0.00 0.00 57.03 56.25 2cqo h ASP 55 Cb 1.08 -0.09 -0.26 0.00 1.72 0.00 0.00 39.33 41.77 2cqo h ASP 55 CO 1.28 1.18 -0.30 -0.54 -2.88 0.00 0.00 179.24 177.97 2cqo s LYS 56 N -2.51 0.39 0.19 0.28 1.02 -1.26 -5.02 119.74 112.82 2cqo s LYS 56 Ca -0.16 0.92 0.21 0.00 0.02 0.00 0.00 55.97 56.96 2cqo s LYS 56 Cb -0.00 0.13 0.88 0.00 -0.52 0.00 0.00 37.83 38.32 2cqo s LYS 56 CO 0.77 -0.19 1.64 -0.35 -0.92 0.00 0.00 175.35 176.29 2cqo n PRO 57 N 4.71 0.14 0.18 -1.68 -0.04 -1.26 -2.43 135.00 134.62 2cqo n PRO 57 Ca -0.17 0.38 0.06 0.00 -0.04 0.00 0.00 63.50 63.72 2cqo n PRO 57 Cb 0.53 -1.77 0.27 0.00 -0.04 0.00 0.00 33.50 32.49 2cqo n PRO 57 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2cqo h SER 58 N 0.00 0.00 0.20 3.54 4.64 -1.83 -2.91 113.55 117.19 2cqo h SER 58 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2cqo h SER 58 Cb 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 2cqo h SER 58 CO 0.00 0.38 -0.51 -1.84 -0.87 0.00 0.00 176.83 173.99 2cqo n GLU 59 N -3.41 0.56 0.05 4.77 0.28 -1.02 -4.10 120.64 117.77 2cqo n GLU 59 Ca 0.00 -0.40 -0.16 0.00 -0.16 0.00 0.00 57.16 56.45 2cqo n GLU 59 Cb 0.56 -1.49 -0.14 0.00 1.43 0.00 0.00 31.44 31.79 2cqo n GLU 59 CO 0.00 0.00 0.00 0.82 -0.16 0.00 0.00 177.13 177.79 2cqo h ILE 60 N 0.97 1.11 -3.60 3.84 2.04 -1.54 -3.49 117.51 116.83 2cqo h ILE 60 Ca 0.00 -2.78 -0.16 0.00 1.00 0.00 0.00 64.86 62.91 2cqo h ILE 60 Cb 0.56 2.71 -0.04 0.00 -0.74 0.00 0.00 36.82 39.31 2cqo h ILE 60 CO 0.00 0.80 0.03 0.68 0.00 0.00 0.00 178.15 179.66 2cqo s VAL 61 N -2.62 0.00 -0.28 1.67 -7.23 -1.18 -5.13 120.40 105.63 2cqo s VAL 61 Ca -0.09 -1.32 -0.24 0.00 -1.81 0.00 0.00 61.98 58.53 2cqo s VAL 61 Cb 0.07 -2.78 0.10 0.00 0.56 0.00 0.00 36.38 34.33 2cqo s VAL 61 CO 0.84 0.00 0.85 1.51 -0.31 0.00 0.00 175.10 177.99 2cqo s ASP 62 N -3.17 -0.64 -0.49 4.85 -4.77 -1.26 -4.66 116.67 106.53 2cqo s ASP 62 Ca 0.24 1.20 -0.45 0.00 -3.30 0.00 0.00 52.55 50.24 2cqo s ASP 62 Cb -0.03 1.23 -0.19 0.00 -1.09 0.00 0.00 42.92 42.84 2cqo s ASP 62 CO 0.17 -0.20 1.92 0.52 0.70 0.00 0.00 175.17 178.27 2cqo n VAL 63 N 2.74 0.02 0.00 2.11 0.31 -1.26 -0.84 118.33 121.41 2cqo n VAL 63 Ca -0.14 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 2cqo n VAL 63 Cb 0.56 -0.57 0.00 0.00 -0.91 0.00 0.00 33.84 32.92 2cqo n VAL 63 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2cqo n GLY 64 N 5.99 1.51 3.75 2.92 0.00 -0.65 -4.99 105.19 113.73 2cqo n GLY 64 Ca 0.44 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 46.06 2cqo n GLY 64 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2cqo s ASP 65 N -1.41 7.36 -0.18 1.61 1.11 -0.02 -4.82 116.67 120.33 2cqo s ASP 65 Ca 0.00 1.62 -0.08 0.00 0.18 0.00 0.00 52.55 54.27 2cqo s ASP 65 Cb 0.00 -2.51 -0.04 0.00 1.07 0.00 0.00 42.92 41.43 2cqo s ASP 65 CO 0.00 0.09 0.10 -0.75 1.18 0.00 0.00 175.17 175.79 2cqo s LYS 66 N -0.55 3.94 0.20 8.23 2.20 -1.26 -1.68 119.74 130.83 2cqo s LYS 66 Ca 0.39 -0.26 -0.02 0.00 -0.36 0.00 0.00 55.97 55.72 2cqo s LYS 66 Cb -0.22 -3.28 -0.04 0.00 -1.51 0.00 0.00 37.83 32.78 2cqo s LYS 66 CO 0.26 0.38 0.16 0.14 -0.36 0.00 0.00 175.35 175.93 2cqo s VAL 67 N 0.10 0.00 -0.15 4.02 -7.23 -0.52 -4.99 120.40 111.62 2cqo s VAL 67 Ca 0.07 -1.95 -0.10 0.00 -1.81 0.00 0.00 61.98 58.19 2cqo s VAL 67 Cb -0.12 -2.47 -0.05 0.00 0.56 0.00 0.00 36.38 34.30 2cqo s VAL 67 CO -0.00 -0.00 0.19 0.26 -0.31 0.00 0.00 175.10 175.24 2cqo s TRP 68 N -4.15 3.50 0.08 2.82 0.52 -1.26 -1.76 118.94 118.69 2cqo s TRP 68 Ca 0.38 0.50 0.02 0.00 0.02 0.00 0.00 56.10 57.02 2cqo s TRP 68 Cb 0.06 -2.15 -0.04 0.00 -1.15 0.00 0.00 33.47 30.20 2cqo s TRP 68 CO 0.12 0.44 -0.07 0.14 0.02 0.00 0.00 176.95 177.60 2cqo s VAL 69 N -0.15 0.62 -0.08 4.03 -7.23 -0.87 -4.67 120.40 112.06 2cqo s VAL 69 Ca 0.13 -1.64 0.01 0.00 -1.81 0.00 0.00 61.98 58.68 2cqo s VAL 69 Cb -0.12 -1.31 0.02 0.00 0.56 0.00 0.00 36.38 35.53 2cqo s VAL 69 CO 0.02 -0.71 -0.09 -0.75 -0.31 0.00 0.00 175.10 173.26 2cqo s LYS 70 N -3.06 1.46 0.18 4.82 2.20 0.11 -2.00 119.74 123.46 2cqo s LYS 70 Ca 0.04 -0.29 -0.32 0.00 -0.36 0.00 0.00 55.97 55.04 2cqo s LYS 70 Cb 0.00 -1.35 -0.12 0.00 -1.51 0.00 0.00 37.83 34.85 2cqo s LYS 70 CO -0.03 -0.09 1.74 -0.11 -0.36 0.00 0.00 175.35 176.49 2cqo n LEU 71 N 4.25 3.93 -0.05 5.43 7.94 -0.79 -1.08 117.00 136.63 2cqo n LEU 71 Ca -0.19 1.05 -0.04 0.00 -1.11 0.00 0.00 56.01 55.71 2cqo n LEU 71 Cb 0.51 -1.56 -0.08 0.00 0.53 0.00 0.00 43.42 42.83 2cqo n LEU 71 CO 0.22 0.14 -0.81 2.30 -1.11 0.00 0.00 177.39 178.13 2cqo n ILE 72 N 4.09 0.64 -3.15 1.96 -5.35 -0.92 -1.61 119.36 115.01 2cqo n ILE 72 Ca 0.17 -0.41 0.04 0.00 -0.27 0.00 0.00 62.75 62.28 2cqo n ILE 72 Cb 0.35 -0.70 -0.01 0.00 -1.74 0.00 0.00 39.64 37.54 2cqo n ILE 72 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2cqo s GLY 73 N -4.16 -0.86 -0.14 3.28 0.00 -1.21 -4.86 107.32 99.38 2cqo s GLY 73 Ca -0.05 2.05 -0.02 0.00 0.00 0.00 0.00 44.72 46.71 2cqo s GLY 73 CO 0.40 3.48 -0.09 1.09 0.00 0.00 0.00 173.10 177.98 2cqo s ARG 74 N 2.88 3.51 -0.06 2.90 1.70 -1.26 -1.14 118.95 127.48 2cqo s ARG 74 Ca 0.16 -0.61 -0.00 0.00 -0.47 0.00 0.00 55.73 54.80 2cqo s ARG 74 Cb -0.14 -2.76 0.03 0.00 -0.57 0.00 0.00 34.95 31.51 2cqo s ARG 74 CO -0.19 0.22 -0.02 -1.21 -1.08 0.00 0.00 175.30 173.03 2cqo s GLU 75 N 0.37 0.71 -0.24 3.89 2.02 0.30 -5.03 118.70 120.71 2cqo s GLU 75 Ca -0.08 0.02 0.01 0.00 0.02 0.00 0.00 54.97 54.94 2cqo s GLU 75 Cb -0.15 -0.93 0.04 0.00 0.10 0.00 0.00 34.13 33.19 2cqo s GLU 75 CO 0.04 -0.22 -0.11 1.41 0.02 0.00 0.00 175.26 176.40 2cqo s MET 76 N 1.55 2.60 0.03 1.61 -2.45 -1.26 -0.34 119.30 121.05 2cqo s MET 76 Ca -0.01 -1.11 0.07 0.00 -1.25 0.00 0.00 55.69 53.39 2cqo s MET 76 Cb -0.13 -2.86 -0.03 0.00 1.25 0.00 0.00 34.83 33.06 2cqo s MET 76 CO -0.03 -0.44 -0.19 0.15 1.05 0.00 0.00 175.02 175.56 2cqo s LYS 77 N 1.22 2.07 0.25 4.11 -0.14 0.79 -4.99 119.74 123.05 2cqo s LYS 77 Ca -0.03 -0.97 0.16 0.00 -1.36 0.00 0.00 55.97 53.77 2cqo s LYS 77 Cb -0.17 -2.17 0.86 0.00 -1.68 0.00 0.00 37.83 34.67 2cqo s LYS 77 CO -0.07 0.54 1.47 -1.71 -0.76 0.00 0.00 175.35 174.83 2cqo n ASN 78 N 1.68 0.41 -0.09 2.83 5.15 -1.26 -0.96 115.26 123.03 2cqo n ASN 78 Ca -0.16 0.68 -0.11 0.00 -0.60 0.00 0.00 54.58 54.38 2cqo n ASN 78 Cb 0.52 -0.72 -0.15 0.00 -0.53 0.00 0.00 39.78 38.90 2cqo n ASN 78 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 2cqo n ASP 79 N -2.06 0.44 -3.52 1.20 8.00 -1.26 -5.04 116.55 114.31 2cqo n ASP 79 Ca -0.01 0.06 -0.09 0.00 0.71 0.00 0.00 54.79 55.45 2cqo n ASP 79 Cb 0.07 0.61 -0.03 0.00 -0.02 0.00 0.00 41.12 41.74 2cqo n ASP 79 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2cqo s ARG 80 N -2.51 0.78 -0.13 -1.24 0.52 -0.13 -5.16 118.95 111.07 2cqo s ARG 80 Ca -0.13 -0.17 0.02 0.00 -0.52 0.00 0.00 55.73 54.94 2cqo s ARG 80 Cb 0.07 0.36 0.00 0.00 0.52 0.00 0.00 34.95 35.90 2cqo s ARG 80 CO 0.80 -0.32 -0.20 0.42 0.02 0.00 0.00 175.30 176.02 2cqo s ILE 81 N -2.55 2.28 -0.09 1.52 1.01 -1.26 -0.15 121.20 121.96 2cqo s ILE 81 Ca 0.03 -0.92 0.03 0.00 0.00 0.00 0.00 60.65 59.79 2cqo s ILE 81 Cb -0.01 -1.92 0.01 0.00 0.01 0.00 0.00 42.46 40.55 2cqo s ILE 81 CO -0.06 0.54 -0.19 -0.75 0.00 0.00 0.00 174.94 174.49 2cqo s LYS 82 N 0.64 2.47 -0.07 2.79 2.47 0.54 -5.00 119.74 123.57 2cqo s LYS 82 Ca -0.11 -0.67 0.02 0.00 -1.56 0.00 0.00 55.97 53.66 2cqo s LYS 82 Cb -0.16 -1.94 0.01 0.00 -1.46 0.00 0.00 37.83 34.28 2cqo s LYS 82 CO 0.02 0.08 -0.13 0.08 0.16 0.00 0.00 175.35 175.56 2cqo s VAL 83 N 0.58 1.21 -0.13 4.02 1.01 -1.26 -0.54 120.40 125.29 2cqo s VAL 83 Ca -0.15 -0.51 -0.01 0.00 0.00 0.00 0.00 61.98 61.31 2cqo s VAL 83 Cb -0.17 -1.11 -0.02 0.00 0.00 0.00 0.00 36.38 35.09 2cqo s VAL 83 CO 0.05 0.37 -0.11 -0.44 0.00 0.00 0.00 175.10 174.97 2cqo s SER 84 N 0.73 4.20 0.12 3.32 0.01 -0.29 -1.80 113.70 119.98 2cqo s SER 84 Ca -0.13 -0.26 0.08 0.00 1.31 0.00 0.00 55.95 56.95 2cqo s SER 84 Cb -0.16 -1.56 -0.04 0.00 0.21 0.00 0.00 66.02 64.47 2cqo s SER 84 CO 0.03 0.19 -0.20 -0.76 0.41 0.00 0.00 173.24 172.91 2cqo s LEU 85 N 0.21 2.34 0.14 2.44 1.43 -0.28 -2.18 118.68 122.78 2cqo s LEU 85 Ca -0.07 -0.74 0.10 0.00 -1.03 0.00 0.00 54.13 52.40 2cqo s LEU 85 Cb -0.15 -0.87 -0.04 0.00 0.03 0.00 0.00 46.19 45.16 2cqo s LEU 85 CO 0.05 0.03 -0.25 -0.94 0.23 0.00 0.00 176.35 175.47 2cqo s SER 86 N -2.13 3.15 0.00 2.29 1.04 -0.24 -4.13 113.70 113.68 2cqo s SER 86 Ca 0.09 -0.77 0.00 0.00 0.48 0.00 0.00 55.95 55.75 2cqo s SER 86 Cb -0.09 -0.21 0.00 0.00 0.10 0.00 0.00 66.02 65.82 2cqo s SER 86 CO 0.05 0.13 0.00 0.23 0.98 0.00 0.00 173.24 174.63 2cqo n MET 87 N 0.76 2.57 0.09 4.02 2.81 -0.98 -0.71 117.12 125.68 2cqo n MET 87 Ca -0.17 0.00 0.10 0.00 -1.81 0.00 0.00 57.70 55.82 2cqo n MET 87 Cb 0.54 -0.85 0.42 0.00 -0.71 0.00 0.00 33.22 32.62 2cqo n MET 87 CO 0.00 0.00 0.00 0.36 1.51 0.00 0.00 175.97 177.84 2cqo n LYS 88 N -1.43 0.12 -0.79 0.03 2.85 0.67 -2.14 118.16 117.47 2cqo n LYS 88 Ca 0.00 0.38 -0.04 0.00 -1.05 0.00 0.00 58.31 57.61 2cqo n LYS 88 Cb 0.27 -1.75 0.21 0.00 -0.65 0.00 0.00 35.03 33.11 2cqo n LYS 88 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 177.40 178.68 2cqo n VAL 89 N -1.98 2.56 -3.71 0.58 0.24 -1.26 -4.85 118.33 109.90 2cqo n VAL 89 Ca 0.02 -2.58 -0.11 0.00 -2.04 0.00 0.00 64.34 59.62 2cqo n VAL 89 Cb 0.19 -0.32 -0.11 0.00 -1.47 0.00 0.00 33.84 32.13 2cqo n VAL 89 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 2cqo s VAL 90 N -3.20 -0.03 0.17 3.34 1.01 -0.91 -3.20 120.40 117.59 2cqo s VAL 90 Ca 0.45 0.09 -0.31 0.00 0.00 0.00 0.00 61.98 62.22 2cqo s VAL 90 Cb 0.40 -0.52 -0.09 0.00 0.00 0.00 0.00 36.38 36.17 2cqo s VAL 90 CO 0.02 0.04 1.44 0.21 0.00 0.00 0.00 175.10 176.81 2cqo s ASN 91 N 1.17 6.73 -0.41 3.32 3.84 -1.15 -4.91 114.94 123.52 2cqo s ASN 91 Ca -0.08 2.49 -0.01 0.00 0.21 0.00 0.00 52.86 55.48 2cqo s ASN 91 Cb -0.08 -2.60 0.32 0.00 -0.55 0.00 0.00 41.25 38.34 2cqo s ASN 91 CO -0.09 -0.70 1.95 0.00 -2.79 0.00 0.00 177.10 175.47 2cqo n GLN 92 N 3.43 2.06 0.00 0.43 1.13 -1.26 -2.73 117.38 120.44 2cqo n GLN 92 Ca 0.10 -2.14 0.00 0.00 -1.94 0.00 0.00 57.00 53.03 2cqo n GLN 92 Cb 0.41 -1.84 0.00 0.00 0.11 0.00 0.00 30.24 28.92 2cqo n GLN 92 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2cqo n GLY 93 N -0.19 -0.00 0.00 1.08 0.00 -1.26 -4.93 105.19 99.88 2cqo n GLY 93 Ca 0.41 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.42 2cqo n GLY 93 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2cqo n THR 94 N -1.83 0.03 -0.85 2.61 -2.24 -1.26 -5.03 114.28 105.71 2cqo n THR 94 Ca 0.00 -0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 2cqo n THR 94 Cb 0.00 -0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.17 2cqo n THR 94 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2cqo n GLY 95 N 2.62 0.62 3.75 3.38 0.00 -1.10 -5.04 105.19 109.41 2cqo n GLY 95 Ca -0.01 -0.75 -0.40 0.00 0.00 0.00 0.00 46.02 44.86 2cqo n GLY 95 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2cqo s LYS 96 N -1.76 4.62 0.04 1.61 2.20 -1.26 -4.78 119.74 120.41 2cqo s LYS 96 Ca 0.00 1.26 -0.31 0.00 -0.36 0.00 0.00 55.97 56.55 2cqo s LYS 96 Cb 0.00 -3.33 -0.10 0.00 -1.51 0.00 0.00 37.83 32.89 2cqo s LYS 96 CO 0.00 0.36 1.90 -3.47 -0.36 0.00 0.00 175.35 173.79 2cqo n ASP 97 N 2.34 3.95 -0.03 1.43 -0.08 -1.26 -2.94 116.55 119.95 2cqo n ASP 97 Ca -0.02 0.95 -0.06 0.00 -1.51 0.00 0.00 54.79 54.15 2cqo n ASP 97 Cb 0.49 -1.50 -0.13 0.00 2.34 0.00 0.00 41.12 42.32 2cqo n ASP 97 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 2cqo n LEU 98 N 6.66 0.55 -3.75 -2.67 4.77 -1.19 -4.63 117.00 116.74 2cqo n LEU 98 Ca 0.20 0.26 -0.28 0.00 -0.03 0.00 0.00 56.01 56.16 2cqo n LEU 98 Cb 0.37 0.24 -0.11 0.00 -2.33 0.00 0.00 43.42 41.58 2cqo n LEU 98 CO 0.68 0.34 -0.10 -0.67 -1.33 0.00 0.00 177.39 176.31 2cqo n ASP 99 N -2.87 2.19 0.00 -1.43 2.03 -1.25 -4.92 116.55 110.30 2cqo n ASP 99 Ca -0.19 -3.02 0.07 0.00 0.52 0.00 0.00 54.79 52.17 2cqo n ASP 99 Cb 1.00 -0.70 0.41 0.00 -0.72 0.00 0.00 41.12 41.11 2cqo n ASP 99 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 2cqo n PRO 100 N 2.10 0.49 -0.02 -0.67 -0.04 -1.26 -2.47 135.00 133.14 2cqo n PRO 100 Ca 0.23 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.55 2cqo n PRO 100 Cb 0.39 -1.45 -0.14 0.00 -0.04 0.00 0.00 33.50 32.26 2cqo n PRO 100 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2cqo n ASN 101 N -0.95 1.36 -3.95 3.54 4.13 -1.26 -4.99 115.26 113.14 2cqo n ASN 101 Ca 0.10 0.30 -0.27 0.00 1.68 0.00 0.00 54.58 56.40 2cqo n ASN 101 Cb 0.05 -0.35 -0.02 0.00 -1.54 0.00 0.00 39.78 37.92 2cqo n ASN 101 CO 0.00 0.00 0.00 -0.46 0.28 0.00 0.00 177.26 177.08 2cqo n ASN 102 N -3.21 -0.90 -0.00 6.41 0.23 -1.03 -4.86 115.26 111.89 2cqo n ASN 102 Ca -0.24 -1.04 0.02 0.00 -0.53 0.00 0.00 54.58 52.78 2cqo n ASN 102 Cb 1.05 -2.93 -0.03 0.00 -2.08 0.00 0.00 39.78 35.79 2cqo n ASN 102 CO 0.00 0.00 0.00 0.52 -0.93 0.00 0.00 177.26 176.85 2cqo n VAL 103 N -4.41 0.04 -0.04 3.53 0.31 -1.26 -4.69 118.33 111.81 2cqo n VAL 103 Ca -0.28 -0.11 -0.11 0.00 -0.01 0.00 0.00 64.34 63.83 2cqo n VAL 103 Cb 0.67 0.19 -0.04 0.00 -0.91 0.00 0.00 33.84 33.75 2cqo n VAL 103 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2cqo h ILE 104 N 0.00 1.11 -0.17 2.52 5.03 -1.98 -2.01 117.51 122.01 2cqo h ILE 104 Ca -0.02 -0.30 0.05 0.00 -0.12 0.00 0.00 64.86 64.48 2cqo h ILE 104 Cb 0.37 0.98 -0.01 0.00 -3.03 0.00 0.00 36.82 35.13 2cqo h ILE 104 CO 0.00 0.10 0.30 0.16 -0.68 0.00 0.00 178.15 178.03 2cqo h ILE 105 N 0.18 0.25 -1.81 -0.67 -0.00 -1.98 -3.36 117.51 110.11 2cqo h ILE 105 Ca 0.06 0.00 -0.53 0.00 -0.00 0.00 0.00 64.86 64.39 2cqo h ILE 105 Cb 0.08 0.74 -0.08 0.00 -0.00 0.00 0.00 36.82 37.56 2cqo h ILE 105 CO -0.01 0.00 1.21 -0.70 -0.00 0.00 0.00 178.15 178.65 2cqo s GLU 106 N -4.41 3.19 -0.08 0.16 2.12 -0.76 -4.95 118.70 113.97 2cqo s GLU 106 Ca -0.04 -0.40 -0.01 0.00 0.36 0.00 0.00 54.97 54.88 2cqo s GLU 106 Cb 0.13 -4.63 0.03 0.00 0.26 0.00 0.00 34.13 29.92 2cqo s GLU 106 CO 0.45 -2.33 -0.02 -1.54 -0.54 0.00 0.00 175.26 171.27 2cqo s SER 107 N 4.99 1.75 -0.65 -1.70 1.04 -1.26 -5.03 113.70 112.83 2cqo s SER 107 Ca 0.45 -0.15 0.05 0.00 0.48 0.00 0.00 55.95 56.78 2cqo s SER 107 Cb -0.06 -0.57 0.18 0.00 0.10 0.00 0.00 66.02 65.67 2cqo s SER 107 CO 0.07 -0.17 0.50 0.61 0.98 0.00 0.00 173.24 175.24 2cqo n GLY 108 N 5.04 3.81 3.77 7.32 0.00 -1.26 -5.10 105.19 118.78 2cqo n GLY 108 Ca -0.09 -2.40 -0.37 0.00 0.00 0.00 0.00 46.02 43.15 2cqo n GLY 108 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cqo s PRO 109 N -1.36 3.74 -0.04 1.61 0.04 -1.26 -4.97 135.00 132.77 2cqo s PRO 109 Ca 0.28 1.77 -0.00 0.00 0.04 0.00 0.00 61.00 63.09 2cqo s PRO 109 Cb -0.00 -2.40 -0.02 0.00 0.04 0.00 0.00 34.50 32.12 2cqo s PRO 109 CO -0.16 -0.56 -0.04 -1.13 0.04 0.00 0.00 177.00 175.15 2cqo n SER 110 N -0.51 2.85 -3.35 6.66 3.41 -1.26 -5.04 113.62 116.37 2cqo n SER 110 Ca 0.07 -0.00 -0.21 0.00 -0.26 0.00 0.00 58.87 58.47 2cqo n SER 110 Cb 0.48 -0.07 0.08 0.00 -0.26 0.00 0.00 64.21 64.44 2cqo n SER 110 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2cqo n SER 111 N -2.75 -5.30 0.00 4.04 7.64 -1.26 -5.39 113.62 110.60 2cqo n SER 111 Ca -0.07 -0.52 0.00 0.00 1.01 0.00 0.00 58.87 59.30 2cqo n SER 111 Cb 0.56 -4.73 0.00 0.00 -1.01 0.00 0.00 64.21 59.03 2cqo n SER 111 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64