#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v86 s SER 2 N 0.00 -0.86 -0.09 1.61 1.04 -1.26 -5.15 113.70 108.99 1v86 s SER 2 Ca 0.00 1.41 0.03 0.00 0.48 0.00 0.00 55.95 57.87 1v86 s SER 2 Cb 0.00 1.30 0.01 0.00 0.10 0.00 0.00 66.02 67.43 1v86 s SER 2 CO 0.00 -0.23 -0.18 -0.94 0.98 0.00 0.00 173.24 172.87 1v86 s SER 3 N 1.44 2.43 -0.20 7.02 1.04 -1.26 -5.12 113.70 119.05 1v86 s SER 3 Ca -0.09 -0.43 -0.13 0.00 0.48 0.00 0.00 55.95 55.79 1v86 s SER 3 Cb -0.05 -1.11 -0.05 0.00 0.10 0.00 0.00 66.02 64.90 1v86 s SER 3 CO -0.16 0.09 0.25 -0.83 0.98 0.00 0.00 173.24 173.56 1v86 s GLY 4 N 0.56 2.08 -0.20 7.32 0.00 -1.26 -5.05 107.32 110.77 1v86 s GLY 4 Ca -0.16 -0.65 -0.33 0.00 0.00 0.00 0.00 44.72 43.58 1v86 s GLY 4 CO 0.05 0.46 1.21 -0.45 0.00 0.00 0.00 173.10 174.37 1v86 s SER 5 N 0.78 -0.15 0.14 1.64 0.15 -1.26 -5.19 113.70 109.81 1v86 s SER 5 Ca 0.13 0.06 -0.25 0.00 0.70 0.00 0.00 55.95 56.58 1v86 s SER 5 Cb -0.13 0.14 0.07 0.00 -1.71 0.00 0.00 66.02 64.39 1v86 s SER 5 CO 0.04 -0.21 0.95 -0.94 1.20 0.00 0.00 173.24 174.28 1v86 s SER 6 N -1.81 -0.19 0.00 5.45 1.04 -1.26 -5.18 113.70 111.74 1v86 s SER 6 Ca 0.08 -0.37 0.00 0.00 0.48 0.00 0.00 55.95 56.14 1v86 s SER 6 Cb -0.01 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.59 1v86 s SER 6 CO -0.05 -0.88 0.00 0.61 0.98 0.00 0.00 173.24 173.90 1v86 n GLY 7 N -0.45 -0.62 3.18 7.32 0.00 -1.26 -5.17 105.19 108.19 1v86 n GLY 7 Ca -0.06 -0.82 -0.11 0.00 0.00 0.00 0.00 46.02 45.03 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 -4.00 0.84 -0.42 1.61 2.15 -1.26 -5.09 116.67 110.50 1v86 s ASP 8 Ca 0.00 -1.13 0.09 0.00 0.43 0.00 0.00 52.55 51.94 1v86 s ASP 8 Cb 0.00 0.18 0.28 0.00 -0.30 0.00 0.00 42.92 43.08 1v86 s ASP 8 CO 0.00 -0.60 0.62 0.00 -0.17 0.00 0.00 175.17 175.03 1v86 n ALA 9 N -0.11 2.60 -0.17 3.66 0.00 -1.26 -5.11 120.51 120.11 1v86 n ALA 9 Ca -0.08 -3.61 0.00 0.00 0.00 0.00 0.00 53.44 49.74 1v86 n ALA 9 Cb 0.63 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 19.23 1v86 n ALA 9 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1v86 n GLY 10 N 0.95 0.70 0.00 0.00 0.00 -1.26 -5.00 105.19 100.58 1v86 n GLY 10 Ca 0.24 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.49 1v86 n GLY 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1v86 n GLY 11 N 0.00 0.77 0.00 -0.02 0.00 -1.26 -5.19 105.19 99.50 1v86 n GLY 11 Ca 0.00 0.33 0.00 0.00 0.00 0.00 0.00 46.02 46.35 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 3.25 2.68 -0.02 0.00 -1.26 -4.86 105.19 104.98 1v86 n GLY 12 Ca 0.00 -1.92 -0.30 0.00 0.00 0.00 0.00 46.02 43.81 1v86 n GLY 12 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1v86 s VAL 13 N -2.42 0.81 -0.04 1.61 1.01 -1.26 -4.93 120.40 115.17 1v86 s VAL 13 Ca 0.00 -1.58 -0.01 0.00 0.00 0.00 0.00 61.98 60.39 1v86 s VAL 13 Cb 0.00 -1.60 0.00 0.00 0.00 0.00 0.00 36.38 34.78 1v86 s VAL 13 CO 0.00 -0.75 0.04 0.61 0.00 0.00 0.00 175.10 174.99 1v86 n GLY 14 N 4.57 -1.86 1.14 4.51 0.00 -1.26 -4.95 105.19 107.33 1v86 n GLY 14 Ca 0.01 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1v86 n GLY 14 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1v86 n LYS 15 N -0.20 -3.26 -2.07 1.61 4.81 -1.26 -4.86 118.16 112.93 1v86 n LYS 15 Ca 0.01 2.41 -0.41 0.00 -0.87 0.00 0.00 58.31 59.45 1v86 n LYS 15 Cb 0.03 -2.71 -0.02 0.00 0.02 0.00 0.00 35.03 32.35 1v86 n LYS 15 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 1v86 s GLU 16 N -4.15 4.32 0.70 1.64 2.56 -1.26 -4.92 118.70 117.59 1v86 s GLU 16 Ca 0.00 2.26 -0.18 0.00 0.00 0.00 0.00 54.97 57.06 1v86 s GLU 16 Cb 0.00 -3.07 -0.15 0.00 2.00 0.00 0.00 34.13 32.92 1v86 s GLU 16 CO 0.00 -0.26 -0.37 1.28 -0.56 0.00 0.00 175.26 175.35 1v86 n LEU 17 N 0.98 -4.47 -4.82 2.70 7.99 -1.26 -4.89 117.00 113.23 1v86 n LEU 17 Ca 0.01 0.47 -0.38 0.00 -0.01 0.00 0.00 56.01 56.11 1v86 n LEU 17 Cb 0.41 -0.82 -0.06 0.00 -0.11 0.00 0.00 43.42 42.84 1v86 n LEU 17 CO 0.60 -5.23 0.30 0.54 -1.51 0.00 0.00 177.39 172.09 1v86 s VAL 18 N -2.00 4.71 -0.17 4.08 0.11 0.50 -4.72 120.40 122.91 1v86 s VAL 18 Ca 0.51 1.18 -0.27 0.00 -2.93 0.00 0.00 61.98 60.46 1v86 s VAL 18 Cb -0.37 -3.87 -0.01 0.00 -1.53 0.00 0.00 36.38 30.59 1v86 s VAL 18 CO 0.72 0.43 0.93 -1.81 -3.33 0.00 0.00 175.10 172.04 1v86 s ASP 19 N -1.33 7.06 0.01 3.54 1.11 -1.26 -2.30 116.67 123.50 1v86 s ASP 19 Ca 0.34 1.31 0.04 0.00 0.18 0.00 0.00 52.55 54.41 1v86 s ASP 19 Cb -0.18 -2.50 -0.01 0.00 1.07 0.00 0.00 42.92 41.29 1v86 s ASP 19 CO 0.20 -0.48 -0.13 -0.76 1.18 0.00 0.00 175.17 175.18 1v86 s LEU 20 N 2.39 2.09 -0.27 1.23 1.43 -1.10 -0.09 118.68 124.37 1v86 s LEU 20 Ca 0.42 -0.33 -0.12 0.00 -1.03 0.00 0.00 54.13 53.07 1v86 s LEU 20 Cb -0.17 -0.60 -0.05 0.00 0.03 0.00 0.00 46.19 45.41 1v86 s LEU 20 CO 0.12 0.09 0.22 -0.54 0.23 0.00 0.00 176.35 176.46 1v86 s LYS 21 N -0.69 3.97 -1.03 1.70 1.02 -1.17 -2.89 119.74 120.66 1v86 s LYS 21 Ca 0.03 -0.26 -0.22 0.00 0.02 0.00 0.00 55.97 55.53 1v86 s LYS 21 Cb -0.06 -3.65 0.06 0.00 -0.52 0.00 0.00 37.83 33.66 1v86 s LYS 21 CO 0.00 -0.17 1.44 0.42 -0.92 0.00 0.00 175.35 176.12 1v86 s ILE 22 N 1.74 4.00 -0.18 2.17 -1.09 -1.10 -1.65 121.20 125.09 1v86 s ILE 22 Ca 0.08 -0.89 -0.28 0.00 -2.23 0.00 0.00 60.65 57.34 1v86 s ILE 22 Cb -0.16 -5.04 -0.00 0.00 -1.58 0.00 0.00 42.46 35.68 1v86 s ILE 22 CO 0.10 -1.91 0.96 -0.63 -1.23 0.00 0.00 174.94 172.23 1v86 s ILE 23 N 4.75 4.77 -0.28 2.92 -1.09 0.17 -3.66 121.20 128.78 1v86 s ILE 23 Ca 0.45 1.88 0.00 0.00 -2.23 0.00 0.00 60.65 60.76 1v86 s ILE 23 Cb -0.00 -4.25 0.17 0.00 -1.58 0.00 0.00 42.46 36.80 1v86 s ILE 23 CO -0.09 -0.07 0.50 0.86 -1.23 0.00 0.00 174.94 174.91 1v86 s TRP 24 N 2.59 -1.31 0.00 3.97 -0.00 -1.24 0.13 118.94 123.08 1v86 s TRP 24 Ca 0.43 1.09 0.00 0.00 -0.00 0.00 0.00 56.10 57.61 1v86 s TRP 24 Cb -0.16 0.23 0.00 0.00 -0.00 0.00 0.00 33.47 33.53 1v86 s TRP 24 CO 0.11 -0.89 0.00 -1.71 -0.00 0.00 0.00 176.95 174.46 1v86 n ASN 25 N 5.39 0.00 -1.61 5.86 2.85 -1.25 -1.88 115.26 124.62 1v86 n ASN 25 Ca -0.00 0.00 -0.01 0.00 -0.11 0.00 0.00 54.58 54.46 1v86 n ASN 25 Cb 0.51 0.00 0.02 0.00 1.24 0.00 0.00 39.78 41.55 1v86 n ASN 25 CO 0.00 0.00 0.00 2.29 -2.11 0.00 0.00 177.26 177.44 1v86 n LYS 26 N 0.00 0.27 -4.29 1.20 2.85 -1.26 -5.15 118.16 111.78 1v86 n LYS 26 Ca 0.00 -0.27 -0.26 0.00 -1.05 0.00 0.00 58.31 56.73 1v86 n LYS 26 Cb 0.00 0.16 -0.09 0.00 -0.65 0.00 0.00 35.03 34.45 1v86 n LYS 26 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 177.40 178.30 1v86 s THR 27 N 0.03 3.29 -0.32 0.58 -4.23 -0.79 -5.11 115.64 109.09 1v86 s THR 27 Ca 0.02 -1.72 -0.02 0.00 -1.18 0.00 0.00 61.69 58.79 1v86 s THR 27 Cb 0.09 -2.67 0.11 0.00 1.34 0.00 0.00 72.50 71.37 1v86 s THR 27 CO -0.03 -0.19 0.16 -1.59 -0.54 0.00 0.00 174.62 172.43 1v86 s LYS 28 N -3.08 0.45 -0.38 3.99 -2.85 -1.25 -3.64 119.74 112.97 1v86 s LYS 28 Ca 0.27 -0.95 -0.10 0.00 -1.00 0.00 0.00 55.97 54.19 1v86 s LYS 28 Cb -0.08 -1.41 0.04 0.00 -2.06 0.00 0.00 37.83 34.33 1v86 s LYS 28 CO 0.17 -1.08 0.21 -1.01 0.10 0.00 0.00 175.35 173.73 1v86 s HIS 29 N 1.60 3.27 -0.37 1.78 3.76 -1.24 -4.89 115.29 119.19 1v86 s HIS 29 Ca 0.12 -1.18 -0.29 0.00 -0.15 0.00 0.00 55.06 53.57 1v86 s HIS 29 Cb -0.19 -2.55 0.00 0.00 1.11 0.00 0.00 32.58 30.95 1v86 s HIS 29 CO -0.21 -0.71 1.49 -0.51 -0.85 0.00 0.00 174.74 173.94 1v86 s ASP 30 N 1.68 6.28 -0.00 1.40 1.11 -1.26 -2.70 116.67 123.18 1v86 s ASP 30 Ca 0.02 1.01 0.07 0.00 0.18 0.00 0.00 52.55 53.83 1v86 s ASP 30 Cb -0.20 -2.54 -0.02 0.00 1.07 0.00 0.00 42.92 41.23 1v86 s ASP 30 CO 0.05 -1.44 -0.22 0.68 1.18 0.00 0.00 175.17 175.42 1v86 s VAL 31 N 5.60 1.75 -0.36 -1.27 -7.23 -1.14 -5.03 120.40 112.72 1v86 s VAL 31 Ca 0.65 -1.02 -0.11 0.00 -1.81 0.00 0.00 61.98 59.69 1v86 s VAL 31 Cb -0.16 -1.47 0.02 0.00 0.56 0.00 0.00 36.38 35.32 1v86 s VAL 31 CO 0.32 0.43 0.20 -1.59 -0.31 0.00 0.00 175.10 174.15 1v86 s LYS 32 N -0.69 3.00 0.08 4.82 -2.85 -1.26 -2.70 119.74 120.14 1v86 s LYS 32 Ca 0.09 -0.96 0.05 0.00 -1.00 0.00 0.00 55.97 54.15 1v86 s LYS 32 Cb -0.09 -3.71 -0.03 0.00 -2.06 0.00 0.00 37.83 31.94 1v86 s LYS 32 CO -0.00 -0.62 -0.14 0.14 0.10 0.00 0.00 175.35 174.83 1v86 s VAL 33 N 1.59 1.14 0.78 1.79 -7.23 -0.97 -4.86 120.40 112.63 1v86 s VAL 33 Ca 0.03 -1.37 -0.11 0.00 -1.81 0.00 0.00 61.98 58.72 1v86 s VAL 33 Cb -0.19 -1.14 0.06 0.00 0.56 0.00 0.00 36.38 35.67 1v86 s VAL 33 CO 0.07 -0.26 1.09 -2.16 -0.31 0.00 0.00 175.10 173.53 1v86 s PRO 34 N -1.89 2.24 -0.09 4.82 0.04 -1.26 0.19 135.00 139.04 1v86 s PRO 34 Ca -0.00 0.69 0.08 0.00 0.04 0.00 0.00 61.00 61.81 1v86 s PRO 34 Cb -0.09 -1.93 0.40 0.00 0.04 0.00 0.00 34.50 32.92 1v86 s PRO 34 CO 0.02 -1.52 1.19 -0.11 0.04 0.00 0.00 177.00 176.61 1v86 n LEU 35 N -3.38 3.08 -0.09 -3.56 7.94 -1.26 -3.39 117.00 116.34 1v86 n LEU 35 Ca 0.07 -1.56 0.09 0.00 -1.11 0.00 0.00 56.01 53.51 1v86 n LEU 35 Cb 0.56 -0.50 -0.09 0.00 0.53 0.00 0.00 43.42 43.92 1v86 n LEU 35 CO 0.56 0.46 0.02 -0.67 -1.11 0.00 0.00 177.39 176.66 1v86 n ASP 36 N 0.41 1.11 -4.68 1.96 2.03 -1.26 -3.35 116.55 112.77 1v86 n ASP 36 Ca 0.14 -1.05 -0.42 0.00 0.52 0.00 0.00 54.79 53.97 1v86 n ASP 36 Cb 0.63 0.89 -0.03 0.00 -0.72 0.00 0.00 41.12 41.89 1v86 n ASP 36 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 1v86 s SER 37 N -2.70 6.65 0.39 1.67 0.01 -1.22 -4.89 113.70 113.62 1v86 s SER 37 Ca 0.09 2.36 -0.25 0.00 1.31 0.00 0.00 55.95 59.46 1v86 s SER 37 Cb 0.15 -2.55 -0.09 0.00 0.21 0.00 0.00 66.02 63.74 1v86 s SER 37 CO 0.73 -0.88 1.14 0.42 0.41 0.00 0.00 173.24 175.06 1v86 s THR 38 N 3.04 3.28 0.60 1.44 -4.23 -1.26 -2.34 115.64 116.18 1v86 s THR 38 Ca 0.73 1.07 0.28 0.00 -1.18 0.00 0.00 61.69 62.59 1v86 s THR 38 Cb -0.37 -3.60 0.38 0.00 1.34 0.00 0.00 72.50 70.26 1v86 s THR 38 CO 0.31 0.09 1.62 1.23 -0.54 0.00 0.00 174.62 177.33 1v86 h GLY 39 N 2.70 0.00 1.46 3.99 0.00 -1.64 1.45 103.07 111.03 1v86 h GLY 39 Ca -0.48 0.00 -0.30 0.00 0.00 0.00 0.00 47.33 46.54 1v86 h GLY 39 CO 0.63 0.00 -1.34 0.23 0.00 0.00 0.00 176.54 176.06 1v86 h SER 40 N 0.00 0.63 0.26 0.19 0.87 -1.84 -3.24 113.55 110.42 1v86 h SER 40 Ca 0.34 -0.66 -0.07 0.00 -1.23 0.00 0.00 61.79 60.17 1v86 h SER 40 Cb 1.99 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 63.73 1v86 h SER 40 CO -0.00 1.51 -0.30 -0.33 -0.53 0.00 0.00 176.83 177.18 1v86 h GLU 41 N 0.12 0.08 -0.95 2.24 5.08 0.16 -2.93 114.58 118.38 1v86 h GLU 41 Ca -0.19 -0.03 0.25 0.00 -1.00 0.00 0.00 59.36 58.39 1v86 h GLU 41 Cb 2.05 -0.01 -0.17 0.00 0.50 0.00 0.00 28.75 31.11 1v86 h GLU 41 CO 0.24 0.38 0.00 -0.07 -1.00 0.00 0.00 179.01 178.55 1v86 h LEU 42 N 0.07 -0.49 -0.19 1.33 3.38 -1.23 0.22 115.31 118.40 1v86 h LEU 42 Ca 0.01 0.27 0.02 0.00 0.09 0.00 0.00 57.88 58.27 1v86 h LEU 42 Cb 0.57 0.47 -0.03 0.00 0.09 0.00 0.00 40.66 41.76 1v86 h LEU 42 CO 0.04 -0.32 -0.20 0.11 0.09 0.00 0.00 178.44 178.16 1v86 h LYS 43 N 0.03 -0.11 -0.07 1.13 1.79 -1.70 1.22 116.57 118.86 1v86 h LYS 43 Ca 0.56 0.01 0.02 0.00 -2.18 0.00 0.00 60.65 59.05 1v86 h LYS 43 Cb 1.10 0.02 -0.00 0.00 -1.58 0.00 0.00 32.23 31.77 1v86 h LYS 43 CO -0.89 -0.07 0.11 1.96 -1.08 0.00 0.00 179.45 179.49 1v86 h GLN 44 N -0.11 0.00 0.00 3.15 4.20 -1.01 1.16 115.11 122.50 1v86 h GLN 44 Ca 0.03 0.00 -0.15 0.00 0.06 0.00 0.00 58.65 58.60 1v86 h GLN 44 Cb 0.19 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.95 1v86 h GLN 44 CO -0.24 0.00 -0.69 -0.22 -0.67 0.00 0.00 178.83 177.01 1v86 h LYS 45 N 0.00 0.00 0.01 1.46 1.63 0.35 -1.77 116.57 118.25 1v86 h LYS 45 Ca 0.03 0.00 -0.29 0.00 -0.85 0.00 0.00 60.65 59.54 1v86 h LYS 45 Cb 0.26 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 31.85 1v86 h LYS 45 CO -0.00 0.69 -1.60 -0.89 -3.45 0.00 0.00 179.45 174.20 1v86 n ILE 46 N -3.60 1.55 -0.34 2.00 5.41 0.35 -4.21 119.36 120.52 1v86 n ILE 46 Ca -0.01 -0.15 0.11 0.00 1.00 0.00 0.00 62.75 63.70 1v86 n ILE 46 Cb 0.71 -1.98 0.31 0.00 -0.71 0.00 0.00 39.64 37.97 1v86 n ILE 46 CO 0.00 0.00 0.00 -0.74 0.00 0.00 0.00 176.55 175.81 1v86 h HIS 47 N -0.92 1.03 0.00 1.39 -0.00 0.10 1.76 115.15 118.51 1v86 h HIS 47 Ca -0.44 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 59.97 1v86 h HIS 47 Cb 1.43 -0.32 0.00 0.00 -0.00 0.00 0.00 27.41 28.52 1v86 h HIS 47 CO 0.06 0.33 0.16 0.77 -0.00 0.00 0.00 177.93 179.25 1v86 h SER 48 N 0.82 0.00 0.00 3.26 0.02 -1.49 1.12 113.55 117.29 1v86 h SER 48 Ca 0.52 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.47 1v86 h SER 48 Cb 0.73 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.27 1v86 h SER 48 CO -0.30 0.00 -0.31 -0.38 -1.14 0.00 0.00 176.83 174.71 1v86 n ILE 49 N -2.70 1.28 -0.07 3.27 5.41 0.28 -4.67 119.36 122.16 1v86 n ILE 49 Ca -0.02 0.32 0.15 0.00 1.00 0.00 0.00 62.75 64.20 1v86 n ILE 49 Cb 0.21 -1.81 0.57 0.00 -0.71 0.00 0.00 39.64 37.90 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 -0.31 0.82 0.00 1.39 1.35 0.23 -3.45 112.91 112.94 1v86 h THR 50 Ca 0.00 -0.09 0.00 0.00 -0.55 0.00 0.00 66.41 65.77 1v86 h THR 50 Cb 0.31 0.53 0.00 0.00 -1.73 0.00 0.00 68.15 67.25 1v86 h THR 50 CO 0.00 0.05 0.00 0.61 -0.25 0.00 0.00 175.52 175.93 1v86 n GLY 51 N -1.56 0.34 3.97 5.82 0.00 0.39 -4.98 105.19 109.17 1v86 n GLY 51 Ca 0.11 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.91 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 3.52 0.44 0.99 2.34 -1.26 -5.03 118.68 119.67 1v86 s LEU 52 Ca 0.00 0.05 -0.22 0.00 0.06 0.00 0.00 54.13 54.02 1v86 s LEU 52 Cb 0.00 -2.96 -0.09 0.00 -0.56 0.00 0.00 46.19 42.59 1v86 s LEU 52 CO 0.00 -0.87 1.05 -2.16 -1.06 0.00 0.00 176.35 173.31 1v86 s PRO 53 N -4.59 4.01 0.21 1.48 0.04 -1.26 -4.60 135.00 130.29 1v86 s PRO 53 Ca 0.52 1.46 0.07 0.00 0.04 0.00 0.00 61.00 63.09 1v86 s PRO 53 Cb -0.10 -2.36 0.12 0.00 0.04 0.00 0.00 34.50 32.20 1v86 s PRO 53 CO 0.37 -0.27 1.47 -1.00 0.04 0.00 0.00 177.00 177.61 1v86 h PRO 54 N 2.11 0.08 -0.18 0.56 0.13 -1.96 -3.01 132.00 129.73 1v86 h PRO 54 Ca -0.49 -0.08 0.04 0.00 -0.87 0.00 0.00 66.00 64.60 1v86 h PRO 54 Cb 1.22 0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.36 1v86 h PRO 54 CO 0.61 0.81 0.13 0.00 -0.23 0.00 0.00 178.00 179.32 1v86 h ALA 55 N 1.16 2.08 -0.73 -0.56 0.00 -2.00 -0.44 119.26 118.77 1v86 h ALA 55 Ca -0.02 -0.01 -0.47 0.00 0.00 0.00 0.00 54.91 54.42 1v86 h ALA 55 Cb 1.36 -0.01 -0.27 0.00 0.00 0.00 0.00 17.79 18.87 1v86 h ALA 55 CO 0.11 -0.12 0.13 -1.33 0.00 0.00 0.00 179.25 178.03 1v86 n MET 56 N -4.50 2.57 -4.17 0.00 2.81 -1.14 -4.99 117.12 107.70 1v86 n MET 56 Ca 0.01 -3.43 -0.26 0.00 -1.81 0.00 0.00 57.70 52.20 1v86 n MET 56 Cb 0.21 -2.12 -0.07 0.00 -0.71 0.00 0.00 33.22 30.53 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 -3.52 2.54 -0.44 0.03 -0.21 -0.18 -3.66 119.66 114.23 1v86 s GLN 57 Ca 0.54 -1.04 0.02 0.00 0.02 0.00 0.00 55.36 54.90 1v86 s GLN 57 Cb 0.45 -2.44 0.13 0.00 1.00 0.00 0.00 33.01 32.15 1v86 s GLN 57 CO 0.02 0.46 0.21 0.15 -2.12 0.00 0.00 175.29 174.02 1v86 s LYS 58 N -2.98 1.41 -0.66 2.91 1.02 -1.23 -4.89 119.74 115.32 1v86 s LYS 58 Ca 0.28 -2.05 -0.22 0.00 0.02 0.00 0.00 55.97 54.00 1v86 s LYS 58 Cb -0.09 -2.62 0.07 0.00 -0.52 0.00 0.00 37.83 34.67 1v86 s LYS 58 CO 0.20 -1.11 0.96 0.08 -0.92 0.00 0.00 175.35 174.56 1v86 s VAL 59 N 0.38 4.33 -0.17 3.17 1.01 -1.26 -3.99 120.40 123.87 1v86 s VAL 59 Ca 0.16 -0.38 -0.06 0.00 0.00 0.00 0.00 61.98 61.70 1v86 s VAL 59 Cb -0.24 -4.68 0.08 0.00 0.00 0.00 0.00 36.38 31.54 1v86 s VAL 59 CO -0.03 -1.46 0.36 -0.04 0.00 0.00 0.00 175.10 173.93 1v86 s MET 60 N 4.04 0.26 -0.31 2.72 1.00 -1.25 -4.10 119.30 121.66 1v86 s MET 60 Ca 0.22 0.91 0.01 0.00 0.00 0.00 0.00 55.69 56.83 1v86 s MET 60 Cb -0.17 0.17 0.10 0.00 0.00 0.00 0.00 34.83 34.93 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 2.43 2.51 -0.62 -0.03 5.04 -1.26 -3.49 117.35 121.94 1v86 s TYR 61 Ca -0.01 -2.20 0.00 0.00 -2.44 0.00 0.00 57.07 52.42 1v86 s TYR 61 Cb -0.12 -2.14 0.00 0.00 0.35 0.00 0.00 41.96 40.05 1v86 s TYR 61 CO -0.11 -0.89 0.00 1.63 -1.34 0.00 0.00 175.55 174.84 1v86 n LYS 62 N 4.62 -2.03 0.00 4.97 5.02 -1.26 -4.66 118.16 124.81 1v86 n LYS 62 Ca -0.01 0.35 0.00 0.00 -2.02 0.00 0.00 58.31 56.63 1v86 n LYS 62 Cb 0.42 -4.74 0.00 0.00 -0.02 0.00 0.00 35.03 30.70 1v86 n LYS 62 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1v86 n GLY 63 N -0.46 3.91 3.66 0.72 0.00 -1.26 -5.12 105.19 106.64 1v86 n GLY 63 Ca -0.07 -0.98 -0.42 0.00 0.00 0.00 0.00 46.02 44.54 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 3.05 -4.29 0.99 7.99 -1.26 -4.69 117.00 118.78 1v86 n LEU 64 Ca 0.00 1.15 -0.36 0.00 -0.01 0.00 0.00 56.01 56.79 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 -0.91 -0.32 -0.69 -1.51 0.00 0.00 177.39 173.95 1v86 s VAL 65 N -1.14 3.56 0.22 4.08 1.01 -1.26 -4.87 120.40 122.01 1v86 s VAL 65 Ca 0.58 -0.81 -0.30 0.00 0.00 0.00 0.00 61.98 61.45 1v86 s VAL 65 Cb -0.59 -2.83 -0.08 0.00 0.00 0.00 0.00 36.38 32.88 1v86 s VAL 65 CO 0.60 0.12 1.10 -2.16 0.00 0.00 0.00 175.10 174.76 1v86 s PRO 66 N 1.43 4.62 0.29 2.72 0.04 -1.26 -4.94 135.00 137.90 1v86 s PRO 66 Ca 0.02 1.75 0.22 0.00 0.04 0.00 0.00 61.00 63.03 1v86 s PRO 66 Cb -0.17 -3.24 0.13 0.00 0.04 0.00 0.00 34.50 31.26 1v86 s PRO 66 CO -0.00 0.14 1.27 0.93 0.04 0.00 0.00 177.00 179.38 1v86 h GLU 67 N 4.56 0.00 0.00 4.56 5.08 -1.97 -3.20 114.58 123.60 1v86 h GLU 67 Ca -0.45 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 1v86 h GLU 67 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1v86 h GLU 67 CO 0.70 0.04 0.00 -0.44 -1.00 0.00 0.00 179.01 178.32 1v86 h ASP 68 N 0.00 0.00 -4.43 1.42 5.19 -1.95 -3.30 116.42 113.35 1v86 h ASP 68 Ca -0.01 0.00 -0.67 0.00 -0.62 0.00 0.00 57.03 55.73 1v86 h ASP 68 Cb 1.06 0.00 -0.30 0.00 0.18 0.00 0.00 39.33 40.26 1v86 h ASP 68 CO 0.01 0.00 -0.88 -0.54 -3.12 0.00 0.00 179.24 174.71 1v86 s LYS 69 N -3.25 2.05 0.91 3.56 -0.14 -1.21 -4.98 119.74 116.68 1v86 s LYS 69 Ca 0.07 -0.86 -0.12 0.00 -1.36 0.00 0.00 55.97 53.70 1v86 s LYS 69 Cb 0.10 -1.92 0.14 0.00 -1.68 0.00 0.00 37.83 34.47 1v86 s LYS 69 CO 0.51 0.48 1.13 0.95 -0.76 0.00 0.00 175.35 177.66 1v86 s THR 70 N -0.47 2.11 0.09 2.17 -4.23 -1.26 -2.73 115.64 111.32 1v86 s THR 70 Ca 0.07 0.04 -0.29 0.00 -1.18 0.00 0.00 61.69 60.33 1v86 s THR 70 Cb -0.10 -2.75 -0.12 0.00 1.34 0.00 0.00 72.50 70.87 1v86 s THR 70 CO -0.00 -0.05 1.46 -0.07 -0.54 0.00 0.00 174.62 175.42 1v86 h LEU 71 N -1.51 -1.34 -1.74 4.79 3.38 -1.68 1.67 115.31 118.87 1v86 h LEU 71 Ca -0.51 0.14 0.23 0.00 0.09 0.00 0.00 57.88 57.83 1v86 h LEU 71 Cb 1.33 0.50 -0.03 0.00 0.09 0.00 0.00 40.66 42.54 1v86 h LEU 71 CO 0.61 -0.45 0.76 -0.09 0.09 0.00 0.00 178.44 179.36 1v86 h ARG 72 N -0.60 0.00 0.18 1.13 2.43 -1.80 0.77 114.38 116.49 1v86 h ARG 72 Ca -0.00 0.00 -0.35 0.00 -0.81 0.00 0.00 59.98 58.82 1v86 h ARG 72 Cb 0.62 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.17 1v86 h ARG 72 CO -0.26 0.00 -1.78 0.93 -1.51 0.00 0.00 179.97 177.35 1v86 h GLU 73 N 0.00 0.37 0.00 0.20 4.39 -0.66 -3.27 114.58 115.61 1v86 h GLU 73 Ca 0.37 -0.64 0.00 0.00 0.34 0.00 0.00 59.36 59.43 1v86 h GLU 73 Cb 1.88 0.24 0.00 0.00 -0.10 0.00 0.00 28.75 30.77 1v86 h GLU 73 CO -0.00 1.30 0.00 0.44 -1.16 0.00 0.00 179.01 179.58 1v86 n ILE 74 N -3.57 0.13 -1.29 3.13 -6.64 0.53 -4.89 119.36 106.76 1v86 n ILE 74 Ca -0.25 0.03 0.00 0.00 -1.77 0.00 0.00 62.75 60.76 1v86 n ILE 74 Cb 1.07 -0.64 0.00 0.00 -1.44 0.00 0.00 39.64 38.63 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 -1.14 0.00 -4.14 6.28 4.01 0.17 -5.03 118.16 118.31 1v86 n LYS 75 Ca 0.15 0.43 -0.16 0.00 -0.51 0.00 0.00 58.31 58.22 1v86 n LYS 75 Cb 0.14 -1.23 -0.12 0.00 -0.51 0.00 0.00 35.03 33.31 1v86 n LYS 75 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 1v86 s VAL 76 N -0.73 0.92 0.00 -0.18 1.01 -0.93 -4.94 120.40 115.54 1v86 s VAL 76 Ca 0.00 -1.27 0.00 0.00 0.00 0.00 0.00 61.98 60.71 1v86 s VAL 76 Cb 0.00 -0.96 0.00 0.00 0.00 0.00 0.00 36.38 35.42 1v86 s VAL 76 CO 0.00 -0.31 0.00 0.35 0.00 0.00 0.00 175.10 175.14 1v86 n THR 77 N 1.26 0.00 -2.60 3.92 -2.24 -1.26 -4.60 114.28 108.76 1v86 n THR 77 Ca -0.21 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.14 1v86 n THR 77 Cb 0.55 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.75 1v86 n THR 77 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1v86 s SER 78 N -0.52 6.58 0.00 3.42 0.01 -1.26 -3.16 113.70 118.77 1v86 s SER 78 Ca 0.00 0.36 0.00 0.00 1.31 0.00 0.00 55.95 57.62 1v86 s SER 78 Cb 0.00 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.68 1v86 s SER 78 CO 0.00 -1.31 0.00 0.61 0.41 0.00 0.00 173.24 172.95 1v86 n GLY 79 N 4.91 1.83 3.61 3.44 0.00 0.87 -4.89 105.19 114.96 1v86 n GLY 79 Ca 0.11 0.00 -0.41 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 3.57 0.58 4.61 0.00 -1.19 -4.93 121.76 122.40 1v86 s ALA 80 Ca 0.00 -0.61 -0.17 0.00 0.00 0.00 0.00 51.96 51.18 1v86 s ALA 80 Cb 0.00 -2.99 -0.04 0.00 0.00 0.00 0.00 23.12 20.08 1v86 s ALA 80 CO 0.00 -0.89 1.08 0.15 0.00 0.00 0.00 175.76 176.09 1v86 s LYS 81 N 2.45 3.30 -0.24 0.00 3.01 -1.26 -3.04 119.74 123.96 1v86 s LYS 81 Ca 0.23 1.34 -0.04 0.00 -1.01 0.00 0.00 55.97 56.50 1v86 s LYS 81 Cb -0.15 -2.02 0.08 0.00 -1.01 0.00 0.00 37.83 34.73 1v86 s LYS 81 CO 0.10 -0.84 0.10 0.42 0.51 0.00 0.00 175.35 175.64 1v86 s ILE 82 N -2.23 0.15 0.06 2.17 -1.09 -0.66 -4.74 121.20 114.86 1v86 s ILE 82 Ca 0.66 -0.65 -0.30 0.00 -2.23 0.00 0.00 60.65 58.14 1v86 s ILE 82 Cb -0.18 -0.97 -0.05 0.00 -1.58 0.00 0.00 42.46 39.68 1v86 s ILE 82 CO 0.33 -0.51 1.00 -0.04 -1.23 0.00 0.00 174.94 174.49 1v86 s MET 83 N 2.01 4.60 0.11 2.79 -1.94 -1.23 0.46 119.30 126.10 1v86 s MET 83 Ca 0.06 1.49 0.07 0.00 -1.71 0.00 0.00 55.69 55.60 1v86 s MET 83 Cb -0.16 -3.41 -0.03 0.00 2.01 0.00 0.00 34.83 33.24 1v86 s MET 83 CO -0.23 0.04 -0.19 0.08 -0.01 0.00 0.00 175.02 174.71 1v86 s VAL 84 N 0.55 1.58 -0.05 -6.03 1.01 0.35 -3.89 120.40 113.92 1v86 s VAL 84 Ca 0.51 -1.56 -0.13 0.00 0.00 0.00 0.00 61.98 60.80 1v86 s VAL 84 Cb -0.23 -1.49 0.02 0.00 0.00 0.00 0.00 36.38 34.68 1v86 s VAL 84 CO 0.29 -0.15 0.30 -0.69 0.00 0.00 0.00 175.10 174.85 1v86 s VAL 85 N -1.37 0.04 -3.57 2.92 1.01 -1.26 -3.95 120.40 114.22 1v86 s VAL 85 Ca 0.06 -0.33 0.00 0.00 0.00 0.00 0.00 61.98 61.72 1v86 s VAL 85 Cb -0.09 -0.54 0.00 0.00 0.00 0.00 0.00 36.38 35.75 1v86 s VAL 85 CO 0.04 -0.18 0.00 0.61 0.00 0.00 0.00 175.10 175.57 1v86 n GLY 86 N 1.87 -0.91 3.90 4.51 0.00 -1.24 -3.47 105.19 109.85 1v86 n GLY 86 Ca -0.19 -1.03 -0.31 0.00 0.00 0.00 0.00 46.02 44.49 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 -4.00 6.51 0.81 1.61 0.15 -1.26 -5.09 113.70 112.42 1v86 s SER 87 Ca 0.00 0.66 -0.11 0.00 0.70 0.00 0.00 55.95 57.19 1v86 s SER 87 Cb 0.00 -2.12 0.10 0.00 -1.71 0.00 0.00 66.02 62.29 1v86 s SER 87 CO 0.00 -0.01 1.17 0.42 1.20 0.00 0.00 173.24 176.02 1v86 s THR 88 N -1.75 2.06 0.00 6.45 -4.23 -1.26 -4.93 115.64 111.98 1v86 s THR 88 Ca 0.42 -0.07 0.00 0.00 -1.18 0.00 0.00 61.69 60.86 1v86 s THR 88 Cb -0.12 -2.99 0.00 0.00 1.34 0.00 0.00 72.50 70.73 1v86 s THR 88 CO 0.25 0.00 0.00 -0.38 -0.54 0.00 0.00 174.62 173.95 1v86 n ILE 89 N -3.30 0.00 -0.63 2.99 5.41 -1.26 -5.14 119.36 117.44 1v86 n ILE 89 Ca 0.09 0.00 0.08 0.00 1.00 0.00 0.00 62.75 63.92 1v86 n ILE 89 Cb 0.61 0.00 -0.03 0.00 -0.71 0.00 0.00 39.64 39.50 1v86 n ILE 89 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 1v86 n SER 90 N 0.00 -3.71 0.00 4.38 3.41 -1.26 -5.08 113.62 111.36 1v86 n SER 90 Ca 0.00 0.47 0.00 0.00 -0.26 0.00 0.00 58.87 59.08 1v86 n SER 90 Cb 0.00 -2.04 0.00 0.00 -0.26 0.00 0.00 64.21 61.91 1v86 n SER 90 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1v86 n GLY 91 N -3.25 0.80 0.08 5.00 0.00 -1.26 -4.80 105.19 101.76 1v86 n GLY 91 Ca -0.02 -2.00 -0.14 0.00 0.00 0.00 0.00 46.02 43.86 1v86 n GLY 91 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1v86 h PRO 92 N 0.00 0.09 -6.03 1.61 0.13 -2.06 -3.48 132.00 122.26 1v86 h PRO 92 Ca 0.00 -0.09 -0.24 0.00 -0.87 0.00 0.00 66.00 64.80 1v86 h PRO 92 Cb 0.00 0.02 0.01 0.00 0.13 0.00 0.00 31.00 31.16 1v86 h PRO 92 CO 0.00 0.82 -0.54 0.43 -0.23 0.00 0.00 178.00 178.48 1v86 n SER 93 N -4.63 -6.36 -2.17 1.44 7.64 -1.26 -4.87 113.62 103.42 1v86 n SER 93 Ca -0.09 -0.52 -0.24 0.00 1.01 0.00 0.00 58.87 59.03 1v86 n SER 93 Cb 0.43 -3.59 0.16 0.00 -1.01 0.00 0.00 64.21 60.19 1v86 n SER 93 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1v86 n SER 94 N -2.21 4.20 0.00 6.43 3.41 -1.26 -5.24 113.62 118.96 1v86 n SER 94 Ca -0.15 -3.54 0.00 0.00 -0.26 0.00 0.00 58.87 54.92 1v86 n SER 94 Cb 0.59 -0.84 0.00 0.00 -0.26 0.00 0.00 64.21 63.70 1v86 n SER 94 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49