#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v86 n SER 2 N 0.00 -7.93 -4.22 1.61 7.64 -1.26 -5.03 113.62 104.44 1v86 n SER 2 Ca 0.00 1.52 -0.17 0.00 1.01 0.00 0.00 58.87 61.23 1v86 n SER 2 Cb 0.00 -5.06 -0.10 0.00 -1.01 0.00 0.00 64.21 58.04 1v86 n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1v86 s SER 3 N -7.14 1.20 0.00 6.43 0.15 -1.26 -5.17 113.70 107.91 1v86 s SER 3 Ca 0.00 -1.43 0.00 0.00 0.70 0.00 0.00 55.95 55.22 1v86 s SER 3 Cb 0.00 0.25 0.00 0.00 -1.71 0.00 0.00 66.02 64.56 1v86 s SER 3 CO 0.00 -0.79 0.00 0.61 1.20 0.00 0.00 173.24 174.26 1v86 n GLY 4 N -0.48 3.40 3.65 9.45 0.00 -1.26 -5.18 105.19 114.76 1v86 n GLY 4 Ca 0.00 -1.12 -0.04 0.00 0.00 0.00 0.00 46.02 44.87 1v86 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1v86 s SER 5 N 0.53 -0.16 0.26 1.61 1.04 -1.26 -5.19 113.70 110.54 1v86 s SER 5 Ca 0.00 0.30 -0.15 0.00 0.48 0.00 0.00 55.95 56.59 1v86 s SER 5 Cb 0.00 0.33 0.00 0.00 0.10 0.00 0.00 66.02 66.45 1v86 s SER 5 CO 0.00 -0.05 0.54 -0.44 0.98 0.00 0.00 173.24 174.27 1v86 s SER 6 N 0.11 -0.12 0.00 7.02 0.01 -1.26 -5.18 113.70 114.28 1v86 s SER 6 Ca 0.06 -0.86 0.00 0.00 1.31 0.00 0.00 55.95 56.45 1v86 s SER 6 Cb -0.05 0.62 0.00 0.00 0.21 0.00 0.00 66.02 66.81 1v86 s SER 6 CO -0.13 -1.20 0.00 0.61 0.41 0.00 0.00 173.24 172.93 1v86 n GLY 7 N -0.41 2.74 3.59 3.44 0.00 -1.26 -5.16 105.19 108.13 1v86 n GLY 7 Ca -0.02 -2.05 -0.05 0.00 0.00 0.00 0.00 46.02 43.90 1v86 n GLY 7 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1v86 s ASP 8 N -0.74 -0.18 0.27 1.61 -1.08 -1.26 -5.19 116.67 110.11 1v86 s ASP 8 Ca 0.00 0.07 -0.01 0.00 -0.52 0.00 0.00 52.55 52.09 1v86 s ASP 8 Cb 0.00 0.17 -0.02 0.00 -1.46 0.00 0.00 42.92 41.61 1v86 s ASP 8 CO 0.00 -0.25 0.29 0.00 0.52 0.00 0.00 175.17 175.73 1v86 s ALA 9 N -2.05 1.09 0.46 3.66 0.00 -1.26 -5.18 121.76 118.48 1v86 s ALA 9 Ca 0.07 -1.66 0.03 0.00 0.00 0.00 0.00 51.96 50.40 1v86 s ALA 9 Cb -0.01 1.33 -0.02 0.00 0.00 0.00 0.00 23.12 24.42 1v86 s ALA 9 CO -0.05 -0.69 0.06 0.20 0.00 0.00 0.00 175.76 175.29 1v86 s GLY 10 N -3.22 2.82 0.00 0.00 0.00 -1.26 -5.16 107.32 100.50 1v86 s GLY 10 Ca 0.36 -0.83 0.00 0.00 0.00 0.00 0.00 44.72 44.24 1v86 s GLY 10 CO 0.18 -2.02 0.00 0.61 0.00 0.00 0.00 173.10 171.87 1v86 n GLY 11 N -1.09 4.75 2.73 0.20 0.00 -1.26 -5.13 105.19 105.39 1v86 n GLY 11 Ca -0.12 -0.94 -0.07 0.00 0.00 0.00 0.00 46.02 44.89 1v86 n GLY 11 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1v86 n GLY 12 N 0.00 -0.15 3.64 -0.02 0.00 -1.26 -5.13 105.19 102.27 1v86 n GLY 12 Ca 0.00 0.22 -0.05 0.00 0.00 0.00 0.00 46.02 46.19 1v86 n GLY 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1v86 s VAL 13 N 0.72 0.00 -1.03 1.61 0.11 -1.26 -5.06 120.40 115.49 1v86 s VAL 13 Ca 0.31 0.00 -0.01 0.00 -2.93 0.00 0.00 61.98 59.35 1v86 s VAL 13 Cb 0.09 -1.00 0.31 0.00 -1.53 0.00 0.00 36.38 34.25 1v86 s VAL 13 CO -0.13 0.00 1.88 0.61 -3.33 0.00 0.00 175.10 174.14 1v86 n GLY 14 N 2.43 6.03 3.24 6.54 0.00 -1.26 -4.89 105.19 117.28 1v86 n GLY 14 Ca -0.14 -2.54 -0.10 0.00 0.00 0.00 0.00 46.02 43.24 1v86 n GLY 14 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1v86 s LYS 15 N -4.12 0.36 -0.14 1.61 1.02 -1.26 -5.11 119.74 112.10 1v86 s LYS 15 Ca 0.41 0.78 -0.31 0.00 0.02 0.00 0.00 55.97 56.88 1v86 s LYS 15 Cb 0.21 -0.00 -0.08 0.00 -0.52 0.00 0.00 37.83 37.44 1v86 s LYS 15 CO -0.15 -0.17 2.09 -1.91 -0.92 0.00 0.00 175.35 174.29 1v86 n GLU 16 N 4.39 2.16 -1.30 1.68 2.13 -1.26 -4.86 120.64 123.58 1v86 n GLU 16 Ca -0.22 0.70 -0.41 0.00 0.66 0.00 0.00 57.16 57.89 1v86 n GLU 16 Cb 0.54 -2.99 0.00 0.00 0.27 0.00 0.00 31.44 29.27 1v86 n GLU 16 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1v86 n LEU 17 N 9.44 -2.89 -4.82 4.31 7.99 -1.26 -4.89 117.00 124.88 1v86 n LEU 17 Ca 0.27 0.78 -0.38 0.00 -0.01 0.00 0.00 56.01 56.67 1v86 n LEU 17 Cb 0.39 -0.89 -0.06 0.00 -0.11 0.00 0.00 43.42 42.75 1v86 n LEU 17 CO 0.69 -4.26 0.27 0.54 -1.51 0.00 0.00 177.39 173.11 1v86 s VAL 18 N -1.74 4.75 -0.02 4.08 0.11 0.50 -4.71 120.40 123.37 1v86 s VAL 18 Ca 0.59 1.16 -0.30 0.00 -2.93 0.00 0.00 61.98 60.50 1v86 s VAL 18 Cb -0.61 -3.87 -0.04 0.00 -1.53 0.00 0.00 36.38 30.34 1v86 s VAL 18 CO 0.63 0.49 1.16 -0.62 -3.33 0.00 0.00 175.10 173.43 1v86 s ASP 19 N -1.22 7.11 0.03 3.54 2.15 -1.26 -2.37 116.67 124.65 1v86 s ASP 19 Ca 0.31 1.83 -0.00 0.00 0.43 0.00 0.00 52.55 55.11 1v86 s ASP 19 Cb -0.19 -2.56 -0.03 0.00 -0.30 0.00 0.00 42.92 39.84 1v86 s ASP 19 CO 0.19 -0.50 -0.03 -0.76 -0.17 0.00 0.00 175.17 173.90 1v86 s LEU 20 N 1.74 2.34 -0.19 -1.34 1.43 -1.08 0.12 118.68 121.70 1v86 s LEU 20 Ca 0.56 -0.70 -0.02 0.00 -1.03 0.00 0.00 54.13 52.94 1v86 s LEU 20 Cb -0.25 0.14 -0.00 0.00 0.03 0.00 0.00 46.19 46.11 1v86 s LEU 20 CO 0.24 -0.42 -0.10 -0.54 0.23 0.00 0.00 176.35 175.76 1v86 s LYS 21 N -2.43 3.26 -1.01 1.70 1.02 -1.03 -2.72 119.74 118.54 1v86 s LYS 21 Ca -0.07 -0.70 -0.20 0.00 0.02 0.00 0.00 55.97 55.03 1v86 s LYS 21 Cb -0.03 -2.82 0.10 0.00 -0.52 0.00 0.00 37.83 34.56 1v86 s LYS 21 CO -0.05 -0.14 1.30 0.42 -0.92 0.00 0.00 175.35 175.97 1v86 s ILE 22 N 1.24 4.43 -0.01 2.17 -1.09 -1.06 -1.19 121.20 125.69 1v86 s ILE 22 Ca 0.03 -1.40 -0.30 0.00 -2.23 0.00 0.00 60.65 56.75 1v86 s ILE 22 Cb -0.14 -4.92 -0.05 0.00 -1.58 0.00 0.00 42.46 35.77 1v86 s ILE 22 CO -0.05 -1.70 1.35 -0.63 -1.23 0.00 0.00 174.94 172.68 1v86 s ILE 23 N 3.50 3.85 -0.28 2.92 -1.09 0.41 -3.34 121.20 127.17 1v86 s ILE 23 Ca 0.40 1.22 -0.16 0.00 -2.23 0.00 0.00 60.65 59.88 1v86 s ILE 23 Cb -0.02 -3.79 0.09 0.00 -1.58 0.00 0.00 42.46 37.16 1v86 s ILE 23 CO -0.08 0.00 0.71 0.86 -1.23 0.00 0.00 174.94 175.20 1v86 s TRP 24 N 2.32 -1.04 0.00 3.97 -0.00 -1.22 0.12 118.94 123.08 1v86 s TRP 24 Ca 0.62 2.07 0.00 0.00 -0.00 0.00 0.00 56.10 58.78 1v86 s TRP 24 Cb -0.30 0.62 0.00 0.00 -0.00 0.00 0.00 33.47 33.80 1v86 s TRP 24 CO 0.25 -0.52 0.00 0.09 -0.00 0.00 0.00 176.95 176.78 1v86 n ASN 25 N 4.33 0.00 -2.49 5.86 3.02 -1.26 -1.85 115.26 122.87 1v86 n ASN 25 Ca -0.19 0.00 -0.03 0.00 -0.03 0.00 0.00 54.58 54.32 1v86 n ASN 25 Cb 0.58 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.76 1v86 n ASN 25 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 1v86 n LYS 26 N 0.00 0.33 -4.18 3.52 2.85 -1.26 -5.16 118.16 114.26 1v86 n LYS 26 Ca 0.00 -0.75 -0.12 0.00 -1.05 0.00 0.00 58.31 56.39 1v86 n LYS 26 Cb 0.00 0.01 -0.09 0.00 -0.65 0.00 0.00 35.03 34.30 1v86 n LYS 26 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 177.40 177.27 1v86 s THR 27 N 0.05 0.00 -0.32 0.58 -1.32 -0.77 -5.13 115.64 108.73 1v86 s THR 27 Ca 0.05 -1.92 -0.02 0.00 -1.21 0.00 0.00 61.69 58.59 1v86 s THR 27 Cb 0.11 -2.47 0.11 0.00 -1.51 0.00 0.00 72.50 68.74 1v86 s THR 27 CO -0.03 0.00 0.14 -0.54 -2.21 0.00 0.00 174.62 171.98 1v86 s LYS 28 N -4.07 0.50 -0.56 7.08 1.02 -1.26 -3.38 119.74 119.07 1v86 s LYS 28 Ca 0.37 -0.93 -0.25 0.00 0.02 0.00 0.00 55.97 55.18 1v86 s LYS 28 Cb 0.06 -1.55 0.04 0.00 -0.52 0.00 0.00 37.83 35.85 1v86 s LYS 28 CO 0.13 -1.04 1.01 -1.01 -0.92 0.00 0.00 175.35 173.52 1v86 s HIS 29 N 1.67 2.74 -0.35 3.18 3.76 -1.21 -4.83 115.29 120.25 1v86 s HIS 29 Ca 0.11 0.10 -0.28 0.00 -0.15 0.00 0.00 55.06 54.84 1v86 s HIS 29 Cb -0.18 -4.19 -0.01 0.00 1.11 0.00 0.00 32.58 29.30 1v86 s HIS 29 CO -0.25 -1.41 1.74 0.16 -0.85 0.00 0.00 174.74 174.12 1v86 s ASP 30 N 2.87 5.94 0.01 1.40 1.47 -1.26 -2.57 116.67 124.54 1v86 s ASP 30 Ca 0.34 1.19 0.04 0.00 1.18 0.00 0.00 52.55 55.30 1v86 s ASP 30 Cb -0.11 -2.53 -0.01 0.00 -0.34 0.00 0.00 42.92 39.93 1v86 s ASP 30 CO 0.21 -1.69 -0.13 0.68 0.68 0.00 0.00 175.17 174.92 1v86 s VAL 31 N 6.72 1.04 -0.24 2.11 -7.23 -1.10 -5.05 120.40 116.65 1v86 s VAL 31 Ca 0.76 -0.71 -0.07 0.00 -1.81 0.00 0.00 61.98 60.15 1v86 s VAL 31 Cb -0.21 -0.90 -0.03 0.00 0.56 0.00 0.00 36.38 35.81 1v86 s VAL 31 CO 0.33 0.18 0.07 -1.59 -0.31 0.00 0.00 175.10 173.77 1v86 s LYS 32 N -0.62 3.69 0.05 4.82 -2.85 -1.26 -2.63 119.74 120.95 1v86 s LYS 32 Ca 0.04 -0.46 0.03 0.00 -1.00 0.00 0.00 55.97 54.57 1v86 s LYS 32 Cb -0.06 -3.30 -0.03 0.00 -2.06 0.00 0.00 37.83 32.38 1v86 s LYS 32 CO 0.00 -0.12 -0.09 0.14 0.10 0.00 0.00 175.35 175.39 1v86 s VAL 33 N 1.43 0.63 0.58 1.79 -7.23 -1.00 -4.86 120.40 111.74 1v86 s VAL 33 Ca 0.05 -1.15 -0.16 0.00 -1.81 0.00 0.00 61.98 58.91 1v86 s VAL 33 Cb -0.15 -0.72 -0.04 0.00 0.56 0.00 0.00 36.38 36.03 1v86 s VAL 33 CO 0.04 -0.38 1.05 -2.16 -0.31 0.00 0.00 175.10 173.33 1v86 s PRO 34 N -1.71 3.41 0.32 4.82 0.04 -1.26 0.19 135.00 140.81 1v86 s PRO 34 Ca -0.08 1.17 0.25 0.00 0.04 0.00 0.00 61.00 62.38 1v86 s PRO 34 Cb -0.09 -2.05 0.56 0.00 0.04 0.00 0.00 34.50 32.96 1v86 s PRO 34 CO 0.00 -0.73 1.67 1.25 0.04 0.00 0.00 177.00 179.23 1v86 h LEU 35 N 0.52 0.00 -0.80 -3.56 5.85 -1.91 -2.97 115.31 112.44 1v86 h LEU 35 Ca -0.47 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.25 1v86 h LEU 35 Cb 1.22 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.25 1v86 h LEU 35 CO 0.58 0.00 0.00 -2.24 -0.34 0.00 0.00 178.44 176.44 1v86 h ASP 36 N 0.00 0.00 -3.16 1.25 3.04 -1.98 -2.95 116.42 112.62 1v86 h ASP 36 Ca 0.00 0.00 -0.53 0.00 -3.24 0.00 0.00 57.03 53.26 1v86 h ASP 36 Cb 0.87 0.00 0.08 0.00 -1.04 0.00 0.00 39.33 39.24 1v86 h ASP 36 CO 0.00 0.00 0.90 -1.20 -2.04 0.00 0.00 179.24 176.90 1v86 n SER 37 N -2.53 3.87 -4.78 4.15 7.64 -1.12 -4.85 113.62 115.99 1v86 n SER 37 Ca 0.02 1.13 -0.36 0.00 1.01 0.00 0.00 58.87 60.67 1v86 n SER 37 Cb 0.29 -1.59 -0.03 0.00 -1.01 0.00 0.00 64.21 61.87 1v86 n SER 37 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1v86 s THR 38 N 0.21 3.61 0.65 0.44 -4.23 -1.26 -2.17 115.64 112.89 1v86 s THR 38 Ca 0.66 1.21 0.24 0.00 -1.18 0.00 0.00 61.69 62.62 1v86 s THR 38 Cb -0.50 -3.62 0.26 0.00 1.34 0.00 0.00 72.50 69.99 1v86 s THR 38 CO 0.46 -0.01 1.72 1.23 -0.54 0.00 0.00 174.62 177.47 1v86 h GLY 39 N 2.36 0.00 0.96 3.99 0.00 -1.32 0.58 103.07 109.65 1v86 h GLY 39 Ca -0.49 0.00 -0.25 0.00 0.00 0.00 0.00 47.33 46.59 1v86 h GLY 39 CO 0.62 0.00 -1.08 0.23 0.00 0.00 0.00 176.54 176.30 1v86 h SER 40 N 0.00 0.66 -0.76 0.19 0.87 -1.78 -3.25 113.55 109.49 1v86 h SER 40 Ca 0.06 -0.91 0.19 0.00 -1.23 0.00 0.00 61.79 59.90 1v86 h SER 40 Cb 1.11 -0.21 -0.04 0.00 -0.44 0.00 0.00 62.40 62.82 1v86 h SER 40 CO -0.00 1.52 0.52 -0.33 -0.53 0.00 0.00 176.83 178.01 1v86 h GLU 41 N -0.09 0.22 -0.79 2.24 5.08 -0.18 -0.68 114.58 120.38 1v86 h GLU 41 Ca -0.18 -0.01 0.17 0.00 -1.00 0.00 0.00 59.36 58.33 1v86 h GLU 41 Cb 1.84 -0.05 -0.15 0.00 0.50 0.00 0.00 28.75 30.89 1v86 h GLU 41 CO 0.20 0.15 -0.12 -0.07 -1.00 0.00 0.00 179.01 178.17 1v86 h LEU 42 N 0.23 -0.60 -0.27 1.33 3.38 -1.54 1.48 115.31 119.33 1v86 h LEU 42 Ca 0.38 0.23 0.04 0.00 0.09 0.00 0.00 57.88 58.61 1v86 h LEU 42 Cb 1.14 0.45 -0.07 0.00 0.09 0.00 0.00 40.66 42.26 1v86 h LEU 42 CO -0.08 -0.24 -0.55 0.11 0.09 0.00 0.00 178.44 177.76 1v86 h LYS 43 N 0.03 -0.48 0.00 1.13 6.56 -1.31 1.63 116.57 124.13 1v86 h LYS 43 Ca 0.40 0.03 0.00 0.00 -1.06 0.00 0.00 60.65 60.02 1v86 h LYS 43 Cb 0.66 0.11 0.00 0.00 -0.57 0.00 0.00 32.23 32.43 1v86 h LYS 43 CO -0.77 -0.32 0.00 1.96 -2.06 0.00 0.00 179.45 178.26 1v86 h GLN 44 N -0.50 0.00 0.00 3.15 4.20 -0.93 0.32 115.11 121.36 1v86 h GLN 44 Ca 0.05 0.00 -0.17 0.00 0.06 0.00 0.00 58.65 58.59 1v86 h GLN 44 Cb 0.64 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.40 1v86 h GLN 44 CO -0.51 0.00 -0.81 -0.22 -0.67 0.00 0.00 178.83 176.61 1v86 h LYS 45 N 0.00 0.00 0.07 1.46 1.63 0.72 -2.49 116.57 117.96 1v86 h LYS 45 Ca 0.00 0.00 -0.30 0.00 -0.85 0.00 0.00 60.65 59.50 1v86 h LYS 45 Cb 0.40 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.00 1v86 h LYS 45 CO 0.00 0.81 -1.62 0.82 -3.45 0.00 0.00 179.45 176.01 1v86 h ILE 46 N 0.00 0.79 -0.11 2.00 2.04 0.30 -3.34 117.51 119.19 1v86 h ILE 46 Ca -0.01 -2.28 0.03 0.00 1.00 0.00 0.00 64.86 63.61 1v86 h ILE 46 Cb 1.57 2.40 -0.00 0.00 -0.74 0.00 0.00 36.82 40.05 1v86 h ILE 46 CO 0.11 0.63 0.10 -0.74 0.00 0.00 0.00 178.15 178.24 1v86 h HIS 47 N -0.43 0.00 0.00 1.37 -0.00 -0.50 1.45 115.15 117.04 1v86 h HIS 47 Ca -0.38 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 59.99 1v86 h HIS 47 Cb 1.69 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 29.10 1v86 h HIS 47 CO 0.09 0.00 0.00 0.43 -0.00 0.00 0.00 177.93 178.45 1v86 n SER 48 N -4.13 0.60 0.01 3.26 7.64 -0.94 -1.11 113.62 118.95 1v86 n SER 48 Ca -0.00 0.63 -0.03 0.00 1.01 0.00 0.00 58.87 60.48 1v86 n SER 48 Cb 0.21 -0.76 -0.01 0.00 -1.01 0.00 0.00 64.21 62.64 1v86 n SER 48 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1v86 n ILE 49 N -2.14 1.26 -0.14 0.44 5.41 0.19 -4.67 119.36 119.70 1v86 n ILE 49 Ca 0.03 0.32 0.16 0.00 1.00 0.00 0.00 62.75 64.26 1v86 n ILE 49 Cb 0.26 -1.79 0.53 0.00 -0.71 0.00 0.00 39.64 37.93 1v86 n ILE 49 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 176.55 177.26 1v86 h THR 50 N -0.28 0.79 0.00 1.39 1.35 0.15 -3.45 112.91 112.86 1v86 h THR 50 Ca 0.00 -0.12 0.00 0.00 -0.55 0.00 0.00 66.41 65.74 1v86 h THR 50 Cb 0.28 0.39 0.00 0.00 -1.73 0.00 0.00 68.15 67.10 1v86 h THR 50 CO 0.00 0.07 0.00 0.61 -0.25 0.00 0.00 175.52 175.95 1v86 n GLY 51 N -1.54 2.52 3.67 5.82 0.00 -0.27 -5.00 105.19 110.39 1v86 n GLY 51 Ca 0.14 -0.10 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 1v86 n GLY 51 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1v86 s LEU 52 N 0.00 1.71 0.48 0.99 2.34 -1.26 -4.93 118.68 118.00 1v86 s LEU 52 Ca 0.00 1.30 -0.21 0.00 0.06 0.00 0.00 54.13 55.29 1v86 s LEU 52 Cb 0.00 -3.52 -0.09 0.00 -0.56 0.00 0.00 46.19 42.02 1v86 s LEU 52 CO 0.00 -3.11 1.04 -2.16 -1.06 0.00 0.00 176.35 171.06 1v86 s PRO 53 N -4.91 3.84 0.26 1.48 0.04 -1.26 -4.45 135.00 130.00 1v86 s PRO 53 Ca 0.65 1.37 0.12 0.00 0.04 0.00 0.00 61.00 63.18 1v86 s PRO 53 Cb -0.19 -2.14 0.25 0.00 0.04 0.00 0.00 34.50 32.47 1v86 s PRO 53 CO 0.58 -0.40 1.54 -1.00 0.04 0.00 0.00 177.00 177.76 1v86 h PRO 54 N 1.65 0.00 -0.41 0.56 0.13 -1.95 -3.03 132.00 128.96 1v86 h PRO 54 Ca -0.49 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.64 1v86 h PRO 54 Cb 1.22 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.33 1v86 h PRO 54 CO 0.59 0.65 0.27 0.00 -0.23 0.00 0.00 178.00 179.29 1v86 h ALA 55 N 1.35 1.73 -0.80 -0.56 0.00 -1.96 -0.79 119.26 118.22 1v86 h ALA 55 Ca -0.01 -0.03 -0.45 0.00 0.00 0.00 0.00 54.91 54.43 1v86 h ALA 55 Cb 1.25 -0.16 -0.26 0.00 0.00 0.00 0.00 17.79 18.63 1v86 h ALA 55 CO 0.08 0.24 0.41 -1.33 0.00 0.00 0.00 179.25 178.66 1v86 n MET 56 N -4.48 2.25 -4.04 0.00 2.81 -1.15 -4.97 117.12 107.55 1v86 n MET 56 Ca 0.03 -3.16 -0.23 0.00 -1.81 0.00 0.00 57.70 52.53 1v86 n MET 56 Cb 0.07 -2.10 -0.06 0.00 -0.71 0.00 0.00 33.22 30.42 1v86 n MET 56 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 1v86 s GLN 57 N -3.38 2.35 -0.36 0.03 -0.21 -0.30 -4.38 119.66 113.42 1v86 s GLN 57 Ca 0.54 -1.62 0.01 0.00 0.02 0.00 0.00 55.36 54.31 1v86 s GLN 57 Cb 0.46 -2.15 0.11 0.00 1.00 0.00 0.00 33.01 32.43 1v86 s GLN 57 CO 0.06 0.01 0.14 0.15 -2.12 0.00 0.00 175.29 173.53 1v86 s LYS 58 N -3.90 1.02 -0.62 2.91 1.02 -1.26 -4.92 119.74 113.99 1v86 s LYS 58 Ca 0.40 -1.50 -0.21 0.00 0.02 0.00 0.00 55.97 54.67 1v86 s LYS 58 Cb -0.01 -2.29 0.08 0.00 -0.52 0.00 0.00 37.83 35.09 1v86 s LYS 58 CO 0.23 -1.04 0.86 0.08 -0.92 0.00 0.00 175.35 174.57 1v86 s VAL 59 N 1.09 4.51 -0.17 3.17 1.01 -1.26 -3.94 120.40 124.81 1v86 s VAL 59 Ca 0.12 -0.52 -0.06 0.00 0.00 0.00 0.00 61.98 61.52 1v86 s VAL 59 Cb -0.20 -4.59 0.08 0.00 0.00 0.00 0.00 36.38 31.67 1v86 s VAL 59 CO -0.14 -1.30 0.36 -0.04 0.00 0.00 0.00 175.10 173.98 1v86 s MET 60 N 3.55 0.26 -0.32 2.72 1.00 -1.25 -4.14 119.30 121.12 1v86 s MET 60 Ca 0.19 0.91 0.01 0.00 0.00 0.00 0.00 55.69 56.80 1v86 s MET 60 Cb -0.19 0.17 0.10 0.00 0.00 0.00 0.00 34.83 34.91 1v86 s MET 60 CO 0.10 -0.26 0.07 -0.47 0.00 0.00 0.00 175.02 174.46 1v86 s TYR 61 N 2.45 2.51 -0.54 -0.03 5.04 -1.26 -3.06 117.35 122.46 1v86 s TYR 61 Ca -0.01 -2.21 0.00 0.00 -2.44 0.00 0.00 57.07 52.41 1v86 s TYR 61 Cb -0.12 -2.16 0.00 0.00 0.35 0.00 0.00 41.96 40.04 1v86 s TYR 61 CO -0.11 -0.90 0.00 0.36 -1.34 0.00 0.00 175.55 173.56 1v86 n LYS 62 N 4.62 -2.11 0.00 4.97 2.85 -1.26 -4.65 118.16 122.57 1v86 n LYS 62 Ca -0.00 0.31 0.00 0.00 -1.05 0.00 0.00 58.31 57.56 1v86 n LYS 62 Cb 0.42 -4.70 0.00 0.00 -0.65 0.00 0.00 35.03 30.10 1v86 n LYS 62 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1v86 n GLY 63 N -0.46 3.93 3.66 2.58 0.00 -1.26 -5.12 105.19 108.52 1v86 n GLY 63 Ca -0.07 -0.97 -0.42 0.00 0.00 0.00 0.00 46.02 44.56 1v86 n GLY 63 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1v86 n LEU 64 N 0.00 3.08 -4.32 0.99 7.99 -1.26 -4.70 117.00 118.78 1v86 n LEU 64 Ca 0.00 1.15 -0.37 0.00 -0.01 0.00 0.00 56.01 56.78 1v86 n LEU 64 Cb 0.00 -1.42 -0.13 0.00 -0.11 0.00 0.00 43.42 41.76 1v86 n LEU 64 CO 0.00 -0.89 -0.29 -0.69 -1.51 0.00 0.00 177.39 174.01 1v86 s VAL 65 N -1.14 3.83 0.41 4.08 1.01 -1.26 -4.87 120.40 122.46 1v86 s VAL 65 Ca 0.58 -0.75 -0.23 0.00 0.00 0.00 0.00 61.98 61.58 1v86 s VAL 65 Cb -0.58 -2.98 -0.09 0.00 0.00 0.00 0.00 36.38 32.73 1v86 s VAL 65 CO 0.60 0.08 1.05 -2.16 0.00 0.00 0.00 175.10 174.68 1v86 s PRO 66 N 1.47 4.10 -0.07 2.72 0.04 -1.26 -4.97 135.00 137.04 1v86 s PRO 66 Ca 0.02 1.50 0.09 0.00 0.04 0.00 0.00 61.00 62.66 1v86 s PRO 66 Cb -0.17 -2.48 -0.24 0.00 0.04 0.00 0.00 34.50 31.65 1v86 s PRO 66 CO 0.02 -0.20 0.58 0.39 0.04 0.00 0.00 177.00 177.83 1v86 n GLU 67 N -0.20 0.66 0.25 4.56 1.02 -1.26 -3.86 120.64 121.80 1v86 n GLU 67 Ca 0.06 0.28 0.10 0.00 -0.02 0.00 0.00 57.16 57.58 1v86 n GLU 67 Cb 0.50 -1.76 0.63 0.00 -0.02 0.00 0.00 31.44 30.79 1v86 n GLU 67 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 1v86 h ASP 68 N 0.01 0.00 -3.34 1.62 3.32 -1.95 -3.30 116.42 112.79 1v86 h ASP 68 Ca -0.32 0.00 -0.66 0.00 0.02 0.00 0.00 57.03 56.07 1v86 h ASP 68 Cb 2.03 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 41.45 1v86 h ASP 68 CO 0.08 0.17 -0.64 -0.54 -1.72 0.00 0.00 179.24 176.58 1v86 s LYS 69 N -4.20 2.75 0.67 3.56 -0.14 -1.25 -4.93 119.74 116.20 1v86 s LYS 69 Ca -0.03 -0.67 -0.07 0.00 -1.36 0.00 0.00 55.97 53.85 1v86 s LYS 69 Cb 0.13 -2.65 0.04 0.00 -1.68 0.00 0.00 37.83 33.68 1v86 s LYS 69 CO 0.62 0.60 0.98 0.95 -0.76 0.00 0.00 175.35 177.74 1v86 s THR 70 N -1.17 2.77 0.14 2.17 -4.23 -1.26 -1.44 115.64 112.63 1v86 s THR 70 Ca 0.22 -0.14 -0.28 0.00 -1.18 0.00 0.00 61.69 60.30 1v86 s THR 70 Cb -0.12 -3.17 -0.03 0.00 1.34 0.00 0.00 72.50 70.53 1v86 s THR 70 CO 0.13 -0.18 1.58 -0.07 -0.54 0.00 0.00 174.62 175.54 1v86 h LEU 71 N -0.47 -1.42 -2.01 4.79 3.38 -1.52 1.97 115.31 120.03 1v86 h LEU 71 Ca -0.45 0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1v86 h LEU 71 Cb 1.29 0.60 0.00 0.00 0.09 0.00 0.00 40.66 42.64 1v86 h LEU 71 CO 0.61 -0.39 0.28 -0.09 0.09 0.00 0.00 178.44 178.93 1v86 h ARG 72 N -0.40 0.00 0.01 1.13 2.43 -1.79 0.45 114.38 116.20 1v86 h ARG 72 Ca 0.11 0.00 -0.34 0.00 -0.81 0.00 0.00 59.98 58.94 1v86 h ARG 72 Cb 0.60 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 30.09 1v86 h ARG 72 CO -0.51 0.00 -2.11 0.39 -1.51 0.00 0.00 179.97 176.24 1v86 n GLU 73 N -2.83 0.67 -0.00 0.20 1.02 0.39 -3.94 120.64 116.15 1v86 n GLU 73 Ca -0.02 0.14 0.13 0.00 -0.02 0.00 0.00 57.16 57.39 1v86 n GLU 73 Cb 0.33 -1.64 0.79 0.00 -0.02 0.00 0.00 31.44 30.90 1v86 n GLU 73 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 1v86 n ILE 74 N -2.94 0.00 -1.79 -3.67 -6.64 0.57 -4.87 119.36 100.03 1v86 n ILE 74 Ca -0.27 -0.01 -0.01 0.00 -1.77 0.00 0.00 62.75 60.69 1v86 n ILE 74 Cb 1.10 -0.40 0.00 0.00 -1.44 0.00 0.00 39.64 38.90 1v86 n ILE 74 CO 0.00 0.00 0.00 0.29 -1.77 0.00 0.00 176.55 175.07 1v86 n LYS 75 N -0.89 -0.36 -4.40 6.28 5.02 -0.04 -5.03 118.16 118.74 1v86 n LYS 75 Ca 0.20 0.76 -0.28 0.00 -2.02 0.00 0.00 58.31 56.97 1v86 n LYS 75 Cb 0.10 -2.34 -0.12 0.00 -0.02 0.00 0.00 35.03 32.65 1v86 n LYS 75 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1v86 s VAL 76 N -2.20 2.36 0.22 -0.18 1.01 -0.92 -4.99 120.40 115.70 1v86 s VAL 76 Ca 0.02 -1.89 0.04 0.00 0.00 0.00 0.00 61.98 60.15 1v86 s VAL 76 Cb -0.01 -2.10 -0.01 0.00 0.00 0.00 0.00 36.38 34.26 1v86 s VAL 76 CO 0.15 -0.03 0.14 0.35 0.00 0.00 0.00 175.10 175.71 1v86 n THR 77 N 0.53 0.00 -2.84 3.92 -2.24 -1.26 -4.76 114.28 107.63 1v86 n THR 77 Ca -0.15 -1.44 -0.43 0.00 -2.27 0.00 0.00 64.05 59.77 1v86 n THR 77 Cb 0.55 0.64 -0.04 0.00 -2.10 0.00 0.00 70.33 69.37 1v86 n THR 77 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1v86 s SER 78 N -2.43 6.29 0.00 3.42 0.15 -1.26 -3.47 113.70 116.40 1v86 s SER 78 Ca 0.19 -0.52 0.00 0.00 0.70 0.00 0.00 55.95 56.32 1v86 s SER 78 Cb 0.01 -2.43 0.00 0.00 -1.71 0.00 0.00 66.02 61.89 1v86 s SER 78 CO 0.14 -1.30 0.00 0.61 1.20 0.00 0.00 173.24 173.89 1v86 n GLY 79 N 5.18 1.86 3.57 9.45 0.00 0.32 -4.88 105.19 120.69 1v86 n GLY 79 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1v86 n GLY 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v86 s ALA 80 N -2.00 0.54 0.11 4.61 0.00 -1.22 -4.83 121.76 118.96 1v86 s ALA 80 Ca 0.00 -1.06 0.07 0.00 0.00 0.00 0.00 51.96 50.97 1v86 s ALA 80 Cb 0.00 -2.84 -0.04 0.00 0.00 0.00 0.00 23.12 20.25 1v86 s ALA 80 CO 0.00 -3.74 -0.17 0.15 0.00 0.00 0.00 175.76 172.00 1v86 s LYS 81 N -5.49 1.04 -0.23 0.00 3.01 -1.26 -2.45 119.74 114.35 1v86 s LYS 81 Ca 0.72 -1.16 -0.03 0.00 -1.01 0.00 0.00 55.97 54.48 1v86 s LYS 81 Cb -0.08 -1.10 0.07 0.00 -1.01 0.00 0.00 37.83 35.71 1v86 s LYS 81 CO 0.56 0.24 0.08 0.42 0.51 0.00 0.00 175.35 177.16 1v86 s ILE 82 N -1.58 0.27 -0.58 2.17 -1.09 -0.33 -4.64 121.20 115.42 1v86 s ILE 82 Ca 0.06 -0.62 -0.25 0.00 -2.23 0.00 0.00 60.65 57.61 1v86 s ILE 82 Cb -0.08 -0.99 0.04 0.00 -1.58 0.00 0.00 42.46 39.85 1v86 s ILE 82 CO 0.04 -0.42 1.01 -0.32 -1.23 0.00 0.00 174.94 174.02 1v86 s MET 83 N 1.96 3.34 0.26 2.79 1.75 -1.17 0.16 119.30 128.38 1v86 s MET 83 Ca 0.04 -0.22 0.06 0.00 -1.25 0.00 0.00 55.69 54.32 1v86 s MET 83 Cb -0.17 -4.07 -0.03 0.00 2.84 0.00 0.00 34.83 33.41 1v86 s MET 83 CO -0.17 -1.59 0.30 0.08 -0.65 0.00 0.00 175.02 172.99 1v86 s VAL 84 N 4.24 4.69 0.13 10.11 1.01 0.32 -3.96 120.40 136.93 1v86 s VAL 84 Ca 0.32 -1.18 0.03 0.00 0.00 0.00 0.00 61.98 61.15 1v86 s VAL 84 Cb -0.12 -3.59 -0.01 0.00 0.00 0.00 0.00 36.38 32.67 1v86 s VAL 84 CO 0.19 -0.31 0.09 0.55 0.00 0.00 0.00 175.10 175.63 1v86 n VAL 85 N -1.34 0.00 -0.49 2.92 3.14 -1.26 -4.31 118.33 116.98 1v86 n VAL 85 Ca -0.07 -0.90 0.00 0.00 -2.96 0.00 0.00 64.34 60.41 1v86 n VAL 85 Cb 0.58 0.42 0.00 0.00 -1.06 0.00 0.00 33.84 33.77 1v86 n VAL 85 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1v86 n GLY 86 N 0.15 -2.91 3.63 7.55 0.00 -1.26 -4.59 105.19 107.75 1v86 n GLY 86 Ca 0.01 -1.77 -0.07 0.00 0.00 0.00 0.00 46.02 44.20 1v86 n GLY 86 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1v86 s SER 87 N -1.76 -0.28 0.00 1.61 0.15 -1.26 -4.94 113.70 107.22 1v86 s SER 87 Ca 0.00 0.46 -0.13 0.00 0.70 0.00 0.00 55.95 56.99 1v86 s SER 87 Cb 0.00 0.44 0.02 0.00 -1.71 0.00 0.00 66.02 64.77 1v86 s SER 87 CO 0.00 -0.15 0.27 0.28 1.20 0.00 0.00 173.24 174.83 1v86 s THR 88 N -0.32 0.07 -0.36 6.45 -1.32 -1.26 -5.08 115.64 113.81 1v86 s THR 88 Ca 0.04 -0.58 0.01 0.00 -1.21 0.00 0.00 61.69 59.95 1v86 s THR 88 Cb -0.03 -0.66 0.15 0.00 -1.51 0.00 0.00 72.50 70.45 1v86 s THR 88 CO -0.07 -0.32 0.26 -0.63 -2.21 0.00 0.00 174.62 171.66 1v86 s ILE 89 N -1.63 0.07 0.19 5.08 1.01 -1.26 -5.04 121.20 119.62 1v86 s ILE 89 Ca -0.12 -1.71 -0.24 0.00 0.00 0.00 0.00 60.65 58.58 1v86 s ILE 89 Cb -0.05 -1.04 0.05 0.00 0.01 0.00 0.00 42.46 41.43 1v86 s ILE 89 CO 0.02 -0.95 0.90 -0.94 0.00 0.00 0.00 174.94 173.97 1v86 s SER 90 N 0.99 -0.18 -0.31 3.58 1.04 -1.26 -5.15 113.70 112.41 1v86 s SER 90 Ca 0.20 -0.50 -0.07 0.00 0.48 0.00 0.00 55.95 56.07 1v86 s SER 90 Cb -0.18 0.56 0.19 0.00 0.10 0.00 0.00 66.02 66.69 1v86 s SER 90 CO -0.03 -1.05 0.94 -0.83 0.98 0.00 0.00 173.24 173.26 1v86 s GLY 91 N -2.97 -1.14 -0.07 7.32 0.00 -1.26 -5.06 107.32 104.15 1v86 s GLY 91 Ca 0.13 1.64 -0.15 0.00 0.00 0.00 0.00 44.72 46.33 1v86 s GLY 91 CO 0.04 4.05 0.58 -0.56 0.00 0.00 0.00 173.10 177.21 1v86 h PRO 92 N 6.98 -0.23 -3.21 2.90 0.13 -2.05 -3.48 132.00 133.03 1v86 h PRO 92 Ca -0.06 0.02 -0.04 0.00 -0.87 0.00 0.00 66.00 65.05 1v86 h PRO 92 Cb 1.19 0.05 -0.13 0.00 0.13 0.00 0.00 31.00 32.24 1v86 h PRO 92 CO -0.04 0.07 0.03 0.45 -0.23 0.00 0.00 178.00 178.29 1v86 s SER 93 N -5.40 -0.37 -0.04 1.44 0.15 -1.26 -5.14 113.70 103.08 1v86 s SER 93 Ca -0.09 -0.17 -0.27 0.00 0.70 0.00 0.00 55.95 56.12 1v86 s SER 93 Cb 0.00 0.52 -0.03 0.00 -1.71 0.00 0.00 66.02 64.80 1v86 s SER 93 CO 0.31 -0.88 0.87 -0.94 1.20 0.00 0.00 173.24 173.80 1v86 s SER 94 N -2.72 7.20 0.00 5.45 1.04 -1.26 -5.27 113.70 118.14 1v86 s SER 94 Ca 0.02 1.46 0.00 0.00 0.48 0.00 0.00 55.95 57.90 1v86 s SER 94 Cb 0.01 -2.51 0.00 0.00 0.10 0.00 0.00 66.02 63.62 1v86 s SER 94 CO -0.12 -0.22 0.00 0.61 0.98 0.00 0.00 173.24 174.49