#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yun s SER 2 N 0.00 0.47 -0.12 1.61 0.01 -1.26 -5.14 113.70 109.28 2yun s SER 2 Ca 0.00 -0.04 0.01 0.00 1.31 0.00 0.00 55.95 57.22 2yun s SER 2 Cb 0.00 -0.23 0.02 0.00 0.21 0.00 0.00 66.02 66.02 2yun s SER 2 CO 0.00 -0.07 -0.13 -0.55 0.41 0.00 0.00 173.24 172.90 2yun s SER 3 N 0.84 2.42 0.00 2.44 0.15 -1.26 -5.07 113.70 113.23 2yun s SER 3 Ca -0.09 -0.41 0.00 0.00 0.70 0.00 0.00 55.95 56.15 2yun s SER 3 Cb -0.12 -1.04 0.00 0.00 -1.71 0.00 0.00 66.02 63.15 2yun s SER 3 CO -0.01 -0.05 0.00 0.61 1.20 0.00 0.00 173.24 174.99 2yun n GLY 4 N 4.61 1.18 3.88 9.45 0.00 -1.26 -5.03 105.19 118.03 2yun n GLY 4 Ca -0.17 -2.09 -0.34 0.00 0.00 0.00 0.00 46.02 43.43 2yun n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2yun s SER 5 N 0.00 6.56 -0.70 1.61 1.04 -1.26 -5.04 113.70 115.91 2yun s SER 5 Ca 0.00 0.67 -0.26 0.00 0.48 0.00 0.00 55.95 56.84 2yun s SER 5 Cb 0.00 -2.13 0.04 0.00 0.10 0.00 0.00 66.02 64.03 2yun s SER 5 CO 0.00 0.16 1.18 -0.94 0.98 0.00 0.00 173.24 174.62 2yun s SER 6 N -1.94 6.19 0.00 7.02 1.04 -1.26 -4.86 113.70 119.88 2yun s SER 6 Ca 0.34 -0.55 0.00 0.00 0.48 0.00 0.00 55.95 56.22 2yun s SER 6 Cb -0.13 -2.52 0.00 0.00 0.10 0.00 0.00 66.02 63.47 2yun s SER 6 CO 0.19 -1.69 0.00 0.61 0.98 0.00 0.00 173.24 173.33 2yun n GLY 7 N 5.34 4.30 3.77 7.32 0.00 -1.26 -5.01 105.19 119.65 2yun n GLY 7 Ca 0.02 -1.20 -0.32 0.00 0.00 0.00 0.00 46.02 44.51 2yun n GLY 7 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2yun s ARG 8 N -3.19 2.71 0.39 1.61 1.81 -1.17 -4.79 118.95 116.31 2yun s ARG 8 Ca 0.00 1.30 0.08 0.00 -1.72 0.00 0.00 55.73 55.38 2yun s ARG 8 Cb 0.00 -1.94 -0.07 0.00 -0.45 0.00 0.00 34.95 32.49 2yun s ARG 8 CO 0.00 -1.31 0.05 -0.51 -0.68 0.00 0.00 175.30 172.84 2yun s LEU 9 N -5.14 2.94 -0.17 2.53 2.01 -1.26 0.59 118.68 120.18 2yun s LEU 9 Ca 0.65 -1.21 -0.30 0.00 0.01 0.00 0.00 54.13 53.27 2yun s LEU 9 Cb -0.19 -1.13 0.14 0.00 0.01 0.00 0.00 46.19 45.02 2yun s LEU 9 CO 0.46 -0.42 1.06 0.00 1.01 0.00 0.00 176.35 178.46 2yun s LYS 11 N -1.38 2.95 -0.77 0.00 2.20 -0.73 -1.26 119.74 120.75 2yun s LYS 11 Ca 0.01 -0.42 -0.25 0.00 -0.36 0.00 0.00 55.97 54.95 2yun s LYS 11 Cb -0.01 -2.77 0.04 0.00 -1.51 0.00 0.00 37.83 33.59 2yun s LYS 11 CO -0.01 0.70 1.25 0.00 -0.36 0.00 0.00 175.35 176.92 2yun s ALA 12 N -0.88 2.82 0.17 3.13 0.00 0.22 -0.74 121.76 126.48 2yun s ALA 12 Ca 0.13 -1.61 -0.12 0.00 0.00 0.00 0.00 51.96 50.36 2yun s ALA 12 Cb -0.11 -4.22 0.06 0.00 0.00 0.00 0.00 23.12 18.85 2yun s ALA 12 CO 0.02 -3.24 1.72 -0.07 0.00 0.00 0.00 175.76 174.19 2yun h LEU 13 N 12.64 0.79 -8.47 0.00 3.38 -0.76 0.14 115.31 123.03 2yun h LEU 13 Ca -0.20 -0.17 -0.66 0.00 0.09 0.00 0.00 57.88 56.93 2yun h LEU 13 Cb 1.05 -0.20 -0.31 0.00 0.09 0.00 0.00 40.66 41.28 2yun h LEU 13 CO 1.28 0.75 -0.88 -0.31 0.09 0.00 0.00 178.44 179.37 2yun s TYR 14 N -5.54 2.23 0.13 1.13 1.51 -1.05 -4.63 117.35 111.13 2yun s TYR 14 Ca -0.13 -0.57 -0.31 0.00 -1.01 0.00 0.00 57.07 55.05 2yun s TYR 14 Cb 0.12 -1.46 -0.09 0.00 -0.11 0.00 0.00 41.96 40.43 2yun s TYR 14 CO 0.79 -0.14 1.46 -1.54 -1.11 0.00 0.00 175.55 175.01 2yun s SER 15 N -0.28 6.73 0.01 2.29 1.04 -1.26 -4.62 113.70 117.60 2yun s SER 15 Ca 0.01 2.44 0.03 0.00 0.48 0.00 0.00 55.95 58.91 2yun s SER 15 Cb -0.12 -2.59 -0.03 0.00 0.10 0.00 0.00 66.02 63.38 2yun s SER 15 CO 0.02 -0.72 -0.06 0.12 0.98 0.00 0.00 173.24 173.57 2yun s PHE 16 N 1.13 2.90 -0.58 5.02 5.36 -0.82 -4.91 117.98 126.08 2yun s PHE 16 Ca 0.67 -0.04 -0.01 0.00 -0.96 0.00 0.00 56.93 56.59 2yun s PHE 16 Cb -0.40 -1.61 0.15 0.00 -0.34 0.00 0.00 43.02 40.83 2yun s PHE 16 CO 0.31 0.38 0.37 -1.14 -1.46 0.00 0.00 175.22 173.67 2yun s GLN 17 N -1.46 2.35 -0.41 10.12 0.74 -1.26 -1.41 119.66 128.33 2yun s GLN 17 Ca 0.17 -2.49 -0.34 0.00 0.05 0.00 0.00 55.36 52.76 2yun s GLN 17 Cb -0.11 -3.60 -0.12 0.00 1.10 0.00 0.00 33.01 30.28 2yun s GLN 17 CO 0.08 -1.14 2.25 0.00 -0.55 0.00 0.00 175.29 175.93 2yun n ALA 18 N 3.49 1.00 -0.01 1.58 0.00 -1.26 -4.80 120.51 120.50 2yun n ALA 18 Ca 0.06 -0.16 0.02 0.00 0.00 0.00 0.00 53.44 53.36 2yun n ALA 18 Cb 0.37 -2.59 0.35 0.00 0.00 0.00 0.00 19.45 17.57 2yun n ALA 18 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2yun h ARG 19 N 13.10 0.56 -4.41 0.00 2.43 -1.95 -3.45 114.38 120.66 2yun h ARG 19 Ca -0.25 -0.07 -0.17 0.00 -0.81 0.00 0.00 59.98 58.68 2yun h ARG 19 Cb 1.31 -0.10 -0.15 0.00 -0.42 0.00 0.00 29.97 30.61 2yun h ARG 19 CO 1.06 0.47 -0.68 -0.65 -1.51 0.00 0.00 179.97 178.67 2yun s GLN 20 N -5.25 0.75 0.34 0.20 -1.52 -1.26 -5.03 119.66 107.88 2yun s GLN 20 Ca -0.08 -1.31 0.13 0.00 -1.95 0.00 0.00 55.36 52.15 2yun s GLN 20 Cb 0.16 0.09 0.99 0.00 -0.22 0.00 0.00 33.01 34.03 2yun s GLN 20 CO 0.75 -0.12 1.70 0.38 -0.25 0.00 0.00 175.29 177.76 2yun h ASP 21 N 3.03 0.59 -1.01 5.90 3.04 -2.02 0.36 116.42 126.31 2yun h ASP 21 Ca -0.35 0.15 0.23 0.00 -3.24 0.00 0.00 57.03 53.83 2yun h ASP 21 Cb 1.16 0.07 -0.11 0.00 -1.04 0.00 0.00 39.33 39.42 2yun h ASP 21 CO 0.64 0.01 0.62 0.44 -2.04 0.00 0.00 179.24 178.91 2yun h ASP 22 N 0.46 0.63 -3.78 4.15 3.32 -1.95 -3.41 116.42 115.83 2yun h ASP 22 Ca 0.68 0.10 -0.47 0.00 0.02 0.00 0.00 57.03 57.37 2yun h ASP 22 Cb 1.45 -0.00 0.07 0.00 0.22 0.00 0.00 39.33 41.07 2yun h ASP 22 CO -0.51 0.15 0.23 -1.61 -1.72 0.00 0.00 179.24 175.78 2yun s GLU 23 N -5.70 2.49 -0.09 3.56 2.02 0.13 -0.94 118.70 120.17 2yun s GLU 23 Ca -0.10 -0.11 0.04 0.00 0.02 0.00 0.00 54.97 54.81 2yun s GLU 23 Cb 0.26 -2.19 0.00 0.00 0.10 0.00 0.00 34.13 32.30 2yun s GLU 23 CO 0.80 -1.04 -0.21 -1.17 0.02 0.00 0.00 175.26 173.66 2yun s LEU 24 N -5.17 1.98 0.38 1.80 0.20 -0.33 -4.35 118.68 113.19 2yun s LEU 24 Ca 0.58 -0.49 -0.25 0.00 0.69 0.00 0.00 54.13 54.66 2yun s LEU 24 Cb -0.11 -1.26 -0.09 0.00 -0.43 0.00 0.00 46.19 44.30 2yun s LEU 24 CO 0.45 0.13 1.04 0.21 -0.29 0.00 0.00 176.35 177.90 2yun s ASN 25 N 0.39 6.88 0.18 3.68 3.84 -1.26 -4.35 114.94 124.31 2yun s ASN 25 Ca -0.17 2.03 0.03 0.00 0.21 0.00 0.00 52.86 54.96 2yun s ASN 25 Cb -0.17 -2.59 -0.05 0.00 -0.55 0.00 0.00 41.25 37.89 2yun s ASN 25 CO 0.07 -0.40 -0.02 -0.76 -2.79 0.00 0.00 177.10 173.20 2yun s LEU 26 N -2.46 2.23 -0.01 3.21 1.43 -0.50 -4.91 118.68 117.68 2yun s LEU 26 Ca 0.56 -1.15 -0.00 0.00 -1.03 0.00 0.00 54.13 52.50 2yun s LEU 26 Cb -0.22 -0.18 0.00 0.00 0.03 0.00 0.00 46.19 45.82 2yun s LEU 26 CO 0.28 -0.50 0.01 -1.61 0.23 0.00 0.00 176.35 174.77 2yun s GLU 27 N -3.86 0.01 -0.48 1.70 2.02 -1.26 -1.94 118.70 114.89 2yun s GLU 27 Ca 0.23 0.03 -0.36 0.00 0.02 0.00 0.00 54.97 54.90 2yun s GLU 27 Cb 0.05 -0.01 -0.14 0.00 0.10 0.00 0.00 34.13 34.13 2yun s GLU 27 CO 0.04 -0.02 2.27 1.17 0.02 0.00 0.00 175.26 178.75 2yun n LYS 28 N 3.17 0.69 -0.73 1.61 4.81 -1.25 -0.52 118.16 125.93 2yun n LYS 28 Ca -0.13 0.16 0.00 0.00 -0.87 0.00 0.00 58.31 57.47 2yun n LYS 28 Cb 0.59 -2.20 0.00 0.00 0.02 0.00 0.00 35.03 33.44 2yun n LYS 28 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2yun n GLY 29 N 6.71 1.27 3.39 3.14 0.00 0.49 -5.01 105.19 115.18 2yun n GLY 29 Ca 0.47 -0.27 -0.34 0.00 0.00 0.00 0.00 46.02 45.89 2yun n GLY 29 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2yun s ASP 30 N -2.33 4.38 -0.22 1.61 1.11 0.32 -4.86 116.67 116.68 2yun s ASP 30 Ca 0.00 -0.28 -0.23 0.00 0.18 0.00 0.00 52.55 52.21 2yun s ASP 30 Cb 0.00 -1.72 -0.01 0.00 1.07 0.00 0.00 42.92 42.26 2yun s ASP 30 CO 0.00 0.10 0.77 -0.63 1.18 0.00 0.00 175.17 176.59 2yun s ILE 31 N 0.77 4.90 0.00 0.77 -1.09 -1.26 -0.61 121.20 124.68 2yun s ILE 31 Ca -0.03 1.46 0.04 0.00 -2.23 0.00 0.00 60.65 59.89 2yun s ILE 31 Cb -0.15 -4.07 -0.03 0.00 -1.58 0.00 0.00 42.46 36.63 2yun s ILE 31 CO 0.02 -0.00 -0.10 -0.69 -1.23 0.00 0.00 174.94 172.94 2yun s VAL 32 N 2.45 3.42 -0.51 2.92 1.01 -0.39 -4.69 120.40 124.60 2yun s VAL 32 Ca 0.33 -0.84 -0.25 0.00 0.00 0.00 0.00 61.98 61.23 2yun s VAL 32 Cb -0.16 -2.46 0.03 0.00 0.00 0.00 0.00 36.38 33.80 2yun s VAL 32 CO 0.09 0.41 0.94 -0.63 0.00 0.00 0.00 175.10 175.91 2yun s ILE 33 N -0.95 4.42 -0.03 2.22 1.01 -0.26 -2.89 121.20 124.72 2yun s ILE 33 Ca 0.16 0.47 -0.30 0.00 0.00 0.00 0.00 60.65 60.98 2yun s ILE 33 Cb -0.11 -4.50 -0.05 0.00 0.01 0.00 0.00 42.46 37.81 2yun s ILE 33 CO 0.06 -1.00 1.54 -0.63 0.00 0.00 0.00 174.94 174.91 2yun s ILE 34 N 3.88 3.61 -0.17 2.92 1.01 0.20 -2.12 121.20 130.53 2yun s ILE 34 Ca 0.33 0.87 -0.07 0.00 0.00 0.00 0.00 60.65 61.78 2yun s ILE 34 Cb -0.11 -3.56 -0.08 0.00 0.01 0.00 0.00 42.46 38.72 2yun s ILE 34 CO 0.22 -0.04 -0.21 1.41 0.00 0.00 0.00 174.94 176.32 2yun n HIS 35 N 6.33 0.00 -3.73 3.97 8.25 0.58 -3.05 115.22 127.56 2yun n HIS 35 Ca 0.15 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.49 2yun n HIS 35 Cb 0.43 -0.60 -0.10 0.00 1.12 0.00 0.00 29.99 30.84 2yun n HIS 35 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 2yun s GLU 36 N -2.31 0.47 -0.02 -0.41 0.41 -0.47 -4.99 118.70 111.39 2yun s GLU 36 Ca -0.23 0.60 0.03 0.00 -0.41 0.00 0.00 54.97 54.96 2yun s GLU 36 Cb 0.09 0.19 0.04 0.00 -1.78 0.00 0.00 34.13 32.67 2yun s GLU 36 CO 0.30 -0.07 0.83 1.63 -0.49 0.00 0.00 175.26 177.46 2yun n LYS 37 N 3.07 1.06 -0.55 1.61 5.02 -1.26 0.27 118.16 127.38 2yun n LYS 37 Ca -0.15 -1.18 0.46 0.00 -2.02 0.00 0.00 58.31 55.42 2yun n LYS 37 Cb 0.57 -0.79 0.75 0.00 -0.02 0.00 0.00 35.03 35.54 2yun n LYS 37 CO 0.00 0.00 0.00 1.57 -0.52 0.00 0.00 177.40 178.45 2yun h LYS 38 N 0.00 0.00 -7.31 1.97 -0.00 -1.96 -3.40 116.57 105.87 2yun h LYS 38 Ca 0.00 0.00 -0.51 0.00 -0.00 0.00 0.00 60.65 60.14 2yun h LYS 38 Cb 0.93 0.00 0.10 0.00 -0.00 0.00 0.00 32.23 33.26 2yun h LYS 38 CO 0.00 0.00 0.36 -2.00 -0.00 0.00 0.00 179.45 177.81 2yun s GLU 39 N -4.80 2.79 -0.78 0.07 2.56 -1.26 -4.96 118.70 112.32 2yun s GLU 39 Ca -0.05 1.06 -0.23 0.00 0.00 0.00 0.00 54.97 55.75 2yun s GLU 39 Cb 0.24 -1.97 0.06 0.00 2.00 0.00 0.00 34.13 34.46 2yun s GLU 39 CO 0.80 -1.22 1.17 -1.21 -0.56 0.00 0.00 175.26 174.25 2yun s GLU 40 N -4.85 3.29 0.00 4.30 2.02 -1.26 -4.18 118.70 118.02 2yun s GLU 40 Ca 0.60 -0.83 0.00 0.00 0.02 0.00 0.00 54.97 54.76 2yun s GLU 40 Cb -0.15 -4.50 0.00 0.00 0.10 0.00 0.00 34.13 29.57 2yun s GLU 40 CO 0.53 -1.98 0.00 0.41 0.02 0.00 0.00 175.26 174.23 2yun n GLY 41 N 5.63 2.27 3.63 -1.39 0.00 -1.26 -4.98 105.19 109.09 2yun n GLY 41 Ca 0.09 -0.52 -0.43 0.00 0.00 0.00 0.00 46.02 45.16 2yun n GLY 41 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2yun s TRP 42 N -0.54 2.73 0.07 1.61 0.52 -1.26 -0.46 118.94 121.61 2yun s TRP 42 Ca 0.00 0.90 0.02 0.00 0.02 0.00 0.00 56.10 57.04 2yun s TRP 42 Cb 0.00 -3.88 -0.04 0.00 -1.15 0.00 0.00 33.47 28.40 2yun s TRP 42 CO 0.00 -1.63 0.13 -1.58 0.02 0.00 0.00 176.95 173.89 2yun s TRP 43 N 4.28 3.31 -0.16 -1.98 0.52 -0.22 -4.10 118.94 120.58 2yun s TRP 43 Ca 0.55 0.14 0.01 0.00 0.02 0.00 0.00 56.10 56.83 2yun s TRP 43 Cb -0.16 -1.67 0.02 0.00 -1.15 0.00 0.00 33.47 30.50 2yun s TRP 43 CO 0.22 0.55 -0.20 0.12 0.02 0.00 0.00 176.95 177.66 2yun s PHE 44 N -1.44 2.65 0.12 -1.98 5.36 0.14 -1.59 117.98 121.25 2yun s PHE 44 Ca 0.31 -1.48 -0.24 0.00 -0.96 0.00 0.00 56.93 54.56 2yun s PHE 44 Cb -0.12 -1.84 0.08 0.00 -0.34 0.00 0.00 43.02 40.80 2yun s PHE 44 CO 0.24 -0.72 1.12 0.20 -1.46 0.00 0.00 175.22 174.60 2yun s GLY 45 N 1.14 0.02 -0.24 13.12 0.00 -1.16 -0.31 107.32 119.89 2yun s GLY 45 Ca 0.01 -0.19 -0.05 0.00 0.00 0.00 0.00 44.72 44.49 2yun s GLY 45 CO -0.09 3.22 0.01 -0.45 0.00 0.00 0.00 173.10 175.79 2yun s SER 46 N -3.50 4.67 0.00 1.64 0.15 -0.90 -2.08 113.70 113.68 2yun s SER 46 Ca 0.24 -0.43 0.00 0.00 0.70 0.00 0.00 55.95 56.45 2yun s SER 46 Cb -0.02 -1.81 0.00 0.00 -1.71 0.00 0.00 66.02 62.48 2yun s SER 46 CO 0.03 -0.06 0.34 -0.11 1.20 0.00 0.00 173.24 174.63 2yun n LEU 47 N 4.84 0.86 -2.45 3.45 7.94 -0.93 -1.10 117.00 129.61 2yun n LEU 47 Ca -0.17 0.46 -0.26 0.00 -1.11 0.00 0.00 56.01 54.94 2yun n LEU 47 Cb 0.50 -0.24 0.00 0.00 0.53 0.00 0.00 43.42 44.22 2yun n LEU 47 CO 0.30 -0.24 0.17 0.59 -1.11 0.00 0.00 177.39 177.11 2yun n ASN 48 N -1.21 4.57 0.00 1.96 3.02 -1.26 -4.58 115.26 117.76 2yun n ASN 48 Ca 0.00 -3.67 0.00 0.00 -0.03 0.00 0.00 54.58 50.88 2yun n ASN 48 Cb 0.00 -0.45 0.00 0.00 -0.61 0.00 0.00 39.78 38.72 2yun n ASN 48 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2yun n GLY 49 N -0.48 0.62 3.04 7.41 0.00 -1.26 -5.06 105.19 109.45 2yun n GLY 49 Ca 0.38 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.10 2yun n GLY 49 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yun s LYS 50 N -0.93 2.34 0.40 1.61 -0.14 -1.26 -5.07 119.74 116.69 2yun s LYS 50 Ca 0.00 -0.58 -0.08 0.00 -1.36 0.00 0.00 55.97 53.94 2yun s LYS 50 Cb 0.00 -2.09 -0.06 0.00 -1.68 0.00 0.00 37.83 34.00 2yun s LYS 50 CO 0.00 -0.19 0.74 0.15 -0.76 0.00 0.00 175.35 175.29 2yun s LYS 51 N 1.34 3.71 0.00 1.68 1.02 -1.26 -2.18 119.74 124.05 2yun s LYS 51 Ca 0.02 0.34 0.00 0.00 0.02 0.00 0.00 55.97 56.35 2yun s LYS 51 Cb -0.13 -2.43 0.00 0.00 -0.52 0.00 0.00 37.83 34.74 2yun s LYS 51 CO -0.08 -0.03 0.00 0.41 -0.92 0.00 0.00 175.35 174.73 2yun n GLY 52 N -1.42 -0.75 3.54 -3.33 0.00 -0.89 -4.87 105.19 97.48 2yun n GLY 52 Ca 0.01 -1.09 -0.41 0.00 0.00 0.00 0.00 46.02 44.54 2yun n GLY 52 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2yun s HIS 53 N -2.00 3.21 0.13 1.61 3.76 -0.11 -3.01 115.29 118.87 2yun s HIS 53 Ca 0.00 -0.02 0.09 0.00 -0.15 0.00 0.00 55.06 54.98 2yun s HIS 53 Cb 0.00 -2.69 -0.04 0.00 1.11 0.00 0.00 32.58 30.97 2yun s HIS 53 CO 0.00 -0.44 -0.21 -0.59 -0.85 0.00 0.00 174.74 172.65 2yun s PHE 54 N 2.04 1.88 0.20 1.40 -0.12 -0.62 -1.18 117.98 121.57 2yun s PHE 54 Ca 0.12 -0.43 -0.30 0.00 -0.05 0.00 0.00 56.93 56.27 2yun s PHE 54 Cb -0.16 -0.99 -0.09 0.00 -0.63 0.00 0.00 43.02 41.14 2yun s PHE 54 CO 0.12 0.27 1.30 -1.25 -0.05 0.00 0.00 175.22 175.61 2yun s PRO 55 N -2.22 4.40 -0.03 1.99 0.04 -1.26 -1.06 135.00 136.86 2yun s PRO 55 Ca 0.11 2.05 -0.25 0.00 0.04 0.00 0.00 61.00 62.94 2yun s PRO 55 Cb -0.09 -3.19 -0.19 0.00 0.04 0.00 0.00 34.50 31.07 2yun s PRO 55 CO 0.05 -0.24 1.18 0.00 0.04 0.00 0.00 177.00 178.04 2yun h ALA 56 N 5.27 -0.09 -0.61 8.56 0.00 -1.08 -3.04 119.26 128.26 2yun h ALA 56 Ca -0.45 -0.24 0.18 0.00 0.00 0.00 0.00 54.91 54.40 2yun h ALA 56 Cb 1.21 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.02 2yun h ALA 56 CO 0.76 -0.30 1.00 0.00 0.00 0.00 0.00 179.25 180.72 2yun h ALA 57 N 0.26 2.50 0.20 0.00 0.00 -1.93 1.49 119.26 121.77 2yun h ALA 57 Ca -0.01 -0.02 -0.33 0.00 0.00 0.00 0.00 54.91 54.55 2yun h ALA 57 Cb 0.51 0.05 0.02 0.00 0.00 0.00 0.00 17.79 18.36 2yun h ALA 57 CO 0.02 -1.32 -1.50 1.88 0.00 0.00 0.00 179.25 178.32 2yun h TYR 58 N 0.00 0.77 -2.58 0.00 -1.99 -1.88 -3.47 116.97 107.82 2yun h TYR 58 Ca 0.29 -0.56 -0.55 0.00 2.00 0.00 0.00 58.73 59.91 2yun h TYR 58 Cb 2.29 -0.03 -0.05 0.00 2.00 0.00 0.00 36.73 40.94 2yun h TYR 58 CO 0.00 1.51 -0.52 0.14 -0.00 0.00 0.00 178.16 179.29 2yun s VAL 59 N -2.61 4.79 -0.10 -2.88 -7.23 0.51 -0.03 120.40 112.85 2yun s VAL 59 Ca -0.09 -0.98 0.01 0.00 -1.81 0.00 0.00 61.98 59.10 2yun s VAL 59 Cb 0.05 -3.47 0.02 0.00 0.56 0.00 0.00 36.38 33.54 2yun s VAL 59 CO 0.90 -0.14 -0.10 -0.70 -0.31 0.00 0.00 175.10 174.76 2yun s GLU 60 N -3.26 1.67 0.23 4.82 2.12 0.08 -4.82 118.70 119.55 2yun s GLU 60 Ca 0.32 -0.35 -0.31 0.00 0.36 0.00 0.00 54.97 54.99 2yun s GLU 60 Cb -0.10 -1.56 -0.14 0.00 0.26 0.00 0.00 34.13 32.59 2yun s GLU 60 CO 0.25 -0.14 1.32 -1.91 -0.54 0.00 0.00 175.26 174.25 2yun n GLU 61 N 4.44 1.79 -4.25 4.30 2.13 -1.26 -1.78 120.64 126.00 2yun n GLU 61 Ca -0.17 0.64 -0.21 0.00 0.66 0.00 0.00 57.16 58.07 2yun n GLU 61 Cb 0.51 -2.24 -0.12 0.00 0.27 0.00 0.00 31.44 29.86 2yun n GLU 61 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 2yun s LEU 62 N 0.19 2.33 -0.02 4.31 1.43 -0.99 -4.88 118.68 121.06 2yun s LEU 62 Ca 0.68 -0.71 -0.26 0.00 -1.03 0.00 0.00 54.13 52.81 2yun s LEU 62 Cb -0.70 -0.71 -0.20 0.00 0.03 0.00 0.00 46.19 44.61 2yun s LEU 62 CO 0.51 -0.03 1.26 1.55 0.23 0.00 0.00 176.35 179.87 2yun h PRO 63 N 3.92 -0.01 -2.41 1.29 0.13 -1.94 -3.39 132.00 129.58 2yun h PRO 63 Ca -0.43 0.00 0.15 0.00 -0.87 0.00 0.00 66.00 64.85 2yun h PRO 63 Cb 1.19 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.23 2yun h PRO 63 CO 0.43 0.48 0.45 0.45 -0.23 0.00 0.00 178.00 179.58 2yun s SER 64 N -5.68 -0.24 -0.11 1.44 0.15 -1.26 -4.93 113.70 103.07 2yun s SER 64 Ca -0.16 -0.33 0.03 0.00 0.70 0.00 0.00 55.95 56.19 2yun s SER 64 Cb 0.02 0.49 0.01 0.00 -1.71 0.00 0.00 66.02 64.83 2yun s SER 64 CO 0.67 -0.89 -0.20 0.21 1.20 0.00 0.00 173.24 174.23 2yun s ASN 65 N -2.85 2.78 -0.30 5.45 3.84 -1.26 -5.09 114.94 117.51 2yun s ASN 65 Ca 0.10 -0.51 -0.03 0.00 0.21 0.00 0.00 52.86 52.64 2yun s ASN 65 Cb -0.02 -1.27 0.19 0.00 -0.55 0.00 0.00 41.25 39.60 2yun s ASN 65 CO -0.00 0.08 0.66 0.00 -2.79 0.00 0.00 177.10 175.06 2yun s ALA 66 N 0.69 -2.43 0.00 1.71 0.00 -1.26 -5.08 121.76 115.39 2yun s ALA 66 Ca -0.12 1.77 0.00 0.00 0.00 0.00 0.00 51.96 53.62 2yun s ALA 66 Cb -0.16 -2.23 0.00 0.00 0.00 0.00 0.00 23.12 20.73 2yun s ALA 66 CO 0.02 -1.36 0.00 0.41 0.00 0.00 0.00 175.76 174.83 2yun n GLY 67 N 5.44 -1.25 3.64 0.00 0.00 -1.26 -5.18 105.19 106.58 2yun n GLY 67 Ca -0.02 0.57 -0.05 0.00 0.00 0.00 0.00 46.02 46.53 2yun n GLY 67 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2yun s ASN 68 N 0.00 -0.23 -0.21 1.61 2.47 -1.26 -5.04 114.94 112.29 2yun s ASN 68 Ca 0.00 0.43 -0.05 0.00 0.42 0.00 0.00 52.86 53.66 2yun s ASN 68 Cb 0.00 0.54 -0.12 0.00 -1.45 0.00 0.00 41.25 40.22 2yun s ASN 68 CO 0.00 -0.07 3.22 1.07 -3.72 0.00 0.00 177.10 177.60 2yun n THR 69 N 2.10 3.14 -3.41 -5.21 5.66 -1.26 -4.71 114.28 110.58 2yun n THR 69 Ca -0.12 -2.17 0.02 0.00 -3.05 0.00 0.00 64.05 58.73 2yun n THR 69 Cb 0.56 -1.81 -0.03 0.00 -1.55 0.00 0.00 70.33 67.51 2yun n THR 69 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2yun s ALA 70 N -0.25 -2.42 1.15 1.79 0.00 -1.26 -5.17 121.76 115.61 2yun s ALA 70 Ca 0.63 2.06 -0.13 0.00 0.00 0.00 0.00 51.96 54.51 2yun s ALA 70 Cb 0.35 -2.02 0.27 0.00 0.00 0.00 0.00 23.12 21.72 2yun s ALA 70 CO -0.10 -1.09 1.04 0.95 0.00 0.00 0.00 175.76 176.56 2yun s THR 71 N 2.78 2.01 -0.17 0.00 -4.23 -1.26 -4.97 115.64 109.79 2yun s THR 71 Ca 0.02 0.00 0.16 0.00 -1.18 0.00 0.00 61.69 60.69 2yun s THR 71 Cb -0.11 -2.15 0.36 0.00 1.34 0.00 0.00 72.50 71.95 2yun s THR 71 CO -0.18 -0.00 1.21 2.29 -0.54 0.00 0.00 174.62 177.40 2yun n LYS 72 N -4.82 1.53 -3.35 3.99 2.85 -1.26 -4.94 118.16 112.16 2yun n LYS 72 Ca 0.03 -2.87 -0.09 0.00 -1.05 0.00 0.00 58.31 54.32 2yun n LYS 72 Cb 0.55 -1.58 -0.08 0.00 -0.65 0.00 0.00 35.03 33.27 2yun n LYS 72 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2yun s ALA 73 N -3.02 -1.06 0.34 0.58 0.00 -1.26 -5.16 121.76 112.18 2yun s ALA 73 Ca 0.35 0.86 0.03 0.00 0.00 0.00 0.00 51.96 53.21 2yun s ALA 73 Cb 0.32 -1.67 -0.02 0.00 0.00 0.00 0.00 23.12 21.75 2yun s ALA 73 CO -0.00 -1.28 0.36 -1.12 0.00 0.00 0.00 175.76 173.73 2yun s SER 74 N 2.54 1.37 0.00 0.00 0.01 -1.26 -4.97 113.70 111.38 2yun s SER 74 Ca 0.12 -1.65 0.00 0.00 1.31 0.00 0.00 55.95 55.73 2yun s SER 74 Cb -0.15 0.60 0.00 0.00 0.21 0.00 0.00 66.02 66.68 2yun s SER 74 CO -0.16 -1.17 0.00 0.61 0.41 0.00 0.00 173.24 172.93 2yun n GLY 75 N -0.60 -0.66 3.55 3.44 0.00 -1.26 -4.92 105.19 104.73 2yun n GLY 75 Ca 0.05 -1.39 -0.35 0.00 0.00 0.00 0.00 46.02 44.32 2yun n GLY 75 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yun s PRO 76 N -2.00 2.60 -1.46 1.61 0.04 -1.26 -3.51 135.00 131.02 2yun s PRO 76 Ca 0.00 0.37 -0.09 0.00 0.04 0.00 0.00 61.00 61.32 2yun s PRO 76 Cb 0.00 -4.57 0.06 0.00 0.04 0.00 0.00 34.50 30.03 2yun s PRO 76 CO 0.00 -2.91 0.87 0.45 0.04 0.00 0.00 177.00 175.45 2yun n SER 77 N 13.09 -3.43 -4.91 6.66 2.88 -1.26 -4.96 113.62 121.69 2yun n SER 77 Ca 0.26 -0.81 -0.29 0.00 -1.33 0.00 0.00 58.87 56.70 2yun n SER 77 Cb 0.51 -3.88 -0.04 0.00 -0.75 0.00 0.00 64.21 60.05 2yun n SER 77 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2yun s SER 78 N -3.69 6.45 0.00 -3.46 0.01 -1.23 -5.23 113.70 106.55 2yun s SER 78 Ca 0.43 0.64 0.00 0.00 1.31 0.00 0.00 55.95 58.32 2yun s SER 78 Cb -0.21 -2.11 0.00 0.00 0.21 0.00 0.00 66.02 63.91 2yun s SER 78 CO 0.83 -0.11 0.00 0.61 0.41 0.00 0.00 173.24 174.98