#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2arp n LEU 2 N 0.00 0.78 -4.73 0.99 7.99 -1.26 -4.68 117.00 116.10 2arp n LEU 2 Ca 0.00 0.48 -0.67 0.00 -0.01 0.00 0.00 56.01 55.81 2arp n LEU 2 Cb 0.00 -0.18 -0.10 0.00 -0.11 0.00 0.00 43.42 43.03 2arp n LEU 2 CO 0.00 -0.18 1.11 1.21 -1.51 0.00 0.00 177.39 178.02 2arp n GLU 3 N -1.04 0.06 -1.79 3.23 4.07 -1.24 -0.39 120.64 123.55 2arp n GLU 3 Ca 0.00 0.02 -0.37 0.00 -0.06 0.00 0.00 57.16 56.75 2arp n GLU 3 Cb 0.00 -1.53 0.06 0.00 -0.06 0.00 0.00 31.44 29.91 2arp n GLU 3 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2arp n ASP 5 N -1.68 0.00 0.00 0.00 2.03 -1.26 -5.04 116.55 110.59 2arp n ASP 5 Ca 0.14 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.45 2arp n ASP 5 Cb 0.48 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.88 2arp n ASP 5 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2arp n GLY 6 N 2.83 0.00 2.96 0.27 0.00 -1.26 -5.18 105.19 104.81 2arp n GLY 6 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 2arp n GLY 6 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2arp s ASN 9 N -3.72 -0.04 0.00 1.61 2.20 -1.26 -5.23 114.94 108.50 2arp s ASN 9 Ca 0.00 -0.75 0.00 0.00 -0.94 0.00 0.00 52.86 51.17 2arp s ASN 9 Cb 0.00 1.24 0.00 0.00 -2.00 0.00 0.00 41.25 40.49 2arp s ASN 9 CO 0.00 -0.28 0.00 0.00 -2.94 0.00 0.00 177.10 173.88 2arp n ILE 10 N 4.84 0.00 -3.02 0.54 0.13 -1.26 -3.49 119.36 117.10 2arp n ILE 10 Ca 0.06 0.00 -0.40 0.00 -1.10 0.00 0.00 62.75 61.31 2arp n ILE 10 Cb 0.50 0.00 -0.05 0.00 -0.84 0.00 0.00 39.64 39.25 2arp n ILE 10 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 2arp s LYS 13 N -3.08 4.50 -0.27 0.00 2.20 0.48 -1.77 119.74 121.80 2arp s LYS 13 Ca -0.00 1.21 -0.09 0.00 -0.36 0.00 0.00 55.97 56.73 2arp s LYS 13 Cb -0.01 -3.46 -0.03 0.00 -1.51 0.00 0.00 37.83 32.82 2arp s LYS 13 CO -0.08 -0.03 0.12 0.21 -0.36 0.00 0.00 175.35 175.21 2arp s LYS 14 N 1.02 3.66 0.21 4.03 2.47 0.15 -0.21 119.74 131.08 2arp s LYS 14 Ca 0.46 -0.49 -0.31 0.00 -1.56 0.00 0.00 55.97 54.08 2arp s LYS 14 Cb -0.20 -3.47 -0.10 0.00 -1.46 0.00 0.00 37.83 32.61 2arp s LYS 14 CO 0.23 -0.24 1.49 -1.14 0.16 0.00 0.00 175.35 175.85 2arp s GLN 15 N 1.65 4.25 -0.21 4.03 2.00 -1.26 -1.73 119.66 128.40 2arp s GLN 15 Ca 0.06 2.31 -0.09 0.00 -2.00 0.00 0.00 55.36 55.65 2arp s GLN 15 Cb -0.16 -3.13 0.09 0.00 0.80 0.00 0.00 33.01 30.60 2arp s GLN 15 CO 0.06 -0.49 0.46 0.12 -0.50 0.00 0.00 175.29 174.94 2arp s PHE 16 N 0.49 -0.83 -0.11 1.67 5.36 -1.26 -4.90 117.98 118.39 2arp s PHE 16 Ca 0.64 1.60 -0.14 0.00 -0.96 0.00 0.00 56.93 58.07 2arp s PHE 16 Cb -0.42 0.38 -0.05 0.00 -0.34 0.00 0.00 43.02 42.59 2arp s PHE 16 CO 0.38 -0.47 0.35 0.12 -1.46 0.00 0.00 175.22 174.14 2arp s PHE 17 N 2.25 3.54 -0.01 10.12 5.36 -1.26 -1.80 117.98 136.18 2arp s PHE 17 Ca -0.05 0.74 0.04 0.00 -0.96 0.00 0.00 56.93 56.70 2arp s PHE 17 Cb -0.10 -2.35 -0.03 0.00 -0.34 0.00 0.00 43.02 40.20 2arp s PHE 17 CO -0.14 0.34 -0.13 0.14 -1.46 0.00 0.00 175.22 173.97 2arp s VAL 18 N 0.07 3.13 -0.17 3.12 -7.23 -0.04 -4.95 120.40 114.34 2arp s VAL 18 Ca 0.20 -0.86 -0.04 0.00 -1.81 0.00 0.00 61.98 59.47 2arp s VAL 18 Cb -0.14 -2.29 -0.03 0.00 0.56 0.00 0.00 36.38 34.49 2arp s VAL 18 CO 0.07 0.48 -0.03 -0.55 -0.31 0.00 0.00 175.10 174.76 2arp s SER 19 N -1.08 4.76 0.33 4.85 0.15 -1.26 -1.50 113.70 119.94 2arp s SER 19 Ca 0.14 -0.16 0.07 0.00 0.70 0.00 0.00 55.95 56.69 2arp s SER 19 Cb -0.11 -1.79 0.59 0.00 -1.71 0.00 0.00 66.02 63.01 2arp s SER 19 CO 0.03 0.14 1.80 -0.26 1.20 0.00 0.00 173.24 176.15 2arp h PHE 20 N 6.95 0.33 0.03 3.44 0.04 -1.63 -2.21 116.94 123.89 2arp h PHE 20 Ca -0.32 -0.06 0.02 0.00 2.80 0.00 0.00 57.97 60.40 2arp h PHE 20 Cb 1.19 -0.08 -0.03 0.00 2.20 0.00 0.00 35.95 39.23 2arp h PHE 20 CO 0.55 0.52 -0.14 -0.22 -0.60 0.00 0.00 178.31 178.42 2arp h LYS 21 N 0.27 -0.23 -0.67 1.51 3.64 -1.89 0.28 116.57 119.47 2arp h LYS 21 Ca 0.04 0.02 0.14 0.00 -1.27 0.00 0.00 60.65 59.58 2arp h LYS 21 Cb 0.58 0.05 -0.11 0.00 -0.41 0.00 0.00 32.23 32.34 2arp h LYS 21 CO 0.04 -0.16 0.04 -0.44 -2.27 0.00 0.00 179.45 176.67 2arp h ASP 22 N -0.24 -0.22 1.14 4.20 3.32 -1.82 -0.94 116.42 121.86 2arp h ASP 22 Ca 0.04 0.16 -0.04 0.00 0.02 0.00 0.00 57.03 57.21 2arp h ASP 22 Cb 0.29 0.27 -0.01 0.00 0.22 0.00 0.00 39.33 40.10 2arp h ASP 22 CO -0.11 -0.11 -0.18 0.40 -1.72 0.00 0.00 179.24 177.52 2arp h ILE 23 N 0.15 0.39 0.00 0.35 2.04 -1.14 -3.47 117.51 115.83 2arp h ILE 23 Ca 0.36 -1.08 0.00 0.00 1.00 0.00 0.00 64.86 65.14 2arp h ILE 23 Cb 0.61 1.81 0.00 0.00 -0.74 0.00 0.00 36.82 38.49 2arp h ILE 23 CO -0.55 0.17 0.00 0.61 0.00 0.00 0.00 178.15 178.38 2arp n GLY 24 N 0.35 0.86 0.58 5.37 0.00 0.10 -4.99 105.19 107.47 2arp n GLY 24 Ca 0.01 -0.21 0.06 0.00 0.00 0.00 0.00 46.02 45.88 2arp n GLY 24 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2arp n TRP 25 N -2.23 0.52 0.55 1.61 8.01 0.77 -4.70 117.44 121.96 2arp n TRP 25 Ca 0.00 -0.68 0.11 0.00 -1.31 0.00 0.00 57.50 55.62 2arp n TRP 25 Cb 0.00 -0.14 0.44 0.00 -2.01 0.00 0.00 31.31 29.60 2arp n TRP 25 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.69 176.95 2arp n ASN 26 N -0.17 0.40 -0.01 -0.99 6.94 -1.16 -0.88 115.26 119.39 2arp n ASN 26 Ca 0.14 0.58 -0.05 0.00 -0.02 0.00 0.00 54.58 55.23 2arp n ASN 26 Cb 0.58 -0.67 -0.12 0.00 -2.36 0.00 0.00 39.78 37.21 2arp n ASN 26 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 2arp n ASP 27 N -1.92 0.76 0.03 0.53 3.85 -1.26 -4.30 116.55 114.24 2arp n ASP 27 Ca 0.04 0.35 -0.19 0.00 -0.71 0.00 0.00 54.79 54.28 2arp n ASP 27 Cb 0.26 0.18 -0.12 0.00 -1.35 0.00 0.00 41.12 40.08 2arp n ASP 27 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.20 175.94 2arp h TRP 28 N 0.00 0.71 -3.63 2.11 7.01 -1.80 -3.43 115.95 116.92 2arp h TRP 28 Ca -0.26 -0.42 -0.63 0.00 2.11 0.00 0.00 58.89 59.69 2arp h TRP 28 Cb 1.84 -0.07 -0.14 0.00 -2.10 0.00 0.00 29.16 28.70 2arp h TRP 28 CO 0.00 1.27 -0.08 0.42 -2.79 0.00 0.00 178.44 177.26 2arp s ILE 29 N -3.00 5.07 0.02 2.65 1.01 -0.06 -1.77 121.20 125.13 2arp s ILE 29 Ca -0.12 0.61 -0.16 0.00 0.00 0.00 0.00 60.65 60.97 2arp s ILE 29 Cb 0.04 -3.85 -0.36 0.00 0.01 0.00 0.00 42.46 38.30 2arp s ILE 29 CO 0.85 -0.01 0.99 0.40 0.00 0.00 0.00 174.94 177.17 2arp h ILE 30 N 5.48 1.29 -1.95 2.92 2.04 -1.08 -3.43 117.51 122.79 2arp h ILE 30 Ca -0.29 -2.69 -0.03 0.00 1.00 0.00 0.00 64.86 62.85 2arp h ILE 30 Cb 1.14 3.06 -0.21 0.00 -0.74 0.00 0.00 36.82 40.07 2arp h ILE 30 CO 0.72 0.80 0.19 0.00 0.00 0.00 0.00 178.15 179.86 2arp s ALA 31 N -2.59 -1.80 1.02 1.87 0.00 -1.00 -4.71 121.76 114.55 2arp s ALA 31 Ca -0.09 1.79 -0.14 0.00 0.00 0.00 0.00 51.96 53.51 2arp s ALA 31 Cb 0.04 -0.83 0.19 0.00 0.00 0.00 0.00 23.12 22.52 2arp s ALA 31 CO 0.94 -0.34 1.05 -0.35 0.00 0.00 0.00 175.76 177.06 2arp n PRO 32 N 2.04 -1.20 0.10 0.00 -0.04 -1.26 -1.18 135.00 133.45 2arp n PRO 32 Ca -0.15 -1.63 0.12 0.00 -0.04 0.00 0.00 63.50 61.80 2arp n PRO 32 Cb 0.56 -1.12 0.24 0.00 -0.04 0.00 0.00 33.50 33.13 2arp n PRO 32 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2arp h SER 33 N -1.50 0.00 -5.92 3.54 4.64 -1.91 -3.48 113.55 108.92 2arp h SER 33 Ca -0.34 -0.10 0.38 0.00 -0.47 0.00 0.00 61.79 61.26 2arp h SER 33 Cb 0.96 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.97 2arp h SER 33 CO 0.24 0.05 0.97 -0.83 -0.87 0.00 0.00 176.83 176.39 2arp s GLY 34 N -3.76 -0.20 0.10 -0.77 0.00 -1.26 -1.51 107.32 99.93 2arp s GLY 34 Ca 0.07 0.16 -0.26 0.00 0.00 0.00 0.00 44.72 44.69 2arp s GLY 34 CO 0.68 5.88 0.94 -2.52 0.00 0.00 0.00 173.10 178.07 2arp s TYR 35 N -2.02 -0.20 -0.95 1.90 -0.85 -0.56 -4.97 117.35 109.69 2arp s TYR 35 Ca 0.30 -0.04 -0.19 0.00 -0.52 0.00 0.00 57.07 56.62 2arp s TYR 35 Cb 0.00 0.60 0.12 0.00 0.38 0.00 0.00 41.96 43.07 2arp s TYR 35 CO -0.02 -0.72 1.18 -1.01 -1.52 0.00 0.00 175.55 173.46 2arp s HIS 36 N -3.22 3.04 0.13 -3.49 3.76 -1.26 -0.86 115.29 113.40 2arp s HIS 36 Ca 0.10 -1.33 -0.12 0.00 -0.15 0.00 0.00 55.06 53.55 2arp s HIS 36 Cb -0.01 -4.34 -0.05 0.00 1.11 0.00 0.00 32.58 29.28 2arp s HIS 36 CO -0.02 -1.55 1.46 0.00 -0.85 0.00 0.00 174.74 173.78 2arp h ALA 37 N 8.92 0.53 -1.27 -1.40 0.00 -1.66 -3.44 119.26 120.95 2arp h ALA 37 Ca 0.17 -0.44 0.14 0.00 0.00 0.00 0.00 54.91 54.78 2arp h ALA 37 Cb 1.02 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.64 2arp h ALA 37 CO 1.16 0.61 -0.35 0.09 0.00 0.00 0.00 179.25 180.76 2arp n ASN 38 N -4.11 -3.26 -3.53 0.00 3.02 -0.97 -0.70 115.26 105.71 2arp n ASN 38 Ca -0.03 0.40 -0.07 0.00 -0.03 0.00 0.00 54.58 54.85 2arp n ASN 38 Cb 0.52 -1.76 -0.00 0.00 -0.61 0.00 0.00 39.78 37.93 2arp n ASN 38 CO 0.00 0.00 0.00 -0.72 -2.62 0.00 0.00 177.26 173.92 2arp s TYR 39 N -2.52 -0.07 -0.19 3.10 -0.85 -0.70 -4.62 117.35 111.50 2arp s TYR 39 Ca 0.00 -0.43 -0.06 0.00 -0.52 0.00 0.00 57.07 56.06 2arp s TYR 39 Cb 0.00 0.74 -0.03 0.00 0.38 0.00 0.00 41.96 43.04 2arp s TYR 39 CO 0.00 -1.25 0.04 0.00 -1.52 0.00 0.00 175.55 172.82 2arp s GLU 41 N 0.71 1.27 0.00 0.00 -1.05 -0.73 -4.96 118.70 113.94 2arp s GLU 41 Ca 0.02 -1.55 0.00 0.00 -0.15 0.00 0.00 54.97 53.29 2arp s GLU 41 Cb -0.14 -1.01 0.00 0.00 -0.44 0.00 0.00 34.13 32.54 2arp s GLU 41 CO 0.02 0.16 0.00 0.41 0.95 0.00 0.00 175.26 176.80 2arp n GLY 42 N -0.32 1.45 3.84 -3.83 0.00 -1.21 -1.52 105.19 103.61 2arp n GLY 42 Ca -0.09 -2.27 -0.36 0.00 0.00 0.00 0.00 46.02 43.31 2arp n GLY 42 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2arp s GLU 43 N -1.34 3.92 -0.59 1.61 0.41 -0.82 -4.65 118.70 117.24 2arp s GLU 43 Ca 0.00 0.40 0.03 0.00 -0.41 0.00 0.00 54.97 54.99 2arp s GLU 43 Cb 0.00 -3.07 0.15 0.00 -1.78 0.00 0.00 34.13 29.43 2arp s GLU 43 CO 0.00 0.58 0.36 0.00 -0.49 0.00 0.00 175.26 175.71 2arp n PRO 45 N 2.95 2.10 -2.03 0.00 -0.05 -1.26 -4.92 135.00 131.79 2arp n PRO 45 Ca 0.09 -1.66 -0.35 0.00 -0.05 0.00 0.00 63.50 61.53 2arp n PRO 45 Cb 0.34 -1.45 0.03 0.00 -0.05 0.00 0.00 33.50 32.37 2arp n PRO 45 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 175.50 173.91 2arp s SER 55 N -1.52 5.28 0.09 3.54 1.04 -1.26 -5.14 113.70 115.72 2arp s SER 55 Ca 0.35 2.30 -0.02 0.00 0.48 0.00 0.00 55.95 59.05 2arp s SER 55 Cb 0.20 -2.59 -0.05 0.00 0.10 0.00 0.00 66.02 63.68 2arp s SER 55 CO 0.28 -1.52 0.27 -0.76 0.98 0.00 0.00 173.24 172.49 2arp s LEU 56 N -4.11 4.33 0.94 2.42 1.02 -1.26 -5.04 118.68 116.98 2arp s LEU 56 Ca 0.75 0.40 -0.11 0.00 0.02 0.00 0.00 54.13 55.18 2arp s LEU 56 Cb -0.28 -3.07 0.16 0.00 0.02 0.00 0.00 46.19 43.02 2arp s LEU 56 CO 0.33 0.13 1.09 -0.94 0.02 0.00 0.00 176.35 176.98 2arp s SER 57 N -2.44 2.94 0.19 2.29 1.04 -1.26 -4.81 113.70 111.65 2arp s SER 57 Ca 0.37 1.65 -0.12 0.00 0.48 0.00 0.00 55.95 58.33 2arp s SER 57 Cb -0.13 -2.30 0.13 0.00 0.10 0.00 0.00 66.02 63.82 2arp s SER 57 CO 0.26 -3.00 1.83 0.15 0.98 0.00 0.00 173.24 173.47 2arp h PHE 58 N -1.80 0.70 -0.01 5.02 3.57 -1.99 -1.00 116.94 121.43 2arp h PHE 58 Ca -0.50 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.02 2arp h PHE 58 Cb 1.29 -0.23 -0.00 0.00 2.79 0.00 0.00 35.95 39.80 2arp h PHE 58 CO 0.42 0.41 0.01 1.25 -2.23 0.00 0.00 178.31 178.17 2arp h HIS 59 N 0.74 0.01 -0.91 0.41 2.76 -2.00 -0.74 115.15 115.43 2arp h HIS 59 Ca 0.23 0.00 0.04 0.00 -2.20 0.00 0.00 60.37 58.45 2arp h HIS 59 Cb -0.01 -0.00 -0.05 0.00 1.55 0.00 0.00 27.41 28.89 2arp h HIS 59 CO -0.05 0.01 0.60 0.77 -1.30 0.00 0.00 177.93 177.96 2arp h SER 60 N 0.02 0.98 -0.25 3.26 0.02 -1.89 -1.70 113.55 113.98 2arp h SER 60 Ca 0.00 -0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 60.91 2arp h SER 60 Cb -0.00 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.31 2arp h SER 60 CO -0.00 0.66 -0.00 0.74 -1.14 0.00 0.00 176.83 177.09 2arp h THR 61 N 1.13 1.26 -0.43 -2.27 2.02 -0.63 -0.89 112.91 113.10 2arp h THR 61 Ca 0.37 -0.91 -0.13 0.00 0.77 0.00 0.00 66.41 66.51 2arp h THR 61 Cb 0.04 1.37 -0.01 0.00 -1.74 0.00 0.00 68.15 67.81 2arp h THR 61 CO -0.12 0.28 -0.23 -0.37 0.37 0.00 0.00 175.52 175.46 2arp h VAL 62 N 0.21 1.27 -0.32 3.16 -1.51 -0.92 -2.99 116.25 115.14 2arp h VAL 62 Ca 0.07 -1.39 -0.08 0.00 -1.23 0.00 0.00 66.70 64.08 2arp h VAL 62 Cb 0.42 1.25 -0.02 0.00 -2.13 0.00 0.00 31.29 30.80 2arp h VAL 62 CO 0.01 0.47 -0.12 0.40 -1.23 0.00 0.00 177.57 177.11 2arp h ILE 63 N 0.74 1.24 -0.21 7.19 1.08 -1.32 -3.16 117.51 123.07 2arp h ILE 63 Ca 0.09 -1.05 -0.04 0.00 -0.39 0.00 0.00 64.86 63.47 2arp h ILE 63 Cb 0.80 1.12 -0.01 0.00 -3.07 0.00 0.00 36.82 35.66 2arp h ILE 63 CO 0.07 0.35 -0.06 0.78 -0.69 0.00 0.00 178.15 178.60 2arp h ASN 64 N 0.51 0.29 -1.01 1.72 2.35 -1.01 -1.23 115.58 117.20 2arp h ASN 64 Ca 0.09 -0.05 0.24 0.00 -0.55 0.00 0.00 56.30 56.03 2arp h ASN 64 Cb 0.51 -0.08 -0.11 0.00 0.05 0.00 0.00 38.32 38.69 2arp h ASN 64 CO 0.03 0.40 0.62 -0.74 -1.65 0.00 0.00 177.43 176.09 2arp h HIS 65 N 0.30 0.90 -0.15 1.19 -0.00 -1.52 -1.97 115.15 113.89 2arp h HIS 65 Ca 0.07 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.47 2arp h HIS 65 Cb 0.30 -0.26 0.00 0.00 -0.00 0.00 0.00 27.41 27.45 2arp h HIS 65 CO 0.01 0.11 0.00 0.66 -0.00 0.00 0.00 177.93 178.71 2arp n TYR 66 N -4.76 0.19 1.12 5.26 4.02 -0.47 -3.38 117.16 119.14 2arp n TYR 66 Ca 0.25 -0.09 0.12 0.00 -0.01 0.00 0.00 57.90 58.17 2arp n TYR 66 Cb 0.74 0.00 0.18 0.00 -0.02 0.00 0.00 39.34 40.24 2arp n TYR 66 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 2arp n ARG 67 N 0.48 0.98 -2.08 -0.72 1.74 -0.74 -0.72 116.66 115.59 2arp n ARG 67 Ca 0.17 -0.71 -0.41 0.00 -0.77 0.00 0.00 57.85 56.13 2arp n ARG 67 Cb 0.38 -1.49 -0.02 0.00 -1.02 0.00 0.00 32.46 30.32 2arp n ARG 67 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 2arp s MET 68 N -2.51 4.31 0.06 5.56 -1.94 -1.22 -4.88 119.30 118.68 2arp s MET 68 Ca 0.21 2.25 -0.38 0.00 -1.71 0.00 0.00 55.69 56.06 2arp s MET 68 Cb 0.19 -3.04 -0.18 0.00 2.01 0.00 0.00 34.83 33.81 2arp s MET 68 CO 0.56 -0.24 1.21 -2.13 -0.01 0.00 0.00 175.02 174.42 2arp n ARG 69 N 0.72 0.69 -0.93 2.03 0.63 -1.26 -1.15 116.66 117.39 2arp n ARG 69 Ca 0.00 0.25 0.00 0.00 -0.92 0.00 0.00 57.85 57.18 2arp n ARG 69 Cb 0.42 -1.82 0.00 0.00 0.45 0.00 0.00 32.46 31.51 2arp n ARG 69 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2arp n GLY 70 N 2.10 0.48 3.77 5.14 0.00 -1.26 -5.01 105.19 110.40 2arp n GLY 70 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.82 2arp n GLY 70 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2arp s HIS 71 N -2.25 3.06 -0.06 1.61 2.46 -0.30 -5.06 115.29 114.75 2arp s HIS 71 Ca 0.00 1.54 0.00 0.00 0.47 0.00 0.00 55.06 57.07 2arp s HIS 71 Cb 0.00 -3.44 0.02 0.00 -0.13 0.00 0.00 32.58 29.04 2arp s HIS 71 CO 0.00 -1.40 -0.04 0.45 -2.47 0.00 0.00 174.74 171.28 2arp s SER 72 N -1.04 1.35 0.97 9.88 0.15 -1.26 -3.70 113.70 120.04 2arp s SER 72 Ca 0.56 -0.16 -0.11 0.00 0.70 0.00 0.00 55.95 56.94 2arp s SER 72 Cb -0.32 -0.53 0.17 0.00 -1.71 0.00 0.00 66.02 63.63 2arp s SER 72 CO 0.41 -0.09 1.09 -2.16 1.20 0.00 0.00 173.24 173.69 2arp s PRO 73 N 1.25 0.63 -0.09 5.44 0.04 -1.26 -5.15 135.00 135.86 2arp s PRO 73 Ca -0.05 1.09 0.03 0.00 0.04 0.00 0.00 61.00 62.11 2arp s PRO 73 Cb -0.14 -1.72 0.01 0.00 0.04 0.00 0.00 34.50 32.69 2arp s PRO 73 CO -0.02 -2.75 -0.20 0.12 0.04 0.00 0.00 177.00 174.19 2arp s PHE 74 N -2.70 2.22 -0.39 0.56 2.19 -1.24 -4.82 117.98 113.80 2arp s PHE 74 Ca 0.66 -0.92 -0.18 0.00 0.33 0.00 0.00 56.93 56.82 2arp s PHE 74 Cb -0.21 -1.52 0.01 0.00 -1.31 0.00 0.00 43.02 39.98 2arp s PHE 74 CO 0.59 -0.40 0.47 0.00 1.83 0.00 0.00 175.22 177.71 2arp s ALA 75 N 0.52 3.44 -1.17 11.12 0.00 0.10 -4.98 121.76 130.80 2arp s ALA 75 Ca -0.16 -1.27 -0.07 0.00 0.00 0.00 0.00 51.96 50.46 2arp s ALA 75 Cb -0.17 -3.03 0.25 0.00 0.00 0.00 0.00 23.12 20.17 2arp s ALA 75 CO 0.06 -1.40 1.60 -1.71 0.00 0.00 0.00 175.76 174.31 2arp n ASN 76 N 5.68 5.79 -4.72 0.00 4.05 -1.26 -4.48 115.26 120.31 2arp n ASN 76 Ca -0.06 -3.25 -0.41 0.00 0.45 0.00 0.00 54.58 51.31 2arp n ASN 76 Cb 0.48 -1.38 -0.04 0.00 1.23 0.00 0.00 39.78 40.08 2arp n ASN 76 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 177.26 173.99 2arp s LEU 77 N -1.42 4.42 -0.69 1.20 0.20 -1.26 -4.94 118.68 116.19 2arp s LEU 77 Ca 0.35 1.68 -0.26 0.00 0.69 0.00 0.00 54.13 56.59 2arp s LEU 77 Cb 0.05 -3.54 -0.03 0.00 -0.43 0.00 0.00 46.19 42.23 2arp s LEU 77 CO 0.05 -0.17 1.93 -0.75 -0.29 0.00 0.00 176.35 177.11 2arp s LYS 78 N 0.59 2.55 0.33 1.98 2.47 -1.26 -4.94 119.74 121.47 2arp s LYS 78 Ca 0.49 0.41 -0.27 0.00 -1.56 0.00 0.00 55.97 55.04 2arp s LYS 78 Cb -0.22 -4.59 -0.09 0.00 -1.46 0.00 0.00 37.83 31.47 2arp s LYS 78 CO 0.28 -2.98 1.09 0.45 0.16 0.00 0.00 175.35 174.35 2arp s SER 79 N 8.39 7.00 0.07 1.43 0.15 -1.26 -4.98 113.70 124.49 2arp s SER 79 Ca 0.70 2.21 -0.26 0.00 0.70 0.00 0.00 55.95 59.30 2arp s SER 79 Cb -0.11 -2.61 0.08 0.00 -1.71 0.00 0.00 66.02 61.66 2arp s SER 79 CO 0.15 -0.33 0.69 0.00 1.20 0.00 0.00 173.24 174.95 2arp s VAL 82 N 9.68 1.65 0.21 0.00 -7.23 -0.69 -4.78 120.40 119.24 2arp s VAL 82 Ca 0.70 -2.10 -0.31 0.00 -1.81 0.00 0.00 61.98 58.47 2arp s VAL 82 Cb -0.11 -2.59 -0.10 0.00 0.56 0.00 0.00 36.38 34.14 2arp s VAL 82 CO 0.15 -0.20 1.48 -2.84 -0.31 0.00 0.00 175.10 173.38 2arp s PRO 83 N -3.75 4.25 -0.00 4.82 0.02 -1.26 -0.53 135.00 138.55 2arp s PRO 83 Ca 0.32 2.31 0.11 0.00 0.02 0.00 0.00 61.00 63.76 2arp s PRO 83 Cb 0.05 -3.13 -0.13 0.00 0.02 0.00 0.00 34.50 31.31 2arp s PRO 83 CO 0.14 -0.49 0.41 0.25 -0.33 0.00 0.00 177.00 176.98 2arp n THR 84 N 3.01 0.00 -3.72 0.99 -2.24 0.41 -4.82 114.28 107.91 2arp n THR 84 Ca 0.10 -0.25 -0.13 0.00 -2.27 0.00 0.00 64.05 61.50 2arp n THR 84 Cb 0.40 0.84 -0.13 0.00 -2.10 0.00 0.00 70.33 69.34 2arp n THR 84 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2arp s LYS 85 N -2.18 0.19 0.21 -0.78 2.47 -1.13 -4.72 119.74 113.80 2arp s LYS 85 Ca 0.02 0.55 0.09 0.00 -1.56 0.00 0.00 55.97 55.07 2arp s LYS 85 Cb 0.08 -0.12 -0.05 0.00 -1.46 0.00 0.00 37.83 36.29 2arp s LYS 85 CO 0.45 -0.18 -0.17 -0.51 0.16 0.00 0.00 175.35 175.10 2arp s LEU 86 N 1.43 2.52 0.13 5.43 2.01 -1.26 -1.07 118.68 127.87 2arp s LEU 86 Ca -0.08 -0.97 0.08 0.00 0.01 0.00 0.00 54.13 53.17 2arp s LEU 86 Cb -0.11 -0.82 -0.04 0.00 0.01 0.00 0.00 46.19 45.24 2arp s LEU 86 CO -0.08 -0.08 -0.18 -0.13 1.01 0.00 0.00 176.35 176.89 2arp s ARG 87 N -3.32 1.13 0.82 1.70 3.00 -0.05 -4.76 118.95 117.47 2arp s ARG 87 Ca 0.22 -1.26 -0.12 0.00 0.00 0.00 0.00 55.73 54.57 2arp s ARG 87 Cb -0.03 -1.21 0.08 0.00 0.00 0.00 0.00 34.95 33.79 2arp s ARG 87 CO 0.08 0.26 1.12 -1.25 0.00 0.00 0.00 175.30 175.51 2arp s PRO 88 N -2.41 1.92 -0.09 3.54 0.04 -1.26 -0.82 135.00 135.92 2arp s PRO 88 Ca 0.10 0.46 -0.11 0.00 0.04 0.00 0.00 61.00 61.49 2arp s PRO 88 Cb -0.07 -1.91 0.03 0.00 0.04 0.00 0.00 34.50 32.58 2arp s PRO 88 CO 0.05 -1.69 0.29 1.41 0.04 0.00 0.00 177.00 177.10 2arp s MET 89 N -5.27 0.40 0.39 4.56 1.75 -0.19 -4.81 119.30 116.14 2arp s MET 89 Ca 0.61 0.29 -0.25 0.00 -1.25 0.00 0.00 55.69 55.10 2arp s MET 89 Cb -0.14 0.19 -0.09 0.00 2.84 0.00 0.00 34.83 37.64 2arp s MET 89 CO 0.53 -0.07 1.08 -1.12 -0.65 0.00 0.00 175.02 174.79 2arp s SER 90 N -0.12 6.77 -0.01 1.11 0.01 -1.26 -0.68 113.70 119.51 2arp s SER 90 Ca -0.03 2.12 -0.14 0.00 1.31 0.00 0.00 55.95 59.22 2arp s SER 90 Cb -0.03 -2.60 0.02 0.00 0.21 0.00 0.00 66.02 63.63 2arp s SER 90 CO 0.01 -0.49 0.29 -0.04 0.41 0.00 0.00 173.24 173.42 2arp s MET 91 N -2.33 0.65 -0.07 12.44 -1.94 0.21 -4.55 119.30 123.72 2arp s MET 91 Ca 0.56 -0.22 0.05 0.00 -1.71 0.00 0.00 55.69 54.37 2arp s MET 91 Cb -0.25 0.29 -0.01 0.00 2.01 0.00 0.00 34.83 36.86 2arp s MET 91 CO 0.31 -0.18 -0.21 -0.51 -0.01 0.00 0.00 175.02 174.43 2arp s LEU 92 N -1.34 2.30 0.26 -0.03 1.43 -0.33 -0.92 118.68 120.04 2arp s LEU 92 Ca -0.14 -0.42 -0.18 0.00 -1.03 0.00 0.00 54.13 52.37 2arp s LEU 92 Cb -0.05 -1.44 0.01 0.00 0.03 0.00 0.00 46.19 44.73 2arp s LEU 92 CO 0.04 0.25 0.61 -0.72 0.23 0.00 0.00 176.35 176.76 2arp s TYR 93 N -0.20 0.01 -0.16 0.29 -0.85 -0.26 -0.52 117.35 115.66 2arp s TYR 93 Ca -0.02 -0.41 -0.15 0.00 -0.52 0.00 0.00 57.07 55.97 2arp s TYR 93 Cb -0.13 0.48 -0.04 0.00 0.38 0.00 0.00 41.96 42.64 2arp s TYR 93 CO 0.03 -1.10 0.36 0.71 -1.52 0.00 0.00 175.55 174.03 2arp s TYR 94 N -3.95 3.45 0.00 -3.49 1.51 -0.73 -1.13 117.35 113.02 2arp s TYR 94 Ca 0.15 0.66 0.00 0.00 -1.01 0.00 0.00 57.07 56.87 2arp s TYR 94 Cb -0.03 -2.43 0.00 0.00 -0.11 0.00 0.00 41.96 39.38 2arp s TYR 94 CO 0.06 0.16 0.00 -0.40 -1.11 0.00 0.00 175.55 174.26 2arp n ASP 95 N 3.82 0.00 0.18 2.29 3.85 -0.79 -4.85 116.55 121.05 2arp n ASP 95 Ca -0.10 -0.89 0.02 0.00 -0.71 0.00 0.00 54.79 53.12 2arp n ASP 95 Cb 0.52 0.00 0.32 0.00 -1.35 0.00 0.00 41.12 40.61 2arp n ASP 95 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 177.20 176.63 2arp h ASP 96 N 0.00 0.00 -0.03 -1.12 5.19 -1.99 0.05 116.42 118.52 2arp h ASP 96 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2arp h ASP 96 Cb 0.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 2arp h ASP 96 CO 0.00 0.43 0.00 0.61 -3.12 0.00 0.00 179.24 177.16 2arp n GLY 97 N -0.20 -0.76 2.47 2.75 0.00 -1.26 -4.89 105.19 103.31 2arp n GLY 97 Ca -0.01 -0.18 -0.16 0.00 0.00 0.00 0.00 46.02 45.66 2arp n GLY 97 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2arp n GLN 98 N -0.59 -2.32 -3.45 1.61 1.13 0.00 -5.01 117.38 108.74 2arp n GLN 98 Ca 0.15 0.73 -0.31 0.00 -1.94 0.00 0.00 57.00 55.63 2arp n GLN 98 Cb 0.12 -5.12 -0.05 0.00 0.11 0.00 0.00 30.24 25.30 2arp n GLN 98 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 2arp s ASN 99 N -2.50 6.58 -0.15 1.08 0.01 -1.26 -4.83 114.94 113.87 2arp s ASN 99 Ca 0.10 0.84 -0.29 0.00 -0.71 0.00 0.00 52.86 52.80 2arp s ASN 99 Cb -0.04 -2.19 -0.00 0.00 0.41 0.00 0.00 41.25 39.42 2arp s ASN 99 CO 0.12 -0.07 1.00 -0.63 -1.51 0.00 0.00 177.10 176.02 2arp s ILE 100 N -1.82 4.76 -0.06 0.60 1.01 -1.26 -1.88 121.20 122.54 2arp s ILE 100 Ca 0.46 2.00 0.04 0.00 0.00 0.00 0.00 60.65 63.14 2arp s ILE 100 Cb -0.11 -4.29 0.00 0.00 0.01 0.00 0.00 42.46 38.06 2arp s ILE 100 CO 0.23 -0.05 -0.18 -0.63 0.00 0.00 0.00 174.94 174.31 2arp s ILE 101 N 2.42 1.51 -0.13 2.92 -1.09 -0.28 -4.98 121.20 121.56 2arp s ILE 101 Ca 0.46 -0.73 -0.05 0.00 -2.23 0.00 0.00 60.65 58.10 2arp s ILE 101 Cb -0.17 -1.31 -0.04 0.00 -1.58 0.00 0.00 42.46 39.36 2arp s ILE 101 CO 0.13 0.43 0.03 -0.75 -1.23 0.00 0.00 174.94 173.56 2arp s LYS 102 N 0.25 3.48 0.05 2.79 2.36 -1.26 -1.10 119.74 126.31 2arp s LYS 102 Ca -0.09 -0.36 0.01 0.00 -2.55 0.00 0.00 55.97 52.97 2arp s LYS 102 Cb -0.14 -3.01 -0.03 0.00 -1.05 0.00 0.00 37.83 33.61 2arp s LYS 102 CO 0.04 0.50 -0.05 0.15 1.55 0.00 0.00 175.35 177.54 2arp s LYS 103 N -0.30 0.56 -0.46 4.03 1.02 -0.10 -5.00 119.74 119.49 2arp s LYS 103 Ca 0.07 -0.93 -0.18 0.00 0.02 0.00 0.00 55.97 54.96 2arp s LYS 103 Cb -0.12 -0.08 0.04 0.00 -0.52 0.00 0.00 37.83 37.15 2arp s LYS 103 CO 0.02 -0.02 0.50 -0.51 -0.92 0.00 0.00 175.35 174.42 2arp s ASP 104 N -2.12 6.20 -0.20 2.83 1.01 -1.26 -0.62 116.67 122.52 2arp s ASP 104 Ca -0.04 -0.84 -0.15 0.00 0.71 0.00 0.00 52.55 52.23 2arp s ASP 104 Cb -0.03 -2.24 -0.04 0.00 1.01 0.00 0.00 42.92 41.61 2arp s ASP 104 CO -0.03 -0.70 0.36 -0.63 0.21 0.00 0.00 175.17 174.38 2arp s ILE 105 N 2.25 5.23 0.61 0.77 -1.09 0.14 -4.91 121.20 124.20 2arp s ILE 105 Ca 0.12 0.64 -0.14 0.00 -2.23 0.00 0.00 60.65 59.05 2arp s ILE 105 Cb -0.19 -3.70 -0.04 0.00 -1.58 0.00 0.00 42.46 36.96 2arp s ILE 105 CO 0.12 0.28 1.04 -1.10 -1.23 0.00 0.00 174.94 174.05 2arp s GLN 106 N 1.14 3.41 -1.50 2.79 -1.52 -1.26 -1.02 119.66 121.70 2arp s GLN 106 Ca 0.18 1.01 -0.02 0.00 -1.95 0.00 0.00 55.36 54.58 2arp s GLN 106 Cb -0.14 -2.05 0.00 0.00 -0.22 0.00 0.00 33.01 30.59 2arp s GLN 106 CO 0.07 -0.72 0.20 0.09 -0.25 0.00 0.00 175.29 174.69 2arp n ASN 107 N -2.32 -5.44 0.07 5.90 3.02 -1.23 -4.85 115.26 110.40 2arp n ASN 107 Ca 0.07 -0.11 0.02 0.00 -0.03 0.00 0.00 54.58 54.53 2arp n ASN 107 Cb 0.53 -4.42 -0.04 0.00 -0.61 0.00 0.00 39.78 35.24 2arp n ASN 107 CO 0.00 0.00 0.00 0.24 -2.62 0.00 0.00 177.26 174.88 2arp h MET 108 N -0.47 0.00 -5.25 3.52 2.86 -1.15 -3.46 114.93 110.98 2arp h MET 108 Ca -0.45 0.00 -0.56 0.00 -2.06 0.00 0.00 59.70 56.63 2arp h MET 108 Cb 1.32 0.00 -0.31 0.00 0.06 0.00 0.00 31.60 32.67 2arp h MET 108 CO 0.51 0.33 -0.84 0.42 1.06 0.00 0.00 176.91 178.39 2arp s ILE 109 N -2.97 1.43 -0.23 -1.22 1.01 -0.51 -4.77 121.20 113.93 2arp s ILE 109 Ca -0.01 -0.71 -0.27 0.00 0.00 0.00 0.00 60.65 59.66 2arp s ILE 109 Cb 0.08 -1.23 0.00 0.00 0.01 0.00 0.00 42.46 41.32 2arp s ILE 109 CO 0.79 0.41 0.96 -0.69 0.00 0.00 0.00 174.94 176.41 2arp s VAL 110 N 0.09 4.74 -0.12 2.92 1.01 0.12 -0.87 120.40 128.29 2arp s VAL 110 Ca -0.05 1.85 0.15 0.00 0.00 0.00 0.00 61.98 63.93 2arp s VAL 110 Cb -0.12 -4.24 -0.21 0.00 0.00 0.00 0.00 36.38 31.81 2arp s VAL 110 CO 0.02 -0.14 0.14 1.21 0.00 0.00 0.00 175.10 176.34 2arp n GLU 111 N 6.20 1.18 -3.64 2.72 4.07 -0.23 -4.71 120.64 126.24 2arp n GLU 111 Ca 0.10 -0.05 -0.15 0.00 -0.06 0.00 0.00 57.16 56.99 2arp n GLU 111 Cb 0.47 -1.40 -0.07 0.00 -0.06 0.00 0.00 31.44 30.37 2arp n GLU 111 CO 0.00 0.00 0.00 -2.00 -0.06 0.00 0.00 177.13 175.07 2arp s GLU 112 N -2.60 0.83 0.09 5.31 2.12 -1.01 -4.94 118.70 118.50 2arp s GLU 112 Ca -0.07 0.22 0.08 0.00 0.36 0.00 0.00 54.97 55.56 2arp s GLU 112 Cb 0.06 0.39 -0.03 0.00 0.26 0.00 0.00 34.13 34.81 2arp s GLU 112 CO 0.66 -0.22 -0.20 0.00 -0.54 0.00 0.00 175.26 174.95 2arp s GLY 114 N -1.79 -0.51 -0.11 0.00 0.00 0.31 -4.74 107.32 100.48 2arp s GLY 114 Ca 0.06 0.59 -0.30 0.00 0.00 0.00 0.00 44.72 45.07 2arp s GLY 114 CO 0.04 0.19 1.30 0.00 0.00 0.00 0.00 173.10 174.63