#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cqo s SER -5 N 0.00 6.78 -0.25 1.61 1.04 -1.26 -5.02 113.70 116.61 2cqo s SER -5 Ca 0.00 0.85 -0.23 0.00 0.48 0.00 0.00 55.95 57.05 2cqo s SER -5 Cb 0.00 -2.46 -0.01 0.00 0.10 0.00 0.00 66.02 63.65 2cqo s SER -5 CO 0.00 -0.69 0.75 -0.44 0.98 0.00 0.00 173.24 173.84 2cqo s SER -4 N 1.58 6.73 0.00 7.02 0.01 -1.26 -4.99 113.70 122.79 2cqo s SER -4 Ca 0.37 0.91 0.00 0.00 1.31 0.00 0.00 55.95 58.54 2cqo s SER -4 Cb -0.14 -2.40 0.00 0.00 0.21 0.00 0.00 66.02 63.70 2cqo s SER -4 CO 0.12 -0.46 0.00 0.61 0.41 0.00 0.00 173.24 173.93 2cqo n GLY -3 N 3.91 1.74 3.80 3.44 0.00 -1.26 -5.15 105.19 111.67 2cqo n GLY -3 Ca 0.03 -0.57 -0.35 0.00 0.00 0.00 0.00 46.02 45.13 2cqo n GLY -3 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cqo s SER -2 N 0.00 6.90 -0.20 1.61 0.01 -1.26 -5.00 113.70 115.76 2cqo s SER -2 Ca 0.00 1.82 -0.07 0.00 1.31 0.00 0.00 55.95 59.01 2cqo s SER -2 Cb 0.00 -2.56 -0.09 0.00 0.21 0.00 0.00 66.02 63.57 2cqo s SER -2 CO 0.00 -0.39 -0.24 -0.24 0.41 0.00 0.00 173.24 172.79 2cqo n SER -1 N -0.32 1.69 -3.64 2.44 2.88 -1.26 -5.08 113.62 110.33 2cqo n SER -1 Ca 0.06 0.16 -0.08 0.00 -1.33 0.00 0.00 58.87 57.68 2cqo n SER -1 Cb 0.52 -0.52 -0.07 0.00 -0.75 0.00 0.00 64.21 63.40 2cqo n SER -1 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2cqo s GLY 0 N -5.48 -0.03 0.00 0.46 0.00 -1.26 -5.05 107.32 95.96 2cqo s GLY 0 Ca -0.27 2.84 0.00 0.00 0.00 0.00 0.00 44.72 47.29 2cqo s GLY 0 CO 0.37 1.80 0.00 1.15 0.00 0.00 0.00 173.10 176.42 2cqo n MET 1 N 1.94 2.29 -3.77 2.90 0.00 -1.26 -4.96 117.12 114.26 2cqo n MET 1 Ca -0.12 0.00 -0.37 0.00 0.00 0.00 0.00 57.70 57.22 2cqo n MET 1 Cb 0.56 -0.91 -0.12 0.00 0.00 0.00 0.00 33.22 32.76 2cqo n MET 1 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 175.97 177.18 2cqo s ASN 2 N -2.17 5.27 0.06 3.17 3.84 -1.26 -5.09 114.94 118.75 2cqo s ASN 2 Ca 0.00 -1.88 -0.09 0.00 0.21 0.00 0.00 52.86 51.10 2cqo s ASN 2 Cb 0.00 -1.84 -0.05 0.00 -0.55 0.00 0.00 41.25 38.81 2cqo s ASN 2 CO 0.00 -0.51 0.37 -0.94 -2.79 0.00 0.00 177.10 173.22 2cqo s SER 3 N 1.82 6.61 0.45 -4.21 1.04 -1.26 -4.91 113.70 113.23 2cqo s SER 3 Ca 0.06 0.73 0.00 0.00 0.48 0.00 0.00 55.95 57.22 2cqo s SER 3 Cb -0.23 -2.16 0.00 0.00 0.10 0.00 0.00 66.02 63.74 2cqo s SER 3 CO -0.03 0.19 0.00 0.61 0.98 0.00 0.00 173.24 174.99 2cqo n GLY 4 N 0.97 -4.95 3.00 7.32 0.00 -1.26 -5.02 105.19 105.25 2cqo n GLY 4 Ca -0.09 -0.52 -0.22 0.00 0.00 0.00 0.00 46.02 45.20 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 -2.68 1.16 0.50 1.61 3.52 -1.26 -5.15 118.95 116.65 2cqo s ARG 5 Ca 0.00 -0.33 -0.08 0.00 -0.13 0.00 0.00 55.73 55.19 2cqo s ARG 5 Cb 0.00 -1.05 0.12 0.00 -1.56 0.00 0.00 34.95 32.47 2cqo s ARG 5 CO 0.00 0.09 0.45 -0.35 -0.81 0.00 0.00 175.30 174.67 2cqo n PRO 6 N 3.46 -1.90 -3.36 5.12 -0.04 -1.26 -4.98 135.00 132.04 2cqo n PRO 6 Ca -0.20 -0.71 -0.45 0.00 -0.04 0.00 0.00 63.50 62.10 2cqo n PRO 6 Cb 0.53 -0.67 -0.05 0.00 -0.04 0.00 0.00 33.50 33.27 2cqo n PRO 6 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2cqo s GLU 7 N -4.01 3.04 0.41 0.54 8.01 -1.26 -5.02 118.70 120.40 2cqo s GLU 7 Ca 0.29 -1.90 0.07 0.00 0.01 0.00 0.00 54.97 53.44 2cqo s GLU 7 Cb -0.03 -4.26 -0.04 0.00 -4.31 0.00 0.00 34.13 25.49 2cqo s GLU 7 CO 0.22 -1.30 0.23 0.95 0.01 0.00 0.00 175.26 175.37 2cqo s THR 8 N 1.21 2.43 0.57 3.63 -4.23 -1.26 -5.00 115.64 112.99 2cqo s THR 8 Ca 0.07 -1.60 0.29 0.00 -1.18 0.00 0.00 61.69 59.26 2cqo s THR 8 Cb -0.25 -3.00 0.41 0.00 1.34 0.00 0.00 72.50 71.00 2cqo s THR 8 CO -0.00 -0.01 1.92 -0.03 -0.54 0.00 0.00 174.62 175.96 2cqo h MET 9 N 1.33 0.00 -2.41 3.99 4.05 -2.04 -2.45 114.93 117.40 2cqo h MET 9 Ca -0.42 0.00 -0.74 0.00 -0.28 0.00 0.00 59.70 58.26 2cqo h MET 9 Cb 1.26 0.00 -0.18 0.00 -0.80 0.00 0.00 31.60 31.88 2cqo h MET 9 CO 0.66 0.00 1.72 -1.91 0.23 0.00 0.00 176.91 177.62 2cqo n GLU 10 N -3.96 4.54 0.08 0.39 2.13 -1.26 -4.58 120.64 117.98 2cqo n GLU 10 Ca 0.11 -3.71 -0.23 0.00 0.66 0.00 0.00 57.16 53.98 2cqo n GLU 10 Cb 0.71 -2.51 -0.15 0.00 0.27 0.00 0.00 31.44 29.76 2cqo n GLU 10 CO 0.00 0.00 0.00 -2.95 -0.41 0.00 0.00 177.13 173.77 2cqo h ASN 11 N 4.23 0.64 -2.86 4.31 7.08 -1.78 -3.47 115.58 123.73 2cqo h ASN 11 Ca 0.62 -0.93 -0.56 0.00 -3.08 0.00 0.00 56.30 52.35 2cqo h ASN 11 Cb 0.34 -0.21 0.20 0.00 -2.08 0.00 0.00 38.32 36.57 2cqo h ASN 11 CO 1.32 1.75 -0.79 0.18 -2.08 0.00 0.00 177.43 177.81 2cqo n LEU 12 N -3.67 -1.16 -4.67 6.14 4.77 -1.26 -4.78 117.00 112.36 2cqo n LEU 12 Ca -0.23 0.49 -0.29 0.00 -0.03 0.00 0.00 56.01 55.96 2cqo n LEU 12 Cb 1.06 -1.08 0.18 0.00 -2.33 0.00 0.00 43.42 41.24 2cqo n LEU 12 CO 0.52 -3.94 0.64 -2.16 -1.33 0.00 0.00 177.39 171.12 2cqo s PRO 13 N -2.51 0.39 0.94 3.23 0.04 -1.26 -5.04 135.00 130.78 2cqo s PRO 13 Ca 0.58 0.51 -0.13 0.00 0.04 0.00 0.00 61.00 62.01 2cqo s PRO 13 Cb -0.32 -1.73 0.15 0.00 0.04 0.00 0.00 34.50 32.64 2cqo s PRO 13 CO 0.65 -2.76 1.14 0.00 0.04 0.00 0.00 177.00 176.07 2cqo s ALA 14 N -2.96 1.67 0.34 8.56 0.00 -1.26 -4.96 121.76 123.16 2cqo s ALA 14 Ca 0.65 -0.59 -0.28 0.00 0.00 0.00 0.00 51.96 51.74 2cqo s ALA 14 Cb -0.19 -3.01 -0.10 0.00 0.00 0.00 0.00 23.12 19.82 2cqo s ALA 14 CO 0.58 -2.42 1.30 -1.17 0.00 0.00 0.00 175.76 174.05 2cqo s LEU 15 N -6.11 4.39 -1.83 0.00 2.96 -1.26 -2.48 118.68 114.34 2cqo s LEU 15 Ca 0.65 2.68 0.00 0.00 -0.22 0.00 0.00 54.13 57.24 2cqo s LEU 15 Cb -0.14 -3.70 0.00 0.00 0.50 0.00 0.00 46.19 42.85 2cqo s LEU 15 CO 0.54 -0.59 0.00 -1.22 -1.32 0.00 0.00 176.35 173.76 2cqo n TYR 16 N 0.68 -0.74 -3.30 5.38 4.01 -0.66 -4.96 117.16 117.56 2cqo n TYR 16 Ca 0.01 0.00 -0.38 0.00 -0.16 0.00 0.00 57.90 57.37 2cqo n TYR 16 Cb 0.42 -3.78 -0.06 0.00 -0.31 0.00 0.00 39.34 35.62 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 -2.95 4.78 -0.17 -0.72 2.01 -1.04 -4.76 115.64 112.79 2cqo s THR 17 Ca 0.00 1.12 -0.07 0.00 0.31 0.00 0.00 61.69 63.05 2cqo s THR 17 Cb 0.00 -3.85 -0.04 0.00 0.01 0.00 0.00 72.50 68.62 2cqo s THR 17 CO 0.00 0.49 0.07 -0.63 -0.69 0.00 0.00 174.62 173.86 2cqo s ILE 18 N -1.19 4.85 0.25 1.82 1.01 -1.26 -2.02 121.20 124.66 2cqo s ILE 18 Ca 0.31 -0.02 -0.11 0.00 0.00 0.00 0.00 60.65 60.83 2cqo s ILE 18 Cb -0.18 -3.17 -0.01 0.00 0.01 0.00 0.00 42.46 39.11 2cqo s ILE 18 CO 0.19 0.48 0.45 0.72 0.00 0.00 0.00 174.94 176.78 2cqo s PHE 19 N 0.17 0.46 -0.21 3.97 -0.12 -0.91 -5.03 117.98 116.33 2cqo s PHE 19 Ca 0.05 -0.81 -0.05 0.00 -0.05 0.00 0.00 56.93 56.07 2cqo s PHE 19 Cb -0.12 0.12 -0.02 0.00 -0.63 0.00 0.00 43.02 42.37 2cqo s PHE 19 CO 0.00 -0.98 -0.00 -1.14 -0.05 0.00 0.00 175.22 173.05 2cqo s GLN 20 N -3.96 3.56 0.17 1.99 0.74 -1.26 -1.81 119.66 119.10 2cqo s GLN 20 Ca 0.24 -0.54 0.03 0.00 0.05 0.00 0.00 55.36 55.14 2cqo s GLN 20 Cb -0.00 -3.09 -0.05 0.00 1.10 0.00 0.00 33.01 30.97 2cqo s GLN 20 CO 0.10 -0.06 -0.02 0.20 -0.55 0.00 0.00 175.29 174.96 2cqo s GLY 21 N 1.19 1.23 0.05 2.59 0.00 -0.50 -4.33 107.32 107.56 2cqo s GLY 21 Ca 0.03 -1.59 0.03 0.00 0.00 0.00 0.00 44.72 43.19 2cqo s GLY 21 CO 0.01 -1.56 0.01 1.85 0.00 0.00 0.00 173.10 173.40 2cqo s GLU 22 N -3.87 2.67 0.01 2.90 2.12 -1.18 -0.86 118.70 120.49 2cqo s GLU 22 Ca 0.23 -0.73 -0.30 0.00 0.36 0.00 0.00 54.97 54.52 2cqo s GLU 22 Cb 0.05 -2.61 -0.05 0.00 0.26 0.00 0.00 34.13 31.79 2cqo s GLU 22 CO 0.04 0.58 1.24 0.08 -0.54 0.00 0.00 175.26 176.65 2cqo s VAL 23 N -1.22 4.04 -0.06 3.70 1.01 -0.25 -0.78 120.40 126.83 2cqo s VAL 23 Ca 0.23 1.43 0.11 0.00 0.00 0.00 0.00 61.98 63.75 2cqo s VAL 23 Cb -0.12 -3.92 -0.16 0.00 0.00 0.00 0.00 36.38 32.19 2cqo s VAL 23 CO 0.15 0.05 0.15 0.00 0.00 0.00 0.00 175.10 175.45 2cqo n ALA 24 N 4.67 2.07 -3.12 5.51 0.00 -0.19 -1.94 120.51 127.50 2cqo n ALA 24 Ca 0.10 -0.52 -0.13 0.00 0.00 0.00 0.00 53.44 52.90 2cqo n ALA 24 Cb 0.46 -0.19 -0.12 0.00 0.00 0.00 0.00 19.45 19.60 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 -2.54 0.29 -0.13 0.00 1.75 -1.22 -4.88 119.30 112.56 2cqo s MET 25 Ca -0.05 0.31 0.02 0.00 -1.25 0.00 0.00 55.69 54.72 2cqo s MET 25 Cb 0.05 0.14 0.01 0.00 2.84 0.00 0.00 34.83 37.88 2cqo s MET 25 CO 0.47 -0.04 -0.19 0.08 -0.65 0.00 0.00 175.02 174.70 2cqo s VAL 26 N 0.07 1.83 0.22 10.11 1.01 -1.26 -0.40 120.40 131.99 2cqo s VAL 26 Ca -0.01 -0.84 0.08 0.00 0.00 0.00 0.00 61.98 61.21 2cqo s VAL 26 Cb -0.02 -1.64 -0.05 0.00 0.00 0.00 0.00 36.38 34.67 2cqo s VAL 26 CO 0.00 0.51 -0.13 0.42 0.00 0.00 0.00 175.10 175.90 2cqo s THR 27 N 0.95 1.75 -2.00 3.92 -4.23 0.14 -5.00 115.64 111.17 2cqo s THR 27 Ca -0.05 -2.21 0.16 0.00 -1.18 0.00 0.00 61.69 58.41 2cqo s THR 27 Cb -0.15 -2.13 0.45 0.00 1.34 0.00 0.00 72.50 72.01 2cqo s THR 27 CO -0.03 -0.53 1.39 0.47 -0.54 0.00 0.00 174.62 175.38 2cqo n ASP 28 N -0.43 0.00 0.00 3.99 9.92 -1.26 -2.09 116.55 126.68 2cqo n ASP 28 Ca -0.07 -0.79 0.00 0.00 -0.53 0.00 0.00 54.79 53.39 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 -2.10 1.24 0.18 -1.26 -4.80 117.16 109.53 2cqo n TYR 29 Ca 0.12 -0.29 0.00 0.00 1.88 0.00 0.00 57.90 59.61 2cqo n TYR 29 Cb 0.05 -0.03 0.00 0.00 -0.38 0.00 0.00 39.34 38.99 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 -0.29 -0.21 3.17 -7.48 0.00 -0.89 -0.96 105.19 98.52 2cqo n GLY 30 Ca 0.00 -1.55 -0.13 0.00 0.00 0.00 0.00 46.02 44.35 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 -0.62 -0.05 4.61 0.00 -0.51 0.27 121.76 124.47 2cqo s ALA 31 Ca 0.00 0.40 -0.16 0.00 0.00 0.00 0.00 51.96 52.20 2cqo s ALA 31 Cb 0.00 -0.14 -0.05 0.00 0.00 0.00 0.00 23.12 22.93 2cqo s ALA 31 CO 0.00 -0.19 0.42 -0.06 0.00 0.00 0.00 175.76 175.93 2cqo s PHE 32 N -0.70 3.64 -0.01 0.00 0.40 0.47 -0.45 117.98 121.33 2cqo s PHE 32 Ca -0.08 0.93 0.08 0.00 -0.60 0.00 0.00 56.93 57.26 2cqo s PHE 32 Cb -0.04 -2.38 -0.02 0.00 0.51 0.00 0.00 43.02 41.09 2cqo s PHE 32 CO 0.02 0.46 -0.25 0.42 0.70 0.00 0.00 175.22 176.57 2cqo s ILE 33 N -0.41 1.95 -0.25 0.64 -1.09 -0.56 -1.02 121.20 120.47 2cqo s ILE 33 Ca 0.24 -1.11 -0.15 0.00 -2.23 0.00 0.00 60.65 57.40 2cqo s ILE 33 Cb -0.16 -1.63 -0.04 0.00 -1.58 0.00 0.00 42.46 39.05 2cqo s ILE 33 CO 0.12 0.50 0.36 -0.54 -1.23 0.00 0.00 174.94 174.15 2cqo s LYS 34 N -0.71 4.07 0.10 2.79 1.02 0.04 -2.72 119.74 124.33 2cqo s LYS 34 Ca 0.10 0.06 -0.24 0.00 0.02 0.00 0.00 55.97 55.90 2cqo s LYS 34 Cb -0.09 -3.61 -0.07 0.00 -0.52 0.00 0.00 37.83 33.54 2cqo s LYS 34 CO -0.00 -0.17 0.74 0.42 -0.92 0.00 0.00 175.35 175.42 2cqo s ILE 35 N 1.74 4.57 -0.32 2.17 1.01 -1.26 -3.12 121.20 125.99 2cqo s ILE 35 Ca 0.15 1.61 -0.29 0.00 0.00 0.00 0.00 60.65 62.12 2cqo s ILE 35 Cb -0.15 -4.10 -0.01 0.00 0.01 0.00 0.00 42.46 38.21 2cqo s ILE 35 CO 0.09 0.46 1.68 -2.16 0.00 0.00 0.00 174.94 175.01 2cqo s PRO 36 N -0.66 3.49 0.00 2.79 0.04 -1.26 -3.26 135.00 136.13 2cqo s PRO 36 Ca 0.36 1.38 0.00 0.00 0.04 0.00 0.00 61.00 62.78 2cqo s PRO 36 Cb -0.21 -4.13 0.00 0.00 0.04 0.00 0.00 34.50 30.20 2cqo s PRO 36 CO 0.24 -1.67 0.00 0.41 0.04 0.00 0.00 177.00 176.01 2cqo n GLY 37 N 5.20 0.53 1.82 0.56 0.00 -1.26 -5.06 105.19 106.97 2cqo n GLY 37 Ca 0.21 -0.37 -0.12 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.39 3.45 -4.33 0.00 0.63 -1.26 -5.03 116.66 109.73 2cqo n ARG 39 Ca 0.03 0.00 -0.24 0.00 -0.92 0.00 0.00 57.85 56.72 2cqo n ARG 39 Cb 0.34 -0.94 -0.08 0.00 0.45 0.00 0.00 32.46 32.23 2cqo n ARG 39 CO 0.00 0.00 0.00 0.15 -2.51 0.00 0.00 177.63 175.27 2cqo s LYS 40 N -1.88 2.11 0.13 -0.14 -0.14 -1.26 -5.14 119.74 113.42 2cqo s LYS 40 Ca 0.00 -1.44 0.06 0.00 -1.36 0.00 0.00 55.97 53.23 2cqo s LYS 40 Cb 0.00 -2.09 -0.04 0.00 -1.68 0.00 0.00 37.83 34.02 2cqo s LYS 40 CO 0.00 0.38 0.00 -0.65 -0.76 0.00 0.00 175.35 174.32 2cqo s GLN 41 N -3.41 2.48 0.19 1.68 1.11 -1.26 -4.60 119.66 115.86 2cqo s GLN 41 Ca 0.29 -0.95 0.05 0.00 0.01 0.00 0.00 55.36 54.76 2cqo s GLN 41 Cb -0.07 -2.46 -0.04 0.00 -1.01 0.00 0.00 33.01 29.43 2cqo s GLN 41 CO 0.18 0.50 0.19 0.20 0.01 0.00 0.00 175.29 176.37 2cqo s GLY 42 N -2.58 1.59 -0.08 3.09 0.00 -1.10 -4.71 107.32 103.53 2cqo s GLY 42 Ca 0.26 -1.24 0.01 0.00 0.00 0.00 0.00 44.72 43.75 2cqo s GLY 42 CO 0.18 -1.26 -0.08 -2.27 0.00 0.00 0.00 173.10 169.68 2cqo s LEU 43 N -3.38 3.11 -0.39 0.66 2.96 -0.93 -1.49 118.68 119.21 2cqo s LEU 43 Ca 0.32 -0.06 -0.02 0.00 -0.22 0.00 0.00 54.13 54.15 2cqo s LEU 43 Cb -0.10 -1.68 0.10 0.00 0.50 0.00 0.00 46.19 45.02 2cqo s LEU 43 CO 0.25 0.33 0.18 -0.69 -1.32 0.00 0.00 176.35 175.10 2cqo s VAL 44 N -0.64 3.17 0.70 1.68 1.01 0.40 -1.56 120.40 125.16 2cqo s VAL 44 Ca 0.10 -2.04 -0.17 0.00 0.00 0.00 0.00 61.98 59.87 2cqo s VAL 44 Cb -0.11 -3.17 -0.06 0.00 0.00 0.00 0.00 36.38 33.04 2cqo s VAL 44 CO 0.02 -0.64 0.42 1.57 0.00 0.00 0.00 175.10 176.46 2cqo n HIS 45 N 4.56 -1.14 0.11 5.22 -0.00 -1.26 -1.42 115.22 121.30 2cqo n HIS 45 Ca -0.02 0.35 0.05 0.00 0.46 0.00 0.00 57.72 58.56 2cqo n HIS 45 Cb 0.42 -1.88 0.50 0.00 -0.12 0.00 0.00 29.99 28.91 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 -0.28 0.30 -0.01 1.57 0.11 -1.39 0.15 114.38 114.82 2cqo h ARG 46 Ca -0.45 -0.02 -0.04 0.00 0.10 0.00 0.00 59.98 59.57 2cqo h ARG 46 Cb 1.36 -0.07 -0.01 0.00 1.11 0.00 0.00 29.97 32.37 2cqo h ARG 46 CO 0.42 0.22 -0.17 1.79 0.10 0.00 0.00 179.97 182.34 2cqo h THR 47 N 0.31 1.13 0.00 0.08 1.35 -1.88 -2.61 112.91 111.28 2cqo h THR 47 Ca 0.08 -0.61 -0.09 0.00 -0.55 0.00 0.00 66.41 65.24 2cqo h THR 47 Cb 0.01 1.31 -0.02 0.00 -1.73 0.00 0.00 68.15 67.72 2cqo h THR 47 CO -0.01 0.17 -1.76 1.41 -0.25 0.00 0.00 175.52 175.09 2cqo n HIS 48 N -4.33 0.38 -0.25 4.73 8.25 -0.51 -4.23 115.22 119.26 2cqo n HIS 48 Ca -0.02 0.12 0.24 0.00 -0.26 0.00 0.00 57.72 57.79 2cqo n HIS 48 Cb 0.24 -0.78 0.59 0.00 1.12 0.00 0.00 29.99 31.15 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 0.25 -2.38 -0.41 2.07 -0.35 0.11 114.93 114.22 2cqo h MET 49 Ca -0.12 -0.02 -0.06 0.00 -2.07 0.00 0.00 59.70 57.43 2cqo h MET 49 Cb 1.31 -0.06 -0.24 0.00 -1.87 0.00 0.00 31.60 30.74 2cqo h MET 49 CO 0.01 0.17 -0.17 0.45 1.07 0.00 0.00 176.91 178.44 2cqo s SER 50 N -5.53 -0.69 0.12 1.22 0.15 -1.24 -4.47 113.70 103.25 2cqo s SER 50 Ca -0.07 1.15 -0.32 0.00 0.70 0.00 0.00 55.95 57.41 2cqo s SER 50 Cb 0.23 1.03 -0.10 0.00 -1.71 0.00 0.00 66.02 65.47 2cqo s SER 50 CO 0.78 -0.21 1.58 0.77 1.20 0.00 0.00 173.24 177.36 2cqo h SER 51 N 7.08 -1.36 -2.48 5.45 4.64 -1.81 -3.43 113.55 121.64 2cqo h SER 51 Ca -0.34 0.16 -0.28 0.00 -0.47 0.00 0.00 61.79 60.86 2cqo h SER 51 Cb 1.20 0.52 0.17 0.00 -0.31 0.00 0.00 62.40 63.98 2cqo h SER 51 CO 0.24 -0.49 -0.14 0.00 -0.87 0.00 0.00 176.83 175.57 2cqo s ARG 53 N -4.59 4.18 -0.30 0.00 0.52 -1.26 -4.99 118.95 112.51 2cqo s ARG 53 Ca 0.52 2.47 -0.04 0.00 -0.52 0.00 0.00 55.73 58.15 2cqo s ARG 53 Cb -0.09 -3.08 0.03 0.00 0.52 0.00 0.00 34.95 32.33 2cqo s ARG 53 CO 0.43 -0.60 0.04 0.08 0.02 0.00 0.00 175.30 175.27 2cqo s VAL 54 N 0.50 3.44 -0.21 3.52 1.01 -1.26 -4.94 120.40 122.45 2cqo s VAL 54 Ca 0.66 -1.09 0.00 0.00 0.00 0.00 0.00 61.98 61.56 2cqo s VAL 54 Cb -0.46 -2.88 -0.13 0.00 0.00 0.00 0.00 36.38 32.91 2cqo s VAL 54 CO 0.40 -0.03 -0.20 0.47 0.00 0.00 0.00 175.10 175.73 2cqo n ASP 55 N 4.75 2.26 -3.61 3.32 8.00 -1.26 -4.86 116.55 125.15 2cqo n ASP 55 Ca -0.14 -0.07 -0.29 0.00 0.71 0.00 0.00 54.79 55.00 2cqo n ASP 55 Cb 0.45 -0.37 -0.12 0.00 -0.02 0.00 0.00 41.12 41.06 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 -2.42 1.06 0.43 -1.24 1.02 -1.26 -4.96 119.74 112.37 2cqo s LYS 56 Ca -0.29 -1.86 0.30 0.00 0.02 0.00 0.00 55.97 54.14 2cqo s LYS 56 Cb 0.08 -1.96 1.23 0.00 -0.52 0.00 0.00 37.83 36.66 2cqo s LYS 56 CO 0.48 -1.21 1.88 -1.00 -0.92 0.00 0.00 175.35 174.58 2cqo h PRO 57 N 6.64 0.00 0.00 -1.68 0.13 -1.87 -2.53 132.00 132.69 2cqo h PRO 57 Ca 0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.18 2cqo h PRO 57 Cb 0.93 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.06 2cqo h PRO 57 CO 0.41 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.05 2cqo n SER 58 N -2.74 0.00 -0.00 1.44 3.41 -1.26 -2.69 113.62 111.78 2cqo n SER 58 Ca 0.01 -0.14 0.05 0.00 -0.26 0.00 0.00 58.87 58.53 2cqo n SER 58 Cb 0.27 -0.25 -0.07 0.00 -0.26 0.00 0.00 64.21 63.89 2cqo n SER 58 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2cqo n GLU 59 N -1.25 1.49 -0.03 4.33 -0.58 -0.96 -4.57 120.64 119.08 2cqo n GLU 59 Ca 0.12 -0.06 -0.17 0.00 -0.42 0.00 0.00 57.16 56.63 2cqo n GLU 59 Cb 0.18 -1.16 -0.08 0.00 -0.57 0.00 0.00 31.44 29.81 2cqo n GLU 59 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 2cqo h ILE 60 N 0.00 1.32 -3.58 -3.67 2.04 -1.54 -3.47 117.51 108.60 2cqo h ILE 60 Ca 0.00 -1.90 -0.38 0.00 1.00 0.00 0.00 64.86 63.58 2cqo h ILE 60 Cb 0.40 2.08 -0.14 0.00 -0.74 0.00 0.00 36.82 38.41 2cqo h ILE 60 CO 0.00 0.59 -0.61 0.68 0.00 0.00 0.00 178.15 178.81 2cqo s VAL 61 N -3.72 0.67 -0.24 1.67 -7.23 -1.23 -5.15 120.40 105.16 2cqo s VAL 61 Ca -0.11 -2.00 -0.21 0.00 -1.81 0.00 0.00 61.98 57.85 2cqo s VAL 61 Cb 0.07 -2.66 0.07 0.00 0.56 0.00 0.00 36.38 34.42 2cqo s VAL 61 CO 0.87 0.00 0.64 -1.81 -0.31 0.00 0.00 175.10 174.49 2cqo s ASP 62 N -3.35 -0.71 -0.19 4.85 1.11 -1.26 -4.77 116.67 112.33 2cqo s ASP 62 Ca 0.37 1.32 -0.41 0.00 0.18 0.00 0.00 52.55 54.01 2cqo s ASP 62 Cb 0.08 1.30 -0.19 0.00 1.07 0.00 0.00 42.92 45.18 2cqo s ASP 62 CO 0.14 -0.23 1.22 0.52 1.18 0.00 0.00 175.17 178.00 2cqo n VAL 63 N 3.09 0.00 0.00 -1.27 0.31 -1.26 -1.31 118.33 117.89 2cqo n VAL 63 Ca -0.15 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 2cqo n VAL 63 Cb 0.56 -0.19 0.00 0.00 -0.91 0.00 0.00 33.84 33.30 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 2.39 2.36 3.77 2.92 0.00 -0.82 -5.00 105.19 110.81 2cqo n GLY 64 Ca 0.23 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.86 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 -1.66 7.13 -0.17 1.61 1.01 -0.43 -4.84 116.67 119.32 2cqo s ASP 65 Ca 0.00 1.35 -0.07 0.00 0.71 0.00 0.00 52.55 54.54 2cqo s ASP 65 Cb 0.00 -2.42 -0.04 0.00 1.01 0.00 0.00 42.92 41.47 2cqo s ASP 65 CO 0.00 0.11 0.07 -0.75 0.21 0.00 0.00 175.17 174.81 2cqo s LYS 66 N -0.41 3.85 0.21 8.23 2.20 -1.26 -1.09 119.74 131.46 2cqo s LYS 66 Ca 0.34 -0.32 -0.02 0.00 -0.36 0.00 0.00 55.97 55.61 2cqo s LYS 66 Cb -0.20 -3.19 -0.04 0.00 -1.51 0.00 0.00 37.83 32.89 2cqo s LYS 66 CO 0.21 0.37 0.16 0.14 -0.36 0.00 0.00 175.35 175.87 2cqo s VAL 67 N 0.10 0.00 -0.17 4.02 -7.23 -0.04 -4.98 120.40 112.11 2cqo s VAL 67 Ca 0.06 -1.95 -0.11 0.00 -1.81 0.00 0.00 61.98 58.17 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 0.00 175.10 175.25 2cqo s TRP 68 N -4.14 3.47 0.12 2.82 0.52 -1.26 -1.41 118.94 119.07 2cqo s TRP 68 Ca 0.38 0.48 0.04 0.00 0.02 0.00 0.00 56.10 57.01 2cqo s TRP 68 Cb 0.06 -2.18 -0.04 0.00 -1.15 0.00 0.00 33.47 30.16 2cqo s TRP 68 CO 0.12 0.37 -0.10 0.14 0.02 0.00 0.00 176.95 177.49 2cqo s VAL 69 N 0.09 1.06 -0.07 4.03 -7.23 -0.75 -4.69 120.40 112.85 2cqo s VAL 69 Ca 0.13 -1.89 0.02 0.00 -1.81 0.00 0.00 61.98 58.42 2cqo s VAL 69 Cb -0.12 -1.66 0.02 0.00 0.56 0.00 0.00 36.38 35.18 2cqo s VAL 69 CO 0.02 -0.68 -0.11 -0.75 -0.31 0.00 0.00 175.10 173.27 2cqo s LYS 70 N -3.38 1.58 0.15 4.82 2.20 -0.18 -2.13 119.74 122.80 2cqo s LYS 70 Ca 0.12 -0.35 -0.31 0.00 -0.36 0.00 0.00 55.97 55.06 2cqo s LYS 70 Cb 0.01 -1.38 -0.11 0.00 -1.51 0.00 0.00 37.83 34.84 2cqo s LYS 70 CO -0.00 -0.04 1.73 -1.17 -0.36 0.00 0.00 175.35 175.51 2cqo s LEU 71 N 0.88 4.38 -0.06 5.43 2.96 -0.86 -1.68 118.68 129.73 2cqo s LEU 71 Ca -0.11 2.74 0.10 0.00 -0.22 0.00 0.00 54.13 56.64 2cqo s LEU 71 Cb -0.15 -3.58 -0.14 0.00 0.50 0.00 0.00 46.19 42.81 2cqo s LEU 71 CO 0.01 -0.95 0.13 2.30 -1.32 0.00 0.00 176.35 176.52 2cqo n ILE 72 N 4.34 0.37 -3.47 6.68 -5.35 -0.94 -1.66 119.36 119.33 2cqo n ILE 72 Ca 0.16 -0.34 0.01 0.00 -0.27 0.00 0.00 62.75 62.31 2cqo n ILE 72 Cb 0.37 -0.28 -0.04 0.00 -1.74 0.00 0.00 39.64 37.96 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 -3.77 -0.47 -0.14 3.28 0.00 -1.21 -4.89 107.32 100.12 2cqo s GLY 73 Ca -0.04 2.67 0.02 0.00 0.00 0.00 0.00 44.72 47.37 2cqo s GLY 73 CO 0.42 3.21 -0.21 1.09 0.00 0.00 0.00 173.10 177.61 2cqo s ARG 74 N 2.69 2.93 -0.08 2.90 1.70 -1.26 -1.33 118.95 126.49 2cqo s ARG 74 Ca -0.02 -0.82 0.00 0.00 -0.47 0.00 0.00 55.73 54.42 2cqo s ARG 74 Cb -0.09 -2.37 0.02 0.00 -0.57 0.00 0.00 34.95 31.94 2cqo s ARG 74 CO -0.18 -0.02 -0.07 -1.21 -1.08 0.00 0.00 175.30 172.74 2cqo s GLU 75 N 0.83 1.30 -0.25 3.89 2.02 -0.07 -5.04 118.70 121.39 2cqo s GLU 75 Ca -0.07 -0.21 -0.00 0.00 0.02 0.00 0.00 54.97 54.71 2cqo s GLU 75 Cb -0.15 -1.32 0.04 0.00 0.10 0.00 0.00 34.13 32.79 2cqo s GLU 75 CO -0.02 -0.17 -0.08 1.41 0.02 0.00 0.00 175.26 176.42 2cqo s MET 76 N 1.36 2.67 0.06 1.61 -2.45 -1.26 -0.09 119.30 121.21 2cqo s MET 76 Ca -0.02 -1.08 0.09 0.00 -1.25 0.00 0.00 55.69 53.42 2cqo s MET 76 Cb -0.14 -2.94 -0.03 0.00 1.25 0.00 0.00 34.83 32.98 2cqo s MET 76 CO -0.03 -0.44 -0.22 0.21 1.05 0.00 0.00 175.02 175.58 2cqo s LYS 77 N 1.26 1.85 0.26 4.11 2.47 0.32 -4.99 119.74 125.01 2cqo s LYS 77 Ca -0.02 -1.10 0.17 0.00 -1.56 0.00 0.00 55.97 53.46 2cqo s LYS 77 Cb -0.17 -2.07 0.93 0.00 -1.46 0.00 0.00 37.83 35.06 2cqo s LYS 77 CO -0.05 0.51 1.52 0.09 0.16 0.00 0.00 175.35 177.57 2cqo n ASN 78 N 1.44 0.44 -0.08 1.43 3.02 -1.26 -0.97 115.26 119.29 2cqo n ASN 78 Ca -0.17 0.70 -0.08 0.00 -0.03 0.00 0.00 54.58 55.00 2cqo n ASN 78 Cb 0.52 -0.76 -0.15 0.00 -0.61 0.00 0.00 39.78 38.78 2cqo n ASN 78 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2cqo n ASP 79 N -2.10 0.18 -3.61 6.41 2.03 -1.26 -5.04 116.55 113.16 2cqo n ASP 79 Ca -0.01 0.08 -0.04 0.00 0.52 0.00 0.00 54.79 55.34 2cqo n ASP 79 Cb 0.04 0.85 -0.03 0.00 -0.72 0.00 0.00 41.12 41.26 2cqo n ASP 79 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2cqo s ARG 80 N -2.58 0.27 -0.11 -0.67 1.70 -0.14 -5.16 118.95 112.26 2cqo s ARG 80 Ca -0.09 -0.06 0.02 0.00 -0.47 0.00 0.00 55.73 55.14 2cqo s ARG 80 Cb 0.07 0.13 -0.01 0.00 -0.57 0.00 0.00 34.95 34.56 2cqo s ARG 80 CO 0.83 -0.11 -0.18 0.42 -1.08 0.00 0.00 175.30 175.18 2cqo s ILE 81 N -1.99 2.61 -0.12 4.99 1.01 -1.26 -0.52 121.20 125.92 2cqo s ILE 81 Ca 0.08 -0.83 0.02 0.00 0.00 0.00 0.00 60.65 59.93 2cqo s ILE 81 Cb -0.01 -2.05 -0.00 0.00 0.01 0.00 0.00 42.46 40.41 2cqo s ILE 81 CO -0.05 0.54 -0.19 -0.75 0.00 0.00 0.00 174.94 174.49 2cqo s LYS 82 N 0.26 3.17 -0.08 2.79 2.20 0.87 -4.99 119.74 123.96 2cqo s LYS 82 Ca -0.13 -0.80 0.02 0.00 -0.36 0.00 0.00 55.97 54.70 2cqo s LYS 82 Cb -0.16 -2.45 0.01 0.00 -1.51 0.00 0.00 37.83 33.72 2cqo s LYS 82 CO 0.07 0.15 -0.13 0.08 -0.36 0.00 0.00 175.35 175.16 2cqo s VAL 83 N 0.44 1.27 -0.13 4.02 1.01 -1.26 -0.89 120.40 124.85 2cqo s VAL 83 Ca -0.14 -0.53 0.01 0.00 0.00 0.00 0.00 61.98 61.32 2cqo s VAL 83 Cb -0.17 -1.16 -0.01 0.00 0.00 0.00 0.00 36.38 35.04 2cqo s VAL 83 CO 0.06 0.39 -0.16 -0.44 0.00 0.00 0.00 175.10 174.95 2cqo s SER 84 N 0.84 3.67 0.16 3.32 0.01 -0.44 -2.19 113.70 119.06 2cqo s SER 84 Ca -0.11 -0.44 0.11 0.00 1.31 0.00 0.00 55.95 56.82 2cqo s SER 84 Cb -0.15 -1.55 -0.04 0.00 0.21 0.00 0.00 66.02 64.49 2cqo s SER 84 CO 0.01 0.13 -0.24 -0.76 0.41 0.00 0.00 173.24 172.79 2cqo s LEU 85 N 0.54 2.38 0.09 2.44 1.43 -0.60 -2.21 118.68 122.75 2cqo s LEU 85 Ca -0.10 -0.81 0.07 0.00 -1.03 0.00 0.00 54.13 52.26 2cqo s LEU 85 Cb -0.16 -1.14 -0.03 0.00 0.03 0.00 0.00 46.19 44.89 2cqo s LEU 85 CO 0.04 0.13 -0.19 -0.44 0.23 0.00 0.00 176.35 176.11 2cqo s SER 86 N -2.38 2.31 0.00 2.29 0.01 -0.67 -4.21 113.70 111.05 2cqo s SER 86 Ca 0.17 -0.66 0.00 0.00 1.31 0.00 0.00 55.95 56.77 2cqo s SER 86 Cb -0.09 -0.12 0.00 0.00 0.21 0.00 0.00 66.02 66.02 2cqo s SER 86 CO 0.08 0.03 0.00 0.23 0.41 0.00 0.00 173.24 173.99 2cqo n MET 87 N 1.19 3.12 0.02 12.44 2.81 -1.19 -1.01 117.12 134.50 2cqo n MET 87 Ca -0.20 0.00 0.04 0.00 -1.81 0.00 0.00 57.70 55.73 2cqo n MET 87 Cb 0.54 -0.91 0.18 0.00 -0.71 0.00 0.00 33.22 32.32 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 -1.69 0.02 -0.24 0.03 2.85 0.39 -0.88 118.16 118.64 2cqo n LYS 88 Ca 0.00 0.42 0.06 0.00 -1.05 0.00 0.00 58.31 57.75 2cqo n LYS 88 Cb 0.38 -1.56 0.17 0.00 -0.65 0.00 0.00 35.03 33.37 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 -1.61 1.40 -3.91 0.58 0.24 -1.26 -4.69 118.33 109.07 2cqo n VAL 89 Ca 0.01 -1.29 -0.16 0.00 -2.04 0.00 0.00 64.34 60.86 2cqo n VAL 89 Cb 0.07 0.26 -0.16 0.00 -1.47 0.00 0.00 33.84 32.55 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 -1.58 0.14 1.09 3.34 1.01 -0.06 -1.88 120.40 122.46 2cqo s VAL 90 Ca 0.27 0.08 -0.12 0.00 0.00 0.00 0.00 61.98 62.21 2cqo s VAL 90 Cb 0.18 -0.22 0.24 0.00 0.00 0.00 0.00 36.38 36.58 2cqo s VAL 90 CO 0.12 0.12 1.06 0.21 0.00 0.00 0.00 175.10 176.61 2cqo s ASN 91 N 0.89 1.63 -0.00 3.32 3.84 -1.11 -4.89 114.94 118.62 2cqo s ASN 91 Ca -0.09 1.58 0.02 0.00 0.21 0.00 0.00 52.86 54.58 2cqo s ASN 91 Cb -0.12 -2.29 -0.02 0.00 -0.55 0.00 0.00 41.25 38.27 2cqo s ASN 91 CO -0.02 -3.80 0.07 0.00 -2.79 0.00 0.00 177.10 170.55 2cqo n GLN 92 N -4.66 5.23 -0.02 0.43 1.13 -1.26 -3.82 117.38 114.41 2cqo n GLN 92 Ca 0.05 -0.00 -0.14 0.00 -1.94 0.00 0.00 57.00 54.97 2cqo n GLN 92 Cb 0.54 -0.67 -0.14 0.00 0.11 0.00 0.00 30.24 30.08 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 1.30 -0.80 0.00 1.08 0.00 -1.26 -4.70 105.19 100.81 2cqo n GLY 93 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.87 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 -3.20 0.00 -0.42 2.61 -2.24 -1.26 -5.04 114.28 104.73 2cqo n THR 94 Ca -0.25 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 2cqo n THR 94 Cb 1.06 -0.61 0.00 0.00 -2.10 0.00 0.00 70.33 68.67 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 2.36 0.76 3.78 3.38 0.00 -1.25 -5.04 105.19 109.20 2cqo n GLY 95 Ca 0.00 -0.25 -0.36 0.00 0.00 0.00 0.00 46.02 45.41 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 -0.72 4.21 0.24 1.61 2.20 -1.26 -4.63 119.74 121.39 2cqo s LYS 96 Ca 0.00 1.47 -0.31 0.00 -0.36 0.00 0.00 55.97 56.76 2cqo s LYS 96 Cb 0.00 -2.55 -0.12 0.00 -1.51 0.00 0.00 37.83 33.65 2cqo s LYS 96 CO 0.00 -0.09 1.68 -3.47 -0.36 0.00 0.00 175.35 173.11 2cqo n ASP 97 N -0.04 3.97 -0.01 1.43 -0.08 -1.26 -2.76 116.55 117.81 2cqo n ASP 97 Ca 0.05 1.09 0.07 0.00 -1.51 0.00 0.00 54.79 54.49 2cqo n ASP 97 Cb 0.50 -1.59 -0.10 0.00 2.34 0.00 0.00 41.12 42.27 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 3.31 0.13 -3.49 -2.67 4.77 -0.79 -4.75 117.00 113.52 2cqo n LEU 98 Ca 0.13 -0.10 -0.27 0.00 -0.03 0.00 0.00 56.01 55.74 2cqo n LEU 98 Cb 0.36 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.35 2cqo n LEU 98 CO 0.64 0.03 -0.15 -0.67 -1.33 0.00 0.00 177.39 175.91 2cqo n ASP 99 N -1.84 1.49 0.00 -1.43 2.03 -1.23 -4.92 116.55 110.65 2cqo n ASP 99 Ca -0.01 -2.89 0.08 0.00 0.52 0.00 0.00 54.79 52.48 2cqo n ASP 99 Cb 0.33 -0.65 0.43 0.00 -0.72 0.00 0.00 41.12 40.51 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 1.87 0.39 0.01 -0.67 -0.04 -1.26 -2.71 135.00 132.59 2cqo n PRO 100 Ca 0.25 0.05 -0.22 0.00 -0.04 0.00 0.00 63.50 63.55 2cqo n PRO 100 Cb 0.44 -1.50 -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 -0.91 -0.04 0.00 0.00 175.50 174.55 2cqo h ASN 101 N 0.00 0.42 -4.88 3.54 2.35 -2.01 -3.49 115.58 111.52 2cqo h ASN 101 Ca 0.00 -0.91 -0.30 0.00 -0.55 0.00 0.00 56.30 54.54 2cqo h ASN 101 Cb 0.05 -0.14 0.12 0.00 0.05 0.00 0.00 38.32 38.40 2cqo h ASN 101 CO 0.00 1.80 -0.57 0.59 -1.65 0.00 0.00 177.43 177.60 2cqo n ASN 102 N -3.62 -4.33 -0.11 5.81 3.02 -1.10 -4.94 115.26 110.00 2cqo n ASN 102 Ca -0.30 -0.45 -0.14 0.00 -0.03 0.00 0.00 54.58 53.66 2cqo n ASN 102 Cb 1.01 -4.14 -0.12 0.00 -0.61 0.00 0.00 39.78 35.93 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 -4.16 1.29 -0.27 2.41 0.31 -1.26 -4.49 118.33 112.15 2cqo n VAL 103 Ca -0.07 -0.58 -0.05 0.00 -0.01 0.00 0.00 64.34 63.62 2cqo n VAL 103 Cb 0.58 -1.08 0.06 0.00 -0.91 0.00 0.00 33.84 32.49 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 1.23 -0.00 2.52 5.03 -1.97 -1.57 117.51 122.75 2cqo h ILE 104 Ca -0.50 -0.59 0.00 0.00 -0.12 0.00 0.00 64.86 63.65 2cqo h ILE 104 Cb 1.88 0.26 -0.00 0.00 -3.03 0.00 0.00 36.82 35.93 2cqo h ILE 104 CO -0.05 0.26 0.13 0.16 -0.68 0.00 0.00 178.15 177.97 2cqo h ILE 105 N 1.03 0.01 -3.56 -0.67 -0.00 -1.99 -3.39 117.51 108.93 2cqo h ILE 105 Ca 0.26 0.00 -0.61 0.00 -0.00 0.00 0.00 64.86 64.51 2cqo h ILE 105 Cb 0.05 0.87 -0.12 0.00 -0.00 0.00 0.00 36.82 37.62 2cqo h ILE 105 CO -0.04 0.00 -0.09 -0.70 -0.00 0.00 0.00 178.15 177.32 2cqo s GLU 106 N -4.14 4.11 -0.80 0.16 2.12 -0.59 -4.97 118.70 114.58 2cqo s GLU 106 Ca -0.04 0.27 -0.22 0.00 0.36 0.00 0.00 54.97 55.33 2cqo s GLU 106 Cb 0.11 -3.61 -0.18 0.00 0.26 0.00 0.00 34.13 30.71 2cqo s GLU 106 CO 0.36 -0.24 2.38 0.43 -0.54 0.00 0.00 175.26 177.65 2cqo n SER 107 N 5.14 1.05 -4.56 -1.70 7.64 -1.26 -4.88 113.62 115.04 2cqo n SER 107 Ca -0.06 -1.02 -0.24 0.00 1.01 0.00 0.00 58.87 58.56 2cqo n SER 107 Cb 0.50 -1.35 -0.09 0.00 -1.01 0.00 0.00 64.21 62.26 2cqo n SER 107 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2cqo s GLY 108 N 8.53 1.92 0.40 0.23 0.00 -1.26 -5.12 107.32 112.02 2cqo s GLY 108 Ca 1.05 -1.87 -0.25 0.00 0.00 0.00 0.00 44.72 43.65 2cqo s GLY 108 CO 0.25 -1.90 1.19 2.56 0.00 0.00 0.00 173.10 175.20 2cqo s PRO 109 N -3.61 4.06 0.19 2.90 0.04 -1.26 -5.04 135.00 132.27 2cqo s PRO 109 Ca 0.32 1.90 -0.23 0.00 0.04 0.00 0.00 61.00 63.02 2cqo s PRO 109 Cb -0.03 -2.71 0.05 0.00 0.04 0.00 0.00 34.50 31.85 2cqo s PRO 109 CO 0.17 -0.33 0.77 0.45 0.04 0.00 0.00 177.00 178.10 2cqo s SER 110 N -1.05 -0.32 0.41 6.66 0.15 -1.26 -5.17 113.70 113.11 2cqo s SER 110 Ca 0.57 -0.35 -0.04 0.00 0.70 0.00 0.00 55.95 56.83 2cqo s SER 110 Cb -0.32 0.60 -0.04 0.00 -1.71 0.00 0.00 66.02 64.55 2cqo s SER 110 CO 0.40 -1.07 0.69 -0.55 1.20 0.00 0.00 173.24 173.91 2cqo s SER 111 N -2.84 6.32 0.00 5.45 0.15 -1.26 -5.34 113.70 116.18 2cqo s SER 111 Ca 0.08 0.78 0.00 0.00 0.70 0.00 0.00 55.95 57.51 2cqo s SER 111 Cb -0.03 -2.18 0.00 0.00 -1.71 0.00 0.00 66.02 62.10 2cqo s SER 111 CO -0.01 -0.43 0.00 0.61 1.20 0.00 0.00 173.24 174.61