#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 -1.27 -3.82 1.61 7.64 -1.26 -4.91 113.62 111.62 2cqo n SER -5 Ca 0.00 -1.23 -0.12 0.00 1.01 0.00 0.00 58.87 58.53 2cqo n SER -5 Cb 0.00 -1.74 -0.13 0.00 -1.01 0.00 0.00 64.21 61.33 2cqo n SER -5 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2cqo s SER -4 N -3.55 -0.14 -0.33 6.43 1.04 -1.26 -5.06 113.70 110.82 2cqo s SER -4 Ca 0.61 0.28 0.12 0.00 0.48 0.00 0.00 55.95 57.44 2cqo s SER -4 Cb -0.35 0.28 0.46 0.00 0.10 0.00 0.00 66.02 66.51 2cqo s SER -4 CO 1.01 -0.05 1.10 0.61 0.98 0.00 0.00 173.24 176.89 2cqo n GLY -3 N 3.05 4.34 3.30 7.32 0.00 -1.26 -5.10 105.19 116.84 2cqo n GLY -3 Ca -0.13 -2.08 -0.29 0.00 0.00 0.00 0.00 46.02 43.52 2cqo n GLY -3 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2cqo n SER -2 N -0.49 -2.97 -4.73 1.61 3.41 -1.26 -5.02 113.62 104.17 2cqo n SER -2 Ca 0.28 -0.49 -0.31 0.00 -0.26 0.00 0.00 58.87 58.09 2cqo n SER -2 Cb 0.81 -1.08 -0.07 0.00 -0.26 0.00 0.00 64.21 63.61 2cqo n SER -2 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2cqo s SER -1 N -2.56 5.28 0.00 4.04 0.01 -1.26 -4.89 113.70 114.32 2cqo s SER -1 Ca 0.64 -0.07 0.00 0.00 1.31 0.00 0.00 55.95 57.84 2cqo s SER -1 Cb -0.17 -1.36 0.00 0.00 0.21 0.00 0.00 66.02 64.70 2cqo s SER -1 CO 0.59 0.19 0.00 0.61 0.41 0.00 0.00 173.24 175.05 2cqo n GLY 0 N 0.67 0.36 0.29 3.44 0.00 -1.26 -4.95 105.19 103.75 2cqo n GLY 0 Ca -0.10 -0.28 -0.08 0.00 0.00 0.00 0.00 46.02 45.55 2cqo n GLY 0 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2cqo h MET 1 N 0.00 -0.12 -6.18 1.61 1.85 -1.98 -3.35 114.93 106.77 2cqo h MET 1 Ca 0.00 0.01 -0.64 0.00 -0.61 0.00 0.00 59.70 58.46 2cqo h MET 1 Cb 0.00 0.03 0.12 0.00 0.43 0.00 0.00 31.60 32.17 2cqo h MET 1 CO 0.00 -0.08 -0.34 0.09 -0.40 0.00 0.00 176.91 176.18 2cqo n ASN 2 N -4.52 -0.52 -3.79 1.39 4.13 -1.26 -0.24 115.26 110.45 2cqo n ASN 2 Ca -0.00 1.11 -0.29 0.00 1.68 0.00 0.00 54.58 57.07 2cqo n ASN 2 Cb 0.20 -1.07 -0.02 0.00 -1.54 0.00 0.00 39.78 37.35 2cqo n ASN 2 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 2cqo n SER 3 N 1.71 -3.11 -1.10 6.41 7.64 -1.26 -4.79 113.62 119.11 2cqo n SER 3 Ca 0.14 -0.68 -0.02 0.00 1.01 0.00 0.00 58.87 59.32 2cqo n SER 3 Cb 0.29 -2.59 0.08 0.00 -1.01 0.00 0.00 64.21 60.99 2cqo n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2cqo n GLY 4 N -1.19 2.29 3.65 0.23 0.00 0.66 -4.94 105.19 105.89 2cqo n GLY 4 Ca 0.04 -0.28 -0.34 0.00 0.00 0.00 0.00 46.02 45.44 2cqo n GLY 4 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cqo n ARG 5 N 0.11 0.24 -1.19 1.61 5.12 -1.26 -4.99 116.66 116.31 2cqo n ARG 5 Ca 0.12 0.15 -0.29 0.00 -1.93 0.00 0.00 57.85 55.90 2cqo n ARG 5 Cb 0.66 -2.34 0.16 0.00 -1.16 0.00 0.00 32.46 29.78 2cqo n ARG 5 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 2cqo s PRO 6 N -3.85 0.87 -0.56 5.56 0.04 -1.26 -4.99 135.00 130.80 2cqo s PRO 6 Ca 0.72 0.68 -0.19 0.00 0.04 0.00 0.00 61.00 62.25 2cqo s PRO 6 Cb -0.30 -1.78 0.09 0.00 0.04 0.00 0.00 34.50 32.55 2cqo s PRO 6 CO 0.52 -2.47 0.67 -1.21 0.04 0.00 0.00 177.00 174.54 2cqo s GLU 7 N -4.95 3.06 0.00 4.56 0.41 -1.26 -4.77 118.70 115.75 2cqo s GLU 7 Ca 0.64 -1.20 0.00 0.00 -0.41 0.00 0.00 54.97 54.00 2cqo s GLU 7 Cb -0.18 -4.21 0.00 0.00 -1.78 0.00 0.00 34.13 27.96 2cqo s GLU 7 CO 0.57 -1.43 0.00 0.25 -0.49 0.00 0.00 175.26 174.17 2cqo n THR 8 N 5.55 0.00 -2.55 3.63 -2.24 -1.26 -4.77 114.28 112.65 2cqo n THR 8 Ca -0.09 -0.21 -0.09 0.00 -2.27 0.00 0.00 64.05 61.40 2cqo n THR 8 Cb 0.43 0.71 0.04 0.00 -2.10 0.00 0.00 70.33 69.41 2cqo n THR 8 CO 0.00 0.00 0.00 1.15 -0.57 0.00 0.00 175.07 175.65 2cqo n MET 9 N -0.99 2.40 -0.54 -0.78 -0.00 -1.26 -4.88 117.12 111.07 2cqo n MET 9 Ca 0.00 -3.75 0.45 0.00 -0.00 0.00 0.00 57.70 54.41 2cqo n MET 9 Cb 0.00 -1.85 0.78 0.00 -0.00 0.00 0.00 33.22 32.15 2cqo n MET 9 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 175.97 177.46 2cqo h GLU 10 N 2.46 0.00 -0.61 3.17 4.81 -1.95 -0.01 114.58 122.46 2cqo h GLU 10 Ca 0.04 0.00 0.10 0.00 -0.13 0.00 0.00 59.36 59.37 2cqo h GLU 10 Cb 1.36 0.00 -0.11 0.00 0.63 0.00 0.00 28.75 30.63 2cqo h GLU 10 CO 0.39 0.00 -0.37 -2.95 -0.73 0.00 0.00 179.01 175.35 2cqo h ASN 11 N 0.00 -1.28 -4.04 1.04 -1.07 -1.90 -3.40 115.58 104.93 2cqo h ASN 11 Ca 0.78 0.24 -0.53 0.00 0.07 0.00 0.00 56.30 56.85 2cqo h ASN 11 Cb 3.18 0.62 0.11 0.00 -2.07 0.00 0.00 38.32 40.16 2cqo h ASN 11 CO -0.01 -0.31 0.56 -0.76 0.07 0.00 0.00 177.43 176.97 2cqo s LEU 12 N -10.68 3.89 0.00 6.14 1.43 -0.02 -4.84 118.68 114.60 2cqo s LEU 12 Ca -0.14 2.58 -0.08 0.00 -1.03 0.00 0.00 54.13 55.46 2cqo s LEU 12 Cb 0.15 -4.29 0.12 0.00 0.03 0.00 0.00 46.19 42.20 2cqo s LEU 12 CO 0.68 -1.36 0.43 -0.81 0.23 0.00 0.00 176.35 175.52 2cqo n PRO 13 N -0.90 -1.87 -2.44 1.29 -0.04 -1.26 -5.05 135.00 124.72 2cqo n PRO 13 Ca 0.10 -0.69 -0.19 0.00 -0.04 0.00 0.00 63.50 62.67 2cqo n PRO 13 Cb 0.46 -0.65 0.09 0.00 -0.04 0.00 0.00 33.50 33.36 2cqo n PRO 13 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2cqo n ALA 14 N -3.75 0.47 -1.77 0.55 0.00 -1.26 -5.03 120.51 109.72 2cqo n ALA 14 Ca -0.08 -1.74 -0.36 0.00 0.00 0.00 0.00 53.44 51.25 2cqo n ALA 14 Cb 0.23 0.35 -0.00 0.00 0.00 0.00 0.00 19.45 20.03 2cqo n ALA 14 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2cqo s LEU 15 N 0.00 3.90 -1.76 0.00 2.96 -1.26 -2.82 118.68 119.70 2cqo s LEU 15 Ca 0.56 2.28 0.00 0.00 -0.22 0.00 0.00 54.13 56.75 2cqo s LEU 15 Cb -0.04 -4.38 0.00 0.00 0.50 0.00 0.00 46.19 42.27 2cqo s LEU 15 CO 0.37 -1.08 0.00 -1.22 -1.32 0.00 0.00 176.35 173.10 2cqo n TYR 16 N -0.84 -0.67 -3.31 5.38 4.01 -0.26 -4.95 117.16 116.52 2cqo n TYR 16 Ca 0.09 0.00 -0.36 0.00 -0.16 0.00 0.00 57.90 57.47 2cqo n TYR 16 Cb 0.49 -3.46 -0.06 0.00 -0.31 0.00 0.00 39.34 36.00 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 -2.78 4.79 -0.10 -0.72 2.01 -1.13 -4.77 115.64 112.95 2cqo s THR 17 Ca 0.00 0.98 -0.01 0.00 0.31 0.00 0.00 61.69 62.97 2cqo s THR 17 Cb 0.00 -3.79 -0.03 0.00 0.01 0.00 0.00 72.50 68.69 2cqo s THR 17 CO 0.00 0.31 -0.05 -0.63 -0.69 0.00 0.00 174.62 173.56 2cqo s ILE 18 N -1.39 3.80 0.18 1.82 1.01 -1.26 -1.62 121.20 123.74 2cqo s ILE 18 Ca 0.36 -0.42 -0.19 0.00 0.00 0.00 0.00 60.65 60.40 2cqo s ILE 18 Cb -0.16 -2.60 0.04 0.00 0.01 0.00 0.00 42.46 39.75 2cqo s ILE 18 CO 0.19 0.56 0.53 0.72 0.00 0.00 0.00 174.94 176.95 2cqo s PHE 19 N -0.34 -0.22 -0.18 3.97 -0.12 -0.90 -5.02 117.98 115.17 2cqo s PHE 19 Ca 0.05 -0.10 -0.15 0.00 -0.05 0.00 0.00 56.93 56.68 2cqo s PHE 19 Cb -0.12 0.43 -0.04 0.00 -0.63 0.00 0.00 43.02 42.65 2cqo s PHE 19 CO 0.02 -0.89 0.35 -1.14 -0.05 0.00 0.00 175.22 173.51 2cqo s GLN 20 N -3.84 4.23 0.08 1.99 0.74 -1.26 -1.97 119.66 119.62 2cqo s GLN 20 Ca 0.07 0.16 0.01 0.00 0.05 0.00 0.00 55.36 55.66 2cqo s GLN 20 Cb -0.01 -3.48 -0.04 0.00 1.10 0.00 0.00 33.01 30.58 2cqo s GLN 20 CO -0.06 0.10 -0.06 0.20 -0.55 0.00 0.00 175.29 174.93 2cqo s GLY 21 N 0.76 0.66 -0.08 2.59 0.00 -0.66 -4.23 107.32 106.36 2cqo s GLY 21 Ca 0.18 -1.19 -0.01 0.00 0.00 0.00 0.00 44.72 43.70 2cqo s GLY 21 CO 0.06 -1.28 -0.01 1.85 0.00 0.00 0.00 173.10 173.72 2cqo s GLU 22 N -3.31 2.93 0.11 2.90 2.12 -1.17 -0.99 118.70 121.29 2cqo s GLU 22 Ca 0.06 -0.44 -0.31 0.00 0.36 0.00 0.00 54.97 54.64 2cqo s GLU 22 Cb 0.02 -2.75 -0.08 0.00 0.26 0.00 0.00 34.13 31.58 2cqo s GLU 22 CO -0.04 0.69 1.47 0.08 -0.54 0.00 0.00 175.26 176.92 2cqo s VAL 23 N -0.87 3.16 -0.02 3.70 1.01 -0.83 -1.09 120.40 125.45 2cqo s VAL 23 Ca 0.13 0.78 0.04 0.00 0.00 0.00 0.00 61.98 62.94 2cqo s VAL 23 Cb -0.11 -3.50 -0.06 0.00 0.00 0.00 0.00 36.38 32.70 2cqo s VAL 23 CO 0.02 0.05 0.06 0.00 0.00 0.00 0.00 175.10 175.23 2cqo n ALA 24 N 4.34 2.05 -3.03 5.51 0.00 -0.65 -2.36 120.51 126.35 2cqo n ALA 24 Ca 0.13 -0.19 -0.12 0.00 0.00 0.00 0.00 53.44 53.25 2cqo n ALA 24 Cb 0.41 -0.02 -0.13 0.00 0.00 0.00 0.00 19.45 19.71 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 -2.23 0.12 -0.14 0.00 1.75 -1.23 -4.90 119.30 112.67 2cqo s MET 25 Ca -0.02 0.16 0.02 0.00 -1.25 0.00 0.00 55.69 54.61 2cqo s MET 25 Cb 0.02 0.05 0.01 0.00 2.84 0.00 0.00 34.83 37.75 2cqo s MET 25 CO 0.19 -0.02 -0.21 0.08 -0.65 0.00 0.00 175.02 174.40 2cqo s VAL 26 N 0.13 2.00 0.24 10.11 1.01 -1.26 -0.59 120.40 132.04 2cqo s VAL 26 Ca -0.01 -0.94 0.10 0.00 0.00 0.00 0.00 61.98 61.14 2cqo s VAL 26 Cb -0.01 -1.78 -0.05 0.00 0.00 0.00 0.00 36.38 34.54 2cqo s VAL 26 CO -0.00 0.54 -0.18 0.42 0.00 0.00 0.00 175.10 175.88 2cqo s THR 27 N 0.93 2.12 -2.00 3.92 -4.23 0.16 -5.00 115.64 111.55 2cqo s THR 27 Ca -0.05 -2.29 0.19 0.00 -1.18 0.00 0.00 61.69 58.37 2cqo s THR 27 Cb -0.15 -2.16 0.55 0.00 1.34 0.00 0.00 72.50 72.08 2cqo s THR 27 CO -0.04 -0.48 1.55 -0.67 -0.54 0.00 0.00 174.62 174.44 2cqo n ASP 28 N -0.45 0.00 -0.03 3.99 2.03 -1.26 -2.12 116.55 118.70 2cqo n ASP 28 Ca -0.07 -0.64 0.01 0.00 0.52 0.00 0.00 54.79 54.61 2cqo n ASP 28 Cb 0.60 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 41.01 2cqo n ASP 28 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2cqo n TYR 29 N -0.99 0.00 -2.02 -0.67 0.18 -1.26 -4.66 117.16 107.74 2cqo n TYR 29 Ca 0.14 -0.35 0.00 0.00 1.88 0.00 0.00 57.90 59.57 2cqo n TYR 29 Cb 0.07 -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 -0.39 0.04 3.27 -7.48 0.00 -0.90 -1.07 105.19 98.66 2cqo n GLY 30 Ca 0.01 -1.53 -0.14 0.00 0.00 0.00 0.00 46.02 44.37 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 -0.90 -0.07 4.61 0.00 -0.68 0.38 121.76 124.09 2cqo s ALA 31 Ca 0.00 0.44 -0.16 0.00 0.00 0.00 0.00 51.96 52.24 2cqo s ALA 31 Cb 0.00 0.07 -0.05 0.00 0.00 0.00 0.00 23.12 23.14 2cqo s ALA 31 CO 0.00 -0.28 0.41 -0.06 0.00 0.00 0.00 175.76 175.83 2cqo s PHE 32 N -1.32 3.60 -0.12 0.00 0.40 0.24 -0.68 117.98 120.10 2cqo s PHE 32 Ca -0.13 0.87 0.01 0.00 -0.60 0.00 0.00 56.93 57.08 2cqo s PHE 32 Cb -0.05 -2.39 -0.01 0.00 0.51 0.00 0.00 43.02 41.08 2cqo s PHE 32 CO 0.05 0.39 -0.16 0.42 0.70 0.00 0.00 175.22 176.63 2cqo s ILE 33 N -0.16 2.79 -0.12 0.64 -1.09 -0.46 -1.64 121.20 121.16 2cqo s ILE 33 Ca 0.23 -0.75 -0.25 0.00 -2.23 0.00 0.00 60.65 57.65 2cqo s ILE 33 Cb -0.15 -2.15 -0.02 0.00 -1.58 0.00 0.00 42.46 38.55 2cqo s ILE 33 CO 0.10 0.53 0.79 -0.54 -1.23 0.00 0.00 174.94 174.59 2cqo s LYS 34 N 0.38 4.37 0.01 2.79 1.02 -0.25 -2.71 119.74 125.35 2cqo s LYS 34 Ca -0.12 0.98 -0.24 0.00 0.02 0.00 0.00 55.97 56.61 2cqo s LYS 34 Cb -0.16 -3.52 -0.05 0.00 -0.52 0.00 0.00 37.83 33.58 2cqo s LYS 34 CO 0.06 -0.16 0.72 0.42 -0.92 0.00 0.00 175.35 175.47 2cqo s ILE 35 N 1.55 4.84 -0.12 2.17 1.01 -1.26 -3.02 121.20 126.36 2cqo s ILE 35 Ca 0.39 1.51 -0.29 0.00 0.00 0.00 0.00 60.65 62.26 2cqo s ILE 35 Cb -0.17 -4.06 -0.04 0.00 0.01 0.00 0.00 42.46 38.20 2cqo s ILE 35 CO 0.16 0.35 1.54 -2.16 0.00 0.00 0.00 174.94 174.83 2cqo s PRO 36 N 0.10 4.10 0.00 2.79 0.04 -1.26 -3.04 135.00 137.73 2cqo s PRO 36 Ca 0.37 1.92 0.00 0.00 0.04 0.00 0.00 61.00 63.33 2cqo s PRO 36 Cb -0.19 -3.94 0.00 0.00 0.04 0.00 0.00 34.50 30.41 2cqo s PRO 36 CO 0.21 -0.92 0.00 0.41 0.04 0.00 0.00 177.00 176.74 2cqo n GLY 37 N 4.13 0.90 3.47 0.56 0.00 -1.26 -5.08 105.19 107.91 2cqo n GLY 37 Ca 0.17 -0.57 -0.14 0.00 0.00 0.00 0.00 46.02 45.47 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 -0.53 2.14 -3.17 0.00 1.74 -1.26 -4.92 116.66 110.66 2cqo n ARG 39 Ca 0.01 0.01 -0.28 0.00 -0.77 0.00 0.00 57.85 56.82 2cqo n ARG 39 Cb 0.62 -1.13 -0.03 0.00 -1.02 0.00 0.00 32.46 30.90 2cqo n ARG 39 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2cqo s LYS 40 N -2.12 3.64 0.18 5.56 -0.14 -1.26 -5.05 119.74 120.55 2cqo s LYS 40 Ca -0.05 0.10 0.10 0.00 -1.36 0.00 0.00 55.97 54.76 2cqo s LYS 40 Cb 0.02 -2.56 -0.04 0.00 -1.68 0.00 0.00 37.83 33.56 2cqo s LYS 40 CO 0.19 0.11 -0.20 -0.65 -0.76 0.00 0.00 175.35 174.04 2cqo s GLN 41 N -3.79 1.38 0.26 1.68 -0.21 -1.26 -4.36 119.66 113.36 2cqo s GLN 41 Ca 0.46 -1.47 0.08 0.00 0.02 0.00 0.00 55.36 54.45 2cqo s GLN 41 Cb -0.10 -1.52 -0.04 0.00 1.00 0.00 0.00 33.01 32.35 2cqo s GLN 41 CO 0.32 0.31 0.14 0.20 -2.12 0.00 0.00 175.29 174.15 2cqo s GLY 42 N -2.71 1.51 -0.09 3.09 0.00 -1.10 -4.77 107.32 103.25 2cqo s GLY 42 Ca 0.18 -1.51 -0.01 0.00 0.00 0.00 0.00 44.72 43.38 2cqo s GLY 42 CO 0.08 -1.55 -0.04 -2.27 0.00 0.00 0.00 173.10 169.33 2cqo s LEU 43 N -3.80 3.34 -0.26 0.66 2.96 -0.51 -1.36 118.68 119.71 2cqo s LEU 43 Ca 0.33 0.03 -0.03 0.00 -0.22 0.00 0.00 54.13 54.24 2cqo s LEU 43 Cb -0.07 -1.75 0.02 0.00 0.50 0.00 0.00 46.19 44.88 2cqo s LEU 43 CO 0.24 0.34 -0.02 -0.69 -1.32 0.00 0.00 176.35 174.90 2cqo s VAL 44 N -0.68 3.24 0.41 1.68 1.01 0.15 -1.06 120.40 125.15 2cqo s VAL 44 Ca 0.11 -0.85 -0.25 0.00 0.00 0.00 0.00 61.98 60.98 2cqo s VAL 44 Cb -0.12 -2.62 -0.10 0.00 0.00 0.00 0.00 36.38 33.54 2cqo s VAL 44 CO 0.02 0.20 1.13 1.57 0.00 0.00 0.00 175.10 178.02 2cqo n HIS 45 N 4.74 1.62 0.13 5.22 -0.00 -1.26 -1.69 115.22 123.98 2cqo n HIS 45 Ca -0.16 0.54 0.09 0.00 0.46 0.00 0.00 57.72 58.65 2cqo n HIS 45 Cb 0.48 -2.30 0.59 0.00 -0.12 0.00 0.00 29.99 28.64 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 1.80 0.16 0.00 1.57 -0.00 -1.44 0.12 114.38 116.60 2cqo h ARG 46 Ca -0.46 -0.01 0.00 0.00 -0.00 0.00 0.00 59.98 59.51 2cqo h ARG 46 Cb 1.32 -0.04 0.00 0.00 -0.00 0.00 0.00 29.97 31.25 2cqo h ARG 46 CO 0.58 0.11 0.00 -2.37 -0.00 0.00 0.00 179.97 178.29 2cqo n THR 47 N -4.50 0.58 0.12 0.08 5.66 -1.26 -3.04 114.28 111.92 2cqo n THR 47 Ca 0.01 -0.15 0.11 0.00 -3.05 0.00 0.00 64.05 60.98 2cqo n THR 47 Cb 0.18 -0.69 -0.10 0.00 -1.55 0.00 0.00 70.33 68.17 2cqo n THR 47 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 175.07 173.43 2cqo n HIS 48 N -2.15 0.28 -0.04 1.09 8.25 0.33 -4.23 115.22 118.75 2cqo n HIS 48 Ca 0.05 0.08 -0.08 0.00 -0.26 0.00 0.00 57.72 57.52 2cqo n HIS 48 Cb 0.38 -0.60 0.10 0.00 1.12 0.00 0.00 29.99 30.99 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 0.66 -3.33 -0.41 2.86 -1.20 1.06 114.93 114.58 2cqo h MET 49 Ca 0.00 -0.31 -0.18 0.00 -2.06 0.00 0.00 59.70 57.15 2cqo h MET 49 Cb 0.95 -0.01 -0.26 0.00 0.06 0.00 0.00 31.60 32.34 2cqo h MET 49 CO 0.00 0.90 -0.52 0.45 1.06 0.00 0.00 176.91 178.80 2cqo s SER 50 N -6.82 -0.17 -0.14 1.22 0.15 -1.25 -4.36 113.70 102.34 2cqo s SER 50 Ca -0.08 0.33 -0.25 0.00 0.70 0.00 0.00 55.95 56.65 2cqo s SER 50 Cb 0.13 0.34 -0.22 0.00 -1.71 0.00 0.00 66.02 64.56 2cqo s SER 50 CO 0.83 -0.07 0.65 0.28 1.20 0.00 0.00 173.24 176.13 2cqo h SER 51 N 5.82 0.00 -1.81 5.45 0.02 -1.87 -3.44 113.55 117.72 2cqo h SER 51 Ca -0.25 -0.85 -0.25 0.00 -0.84 0.00 0.00 61.79 59.60 2cqo h SER 51 Cb 1.20 0.00 0.14 0.00 0.14 0.00 0.00 62.40 63.88 2cqo h SER 51 CO 0.40 0.94 -0.59 0.00 -1.14 0.00 0.00 176.83 176.44 2cqo n ARG 53 N -1.00 0.94 -2.63 0.00 0.63 -1.26 -4.91 116.66 108.43 2cqo n ARG 53 Ca 0.04 -0.17 -0.42 0.00 -0.92 0.00 0.00 57.85 56.37 2cqo n ARG 53 Cb 0.39 -3.50 -0.03 0.00 0.45 0.00 0.00 32.46 29.77 2cqo n ARG 53 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 2cqo s VAL 54 N 12.77 4.65 -0.16 5.15 1.01 -1.26 -4.92 120.40 137.64 2cqo s VAL 54 Ca 0.97 1.93 -0.06 0.00 0.00 0.00 0.00 61.98 64.82 2cqo s VAL 54 Cb -0.17 -4.24 -0.08 0.00 0.00 0.00 0.00 36.38 31.89 2cqo s VAL 54 CO 0.23 0.02 -0.20 0.47 0.00 0.00 0.00 175.10 175.62 2cqo n ASP 55 N 4.91 1.59 -3.59 3.32 8.00 -1.26 -4.99 116.55 124.52 2cqo n ASP 55 Ca 0.09 0.13 -0.20 0.00 0.71 0.00 0.00 54.79 55.51 2cqo n ASP 55 Cb 0.48 -0.43 -0.15 0.00 -0.02 0.00 0.00 41.12 41.00 2cqo n ASP 55 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2cqo s LYS 56 N -2.31 0.08 0.38 -1.24 1.02 -1.26 -5.01 119.74 111.41 2cqo s LYS 56 Ca -0.23 0.23 0.28 0.00 0.02 0.00 0.00 55.97 56.27 2cqo s LYS 56 Cb 0.08 -1.09 1.17 0.00 -0.52 0.00 0.00 37.83 37.47 2cqo s LYS 56 CO 0.31 -0.54 1.83 -1.00 -0.92 0.00 0.00 175.35 175.04 2cqo h PRO 57 N 8.37 0.00 0.00 -1.68 0.13 -1.84 -2.49 132.00 134.49 2cqo h PRO 57 Ca -0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.98 2cqo h PRO 57 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 2cqo h PRO 57 CO 0.23 0.00 0.00 0.45 -0.23 0.00 0.00 178.00 178.45 2cqo n SER 58 N -2.59 0.28 -0.63 1.44 2.88 -1.26 -2.71 113.62 111.03 2cqo n SER 58 Ca 0.01 0.54 0.08 0.00 -1.33 0.00 0.00 58.87 58.17 2cqo n SER 58 Cb 0.25 -0.61 0.07 0.00 -0.75 0.00 0.00 64.21 63.17 2cqo n SER 58 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 2cqo n GLU 59 N -1.77 1.20 -0.10 -1.46 -0.00 -0.94 -4.44 120.64 113.13 2cqo n GLU 59 Ca 0.05 -1.45 -0.12 0.00 -0.00 0.00 0.00 57.16 55.65 2cqo n GLU 59 Cb 0.32 -1.30 -0.15 0.00 -0.00 0.00 0.00 31.44 30.31 2cqo n GLU 59 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.13 176.24 2cqo n ILE 60 N 0.87 1.42 -4.11 3.84 5.41 -1.10 -5.00 119.36 120.69 2cqo n ILE 60 Ca 0.09 -0.80 -0.13 0.00 1.00 0.00 0.00 62.75 62.91 2cqo n ILE 60 Cb 0.39 -0.68 -0.11 0.00 -0.71 0.00 0.00 39.64 38.53 2cqo n ILE 60 CO 0.00 0.00 0.00 0.68 0.00 0.00 0.00 176.55 177.23 2cqo s VAL 61 N -2.50 0.70 -0.05 1.39 -7.23 -1.18 -5.14 120.40 106.39 2cqo s VAL 61 Ca -0.15 -1.36 -0.08 0.00 -1.81 0.00 0.00 61.98 58.58 2cqo s VAL 61 Cb 0.07 -0.99 0.02 0.00 0.56 0.00 0.00 36.38 36.03 2cqo s VAL 61 CO 0.78 -0.49 0.20 1.51 -0.31 0.00 0.00 175.10 176.80 2cqo s ASP 62 N -2.03 -0.16 -0.28 4.85 -4.77 -1.26 -4.73 116.67 108.29 2cqo s ASP 62 Ca -0.02 0.25 -0.37 0.00 -3.30 0.00 0.00 52.55 49.10 2cqo s ASP 62 Cb -0.06 0.37 -0.13 0.00 -1.09 0.00 0.00 42.92 42.01 2cqo s ASP 62 CO -0.00 -0.18 1.97 0.52 0.70 0.00 0.00 175.17 178.18 2cqo n VAL 63 N 2.44 0.30 0.00 2.11 0.31 -1.26 -1.26 118.33 120.97 2cqo n VAL 63 Ca -0.16 -0.15 0.00 0.00 -0.01 0.00 0.00 64.34 64.02 2cqo n VAL 63 Cb 0.58 -1.50 0.00 0.00 -0.91 0.00 0.00 33.84 32.01 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 5.33 1.83 3.70 2.92 0.00 -1.00 -5.01 105.19 112.95 2cqo n GLY 64 Ca 0.33 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.94 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 -1.63 6.99 -0.11 1.61 1.11 -0.39 -4.84 116.67 119.41 2cqo s ASP 65 Ca 0.00 1.20 -0.14 0.00 0.18 0.00 0.00 52.55 53.79 2cqo s ASP 65 Cb 0.00 -2.43 -0.05 0.00 1.07 0.00 0.00 42.92 41.51 2cqo s ASP 65 CO 0.00 -0.22 0.32 -0.75 1.18 0.00 0.00 175.17 175.71 2cqo s LYS 66 N 1.26 4.08 0.12 8.23 2.36 -1.26 -1.97 119.74 132.56 2cqo s LYS 66 Ca 0.38 0.18 -0.02 0.00 -2.55 0.00 0.00 55.97 53.96 2cqo s LYS 66 Cb -0.18 -3.35 -0.03 0.00 -1.05 0.00 0.00 37.83 33.22 2cqo s LYS 66 CO 0.17 0.41 0.08 0.14 1.55 0.00 0.00 175.35 177.70 2cqo s VAL 67 N -0.08 0.11 -0.12 4.02 -7.23 -0.16 -4.98 120.40 111.96 2cqo s VAL 67 Ca 0.19 -1.81 -0.18 0.00 -1.81 0.00 0.00 61.98 58.38 2cqo s VAL 67 Cb -0.14 -1.93 -0.04 0.00 0.56 0.00 0.00 36.38 34.83 2cqo s VAL 67 CO 0.07 -0.52 0.47 0.26 -0.31 0.00 0.00 175.10 175.06 2cqo s TRP 68 N -4.01 3.51 0.15 2.82 0.52 -1.26 -1.65 118.94 119.00 2cqo s TRP 68 Ca 0.20 0.87 0.07 0.00 0.02 0.00 0.00 56.10 57.26 2cqo s TRP 68 Cb 0.07 -2.54 -0.04 0.00 -1.15 0.00 0.00 33.47 29.81 2cqo s TRP 68 CO -0.00 0.17 -0.15 0.14 0.02 0.00 0.00 176.95 177.12 2cqo s VAL 69 N 0.64 1.53 -0.07 4.03 -7.23 -0.83 -4.62 120.40 113.85 2cqo s VAL 69 Ca 0.25 -1.87 0.01 0.00 -1.81 0.00 0.00 61.98 58.56 2cqo s VAL 69 Cb -0.15 -1.72 0.02 0.00 0.56 0.00 0.00 36.38 35.09 2cqo s VAL 69 CO 0.10 -0.43 -0.08 -0.75 -0.31 0.00 0.00 175.10 173.63 2cqo s LYS 70 N -2.91 1.36 0.15 4.82 2.20 0.10 -2.12 119.74 123.33 2cqo s LYS 70 Ca 0.13 -0.26 -0.31 0.00 -0.36 0.00 0.00 55.97 55.17 2cqo s LYS 70 Cb -0.04 -1.27 -0.10 0.00 -1.51 0.00 0.00 37.83 34.91 2cqo s LYS 70 CO 0.04 -0.09 1.62 -1.17 -0.36 0.00 0.00 175.35 175.40 2cqo s LEU 71 N 1.05 4.37 -0.05 5.43 2.96 -0.64 -0.60 118.68 131.21 2cqo s LEU 71 Ca -0.08 2.64 0.08 0.00 -0.22 0.00 0.00 54.13 56.55 2cqo s LEU 71 Cb -0.14 -3.59 -0.12 0.00 0.50 0.00 0.00 46.19 42.84 2cqo s LEU 71 CO -0.01 -0.87 0.12 2.30 -1.32 0.00 0.00 176.35 176.57 2cqo n ILE 72 N 4.16 0.29 -3.62 6.68 -5.35 -0.92 -1.10 119.36 119.49 2cqo n ILE 72 Ca 0.15 -0.28 -0.03 0.00 -0.27 0.00 0.00 62.75 62.31 2cqo n ILE 72 Cb 0.38 -0.24 -0.05 0.00 -1.74 0.00 0.00 39.64 37.99 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 -3.54 -0.60 -0.15 3.28 0.00 -1.21 -4.85 107.32 100.25 2cqo s GLY 73 Ca -0.04 2.50 0.02 0.00 0.00 0.00 0.00 44.72 47.20 2cqo s GLY 73 CO 0.36 2.82 -0.19 1.09 0.00 0.00 0.00 173.10 177.18 2cqo s ARG 74 N 2.30 2.77 -0.09 2.90 1.70 -1.26 -1.60 118.95 125.67 2cqo s ARG 74 Ca -0.07 -0.75 0.00 0.00 -0.47 0.00 0.00 55.73 54.44 2cqo s ARG 74 Cb -0.08 -2.32 0.02 0.00 -0.57 0.00 0.00 34.95 31.99 2cqo s ARG 74 CO -0.19 -0.10 -0.08 -1.21 -1.08 0.00 0.00 175.30 172.64 2cqo s GLU 75 N 1.06 1.42 -0.27 3.89 0.41 -0.48 -5.05 118.70 119.67 2cqo s GLU 75 Ca -0.02 -0.25 -0.03 0.00 -0.41 0.00 0.00 54.97 54.26 2cqo s GLU 75 Cb -0.14 -1.39 0.03 0.00 -1.78 0.00 0.00 34.13 30.84 2cqo s GLU 75 CO -0.06 -0.16 -0.01 -1.64 -0.49 0.00 0.00 175.26 172.89 2cqo s MET 76 N 1.34 2.81 0.05 1.61 -1.94 -1.26 -0.08 119.30 121.82 2cqo s MET 76 Ca -0.03 -1.01 0.08 0.00 -1.71 0.00 0.00 55.69 53.02 2cqo s MET 76 Cb -0.14 -3.12 -0.03 0.00 2.01 0.00 0.00 34.83 33.55 2cqo s MET 76 CO -0.04 -0.46 -0.19 0.15 -0.01 0.00 0.00 175.02 174.47 2cqo s LYS 77 N 1.35 1.99 0.26 2.03 3.01 -0.37 -4.99 119.74 123.01 2cqo s LYS 77 Ca -0.00 -1.03 0.17 0.00 -1.01 0.00 0.00 55.97 54.10 2cqo s LYS 77 Cb -0.17 -2.14 0.94 0.00 -1.01 0.00 0.00 37.83 35.44 2cqo s LYS 77 CO -0.02 0.53 1.52 -1.71 0.51 0.00 0.00 175.35 176.18 2cqo n ASN 78 N 1.49 0.45 -0.05 2.83 2.85 -1.26 -0.98 115.26 120.60 2cqo n ASN 78 Ca -0.16 0.71 -0.11 0.00 -0.11 0.00 0.00 54.58 54.91 2cqo n ASN 78 Cb 0.52 -0.76 -0.15 0.00 1.24 0.00 0.00 39.78 40.64 2cqo n ASN 78 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 2cqo n ASP 79 N -2.11 0.81 -3.60 1.20 9.92 -1.26 -5.03 116.55 116.48 2cqo n ASP 79 Ca -0.01 0.23 -0.04 0.00 -0.53 0.00 0.00 54.79 54.44 2cqo n ASP 79 Cb 0.04 0.15 -0.03 0.00 -0.64 0.00 0.00 41.12 40.64 2cqo n ASP 79 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2cqo s ARG 80 N -2.56 0.28 -0.23 -1.24 1.70 -0.15 -5.15 118.95 111.61 2cqo s ARG 80 Ca -0.10 -0.06 -0.08 0.00 -0.47 0.00 0.00 55.73 55.02 2cqo s ARG 80 Cb 0.07 0.13 -0.04 0.00 -0.57 0.00 0.00 34.95 34.54 2cqo s ARG 80 CO 0.81 -0.11 0.10 0.42 -1.08 0.00 0.00 175.30 175.43 2cqo s ILE 81 N -2.00 4.81 -0.17 4.99 1.01 -1.26 -1.24 121.20 127.34 2cqo s ILE 81 Ca 0.08 -0.01 -0.05 0.00 0.00 0.00 0.00 60.65 60.67 2cqo s ILE 81 Cb -0.01 -3.23 -0.03 0.00 0.01 0.00 0.00 42.46 39.21 2cqo s ILE 81 CO -0.05 0.37 -0.00 -0.75 0.00 0.00 0.00 174.94 174.51 2cqo s LYS 82 N 1.07 3.74 -0.10 2.79 2.20 0.88 -4.99 119.74 125.33 2cqo s LYS 82 Ca 0.05 -0.47 -0.01 0.00 -0.36 0.00 0.00 55.97 55.18 2cqo s LYS 82 Cb -0.14 -3.03 0.03 0.00 -1.51 0.00 0.00 37.83 33.18 2cqo s LYS 82 CO 0.04 0.20 -0.05 0.08 -0.36 0.00 0.00 175.35 175.26 2cqo s VAL 83 N 0.49 0.80 -0.14 4.02 1.01 -1.26 -1.38 120.40 123.93 2cqo s VAL 83 Ca -0.01 -0.14 -0.02 0.00 0.00 0.00 0.00 61.98 61.81 2cqo s VAL 83 Cb -0.14 -0.87 -0.02 0.00 0.00 0.00 0.00 36.38 35.36 2cqo s VAL 83 CO 0.02 0.33 -0.09 -0.44 0.00 0.00 0.00 175.10 174.92 2cqo s SER 84 N 1.80 4.29 0.27 3.32 0.01 -0.63 -1.42 113.70 121.34 2cqo s SER 84 Ca 0.05 -0.26 0.10 0.00 1.31 0.00 0.00 55.95 57.14 2cqo s SER 84 Cb -0.12 -1.68 -0.05 0.00 0.21 0.00 0.00 66.02 64.38 2cqo s SER 84 CO -0.07 0.15 -0.15 -0.76 0.41 0.00 0.00 173.24 172.83 2cqo s LEU 85 N 0.42 2.58 0.02 2.44 1.43 -0.22 -2.16 118.68 123.20 2cqo s LEU 85 Ca -0.08 -1.07 0.03 0.00 -1.03 0.00 0.00 54.13 51.98 2cqo s LEU 85 Cb -0.15 -0.89 -0.02 0.00 0.03 0.00 0.00 46.19 45.16 2cqo s LEU 85 CO 0.04 -0.11 -0.08 -0.55 0.23 0.00 0.00 176.35 175.88 2cqo s SER 86 N -3.46 0.97 -0.01 2.29 0.15 0.23 -4.01 113.70 109.87 2cqo s SER 86 Ca 0.28 -0.35 0.03 0.00 0.70 0.00 0.00 55.95 56.61 2cqo s SER 86 Cb -0.01 -0.04 -0.04 0.00 -1.71 0.00 0.00 66.02 64.21 2cqo s SER 86 CO 0.12 -0.04 0.04 0.23 1.20 0.00 0.00 173.24 174.79 2cqo n MET 87 N 2.16 1.56 0.12 5.44 2.81 -0.97 0.00 117.12 128.25 2cqo n MET 87 Ca -0.18 -0.02 0.11 0.00 -1.81 0.00 0.00 57.70 55.80 2cqo n MET 87 Cb 0.56 -1.07 0.47 0.00 -0.71 0.00 0.00 33.22 32.48 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 -1.81 0.15 -0.45 0.03 2.85 0.36 -1.54 118.16 117.76 2cqo n LYS 88 Ca -0.02 0.47 0.08 0.00 -1.05 0.00 0.00 58.31 57.78 2cqo n LYS 88 Cb 0.29 -1.84 0.26 0.00 -0.65 0.00 0.00 35.03 33.09 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 -2.13 2.02 -3.83 0.58 0.24 -1.26 -4.91 118.33 109.03 2cqo n VAL 89 Ca 0.01 -1.58 -0.13 0.00 -2.04 0.00 0.00 64.34 60.60 2cqo n VAL 89 Cb 0.16 -0.06 -0.14 0.00 -1.47 0.00 0.00 33.84 32.33 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 -2.34 -0.01 0.06 3.34 1.01 -0.59 -2.09 120.40 119.78 2cqo s VAL 90 Ca 0.40 0.04 -0.31 0.00 0.00 0.00 0.00 61.98 62.12 2cqo s VAL 90 Cb 0.30 -0.11 -0.06 0.00 0.00 0.00 0.00 36.38 36.51 2cqo s VAL 90 CO 0.13 0.02 1.27 0.21 0.00 0.00 0.00 175.10 176.72 2cqo s ASN 91 N 0.25 6.99 -0.67 3.32 3.84 -1.10 -4.90 114.94 122.66 2cqo s ASN 91 Ca -0.02 2.08 -0.04 0.00 0.21 0.00 0.00 52.86 55.10 2cqo s ASN 91 Cb -0.03 -2.58 0.11 0.00 -0.55 0.00 0.00 41.25 38.21 2cqo s ASN 91 CO -0.01 -0.55 2.59 0.00 -2.79 0.00 0.00 177.10 176.34 2cqo n GLN 92 N 4.22 2.95 0.00 0.43 3.00 -1.26 -2.70 117.38 124.02 2cqo n GLN 92 Ca 0.10 -2.76 0.00 0.00 -0.01 0.00 0.00 57.00 54.33 2cqo n GLN 92 Cb 0.45 -2.26 0.00 0.00 0.00 0.00 0.00 30.24 28.43 2cqo n GLN 92 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2cqo n GLY 93 N 0.85 0.20 0.00 1.08 0.00 -1.26 -4.95 105.19 101.10 2cqo n GLY 93 Ca 0.52 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.43 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 -1.11 0.00 -1.29 2.61 -2.24 -1.26 -5.04 114.28 105.95 2cqo n THR 94 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2cqo n THR 94 Cb 0.00 -0.45 0.00 0.00 -2.10 0.00 0.00 70.33 67.78 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 2.44 0.93 3.78 3.38 0.00 -1.10 -5.06 105.19 109.56 2cqo n GLY 95 Ca 0.00 -0.58 -0.37 0.00 0.00 0.00 0.00 46.02 45.06 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 -2.93 4.09 0.08 1.61 2.20 -1.26 -4.86 119.74 118.68 2cqo s LYS 96 Ca 0.00 0.30 -0.31 0.00 -0.36 0.00 0.00 55.97 55.60 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 0.43 1.89 -3.47 -0.36 0.00 0.00 175.35 173.84 2cqo n ASP 97 N 2.79 4.06 -0.06 1.43 2.03 -1.26 -2.72 116.55 122.83 2cqo n ASP 97 Ca -0.12 0.96 -0.13 0.00 0.52 0.00 0.00 54.79 56.01 2cqo n ASP 97 Cb 0.52 -1.53 -0.14 0.00 -0.72 0.00 0.00 41.12 39.25 2cqo n ASP 97 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2cqo n LEU 98 N 6.35 1.40 -3.88 -2.67 4.77 -0.89 -4.61 117.00 117.47 2cqo n LEU 98 Ca 0.19 0.15 -0.34 0.00 -0.03 0.00 0.00 56.01 55.98 2cqo n LEU 98 Cb 0.38 -0.22 -0.06 0.00 -2.33 0.00 0.00 43.42 41.19 2cqo n LEU 98 CO 0.67 0.62 0.37 -0.67 -1.33 0.00 0.00 177.39 177.05 2cqo n ASP 99 N -3.10 4.35 0.03 -1.43 2.03 -1.20 -4.86 116.55 112.36 2cqo n ASP 99 Ca -0.30 -3.27 0.08 0.00 0.52 0.00 0.00 54.79 51.81 2cqo n ASP 99 Cb 1.07 -0.96 0.34 0.00 -0.72 0.00 0.00 41.12 40.85 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 1.70 0.04 0.07 -0.67 -0.04 -1.26 -2.67 135.00 132.17 2cqo n PRO 100 Ca 0.25 0.29 -0.20 0.00 -0.04 0.00 0.00 63.50 63.80 2cqo n PRO 100 Cb 0.37 -1.57 -0.15 0.00 -0.04 0.00 0.00 33.50 32.11 2cqo n PRO 100 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 2cqo h ASN 101 N 0.00 0.51 -5.71 3.54 4.21 -1.99 -3.48 115.58 112.65 2cqo h ASN 101 Ca 0.00 -0.71 -0.35 0.00 1.21 0.00 0.00 56.30 56.46 2cqo h ASN 101 Cb 0.26 -0.17 0.16 0.00 -1.12 0.00 0.00 38.32 37.45 2cqo h ASN 101 CO 0.00 1.59 -0.76 0.59 -1.29 0.00 0.00 177.43 177.56 2cqo n ASN 102 N -3.52 -2.70 -0.06 5.81 3.02 -1.09 -4.92 115.26 111.79 2cqo n ASN 102 Ca -0.19 -0.62 -0.04 0.00 -0.03 0.00 0.00 54.58 53.70 2cqo n ASN 102 Cb 1.06 -5.04 -0.12 0.00 -0.61 0.00 0.00 39.78 35.07 2cqo n ASN 102 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 2cqo n VAL 103 N -4.28 0.80 -0.03 2.41 0.31 -1.26 -4.50 118.33 111.78 2cqo n VAL 103 Ca -0.24 -0.57 -0.13 0.00 -0.01 0.00 0.00 64.34 63.39 2cqo n VAL 103 Cb 0.65 -0.46 -0.09 0.00 -0.91 0.00 0.00 33.84 33.02 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 1.40 -0.48 2.52 5.03 -1.97 -3.04 117.51 120.98 2cqo h ILE 104 Ca -0.32 -1.27 0.14 0.00 -0.12 0.00 0.00 64.86 63.29 2cqo h ILE 104 Cb 1.67 2.17 -0.02 0.00 -3.03 0.00 0.00 36.82 37.61 2cqo h ILE 104 CO 0.02 0.34 0.52 0.16 -0.68 0.00 0.00 178.15 178.51 2cqo h ILE 105 N -0.39 0.34 -0.31 -0.67 -0.00 -1.99 -2.36 117.51 112.11 2cqo h ILE 105 Ca 0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 64.86 64.57 2cqo h ILE 105 Cb 0.58 0.58 -0.10 0.00 -0.00 0.00 0.00 36.82 37.88 2cqo h ILE 105 CO 0.01 0.00 -0.01 1.21 -0.00 0.00 0.00 178.15 179.36 2cqo n GLU 106 N -3.67 2.20 -5.04 0.16 0.00 -1.15 -4.85 120.64 108.29 2cqo n GLU 106 Ca 0.09 -1.44 -0.32 0.00 0.00 0.00 0.00 57.16 55.49 2cqo n GLU 106 Cb 0.71 -2.07 -0.17 0.00 0.00 0.00 0.00 31.44 29.91 2cqo n GLU 106 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.13 175.59 2cqo s SER 107 N 1.53 3.05 0.00 4.31 1.04 -0.89 -4.87 113.70 117.87 2cqo s SER 107 Ca 0.65 -0.56 0.00 0.00 0.48 0.00 0.00 55.95 56.51 2cqo s SER 107 Cb 0.33 -1.40 0.00 0.00 0.10 0.00 0.00 66.02 65.05 2cqo s SER 107 CO -0.07 0.13 0.00 0.61 0.98 0.00 0.00 173.24 174.90 2cqo n GLY 108 N 3.69 1.82 2.46 7.32 0.00 -1.26 -5.10 105.19 114.12 2cqo n GLY 108 Ca -0.19 -0.49 -0.21 0.00 0.00 0.00 0.00 46.02 45.12 2cqo n GLY 108 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2cqo n PRO 109 N 0.00 -2.52 0.00 1.61 -0.04 -1.26 -5.05 135.00 127.75 2cqo n PRO 109 Ca 0.00 -1.23 0.00 0.00 -0.04 0.00 0.00 63.50 62.23 2cqo n PRO 109 Cb 0.00 -1.15 0.00 0.00 -0.04 0.00 0.00 33.50 32.31 2cqo n PRO 109 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2cqo n SER 110 N -4.32 0.26 -4.50 3.54 7.64 -1.26 -5.03 113.62 109.96 2cqo n SER 110 Ca 0.11 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.57 2cqo n SER 110 Cb 0.41 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.52 2cqo n SER 110 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2cqo s SER 111 N -4.75 6.13 0.00 6.43 0.15 -1.26 -5.22 113.70 115.18 2cqo s SER 111 Ca 0.00 -0.61 0.00 0.00 0.70 0.00 0.00 55.95 56.04 2cqo s SER 111 Cb 0.00 -2.17 0.00 0.00 -1.71 0.00 0.00 66.02 62.14 2cqo s SER 111 CO 0.00 -0.40 0.06 0.61 1.20 0.00 0.00 173.24 174.71