#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yn5 s GLN 46 N 0.00 2.61 -0.81 0.03 2.00 0.11 -4.85 119.66 118.74 1yn5 s GLN 46 Ca 0.00 -1.44 -0.22 0.00 -2.00 0.00 0.00 55.36 51.70 1yn5 s GLN 46 Cb 0.00 -3.77 0.08 0.00 0.80 0.00 0.00 33.01 30.12 1yn5 s GLN 46 CO 0.00 -0.94 1.12 1.21 -0.50 0.00 0.00 175.29 176.18 1yn5 s ASN 47 N 2.08 6.37 -0.34 6.67 3.84 -1.26 -1.31 114.94 131.00 1yn5 s ASN 47 Ca 0.03 -1.35 -0.10 0.00 0.21 0.00 0.00 52.86 51.64 1yn5 s ASN 47 Cb -0.23 -2.45 0.00 0.00 -0.55 0.00 0.00 41.25 38.03 1yn5 s ASN 47 CO 0.02 -1.37 0.18 -0.69 -2.79 0.00 0.00 177.10 172.45 1yn5 s VAL 48 N 3.92 4.66 0.49 -5.21 1.01 -1.05 -4.97 120.40 119.25 1yn5 s VAL 48 Ca 0.31 -0.55 -0.21 0.00 0.00 0.00 0.00 61.98 61.52 1yn5 s VAL 48 Cb -0.09 -3.45 -0.07 0.00 0.00 0.00 0.00 36.38 32.76 1yn5 s VAL 48 CO 0.01 -0.04 1.11 -2.16 0.00 0.00 0.00 175.10 174.02 1yn5 s PRO 49 N 1.60 3.67 0.06 2.72 0.04 -1.26 -1.70 135.00 140.14 1yn5 s PRO 49 Ca 0.04 1.60 -0.01 0.00 0.04 0.00 0.00 61.00 62.67 1yn5 s PRO 49 Cb -0.18 -2.22 -0.04 0.00 0.04 0.00 0.00 34.50 32.11 1yn5 s PRO 49 CO 0.07 -0.58 -0.01 1.52 0.04 0.00 0.00 177.00 178.03 1yn5 s TYR 50 N -1.73 0.56 0.03 0.56 -0.85 -1.14 -1.66 117.35 113.12 1yn5 s TYR 50 Ca 0.67 -1.08 0.02 0.00 -0.52 0.00 0.00 57.07 56.15 1yn5 s TYR 50 Cb -0.24 -0.39 -0.02 0.00 0.38 0.00 0.00 41.96 41.69 1yn5 s TYR 50 CO 0.28 -0.41 -0.06 0.95 -1.52 0.00 0.00 175.55 174.79 1yn5 s THR 51 N -3.94 0.41 -0.06 -3.49 -4.23 -0.42 -4.40 115.64 99.52 1yn5 s THR 51 Ca 0.10 -0.84 0.03 0.00 -1.18 0.00 0.00 61.69 59.80 1yn5 s THR 51 Cb 0.08 -0.47 0.01 0.00 1.34 0.00 0.00 72.50 73.45 1yn5 s THR 51 CO -0.08 -0.29 -0.14 -0.63 -0.54 0.00 0.00 174.62 172.93 1yn5 s ILE 52 N -1.09 1.26 -0.06 2.99 1.01 -1.26 -1.11 121.20 122.95 1yn5 s ILE 52 Ca -0.08 -0.59 0.01 0.00 0.00 0.00 0.00 60.65 59.99 1yn5 s ILE 52 Cb -0.08 -1.12 0.02 0.00 0.01 0.00 0.00 42.46 41.29 1yn5 s ILE 52 CO 0.00 0.38 -0.06 0.00 0.00 0.00 0.00 174.94 175.26 1yn5 s ALA 53 N 0.38 0.85 -0.27 9.38 0.00 -0.95 -2.34 121.76 128.80 1yn5 s ALA 53 Ca -0.10 -0.18 -0.01 0.00 0.00 0.00 0.00 51.96 51.68 1yn5 s ALA 53 Cb -0.14 -0.53 0.08 0.00 0.00 0.00 0.00 23.12 22.53 1yn5 s ALA 53 CO 0.03 -0.08 0.06 0.14 0.00 0.00 0.00 175.76 175.91 1yn5 s VAL 54 N 1.07 0.99 -1.29 0.00 -7.23 -0.97 -1.37 120.40 111.60 1yn5 s VAL 54 Ca -0.08 -1.24 -0.08 0.00 -1.81 0.00 0.00 61.98 58.77 1yn5 s VAL 54 Cb -0.14 -1.61 0.01 0.00 0.56 0.00 0.00 36.38 35.20 1yn5 s VAL 54 CO -0.01 -0.47 1.12 0.47 -0.31 0.00 0.00 175.10 175.90 1yn5 n ASP 55 N 4.83 -5.73 0.00 4.85 8.00 -0.92 -2.13 116.55 125.45 1yn5 n ASP 55 Ca -0.05 -0.53 0.00 0.00 0.71 0.00 0.00 54.79 54.92 1yn5 n ASP 55 Cb 0.43 -4.88 0.00 0.00 -0.02 0.00 0.00 41.12 36.66 1yn5 n ASP 55 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1yn5 n GLY 56 N -1.86 1.26 3.53 0.44 0.00 -1.26 -4.99 105.19 102.31 1yn5 n GLY 56 Ca -0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 1yn5 n GLY 56 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1yn5 s ILE 57 N -3.76 4.35 0.53 -0.61 -5.25 -0.90 -5.00 121.20 110.55 1yn5 s ILE 57 Ca 0.00 0.32 -0.07 0.00 -0.99 0.00 0.00 60.65 59.91 1yn5 s ILE 57 Cb 0.00 -4.56 -0.04 0.00 2.95 0.00 0.00 42.46 40.82 1yn5 s ILE 57 CO 0.00 -1.14 0.87 -0.04 -1.79 0.00 0.00 174.94 172.84 1yn5 s MET 58 N 4.04 3.53 0.29 0.37 -1.94 -1.25 -2.29 119.30 122.06 1yn5 s MET 58 Ca 0.31 0.36 -0.29 0.00 -1.71 0.00 0.00 55.69 54.36 1yn5 s MET 58 Cb -0.12 -2.28 -0.10 0.00 2.01 0.00 0.00 34.83 34.34 1yn5 s MET 58 CO 0.20 -0.34 1.27 0.00 -0.01 0.00 0.00 175.02 176.14 1yn5 s ALA 59 N -2.89 3.49 0.08 3.03 0.00 -0.99 -4.94 121.76 119.54 1yn5 s ALA 59 Ca 0.50 1.16 -0.15 0.00 0.00 0.00 0.00 51.96 53.47 1yn5 s ALA 59 Cb -0.11 -3.45 -0.16 0.00 0.00 0.00 0.00 23.12 19.40 1yn5 s ALA 59 CO 0.48 -0.53 1.28 0.35 0.00 0.00 0.00 175.76 177.33 1yn5 h PHE 60 N 3.96 0.91 -3.87 0.00 3.57 -1.96 -3.44 116.94 116.12 1yn5 h PHE 60 Ca -0.47 -0.40 -0.69 0.00 3.53 0.00 0.00 57.97 59.94 1yn5 h PHE 60 Cb 1.22 -0.14 -0.21 0.00 2.79 0.00 0.00 35.95 39.60 1yn5 h PHE 60 CO 0.58 1.21 -0.74 -0.80 -2.23 0.00 0.00 178.31 176.33 1yn5 s ASN 61 N -6.91 4.29 -0.17 0.41 0.01 -1.26 -5.09 114.94 106.23 1yn5 s ASN 61 Ca -0.11 -0.13 -0.29 0.00 -0.71 0.00 0.00 52.86 51.62 1yn5 s ASN 61 Cb 0.07 -0.98 -0.01 0.00 0.41 0.00 0.00 41.25 40.74 1yn5 s ASN 61 CO 0.87 0.35 1.28 -1.58 -1.51 0.00 0.00 177.10 176.51 1yn5 s GLN 62 N -0.80 4.21 0.39 -0.60 2.00 -1.26 -5.02 119.66 118.58 1yn5 s GLN 62 Ca 0.12 1.66 0.08 0.00 -2.00 0.00 0.00 55.36 55.22 1yn5 s GLN 62 Cb -0.11 -3.78 -0.05 0.00 0.80 0.00 0.00 33.01 29.88 1yn5 s GLN 62 CO 0.01 -0.74 0.18 -1.12 -0.50 0.00 0.00 175.29 173.12 1yn5 s SER 63 N 2.08 4.53 0.15 6.67 0.01 -1.26 -5.08 113.70 120.79 1yn5 s SER 63 Ca 0.55 -0.96 0.03 0.00 1.31 0.00 0.00 55.95 56.88 1yn5 s SER 63 Cb -0.22 -0.55 -0.04 0.00 0.21 0.00 0.00 66.02 65.41 1yn5 s SER 63 CO 0.16 -0.47 -0.06 -0.31 0.41 0.00 0.00 173.24 172.96 1yn5 s TYR 64 N -2.54 1.18 -0.06 2.43 1.51 -1.26 -2.87 117.35 115.73 1yn5 s TYR 64 Ca 0.40 -0.86 0.01 0.00 -1.01 0.00 0.00 57.07 55.61 1yn5 s TYR 64 Cb 0.01 -0.64 0.02 0.00 -0.11 0.00 0.00 41.96 41.24 1yn5 s TYR 64 CO 0.23 -0.05 -0.06 -0.48 -1.11 0.00 0.00 175.55 174.08 1yn5 s LEU 65 N -3.15 1.30 -0.16 -1.29 0.05 -0.69 -4.96 118.68 109.78 1yn5 s LEU 65 Ca 0.18 -0.19 -0.13 0.00 0.05 0.00 0.00 54.13 54.04 1yn5 s LEU 65 Cb 0.04 -0.61 -0.05 0.00 -2.05 0.00 0.00 46.19 43.53 1yn5 s LEU 65 CO 0.00 -0.06 0.25 0.20 -0.55 0.00 0.00 176.35 176.19 1yn5 s ASN 66 N 1.10 6.39 0.19 1.48 0.02 -1.26 -2.52 114.94 120.34 1yn5 s ASN 66 Ca -0.08 0.45 0.11 0.00 -1.02 0.00 0.00 52.86 52.32 1yn5 s ASN 66 Cb -0.14 -2.16 -0.04 0.00 0.02 0.00 0.00 41.25 38.93 1yn5 s ASN 66 CO -0.01 0.14 -0.19 -0.76 0.02 0.00 0.00 177.10 176.30 1yn5 s LEU 67 N 0.32 2.63 0.29 0.60 1.43 -0.43 -4.93 118.68 118.60 1yn5 s LEU 67 Ca 0.15 -0.77 -0.29 0.00 -1.03 0.00 0.00 54.13 52.19 1yn5 s LEU 67 Cb -0.13 -1.34 -0.10 0.00 0.03 0.00 0.00 46.19 44.66 1yn5 s LEU 67 CO 0.03 0.11 1.25 -2.16 0.23 0.00 0.00 176.35 175.81 1yn5 s PRO 68 N -2.74 4.44 0.62 1.29 0.04 -1.26 0.05 135.00 137.44 1yn5 s PRO 68 Ca 0.22 2.07 -0.10 0.00 0.04 0.00 0.00 61.00 63.23 1yn5 s PRO 68 Cb -0.08 -3.13 -0.03 0.00 0.04 0.00 0.00 34.50 31.30 1yn5 s PRO 68 CO 0.12 -0.09 1.01 -1.59 0.04 0.00 0.00 177.00 176.49 1yn5 s LYS 69 N -1.40 3.51 -1.25 4.56 0.00 -1.26 -4.09 119.74 119.81 1yn5 s LYS 69 Ca 0.49 0.66 0.00 0.00 0.00 0.00 0.00 55.97 57.12 1yn5 s LYS 69 Cb -0.37 -2.10 0.00 0.00 0.00 0.00 0.00 37.83 35.36 1yn5 s LYS 69 CO 0.47 -0.59 0.00 -0.25 0.00 0.00 0.00 175.35 174.98 1yn5 n ASP 70 N -2.73 -4.26 -4.43 0.03 8.00 -1.26 -4.97 116.55 106.93 1yn5 n ASP 70 Ca 0.06 0.17 -0.25 0.00 0.71 0.00 0.00 54.79 55.48 1yn5 n ASP 70 Cb 0.54 -3.64 -0.11 0.00 -0.02 0.00 0.00 41.12 37.90 1yn5 n ASP 70 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1yn5 s SER 71 N -2.05 3.40 -0.43 -2.24 1.04 -1.26 -5.02 113.70 107.13 1yn5 s SER 71 Ca 0.00 -0.94 -0.10 0.00 0.48 0.00 0.00 55.95 55.39 1yn5 s SER 71 Cb 0.00 -0.26 0.08 0.00 0.10 0.00 0.00 66.02 65.94 1yn5 s SER 71 CO 0.00 0.06 0.29 -1.10 0.98 0.00 0.00 173.24 173.47 1yn5 s GLN 72 N -3.05 2.68 0.24 4.02 -1.52 -1.26 -1.24 119.66 119.53 1yn5 s GLN 72 Ca 0.24 -1.44 -0.01 0.00 -1.95 0.00 0.00 55.36 52.19 1yn5 s GLN 72 Cb -0.06 -3.86 -0.04 0.00 -0.22 0.00 0.00 33.01 28.83 1yn5 s GLN 72 CO 0.11 -0.97 0.45 -0.51 -0.25 0.00 0.00 175.29 174.12 1yn5 s LEU 73 N 1.47 4.16 -0.04 2.90 1.43 -0.17 -4.74 118.68 123.69 1yn5 s LEU 73 Ca 0.03 0.47 -0.27 0.00 -1.03 0.00 0.00 54.13 53.33 1yn5 s LEU 73 Cb -0.23 -3.26 -0.03 0.00 0.03 0.00 0.00 46.19 42.69 1yn5 s LEU 73 CO 0.03 -0.11 0.88 -0.55 0.23 0.00 0.00 176.35 176.83 1yn5 s SER 74 N -3.29 7.20 0.36 2.29 0.15 -1.26 0.43 113.70 119.58 1yn5 s SER 74 Ca 0.40 1.46 0.06 0.00 0.70 0.00 0.00 55.95 58.56 1yn5 s SER 74 Cb -0.11 -2.51 0.73 0.00 -1.71 0.00 0.00 66.02 62.43 1yn5 s SER 74 CO 0.30 -0.23 1.96 1.88 1.20 0.00 0.00 173.24 178.34 1yn5 h TYR 75 N 6.84 0.77 -0.79 3.44 -1.99 -1.86 -1.81 116.97 121.57 1yn5 h TYR 75 Ca -0.40 0.02 0.16 0.00 2.00 0.00 0.00 58.73 60.52 1yn5 h TYR 75 Cb 1.20 -0.25 -0.10 0.00 2.00 0.00 0.00 36.73 39.57 1yn5 h TYR 75 CO 0.67 0.41 0.31 1.25 -0.00 0.00 0.00 178.16 180.80 1yn5 h LEU 76 N 0.76 0.26 -0.52 3.88 5.85 -1.85 0.29 115.31 123.98 1yn5 h LEU 76 Ca 0.32 0.13 -0.16 0.00 0.84 0.00 0.00 57.88 59.00 1yn5 h LEU 76 Cb 0.26 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 1yn5 h LEU 76 CO -0.11 0.06 -0.55 0.44 -0.34 0.00 0.00 178.44 177.94 1yn5 h ASP 77 N 0.42 0.61 -0.27 1.25 3.32 -1.75 -2.54 116.42 117.46 1yn5 h ASP 77 Ca 0.45 -0.33 -0.02 0.00 0.02 0.00 0.00 57.03 57.16 1yn5 h ASP 77 Cb 0.74 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.11 1yn5 h ASP 77 CO -0.45 1.04 0.09 0.25 -1.72 0.00 0.00 179.24 178.45 1yn5 h LEU 78 N 0.42 0.38 -1.57 1.55 5.85 -0.41 -0.69 115.31 120.85 1yn5 h LEU 78 Ca 0.01 -0.19 0.04 0.00 0.84 0.00 0.00 57.88 58.58 1yn5 h LEU 78 Cb 1.10 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 42.00 1yn5 h LEU 78 CO 0.10 0.47 0.34 1.23 -0.34 0.00 0.00 178.44 180.25 1yn5 h GLY 79 N 0.27 0.65 1.17 3.75 0.00 -0.54 0.14 103.07 108.51 1yn5 h GLY 79 Ca 0.09 -0.22 -0.13 0.00 0.00 0.00 0.00 47.33 47.07 1yn5 h GLY 79 CO -0.00 0.19 -0.21 -0.57 0.00 0.00 0.00 176.54 175.95 1yn5 h ASN 80 N 0.56 0.97 -0.29 0.19 -1.24 -0.95 0.84 115.58 115.66 1yn5 h ASN 80 Ca 0.21 -0.36 -0.03 0.00 0.71 0.00 0.00 56.30 56.83 1yn5 h ASN 80 Cb 0.15 -0.27 -0.01 0.00 0.73 0.00 0.00 38.32 38.92 1yn5 h ASN 80 CO -0.06 1.14 0.06 0.11 -1.29 0.00 0.00 177.43 177.40 1yn5 h LYS 81 N 0.83 0.47 0.01 6.67 1.57 0.27 -1.20 116.57 125.19 1yn5 h LYS 81 Ca 0.11 -0.12 0.03 0.00 -1.87 0.00 0.00 60.65 58.80 1yn5 h LYS 81 Cb 0.77 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.98 1yn5 h LYS 81 CO 0.06 0.56 -0.24 0.28 -0.57 0.00 0.00 179.45 179.54 1yn5 h VAL 82 N 0.30 0.45 -0.79 0.50 2.07 -0.77 -0.57 116.25 117.45 1yn5 h VAL 82 Ca 0.09 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.74 1yn5 h VAL 82 Cb 0.31 0.45 -0.06 0.00 -1.52 0.00 0.00 31.29 30.47 1yn5 h VAL 82 CO 0.00 0.00 0.52 0.11 0.02 0.00 0.00 177.57 178.22 1yn5 h LYS 83 N -0.38 0.56 -0.18 1.57 1.57 -0.64 -0.93 116.57 118.14 1yn5 h LYS 83 Ca 0.06 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.77 1yn5 h LYS 83 Cb 0.46 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 1yn5 h LYS 83 CO -0.21 0.37 -0.03 0.00 -0.57 0.00 0.00 179.45 179.01 1yn5 h ALA 84 N 1.62 0.25 -0.44 3.86 0.00 -0.13 -1.08 119.26 123.34 1yn5 h ALA 84 Ca 0.38 -0.24 0.05 0.00 0.00 0.00 0.00 54.91 55.10 1yn5 h ALA 84 Cb 0.67 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.36 1yn5 h ALA 84 CO -0.14 0.00 0.19 -0.07 0.00 0.00 0.00 179.25 179.23 1yn5 h LEU 85 N 0.06 0.25 -1.17 0.00 3.38 -0.31 1.10 115.31 118.62 1yn5 h LEU 85 Ca 0.05 0.04 0.04 0.00 0.09 0.00 0.00 57.88 58.09 1yn5 h LEU 85 Cb 0.46 -0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.16 1yn5 h LEU 85 CO 0.02 0.18 0.57 -0.07 0.09 0.00 0.00 178.44 179.23 1yn5 h LEU 86 N 0.39 0.93 0.04 1.67 3.38 -1.09 0.18 115.31 120.81 1yn5 h LEU 86 Ca 0.20 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.16 1yn5 h LEU 86 Cb 0.15 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1yn5 h LEU 86 CO -0.17 0.63 -0.02 0.22 0.09 0.00 0.00 178.44 179.19 1yn5 h TYR 87 N 1.07 -0.06 -0.56 1.13 5.03 0.23 -1.88 116.97 121.93 1yn5 h TYR 87 Ca 0.35 -0.00 0.02 0.00 2.58 0.00 0.00 58.73 61.67 1yn5 h TYR 87 Cb 0.04 0.02 -0.03 0.00 1.55 0.00 0.00 36.73 38.31 1yn5 h TYR 87 CO -0.00 0.44 0.37 -0.44 -1.32 0.00 0.00 178.16 177.21 1yn5 h ASP 88 N -0.97 0.61 0.09 -2.11 3.32 0.12 -0.33 116.42 117.16 1yn5 h ASP 88 Ca -0.01 -0.01 -0.35 0.00 0.02 0.00 0.00 57.03 56.68 1yn5 h ASP 88 Cb 0.52 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.90 1yn5 h ASP 88 CO 0.01 0.44 -1.97 -0.62 -1.72 0.00 0.00 179.24 175.38 1yn5 n GLU 89 N -4.46 0.72 -0.05 3.56 1.02 0.62 -4.61 120.64 117.43 1yn5 n GLU 89 Ca 0.06 0.29 0.02 0.00 -0.02 0.00 0.00 57.16 57.51 1yn5 n GLU 89 Cb 0.08 -1.69 0.05 0.00 -0.02 0.00 0.00 31.44 29.86 1yn5 n GLU 89 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1yn5 n ARG 90 N -3.61 1.97 -2.53 3.49 5.12 -0.77 -4.98 116.66 115.35 1yn5 n ARG 90 Ca -0.34 -1.44 -0.20 0.00 -1.93 0.00 0.00 57.85 53.94 1yn5 n ARG 90 Cb 0.99 -1.10 0.00 0.00 -1.16 0.00 0.00 32.46 31.19 1yn5 n ARG 90 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1yn5 n GLY 91 N 0.01 -0.42 3.62 -0.13 0.00 -0.13 -4.94 105.19 103.19 1yn5 n GLY 91 Ca 0.04 -0.04 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1yn5 n GLY 91 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1yn5 s VAL 92 N -3.01 4.90 0.67 1.61 1.01 -0.82 -4.95 120.40 119.80 1yn5 s VAL 92 Ca 0.08 1.12 -0.03 0.00 0.00 0.00 0.00 61.98 63.15 1yn5 s VAL 92 Cb -0.04 -4.04 0.07 0.00 0.00 0.00 0.00 36.38 32.38 1yn5 s VAL 92 CO 0.10 -0.11 0.94 0.42 0.00 0.00 0.00 175.10 176.45 1yn5 s THR 93 N 2.71 2.37 0.21 3.92 -4.23 -1.26 -3.67 115.64 115.69 1yn5 s THR 93 Ca 0.29 -0.45 -0.08 0.00 -1.18 0.00 0.00 61.69 60.27 1yn5 s THR 93 Cb -0.15 -2.92 0.16 0.00 1.34 0.00 0.00 72.50 70.93 1yn5 s THR 93 CO 0.10 0.00 1.79 -0.65 -0.54 0.00 0.00 174.62 175.33 1yn5 h PRO 94 N -0.41 1.17 -0.69 3.99 0.11 -1.97 -2.67 132.00 131.54 1yn5 h PRO 94 Ca -0.42 -0.19 -0.07 0.00 0.11 0.00 0.00 66.00 65.43 1yn5 h PRO 94 Cb 1.30 -0.20 -0.03 0.00 0.11 0.00 0.00 31.00 32.18 1yn5 h PRO 94 CO 0.53 0.92 0.15 1.05 -0.21 0.00 0.00 178.00 180.44 1yn5 h GLU 95 N 1.15 1.11 -0.72 1.05 4.11 -1.98 0.11 114.58 119.40 1yn5 h GLU 95 Ca 0.27 -0.28 0.12 0.00 0.07 0.00 0.00 59.36 59.55 1yn5 h GLU 95 Cb 0.16 -0.14 -0.09 0.00 0.50 0.00 0.00 28.75 29.18 1yn5 h GLU 95 CO -0.03 1.00 0.30 -0.22 0.07 0.00 0.00 179.01 180.13 1yn5 h LYS 96 N 1.04 0.46 -0.44 1.06 1.63 -1.87 0.24 116.57 118.69 1yn5 h LYS 96 Ca 0.21 -0.03 -0.13 0.00 -0.85 0.00 0.00 60.65 59.85 1yn5 h LYS 96 Cb 0.40 -0.10 -0.01 0.00 -0.60 0.00 0.00 32.23 31.91 1yn5 h LYS 96 CO 0.01 0.30 -0.25 0.82 -3.45 0.00 0.00 179.45 176.88 1yn5 h ILE 97 N 0.47 1.27 -0.55 2.00 2.04 -1.18 0.47 117.51 122.04 1yn5 h ILE 97 Ca 0.38 -1.41 0.08 0.00 1.00 0.00 0.00 64.86 64.91 1yn5 h ILE 97 Cb 0.53 1.22 -0.07 0.00 -0.74 0.00 0.00 36.82 37.76 1yn5 h ILE 97 CO -0.36 0.48 0.18 0.03 0.00 0.00 0.00 178.15 178.49 1yn5 h ARG 98 N 0.79 0.34 -0.00 2.37 2.47 0.13 -2.71 114.38 117.78 1yn5 h ARG 98 Ca 0.09 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.79 1yn5 h ARG 98 Cb 0.83 -0.08 0.00 0.00 -1.65 0.00 0.00 29.97 29.07 1yn5 h ARG 98 CO 0.07 0.23 -0.49 0.09 0.56 0.00 0.00 179.97 180.43 1yn5 n ASN 99 N -5.02 0.67 -4.50 7.04 3.02 0.50 -4.97 115.26 111.99 1yn5 n ASN 99 Ca 0.07 -0.45 -0.31 0.00 -0.03 0.00 0.00 54.58 53.86 1yn5 n ASN 99 Cb 0.24 0.29 0.19 0.00 -0.61 0.00 0.00 39.78 39.90 1yn5 n ASN 99 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1yn5 n ALA 100 N -1.31 -2.36 -0.02 5.41 0.00 0.15 -4.91 120.51 117.47 1yn5 n ALA 100 Ca 0.07 -0.90 -0.16 0.00 0.00 0.00 0.00 53.44 52.44 1yn5 n ALA 100 Cb 0.34 -1.96 -0.06 0.00 0.00 0.00 0.00 19.45 17.77 1yn5 n ALA 100 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1yn5 h LYS 101 N -2.16 0.77 -2.18 0.00 1.79 0.48 -3.46 116.57 111.82 1yn5 h LYS 101 Ca -0.51 -0.61 -0.06 0.00 -2.18 0.00 0.00 60.65 57.28 1yn5 h LYS 101 Cb 1.31 0.12 -0.20 0.00 -1.58 0.00 0.00 32.23 31.88 1yn5 h LYS 101 CO 0.42 1.22 0.08 -1.54 -1.08 0.00 0.00 179.45 178.55 1yn5 s SER 102 N -7.08 -0.63 -0.21 0.86 1.04 -0.93 -5.01 113.70 101.74 1yn5 s SER 102 Ca -0.10 0.97 -0.04 0.00 0.48 0.00 0.00 55.95 57.26 1yn5 s SER 102 Cb 0.09 0.93 0.09 0.00 0.10 0.00 0.00 66.02 67.23 1yn5 s SER 102 CO 0.90 -0.40 0.19 0.00 0.98 0.00 0.00 173.24 174.91 1yn5 s ALA 103 N -0.41 -0.04 0.23 5.32 0.00 -1.26 -0.35 121.76 125.24 1yn5 s ALA 103 Ca -0.06 -0.07 -0.06 0.00 0.00 0.00 0.00 51.96 51.78 1yn5 s ALA 103 Cb -0.03 -1.31 -0.02 0.00 0.00 0.00 0.00 23.12 21.76 1yn5 s ALA 103 CO 0.05 -1.30 0.29 0.14 0.00 0.00 0.00 175.76 174.95 1yn5 s VAL 104 N 2.26 0.00 -0.10 0.00 -7.23 -0.13 -0.11 120.40 115.09 1yn5 s VAL 104 Ca 0.06 -1.73 -0.05 0.00 -1.81 0.00 0.00 61.98 58.45 1yn5 s VAL 104 Cb -0.16 -2.38 0.04 0.00 0.56 0.00 0.00 36.38 34.45 1yn5 s VAL 104 CO -0.16 0.00 0.23 -0.72 -0.31 0.00 0.00 175.10 174.14 1yn5 s TYR 105 N -4.06 -0.30 -0.15 2.82 -0.85 -0.93 0.85 117.35 114.74 1yn5 s TYR 105 Ca 0.32 0.73 -0.06 0.00 -0.52 0.00 0.00 57.07 57.53 1yn5 s TYR 105 Cb 0.03 0.02 -0.04 0.00 0.38 0.00 0.00 41.96 42.35 1yn5 s TYR 105 CO 0.11 -0.22 0.07 0.99 -1.52 0.00 0.00 175.55 174.98 1yn5 s THR 106 N 1.25 4.89 -0.25 -3.49 2.01 0.35 -1.22 115.64 119.18 1yn5 s THR 106 Ca -0.09 -0.01 -0.10 0.00 0.31 0.00 0.00 61.69 61.80 1yn5 s THR 106 Cb -0.11 -3.16 -0.04 0.00 0.01 0.00 0.00 72.50 69.20 1yn5 s THR 106 CO -0.08 0.52 0.14 -0.63 -0.69 0.00 0.00 174.62 173.88 1yn5 s ILE 107 N -0.16 5.06 -0.31 1.82 1.01 0.11 -0.48 121.20 128.27 1yn5 s ILE 107 Ca 0.08 0.08 -0.11 0.00 0.00 0.00 0.00 60.65 60.70 1yn5 s ILE 107 Cb -0.12 -3.37 -0.02 0.00 0.01 0.00 0.00 42.46 38.96 1yn5 s ILE 107 CO 0.01 0.33 0.18 -0.89 0.00 0.00 0.00 174.94 174.57 1yn5 s THR 108 N 1.31 4.96 0.81 2.92 2.01 0.05 -0.29 115.64 127.41 1yn5 s THR 108 Ca 0.06 -0.19 -0.12 0.00 0.31 0.00 0.00 61.69 61.76 1yn5 s THR 108 Cb -0.14 -3.48 0.08 0.00 0.01 0.00 0.00 72.50 68.97 1yn5 s THR 108 CO 0.06 0.11 1.11 0.26 -0.69 0.00 0.00 174.62 175.48 1yn5 s TRP 109 N 1.68 2.85 0.31 4.92 0.52 0.22 0.18 118.94 129.62 1yn5 s TRP 109 Ca 0.06 1.03 0.37 0.00 0.02 0.00 0.00 56.10 57.58 1yn5 s TRP 109 Cb -0.17 -3.21 1.74 0.00 -1.15 0.00 0.00 33.47 30.69 1yn5 s TRP 109 CO 0.08 -1.81 2.12 0.87 0.02 0.00 0.00 176.95 178.24 1yn5 h LYS 110 N -1.10 0.00 -0.04 4.98 1.57 -1.39 -1.48 116.57 119.10 1yn5 h LYS 110 Ca -0.47 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 1yn5 h LYS 110 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.60 1yn5 h LYS 110 CO 0.61 0.01 0.00 -0.40 -0.57 0.00 0.00 179.45 179.10 1yn5 n ASP 111 N -3.11 0.33 0.00 0.86 5.75 -1.26 -4.85 116.55 114.27 1yn5 n ASP 111 Ca -0.01 -1.68 0.00 0.00 -0.01 0.00 0.00 54.79 53.09 1yn5 n ASP 111 Cb 0.22 -0.03 0.00 0.00 -1.03 0.00 0.00 41.12 40.28 1yn5 n ASP 111 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1yn5 n GLY 112 N 0.76 1.38 3.79 6.12 0.00 -0.56 -5.03 105.19 111.64 1yn5 n GLY 112 Ca 0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.77 1yn5 n GLY 112 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1yn5 s SER 113 N -3.15 6.22 0.17 1.61 0.01 -1.25 -4.77 113.70 112.55 1yn5 s SER 113 Ca 0.00 2.05 0.09 0.00 1.31 0.00 0.00 55.95 59.40 1yn5 s SER 113 Cb 0.00 -2.57 -0.04 0.00 0.21 0.00 0.00 66.02 63.61 1yn5 s SER 113 CO 0.00 -0.87 -0.10 -0.54 0.41 0.00 0.00 173.24 172.15 1yn5 s LYS 114 N -3.08 2.06 -0.21 12.44 1.02 -1.26 0.71 119.74 131.43 1yn5 s LYS 114 Ca 0.67 -1.24 -0.04 0.00 0.02 0.00 0.00 55.97 55.38 1yn5 s LYS 114 Cb -0.20 -2.18 0.09 0.00 -0.52 0.00 0.00 37.83 35.02 1yn5 s LYS 114 CO 0.24 0.44 0.22 0.21 -0.92 0.00 0.00 175.35 175.55 1yn5 s LYS 115 N -2.74 0.20 -0.16 1.68 2.47 0.61 -4.95 119.74 116.84 1yn5 s LYS 115 Ca 0.24 0.19 -0.20 0.00 -1.56 0.00 0.00 55.97 54.65 1yn5 s LYS 115 Cb -0.09 -1.20 -0.03 0.00 -1.46 0.00 0.00 37.83 35.05 1yn5 s LYS 115 CO 0.15 -0.67 0.56 -2.00 0.16 0.00 0.00 175.35 173.55 1yn5 s GLU 116 N 2.33 4.26 -0.11 4.03 2.12 -1.26 0.09 118.70 130.16 1yn5 s GLU 116 Ca 0.07 0.53 -0.02 0.00 0.36 0.00 0.00 54.97 55.91 1yn5 s GLU 116 Cb -0.16 -3.52 -0.03 0.00 0.26 0.00 0.00 34.13 30.68 1yn5 s GLU 116 CO -0.13 -0.07 -0.04 0.08 -0.54 0.00 0.00 175.26 174.56 1yn5 s VAL 117 N 1.37 3.95 -0.30 3.70 1.01 -0.36 -5.00 120.40 124.77 1yn5 s VAL 117 Ca 0.27 -0.37 -0.17 0.00 0.00 0.00 0.00 61.98 61.71 1yn5 s VAL 117 Cb -0.16 -2.67 -0.02 0.00 0.00 0.00 0.00 36.38 33.53 1yn5 s VAL 117 CO 0.11 0.56 0.47 -0.62 0.00 0.00 0.00 175.10 175.62 1yn5 s ASP 118 N -0.39 6.33 0.30 3.32 -1.08 -1.26 -2.18 116.67 121.72 1yn5 s ASP 118 Ca 0.06 0.20 0.16 0.00 -0.52 0.00 0.00 52.55 52.46 1yn5 s ASP 118 Cb -0.12 -2.25 0.25 0.00 -1.46 0.00 0.00 42.92 39.34 1yn5 s ASP 118 CO 0.02 -0.34 1.53 -0.07 0.52 0.00 0.00 175.17 176.83 1yn5 h LEU 119 N 8.86 0.00 -0.44 -1.34 3.38 -0.87 -3.13 115.31 121.77 1yn5 h LEU 119 Ca -0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1yn5 h LEU 119 Cb 1.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.89 1yn5 h LEU 119 CO 0.72 0.48 0.00 0.29 0.09 0.00 0.00 178.44 180.02 1yn5 n LYS 120 N -3.32 0.17 -3.44 1.13 5.02 -1.23 -3.93 118.16 112.56 1yn5 n LYS 120 Ca 0.01 0.34 -0.37 0.00 -2.02 0.00 0.00 58.31 56.28 1yn5 n LYS 120 Cb 0.67 -1.79 -0.05 0.00 -0.02 0.00 0.00 35.03 33.85 1yn5 n LYS 120 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1yn5 n LYS 121 N -2.10 3.09 -1.70 1.97 4.76 -1.18 -4.97 118.16 118.02 1yn5 n LYS 121 Ca 0.03 -4.53 -0.41 0.00 -2.87 0.00 0.00 58.31 50.53 1yn5 n LYS 121 Cb 0.26 -2.42 -0.01 0.00 -1.84 0.00 0.00 35.03 31.03 1yn5 n LYS 121 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 1yn5 n ASP 122 N 1.86 5.31 -4.89 4.39 4.64 -1.25 -4.92 116.55 121.68 1yn5 n ASP 122 Ca 0.24 -2.81 -0.34 0.00 -1.38 0.00 0.00 54.79 50.50 1yn5 n ASP 122 Cb 0.37 -1.61 -0.05 0.00 -1.04 0.00 0.00 41.12 38.79 1yn5 n ASP 122 CO 0.00 0.00 0.00 -0.55 -0.82 0.00 0.00 177.20 175.83 1yn5 s SER 123 N 2.61 6.47 0.56 1.67 0.15 -1.26 -5.06 113.70 118.84 1yn5 s SER 123 Ca 0.52 0.51 -0.20 0.00 0.70 0.00 0.00 55.95 57.48 1yn5 s SER 123 Cb 0.15 -2.07 -0.04 0.00 -1.71 0.00 0.00 66.02 62.35 1yn5 s SER 123 CO -0.07 0.21 1.22 -0.47 1.20 0.00 0.00 173.24 175.33 1yn5 s TYR 124 N -1.38 2.45 0.05 3.44 5.04 -1.26 -5.04 117.35 120.65 1yn5 s TYR 124 Ca 0.30 1.50 -0.12 0.00 -2.44 0.00 0.00 57.07 56.31 1yn5 s TYR 124 Cb -0.13 -3.51 0.01 0.00 0.35 0.00 0.00 41.96 38.69 1yn5 s TYR 124 CO 0.19 -2.19 0.27 -0.08 -1.34 0.00 0.00 175.55 172.40 1yn5 s THR 125 N -1.55 0.09 -0.11 4.34 -1.32 -1.26 -5.05 115.64 110.79 1yn5 s THR 125 Ca 0.74 -0.76 0.16 0.00 -1.21 0.00 0.00 61.69 60.63 1yn5 s THR 125 Cb -0.31 -0.95 -0.24 0.00 -1.51 0.00 0.00 72.50 69.49 1yn5 s THR 125 CO 0.35 -0.42 0.39 0.00 -2.21 0.00 0.00 174.62 172.73 1yn5 n ALA 126 N 0.57 2.77 -1.54 11.08 0.00 -1.26 -4.75 120.51 127.38 1yn5 n ALA 126 Ca -0.18 -0.39 -0.49 0.00 0.00 0.00 0.00 53.44 52.38 1yn5 n ALA 126 Cb 0.59 -0.55 -0.04 0.00 0.00 0.00 0.00 19.45 19.46 1yn5 n ALA 126 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1yn5 n ASN 127 N -1.97 0.78 -4.50 0.00 3.02 -1.26 -4.89 115.26 106.45 1yn5 n ASN 127 Ca -0.02 1.15 -0.25 0.00 -0.03 0.00 0.00 54.58 55.43 1yn5 n ASN 127 Cb 0.39 -1.16 -0.10 0.00 -0.61 0.00 0.00 39.78 38.30 1yn5 n ASN 127 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1yn5 s LEU 128 N 0.95 2.69 0.19 3.41 1.43 -1.26 -2.75 118.68 123.34 1yn5 s LEU 128 Ca 0.70 -0.87 0.04 0.00 -1.03 0.00 0.00 54.13 52.97 1yn5 s LEU 128 Cb -0.87 -1.28 -0.05 0.00 0.03 0.00 0.00 46.19 44.02 1yn5 s LEU 128 CO 0.55 0.06 -0.06 0.72 0.23 0.00 0.00 176.35 177.85 1yn5 s PHE 129 N -2.16 1.46 -0.56 0.29 -0.12 0.17 -4.90 117.98 112.17 1yn5 s PHE 129 Ca 0.27 -0.81 -0.28 0.00 -0.05 0.00 0.00 56.93 56.05 1yn5 s PHE 129 Cb -0.06 -0.79 0.03 0.00 -0.63 0.00 0.00 43.02 41.56 1yn5 s PHE 129 CO 0.14 0.06 1.21 -0.51 -0.05 0.00 0.00 175.22 176.08 1yn5 s ASP 130 N -3.25 6.44 0.22 1.98 1.01 -1.26 -1.00 116.67 120.80 1yn5 s ASP 130 Ca 0.23 0.20 -0.11 0.00 0.71 0.00 0.00 52.55 53.58 1yn5 s ASP 130 Cb 0.04 -2.55 0.30 0.00 1.01 0.00 0.00 42.92 41.71 1yn5 s ASP 130 CO 0.05 -1.47 1.65 -1.28 0.21 0.00 0.00 175.17 174.34 1yn5 h SER 131 N 9.67 -0.33 0.19 0.27 0.87 -1.48 0.14 113.55 122.89 1yn5 h SER 131 Ca -0.25 0.16 0.00 0.00 -1.23 0.00 0.00 61.79 60.47 1yn5 h SER 131 Cb 1.06 0.29 0.00 0.00 -0.44 0.00 0.00 62.40 63.32 1yn5 h SER 131 CO 1.17 -0.13 0.00 0.59 -0.53 0.00 0.00 176.83 177.93 1yn5 n ASN 132 N -5.31 0.00 0.09 6.23 5.03 -1.26 -2.88 115.26 117.15 1yn5 n ASN 132 Ca 0.09 0.44 0.12 0.00 0.87 0.00 0.00 54.58 56.10 1yn5 n ASN 132 Cb 0.36 -0.46 0.23 0.00 -1.02 0.00 0.00 39.78 38.89 1yn5 n ASN 132 CO 0.00 0.00 0.00 -1.28 -1.83 0.00 0.00 177.26 174.15 1yn5 h SER 133 N 0.00 0.00 -3.41 6.41 0.87 -1.10 -3.47 113.55 112.85 1yn5 h SER 133 Ca 0.00 -0.12 -0.55 0.00 -1.23 0.00 0.00 61.79 59.89 1yn5 h SER 133 Cb 0.10 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.02 1yn5 h SER 133 CO 0.00 0.06 0.15 0.27 -0.53 0.00 0.00 176.83 176.78 1yn5 s ILE 134 N -3.17 4.81 -0.14 2.23 -4.36 -1.14 -1.05 121.20 118.39 1yn5 s ILE 134 Ca 0.07 1.60 -0.09 0.00 -0.26 0.00 0.00 60.65 61.98 1yn5 s ILE 134 Cb 0.12 -4.11 -0.03 0.00 1.25 0.00 0.00 42.46 39.69 1yn5 s ILE 134 CO 0.69 0.33 -0.16 0.50 0.24 0.00 0.00 174.94 176.54 1yn5 h LYS 135 N 5.97 0.00 -3.41 0.37 1.63 -0.48 -3.44 116.57 117.21 1yn5 h LYS 135 Ca -0.43 0.00 -0.03 0.00 -0.85 0.00 0.00 60.65 59.34 1yn5 h LYS 135 Cb 1.20 0.00 -0.10 0.00 -0.60 0.00 0.00 32.23 32.74 1yn5 h LYS 135 CO 0.72 0.02 -0.02 1.14 -3.45 0.00 0.00 179.45 177.86 1yn5 s GLN 136 N -2.19 1.40 -0.09 1.90 -2.07 -1.01 -4.15 119.66 113.45 1yn5 s GLN 136 Ca -0.14 -0.97 0.02 0.00 -1.82 0.00 0.00 55.36 52.45 1yn5 s GLN 136 Cb 0.02 0.50 0.01 0.00 -1.09 0.00 0.00 33.01 32.45 1yn5 s GLN 136 CO 0.21 -0.59 -0.13 0.42 -1.32 0.00 0.00 175.29 173.88 1yn5 s ILE 137 N -3.91 1.31 -0.28 3.63 1.01 -0.67 -0.77 121.20 121.52 1yn5 s ILE 137 Ca 0.12 -0.54 -0.01 0.00 0.00 0.00 0.00 60.65 60.22 1yn5 s ILE 137 Cb -0.01 -1.21 0.05 0.00 0.01 0.00 0.00 42.46 41.30 1yn5 s ILE 137 CO -0.00 0.40 -0.03 -1.81 0.00 0.00 0.00 174.94 173.50 1yn5 s ASP 138 N 0.92 4.70 -0.14 3.58 1.01 0.37 -1.30 116.67 125.82 1yn5 s ASP 138 Ca -0.09 -1.19 -0.11 0.00 0.71 0.00 0.00 52.55 51.87 1yn5 s ASP 138 Cb -0.15 -1.68 -0.05 0.00 1.01 0.00 0.00 42.92 42.05 1yn5 s ASP 138 CO 0.00 -0.22 0.23 -0.63 0.21 0.00 0.00 175.17 174.76 1yn5 s ILE 139 N 1.25 5.35 -0.07 0.77 1.01 -0.26 0.13 121.20 129.38 1yn5 s ILE 139 Ca -0.04 0.42 -0.03 0.00 0.00 0.00 0.00 60.65 60.99 1yn5 s ILE 139 Cb -0.19 -3.54 0.04 0.00 0.01 0.00 0.00 42.46 38.78 1yn5 s ILE 139 CO -0.02 0.49 0.11 0.21 0.00 0.00 0.00 174.94 175.72 1yn5 s ASN 140 N -0.18 1.00 -0.08 3.58 3.04 0.25 -2.24 114.94 120.31 1yn5 s ASN 140 Ca 0.15 0.17 0.05 0.00 0.04 0.00 0.00 52.86 53.27 1yn5 s ASN 140 Cb -0.13 0.05 -0.01 0.00 -1.54 0.00 0.00 41.25 39.63 1yn5 s ASN 140 CO 0.04 -0.25 -0.22 -0.69 -3.04 0.00 0.00 177.10 172.93 1yn5 s VAL 141 N 2.23 2.27 -0.11 -5.21 1.01 -0.47 -0.96 120.40 119.16 1yn5 s VAL 141 Ca 0.04 -0.97 0.01 0.00 0.00 0.00 0.00 61.98 61.06 1yn5 s VAL 141 Cb -0.12 -1.86 0.02 0.00 0.00 0.00 0.00 36.38 34.42 1yn5 s VAL 141 CO -0.05 0.56 -0.13 -0.54 0.00 0.00 0.00 175.10 174.95 1yn5 s LYS 142 N -0.02 2.00 -0.16 2.72 1.02 0.52 -2.16 119.74 123.67 1yn5 s LYS 142 Ca -0.07 -0.47 -0.13 0.00 0.02 0.00 0.00 55.97 55.33 1yn5 s LYS 142 Cb -0.15 -1.81 -0.08 0.00 -0.52 0.00 0.00 37.83 35.27 1yn5 s LYS 142 CO 0.05 -0.14 -0.02 1.15 -0.92 0.00 0.00 175.35 175.46 1yn5 h THR 143 N 6.04 0.32 0.00 2.17 2.02 -1.93 0.74 112.91 122.26 1yn5 h THR 143 Ca -0.33 -1.39 0.00 0.00 0.77 0.00 0.00 66.41 65.47 1yn5 h THR 143 Cb 1.16 0.75 0.00 0.00 -1.74 0.00 0.00 68.15 68.32 1yn5 h THR 143 CO 0.48 0.11 0.00 1.17 0.37 0.00 0.00 175.52 177.65