#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uad n ARG 5 N 0.00 -1.58 -2.50 -1.46 5.12 -0.93 -4.99 116.66 110.32 1uad n ARG 5 Ca 0.00 -1.62 -0.27 0.00 -1.93 0.00 0.00 57.85 54.03 1uad n ARG 5 Cb 0.00 -1.20 0.02 0.00 -1.16 0.00 0.00 32.46 30.12 1uad n ARG 5 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 1uad s GLN 6 N -5.29 3.16 0.67 5.56 -0.21 -1.26 -4.33 119.66 117.96 1uad s GLN 6 Ca 0.61 0.06 -0.17 0.00 0.02 0.00 0.00 55.36 55.88 1uad s GLN 6 Cb -0.03 -2.32 0.00 0.00 1.00 0.00 0.00 33.01 31.66 1uad s GLN 6 CO 0.44 -0.50 1.26 -2.14 -2.12 0.00 0.00 175.29 172.23 1uad s PRO 7 N -4.88 2.46 0.40 2.91 0.02 -1.24 -4.38 135.00 130.29 1uad s PRO 7 Ca 0.51 1.96 -0.26 0.00 0.02 0.00 0.00 61.00 63.23 1uad s PRO 7 Cb -0.10 -1.85 -0.09 0.00 0.02 0.00 0.00 34.50 32.48 1uad s PRO 7 CO 0.45 -1.64 1.27 -2.14 -0.33 0.00 0.00 177.00 174.61 1uad s PRO 8 N -3.53 3.98 -0.22 5.54 0.02 -1.25 -4.73 135.00 134.81 1uad s PRO 8 Ca 0.80 2.07 -0.02 0.00 0.02 0.00 0.00 61.00 63.87 1uad s PRO 8 Cb -0.34 -2.73 0.07 0.00 0.02 0.00 0.00 34.50 31.51 1uad s PRO 8 CO 0.41 -0.45 0.04 -1.17 -0.33 0.00 0.00 177.00 175.50 1uad s LEU 9 N -2.45 1.48 -0.22 -5.54 2.96 -0.18 -1.72 118.68 112.99 1uad s LEU 9 Ca 0.57 -1.03 -0.24 0.00 -0.22 0.00 0.00 54.13 53.21 1uad s LEU 9 Cb -0.36 -0.69 -0.01 0.00 0.50 0.00 0.00 46.19 45.63 1uad s LEU 9 CO 0.46 -0.33 0.80 -0.69 -1.32 0.00 0.00 176.35 175.27 1uad s VAL 10 N 1.78 4.87 -0.08 1.68 1.01 0.08 -0.99 120.40 128.75 1uad s VAL 10 Ca 0.01 1.52 0.01 0.00 0.00 0.00 0.00 61.98 63.52 1uad s VAL 10 Cb -0.17 -4.09 0.00 0.00 0.00 0.00 0.00 36.38 32.12 1uad s VAL 10 CO -0.12 -0.03 0.48 0.35 0.00 0.00 0.00 175.10 175.77 1uad n THR 11 N 5.10 0.00 -3.81 3.92 -2.24 -0.39 -0.17 114.28 116.68 1uad n THR 11 Ca 0.04 -0.50 -0.12 0.00 -2.27 0.00 0.00 64.05 61.20 1uad n THR 11 Cb 0.48 1.01 -0.10 0.00 -2.10 0.00 0.00 70.33 69.62 1uad n THR 11 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1uad s GLY 12 N -0.14 -0.10 -0.08 3.38 0.00 -0.71 -4.77 107.32 104.89 1uad s GLY 12 Ca 0.01 0.35 -0.03 0.00 0.00 0.00 0.00 44.72 45.04 1uad s GLY 12 CO 0.01 0.22 0.17 -1.50 0.00 0.00 0.00 173.10 172.00 1uad s ILE 13 N -0.64 -0.21 -0.17 0.90 1.10 -1.26 -1.39 121.20 119.52 1uad s ILE 13 Ca -0.07 0.29 -0.02 0.00 -0.51 0.00 0.00 60.65 60.33 1uad s ILE 13 Cb -0.04 -0.30 0.05 0.00 0.15 0.00 0.00 42.46 42.32 1uad s ILE 13 CO 0.02 0.12 0.02 -0.55 -2.11 0.00 0.00 174.94 172.44 1uad s SER 14 N 1.94 2.73 0.85 4.50 0.15 -0.15 -3.54 113.70 120.18 1uad s SER 14 Ca -0.01 -0.71 -0.13 0.00 0.70 0.00 0.00 55.95 55.80 1uad s SER 14 Cb -0.12 -0.61 0.11 0.00 -1.71 0.00 0.00 66.02 63.69 1uad s SER 14 CO -0.06 -0.28 1.22 -2.16 1.20 0.00 0.00 173.24 173.16 1uad s PRO 15 N 1.84 1.62 0.00 5.44 0.04 -1.26 0.28 135.00 142.96 1uad s PRO 15 Ca -0.00 -0.03 0.25 0.00 0.04 0.00 0.00 61.00 61.27 1uad s PRO 15 Cb -0.16 -1.92 1.01 0.00 0.04 0.00 0.00 34.50 33.46 1uad s PRO 15 CO -0.07 -1.81 1.71 0.27 0.04 0.00 0.00 177.00 177.14 1uad n ASN 16 N -3.43 1.39 -3.60 6.66 0.23 -1.23 -4.86 115.26 110.41 1uad n ASN 16 Ca 0.10 -1.53 -0.10 0.00 -0.53 0.00 0.00 54.58 52.51 1uad n ASN 16 Cb 0.61 -0.04 -0.02 0.00 -2.08 0.00 0.00 39.78 38.25 1uad n ASN 16 CO 0.00 0.00 0.00 -1.83 -0.93 0.00 0.00 177.26 174.50 1uad s GLU 17 N -1.93 1.45 0.00 -3.83 -1.05 -1.26 -0.53 118.70 111.55 1uad s GLU 17 Ca 0.36 -0.69 0.00 0.00 -0.15 0.00 0.00 54.97 54.50 1uad s GLU 17 Cb 0.20 0.59 0.00 0.00 -0.44 0.00 0.00 34.13 34.47 1uad s GLU 17 CO 0.31 -0.64 0.00 0.41 0.95 0.00 0.00 175.26 176.29 1uad n GLY 18 N -0.40 2.26 3.75 -3.83 0.00 -0.81 -4.93 105.19 101.24 1uad n GLY 18 Ca -0.12 -0.88 -0.30 0.00 0.00 0.00 0.00 46.02 44.72 1uad n GLY 18 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1uad s ILE 19 N -2.00 3.06 0.53 -0.61 1.09 -1.26 -0.37 121.20 121.63 1uad s ILE 19 Ca 0.00 0.34 -0.21 0.00 -1.10 0.00 0.00 60.65 59.68 1uad s ILE 19 Cb 0.00 -2.87 -0.07 0.00 -1.06 0.00 0.00 42.46 38.46 1uad s ILE 19 CO 0.00 -0.45 1.00 -2.65 -0.10 0.00 0.00 174.94 172.74 1uad n PRO 20 N -3.64 1.14 -1.69 2.79 -0.02 -1.25 -2.33 135.00 129.99 1uad n PRO 20 Ca 0.08 0.43 -0.13 0.00 -2.02 0.00 0.00 63.50 61.86 1uad n PRO 20 Cb 0.54 -2.15 -0.04 0.00 -0.02 0.00 0.00 33.50 31.84 1uad n PRO 20 CO 0.00 0.00 0.00 1.87 1.98 0.00 0.00 175.50 179.35 1uad n TRP 21 N -1.20 -0.22 -2.67 6.00 -0.00 0.13 -5.00 117.44 114.48 1uad n TRP 21 Ca 0.11 0.00 -0.40 0.00 -0.00 0.00 0.00 57.50 57.21 1uad n TRP 21 Cb 0.44 -2.51 -0.05 0.00 -0.00 0.00 0.00 31.31 29.19 1uad n TRP 21 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 177.69 178.68 1uad s THR 22 N -2.54 3.93 -0.26 5.87 2.01 -0.99 -4.74 115.64 118.93 1uad s THR 22 Ca 0.00 1.93 -0.27 0.00 0.31 0.00 0.00 61.69 63.65 1uad s THR 22 Cb 0.00 -4.23 0.01 0.00 0.01 0.00 0.00 72.50 68.29 1uad s THR 22 CO 0.00 0.45 0.96 -0.75 -0.69 0.00 0.00 174.62 174.59 1uad s LYS 23 N -1.19 4.17 0.05 4.92 2.20 -1.26 -2.04 119.74 126.58 1uad s LYS 23 Ca 0.42 1.10 0.09 0.00 -0.36 0.00 0.00 55.97 57.23 1uad s LYS 23 Cb -0.28 -3.67 -0.03 0.00 -1.51 0.00 0.00 37.83 32.34 1uad s LYS 23 CO 0.34 -0.66 -0.26 0.14 -0.36 0.00 0.00 175.35 174.56 1uad s VAL 24 N 3.17 2.21 -0.22 4.02 -7.23 0.22 -4.56 120.40 118.00 1uad s VAL 24 Ca 0.40 -1.39 -0.09 0.00 -1.81 0.00 0.00 61.98 59.10 1uad s VAL 24 Cb -0.14 -1.87 -0.04 0.00 0.56 0.00 0.00 36.38 34.89 1uad s VAL 24 CO 0.09 0.36 0.11 -0.89 -0.31 0.00 0.00 175.10 174.45 1uad s THR 25 N -0.82 4.90 -0.20 5.32 2.01 0.14 -1.66 115.64 125.33 1uad s THR 25 Ca 0.12 0.02 -0.08 0.00 0.31 0.00 0.00 61.69 62.06 1uad s THR 25 Cb -0.10 -3.27 -0.04 0.00 0.01 0.00 0.00 72.50 69.10 1uad s THR 25 CO 0.02 0.38 0.07 -0.63 -0.69 0.00 0.00 174.62 173.77 1uad s ILE 26 N 1.01 4.76 0.17 1.82 1.01 0.21 -0.98 121.20 129.18 1uad s ILE 26 Ca 0.05 -0.04 0.10 0.00 0.00 0.00 0.00 60.65 60.77 1uad s ILE 26 Cb -0.14 -3.16 -0.04 0.00 0.01 0.00 0.00 42.46 39.13 1uad s ILE 26 CO 0.03 0.43 -0.21 -0.13 0.00 0.00 0.00 174.94 175.07 1uad s ARG 27 N 0.64 1.65 0.00 2.79 1.81 -0.49 -1.09 118.95 124.26 1uad s ARG 27 Ca 0.04 -1.39 0.00 0.00 -1.72 0.00 0.00 55.73 52.66 1uad s ARG 27 Cb -0.13 -1.96 0.00 0.00 -0.45 0.00 0.00 34.95 32.41 1uad s ARG 27 CO 0.01 0.43 0.00 0.41 -0.68 0.00 0.00 175.30 175.47 1uad n GLY 28 N 0.41 -0.63 3.14 -3.53 0.00 -0.92 -1.27 105.19 102.39 1uad n GLY 28 Ca -0.14 -0.58 -0.22 0.00 0.00 0.00 0.00 46.02 45.09 1uad n GLY 28 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1uad s GLU 29 N -0.99 1.07 -1.35 1.61 2.02 -0.16 -4.27 118.70 116.62 1uad s GLU 29 Ca 0.00 -0.65 -0.05 0.00 0.02 0.00 0.00 54.97 54.29 1uad s GLU 29 Cb 0.00 -1.07 0.02 0.00 0.10 0.00 0.00 34.13 33.18 1uad s GLU 29 CO 0.00 0.28 0.90 0.09 0.02 0.00 0.00 175.26 176.55 1uad n ASN 30 N 2.30 -3.02 -0.42 -0.19 3.02 -1.08 -1.01 115.26 114.85 1uad n ASN 30 Ca -0.16 -0.73 0.04 0.00 -0.03 0.00 0.00 54.58 53.70 1uad n ASN 30 Cb 0.55 -4.36 0.10 0.00 -0.61 0.00 0.00 39.78 35.46 1uad n ASN 30 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1uad n LEU 31 N -4.46 1.22 0.00 3.41 4.77 0.12 -3.79 117.00 118.27 1uad n LEU 31 Ca -0.17 -0.61 0.00 0.00 -0.03 0.00 0.00 56.01 55.20 1uad n LEU 31 Cb 0.62 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 1uad n LEU 31 CO 0.68 0.30 0.00 0.61 -1.33 0.00 0.00 177.39 177.66 1uad n GLY 32 N 0.86 4.44 0.01 -0.72 0.00 -1.26 -4.81 105.19 103.72 1uad n GLY 32 Ca 0.08 -0.89 0.15 0.00 0.00 0.00 0.00 46.02 45.35 1uad n GLY 32 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1uad n THR 33 N -0.70 0.00 -3.70 2.61 -2.24 -1.26 -3.66 114.28 105.32 1uad n THR 33 Ca 0.00 -0.01 0.03 0.00 -2.27 0.00 0.00 64.05 61.81 1uad n THR 33 Cb 0.00 -0.45 0.00 0.00 -2.10 0.00 0.00 70.33 67.78 1uad n THR 33 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1uad s GLY 34 N -2.49 -0.40 0.38 3.38 0.00 -1.26 -4.99 107.32 101.95 1uad s GLY 34 Ca 0.31 0.67 0.09 0.00 0.00 0.00 0.00 44.72 45.79 1uad s GLY 34 CO 0.45 1.99 1.94 -2.55 0.00 0.00 0.00 173.10 174.93 1uad h PRO 35 N 2.00 0.62 -0.00 2.90 0.11 -1.91 -1.78 132.00 133.95 1uad h PRO 35 Ca -0.29 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1uad h PRO 35 Cb 1.19 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1uad h PRO 35 CO 0.30 0.41 -0.18 0.25 -0.21 0.00 0.00 178.00 178.57 1uad n THR 36 N -4.49 0.00 0.24 -1.15 -2.24 -1.26 -3.80 114.28 101.58 1uad n THR 36 Ca 0.12 -0.03 0.14 0.00 -2.27 0.00 0.00 64.05 62.01 1uad n THR 36 Cb 0.33 -0.12 0.39 0.00 -2.10 0.00 0.00 70.33 68.83 1uad n THR 36 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 1uad h ASP 37 N 0.26 0.00 -3.37 3.42 3.58 -1.70 -3.44 116.42 115.16 1uad h ASP 37 Ca 0.00 0.00 -0.57 0.00 0.42 0.00 0.00 57.03 56.88 1uad h ASP 37 Cb 0.44 0.00 -0.07 0.00 1.72 0.00 0.00 39.33 41.42 1uad h ASP 37 CO 0.00 0.02 0.85 -0.22 -2.88 0.00 0.00 179.24 177.01 1uad s LEU 38 N -6.22 3.89 0.00 2.28 2.96 -1.25 -0.58 118.68 119.76 1uad s LEU 38 Ca 0.04 0.95 0.00 0.00 -0.22 0.00 0.00 54.13 54.91 1uad s LEU 38 Cb 0.07 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 43.22 1uad s LEU 38 CO 0.62 -0.93 0.75 2.30 -1.32 0.00 0.00 176.35 177.76 1uad n ILE 39 N 6.01 0.56 -3.64 6.68 -5.35 -0.17 -4.96 119.36 118.49 1uad n ILE 39 Ca 0.12 -0.65 -0.08 0.00 -0.27 0.00 0.00 62.75 61.87 1uad n ILE 39 Cb 0.47 0.78 -0.07 0.00 -1.74 0.00 0.00 39.64 39.09 1uad n ILE 39 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1uad s GLY 40 N -0.56 -0.33 -0.29 3.28 0.00 -0.70 -4.91 107.32 103.81 1uad s GLY 40 Ca 0.00 2.55 0.03 0.00 0.00 0.00 0.00 44.72 47.30 1uad s GLY 40 CO 0.00 2.10 0.53 -2.27 0.00 0.00 0.00 173.10 173.47 1uad s LEU 41 N 0.82 -1.30 -0.08 0.66 2.96 -1.25 -0.61 118.68 119.89 1uad s LEU 41 Ca -0.03 0.24 0.04 0.00 -0.22 0.00 0.00 54.13 54.16 1uad s LEU 41 Cb -0.05 1.78 -0.00 0.00 0.50 0.00 0.00 46.19 48.42 1uad s LEU 41 CO -0.09 -0.30 -0.22 -0.89 -1.32 0.00 0.00 176.35 173.52 1uad s THR 42 N 2.75 1.90 -0.13 3.68 2.01 -0.21 0.01 115.64 125.65 1uad s THR 42 Ca 0.13 -0.95 -0.00 0.00 0.31 0.00 0.00 61.69 61.18 1uad s THR 42 Cb -0.12 -1.64 0.03 0.00 0.01 0.00 0.00 72.50 70.77 1uad s THR 42 CO -0.25 0.53 -0.09 -0.63 -0.69 0.00 0.00 174.62 173.49 1uad s ILE 43 N 0.22 1.19 -1.50 1.82 1.01 -0.13 -0.46 121.20 123.35 1uad s ILE 43 Ca -0.13 -0.44 -0.06 0.00 0.00 0.00 0.00 60.65 60.02 1uad s ILE 43 Cb -0.16 -1.20 0.01 0.00 0.01 0.00 0.00 42.46 41.11 1uad s ILE 43 CO 0.07 0.35 0.73 0.00 0.00 0.00 0.00 174.94 176.08 1uad n GLY 45 N -1.63 2.97 3.73 0.00 0.00 -1.26 -1.81 105.19 107.19 1uad n GLY 45 Ca -0.09 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.53 1uad n GLY 45 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1uad s HIS 46 N -2.17 3.64 -0.38 1.61 5.65 -0.36 -4.72 115.29 118.57 1uad s HIS 46 Ca 0.00 1.36 -0.29 0.00 0.25 0.00 0.00 55.06 56.38 1uad s HIS 46 Cb 0.00 -2.82 0.01 0.00 -1.18 0.00 0.00 32.58 28.58 1uad s HIS 46 CO 0.00 0.15 1.38 1.21 -0.65 0.00 0.00 174.74 176.83 1uad s ASN 47 N 0.49 6.44 0.00 9.88 3.04 -1.26 -0.96 114.94 132.57 1uad s ASN 47 Ca 0.39 0.93 0.12 0.00 0.04 0.00 0.00 52.86 54.34 1uad s ASN 47 Cb -0.19 -2.54 0.25 0.00 -1.54 0.00 0.00 41.25 37.23 1uad s ASN 47 CO 0.20 -1.33 1.14 0.00 -3.04 0.00 0.00 177.10 174.08 1uad h LEU 49 N 2.33 0.16 -2.07 0.00 5.85 -1.86 -1.91 115.31 117.82 1uad h LEU 49 Ca 0.00 0.15 0.10 0.00 0.84 0.00 0.00 57.88 58.97 1uad h LEU 49 Cb 0.67 0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.85 1uad h LEU 49 CO 0.00 -0.01 0.29 -0.07 -0.34 0.00 0.00 178.44 178.31 1uad h LEU 50 N 0.34 0.00 -2.10 2.25 4.07 -1.92 -0.79 115.31 117.15 1uad h LEU 50 Ca 0.47 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.43 1uad h LEU 50 Cb 0.83 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.57 1uad h LEU 50 CO -0.51 0.00 0.00 0.35 -1.08 0.00 0.00 178.44 177.20 1uad n THR 51 N -4.15 0.36 -2.35 0.22 -2.24 -0.74 -4.98 114.28 100.40 1uad n THR 51 Ca 0.05 -0.68 -0.42 0.00 -2.27 0.00 0.00 64.05 60.73 1uad n THR 51 Cb 0.46 1.05 -0.03 0.00 -2.10 0.00 0.00 70.33 69.71 1uad n THR 51 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1uad s ALA 52 N -1.31 3.45 -0.29 6.98 0.00 -0.31 -4.29 121.76 126.01 1uad s ALA 52 Ca 0.27 0.91 0.02 0.00 0.00 0.00 0.00 51.96 53.16 1uad s ALA 52 Cb 0.16 -3.48 0.08 0.00 0.00 0.00 0.00 23.12 19.89 1uad s ALA 52 CO 0.23 -0.51 -0.00 -1.21 0.00 0.00 0.00 175.76 174.27 1uad s GLU 53 N 1.16 1.54 0.19 0.00 2.02 0.19 -4.97 118.70 118.83 1uad s GLU 53 Ca 0.60 -1.37 -0.31 0.00 0.02 0.00 0.00 54.97 53.91 1uad s GLU 53 Cb -0.31 -2.76 -0.10 0.00 0.10 0.00 0.00 34.13 31.06 1uad s GLU 53 CO 0.29 -0.77 1.53 -0.46 0.02 0.00 0.00 175.26 175.87 1uad s TRP 54 N 1.21 3.04 -0.09 1.61 -0.00 -1.26 -1.86 118.94 121.59 1uad s TRP 54 Ca 0.02 0.76 0.00 0.00 -0.00 0.00 0.00 56.10 56.88 1uad s TRP 54 Cb -0.19 -3.90 -0.06 0.00 -0.00 0.00 0.00 33.47 29.33 1uad s TRP 54 CO -0.10 -3.19 -0.08 -1.33 -0.00 0.00 0.00 176.95 172.25 1uad n MET 55 N 3.41 0.22 -3.78 5.86 2.81 0.03 -4.90 117.12 120.77 1uad n MET 55 Ca 0.11 0.05 -0.03 0.00 -1.81 0.00 0.00 57.70 56.02 1uad n MET 55 Cb 0.39 -1.16 -0.00 0.00 -0.71 0.00 0.00 33.22 31.74 1uad n MET 55 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 1uad s SER 56 N -4.89 -0.12 0.00 7.83 1.04 -0.82 -4.94 113.70 111.80 1uad s SER 56 Ca -0.12 -0.48 0.05 0.00 0.48 0.00 0.00 55.95 55.88 1uad s SER 56 Cb 0.03 0.49 0.22 0.00 0.10 0.00 0.00 66.02 66.85 1uad s SER 56 CO 0.20 -0.92 1.07 0.00 0.98 0.00 0.00 173.24 174.57 1uad n ALA 57 N -0.53 1.30 0.04 5.32 0.00 -1.24 -1.24 120.51 124.15 1uad n ALA 57 Ca -0.05 -0.02 0.02 0.00 0.00 0.00 0.00 53.44 53.38 1uad n ALA 57 Cb 0.60 -1.08 0.03 0.00 0.00 0.00 0.00 19.45 19.01 1uad n ALA 57 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1uad n SER 58 N -1.40 1.79 -3.68 0.00 3.41 -1.26 0.12 113.62 112.60 1uad n SER 58 Ca 0.02 -1.59 -0.09 0.00 -0.26 0.00 0.00 58.87 56.94 1uad n SER 58 Cb 0.05 -0.04 -0.10 0.00 -0.26 0.00 0.00 64.21 63.86 1uad n SER 58 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1uad s LYS 59 N -0.65 0.43 -0.01 4.33 2.20 -0.38 -2.18 119.74 123.48 1uad s LYS 59 Ca 0.05 0.91 0.02 0.00 -0.36 0.00 0.00 55.97 56.59 1uad s LYS 59 Cb 0.03 0.08 -0.00 0.00 -1.51 0.00 0.00 37.83 36.43 1uad s LYS 59 CO 0.04 -0.17 -0.05 0.42 -0.36 0.00 0.00 175.35 175.23 1uad s ILE 60 N 1.67 0.41 -0.03 5.43 1.01 -0.25 -0.79 121.20 128.65 1uad s ILE 60 Ca -0.08 -0.20 0.07 0.00 0.00 0.00 0.00 60.65 60.43 1uad s ILE 60 Cb -0.09 -0.37 -0.02 0.00 0.01 0.00 0.00 42.46 42.00 1uad s ILE 60 CO -0.14 0.13 -0.22 -0.69 0.00 0.00 0.00 174.94 174.01 1uad s VAL 61 N 0.01 2.36 0.04 2.92 1.01 -0.78 0.64 120.40 126.60 1uad s VAL 61 Ca 0.00 -0.99 -0.01 0.00 0.00 0.00 0.00 61.98 60.98 1uad s VAL 61 Cb -0.04 -1.85 0.00 0.00 0.00 0.00 0.00 36.38 34.49 1uad s VAL 61 CO -0.00 0.58 0.07 0.00 0.00 0.00 0.00 175.10 175.75 1uad s ARG 63 N -2.03 1.88 0.55 0.00 0.52 -1.26 -0.61 118.95 118.00 1uad s ARG 63 Ca 0.02 -0.57 -0.16 0.00 -0.52 0.00 0.00 55.73 54.50 1uad s ARG 63 Cb -0.00 -1.57 -0.06 0.00 0.52 0.00 0.00 34.95 33.83 1uad s ARG 63 CO 0.01 0.17 1.01 0.08 0.02 0.00 0.00 175.30 176.59 1uad s VAL 64 N 0.26 4.37 0.34 3.52 1.01 -0.87 -4.79 120.40 124.25 1uad s VAL 64 Ca -0.09 1.09 0.03 0.00 0.00 0.00 0.00 61.98 63.01 1uad s VAL 64 Cb -0.13 -3.65 -0.05 0.00 0.00 0.00 0.00 36.38 32.54 1uad s VAL 64 CO 0.03 -0.70 0.08 -0.83 0.00 0.00 0.00 175.10 173.68 1uad s GLY 65 N -3.14 2.18 0.16 4.51 0.00 -1.26 0.21 107.32 109.99 1uad s GLY 65 Ca 0.60 -1.81 -0.34 0.00 0.00 0.00 0.00 44.72 43.17 1uad s GLY 65 CO 0.35 -1.80 1.29 -1.06 0.00 0.00 0.00 173.10 171.88 1uad n GLN 66 N -0.72 1.41 -1.81 2.90 6.02 -1.26 -4.83 117.38 119.09 1uad n GLN 66 Ca -0.03 0.51 -0.34 0.00 -0.01 0.00 0.00 57.00 57.12 1uad n GLN 66 Cb 0.66 -2.09 0.05 0.00 1.02 0.00 0.00 30.24 29.88 1uad n GLN 66 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1uad s ALA 67 N 0.10 2.43 0.00 -1.58 0.00 -1.26 -4.59 121.76 116.87 1uad s ALA 67 Ca 0.76 0.76 0.00 0.00 0.00 0.00 0.00 51.96 53.48 1uad s ALA 67 Cb -0.82 -3.39 0.00 0.00 0.00 0.00 0.00 23.12 18.91 1uad s ALA 67 CO 0.49 -1.32 0.00 1.63 0.00 0.00 0.00 175.76 176.56 1uad n LYS 68 N -2.15 3.21 -4.46 0.00 5.02 -0.75 -4.96 118.16 114.07 1uad n LYS 68 Ca 0.12 0.00 -0.22 0.00 -2.02 0.00 0.00 58.31 56.18 1uad n LYS 68 Cb 0.51 -0.70 -0.10 0.00 -0.02 0.00 0.00 35.03 34.72 1uad n LYS 68 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1uad s ASN 69 N -1.31 3.04 0.00 4.39 -0.87 -0.97 -4.96 114.94 114.26 1uad s ASN 69 Ca 0.00 -1.18 0.17 0.00 -1.57 0.00 0.00 52.86 50.29 1uad s ASN 69 Cb 0.00 -0.22 0.10 0.00 -0.02 0.00 0.00 41.25 41.11 1uad s ASN 69 CO 0.00 -0.28 1.00 -0.90 -2.57 0.00 0.00 177.10 174.35 1uad n ASP 70 N -0.63 2.22 -4.85 -1.22 3.85 -1.26 -4.83 116.55 109.83 1uad n ASP 70 Ca -0.05 -1.61 -0.37 0.00 -0.71 0.00 0.00 54.79 52.05 1uad n ASP 70 Cb 0.63 0.14 -0.06 0.00 -1.35 0.00 0.00 41.12 40.48 1uad n ASP 70 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.20 174.60 1uad s LYS 71 N -1.62 3.59 -0.20 0.11 0.00 -1.26 -4.99 119.74 115.36 1uad s LYS 71 Ca 0.19 -0.09 -0.02 0.00 0.00 0.00 0.00 55.97 56.04 1uad s LYS 71 Cb 0.14 -3.23 0.07 0.00 0.00 0.00 0.00 37.83 34.81 1uad s LYS 71 CO 0.28 0.70 2.32 0.41 0.00 0.00 0.00 175.35 179.07 1uad n GLY 72 N 2.19 3.51 3.77 0.59 0.00 -1.25 -4.15 105.19 109.84 1uad n GLY 72 Ca -0.19 -0.89 -0.40 0.00 0.00 0.00 0.00 46.02 44.54 1uad n GLY 72 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1uad s ASP 73 N 0.99 6.60 -0.41 1.61 -1.08 -1.26 0.08 116.67 123.20 1uad s ASP 73 Ca 0.30 2.73 0.04 0.00 -0.52 0.00 0.00 52.55 55.10 1uad s ASP 73 Cb 0.20 -2.65 0.11 0.00 -1.46 0.00 0.00 42.92 39.12 1uad s ASP 73 CO -0.03 -0.65 0.13 -0.63 0.52 0.00 0.00 175.17 174.50 1uad s ILE 74 N -1.17 2.37 -0.33 4.11 1.01 -1.26 -1.38 121.20 124.56 1uad s ILE 74 Ca 0.51 -2.71 -0.12 0.00 0.00 0.00 0.00 60.65 58.34 1uad s ILE 74 Cb -0.40 -2.71 -0.01 0.00 0.01 0.00 0.00 42.46 39.34 1uad s ILE 74 CO 0.53 -0.68 0.21 -0.63 0.00 0.00 0.00 174.94 174.37 1uad s ILE 75 N 0.45 4.99 -0.12 2.92 1.01 0.39 -4.00 121.20 126.85 1uad s ILE 75 Ca 0.13 -0.34 -0.03 0.00 0.00 0.00 0.00 60.65 60.42 1uad s ILE 75 Cb -0.22 -3.57 -0.03 0.00 0.01 0.00 0.00 42.46 38.65 1uad s ILE 75 CO -0.05 0.00 -0.02 -0.69 0.00 0.00 0.00 174.94 174.18 1uad s VAL 76 N 1.67 4.09 -0.11 2.92 1.01 -1.26 -1.04 120.40 127.68 1uad s VAL 76 Ca 0.05 -0.31 0.02 0.00 0.00 0.00 0.00 61.98 61.74 1uad s VAL 76 Cb -0.17 -2.75 0.01 0.00 0.00 0.00 0.00 36.38 33.47 1uad s VAL 76 CO 0.09 0.55 -0.15 -0.89 0.00 0.00 0.00 175.10 174.69 1uad s THR 77 N -0.27 1.48 0.26 3.92 2.01 0.22 -0.23 115.64 123.03 1uad s THR 77 Ca 0.05 -0.63 0.10 0.00 0.31 0.00 0.00 61.69 61.52 1uad s THR 77 Cb -0.12 -1.35 -0.04 0.00 0.01 0.00 0.00 72.50 70.99 1uad s THR 77 CO 0.02 0.44 -0.08 0.42 -0.69 0.00 0.00 174.62 174.73 1uad s THR 78 N 0.97 3.10 0.11 -0.82 -4.23 -0.74 -1.00 115.64 113.03 1uad s THR 78 Ca -0.07 -2.02 -0.13 0.00 -1.18 0.00 0.00 61.69 58.28 1uad s THR 78 Cb -0.15 -2.63 -0.09 0.00 1.34 0.00 0.00 72.50 70.97 1uad s THR 78 CO -0.01 -0.34 1.40 0.11 -0.54 0.00 0.00 174.62 175.24 1uad h LYS 79 N 2.18 0.78 -0.30 3.99 1.57 -1.16 -0.96 116.57 122.68 1uad h LYS 79 Ca -0.43 -0.47 -0.11 0.00 -1.87 0.00 0.00 60.65 57.76 1uad h LYS 79 Cb 1.24 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.59 1uad h LYS 79 CO 0.59 1.10 -0.29 0.66 -0.57 0.00 0.00 179.45 180.93 1uad h SER 80 N 0.54 0.63 0.00 0.86 4.64 -1.96 -3.37 113.55 114.89 1uad h SER 80 Ca 0.03 -0.24 0.00 0.00 -0.47 0.00 0.00 61.79 61.11 1uad h SER 80 Cb 1.02 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 1uad h SER 80 CO 0.10 0.89 0.00 0.61 -0.87 0.00 0.00 176.83 177.56 1uad n GLY 81 N -0.21 -0.59 5.32 -0.77 0.00 -1.24 -2.20 105.19 105.51 1uad n GLY 81 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1uad n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uad n GLY 82 N 0.30 -1.35 3.73 -0.02 0.00 -0.36 -3.67 105.19 103.81 1uad n GLY 82 Ca 0.00 -1.44 -0.41 0.00 0.00 0.00 0.00 46.02 44.17 1uad n GLY 82 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1uad s ARG 83 N 0.00 4.57 0.11 1.61 3.52 -1.26 -1.80 118.95 125.70 1uad s ARG 83 Ca 0.00 1.67 0.01 0.00 -0.13 0.00 0.00 55.73 57.28 1uad s ARG 83 Cb 0.00 -3.32 0.01 0.00 -1.56 0.00 0.00 34.95 30.08 1uad s ARG 83 CO 0.00 0.00 0.10 0.41 -0.81 0.00 0.00 175.30 175.00 1uad n GLY 84 N 2.42 2.74 3.30 8.12 0.00 0.68 -4.53 105.19 117.92 1uad n GLY 84 Ca 0.04 -2.18 -0.17 0.00 0.00 0.00 0.00 46.02 43.71 1uad n GLY 84 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1uad s THR 85 N -0.33 0.28 0.04 2.61 -4.23 -0.70 -4.51 115.64 108.80 1uad s THR 85 Ca 0.07 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 58.61 1uad s THR 85 Cb -0.01 -2.54 -0.02 0.00 1.34 0.00 0.00 72.50 71.28 1uad s THR 85 CO 0.05 0.00 -0.09 -0.94 -0.54 0.00 0.00 174.62 173.10 1uad s SER 86 N -3.31 0.98 0.06 3.99 1.04 -1.26 -0.74 113.70 114.46 1uad s SER 86 Ca 0.37 -0.51 0.23 0.00 0.48 0.00 0.00 55.95 56.52 1uad s SER 86 Cb 0.06 0.01 0.06 0.00 0.10 0.00 0.00 66.02 66.24 1uad s SER 86 CO 0.16 -0.15 1.03 0.35 0.98 0.00 0.00 173.24 175.62 1uad n THR 87 N 1.61 0.21 -4.56 2.02 -2.24 0.76 -4.93 114.28 107.14 1uad n THR 87 Ca -0.21 -0.27 -0.27 0.00 -2.27 0.00 0.00 64.05 61.03 1uad n THR 87 Cb 0.55 0.14 -0.11 0.00 -2.10 0.00 0.00 70.33 68.81 1uad n THR 87 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1uad s VAL 88 N -3.21 2.14 0.15 2.28 -7.23 -1.26 -5.05 120.40 108.23 1uad s VAL 88 Ca 0.03 -2.09 0.05 0.00 -1.81 0.00 0.00 61.98 58.16 1uad s VAL 88 Cb 0.14 -2.83 -0.04 0.00 0.56 0.00 0.00 36.38 34.21 1uad s VAL 88 CO 0.80 -0.10 -0.11 -0.94 -0.31 0.00 0.00 175.10 174.43 1uad s SER 89 N -3.67 1.93 -0.05 4.85 1.04 -1.26 -4.45 113.70 112.09 1uad s SER 89 Ca 0.34 -1.00 0.02 0.00 0.48 0.00 0.00 55.95 55.79 1uad s SER 89 Cb 0.06 -0.03 -0.03 0.00 0.10 0.00 0.00 66.02 66.12 1uad s SER 89 CO 0.17 -0.29 -0.09 0.12 0.98 0.00 0.00 173.24 174.13 1uad s PHE 90 N -3.20 2.86 -0.35 5.02 5.36 0.11 -4.88 117.98 122.89 1uad s PHE 90 Ca 0.17 -0.04 -0.08 0.00 -0.96 0.00 0.00 56.93 56.02 1uad s PHE 90 Cb 0.02 -1.67 0.04 0.00 -0.34 0.00 0.00 43.02 41.06 1uad s PHE 90 CO 0.02 0.30 0.14 0.21 -1.46 0.00 0.00 175.22 174.42 1uad s LYS 91 N -0.89 2.68 -0.21 10.12 2.20 0.31 -3.91 119.74 130.05 1uad s LYS 91 Ca 0.13 -1.16 -0.29 0.00 -0.36 0.00 0.00 55.97 54.29 1uad s LYS 91 Cb -0.11 -3.55 -0.00 0.00 -1.51 0.00 0.00 37.83 32.66 1uad s LYS 91 CO 0.02 -0.68 1.17 -1.17 -0.36 0.00 0.00 175.35 174.33 1uad s LEU 92 N 1.45 4.11 0.28 5.43 2.96 -1.26 -1.92 118.68 129.73 1uad s LEU 92 Ca -0.00 1.50 -0.01 0.00 -0.22 0.00 0.00 54.13 55.40 1uad s LEU 92 Cb -0.19 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 42.92 1uad s LEU 92 CO 0.04 -0.76 0.49 -0.76 -1.32 0.00 0.00 176.35 174.04 1uad s LEU 93 N 3.47 4.11 -0.12 -0.68 1.43 0.50 -4.91 118.68 122.48 1uad s LEU 93 Ca 0.50 0.48 -0.02 0.00 -1.03 0.00 0.00 54.13 54.06 1uad s LEU 93 Cb -0.18 -3.29 -0.03 0.00 0.03 0.00 0.00 46.19 42.71 1uad s LEU 93 CO 0.12 -0.17 -0.04 -1.59 0.23 0.00 0.00 176.35 174.90 1uad s LYS 94 N -3.77 3.35 0.00 1.70 -2.85 -1.26 -3.87 119.74 113.04 1uad s LYS 94 Ca 0.40 -0.51 0.00 0.00 -1.00 0.00 0.00 55.97 54.86 1uad s LYS 94 Cb -0.10 -2.82 0.00 0.00 -2.06 0.00 0.00 37.83 32.85 1uad s LYS 94 CO 0.32 0.41 0.37 -2.30 0.10 0.00 0.00 175.35 174.25