#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yun n SER 2 N 0.00 -2.64 -4.44 1.61 7.64 -1.26 -4.89 113.62 109.64 2yun n SER 2 Ca 0.00 0.17 -0.44 0.00 1.01 0.00 0.00 58.87 59.61 2yun n SER 2 Cb 0.00 -1.06 -0.05 0.00 -1.01 0.00 0.00 64.21 62.09 2yun n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2yun s SER 3 N -1.81 6.22 0.00 6.43 0.15 -1.26 -4.91 113.70 118.52 2yun s SER 3 Ca 0.54 -0.97 0.00 0.00 0.70 0.00 0.00 55.95 56.21 2yun s SER 3 Cb -0.17 -2.35 0.00 0.00 -1.71 0.00 0.00 66.02 61.80 2yun s SER 3 CO 0.69 -1.13 0.00 0.61 1.20 0.00 0.00 173.24 174.60 2yun n GLY 4 N 5.23 -1.19 3.93 9.45 0.00 -1.26 -5.03 105.19 116.33 2yun n GLY 4 Ca -0.05 -2.10 -0.28 0.00 0.00 0.00 0.00 46.02 43.59 2yun n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yun s SER 5 N -4.00 4.08 -0.51 1.61 0.01 -1.26 -5.00 113.70 108.63 2yun s SER 5 Ca 0.00 0.34 0.02 0.00 1.31 0.00 0.00 55.95 57.62 2yun s SER 5 Cb 0.00 -0.70 0.45 0.00 0.21 0.00 0.00 66.02 65.98 2yun s SER 5 CO 0.00 -2.10 1.66 -1.20 0.41 0.00 0.00 173.24 172.01 2yun n SER 6 N -3.29 6.46 0.00 2.44 7.64 -1.26 -4.99 113.62 120.62 2yun n SER 6 Ca 0.12 -3.77 0.00 0.00 1.01 0.00 0.00 58.87 56.22 2yun n SER 6 Cb 0.60 -0.70 0.00 0.00 -1.01 0.00 0.00 64.21 63.10 2yun n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2yun n GLY 7 N -0.81 4.25 3.77 0.23 0.00 -1.26 -4.98 105.19 106.39 2yun n GLY 7 Ca 0.54 -0.94 -0.30 0.00 0.00 0.00 0.00 46.02 45.31 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 2.02 0.29 1.61 1.81 -1.21 -4.78 118.95 115.51 2yun s ARG 8 Ca 0.00 0.93 0.11 0.00 -1.72 0.00 0.00 55.73 55.05 2yun s ARG 8 Cb 0.00 -1.89 -0.05 0.00 -0.45 0.00 0.00 34.95 32.56 2yun s ARG 8 CO 0.00 -1.74 -0.13 -0.51 -0.68 0.00 0.00 175.30 172.24 2yun s LEU 9 N -5.93 2.75 -0.06 2.53 2.01 -1.26 -0.06 118.68 118.67 2yun s LEU 9 Ca 0.61 -0.97 -0.29 0.00 0.01 0.00 0.00 54.13 53.49 2yun s LEU 9 Cb -0.16 -1.22 0.09 0.00 0.01 0.00 0.00 46.19 44.91 2yun s LEU 9 CO 0.56 -0.02 0.81 0.00 1.01 0.00 0.00 176.35 178.71 2yun s LYS 11 N -1.74 2.87 -0.49 0.00 2.20 -0.67 -1.20 119.74 120.71 2yun s LYS 11 Ca -0.04 -0.63 -0.29 0.00 -0.36 0.00 0.00 55.97 54.65 2yun s LYS 11 Cb -0.00 -2.55 0.02 0.00 -1.51 0.00 0.00 37.83 33.79 2yun s LYS 11 CO 0.02 0.52 1.32 0.00 -0.36 0.00 0.00 175.35 176.85 2yun s ALA 12 N -0.44 3.00 0.11 3.13 0.00 -0.11 -0.62 121.76 126.83 2yun s ALA 12 Ca 0.06 -0.45 -0.13 0.00 0.00 0.00 0.00 51.96 51.44 2yun s ALA 12 Cb -0.12 -3.99 -0.10 0.00 0.00 0.00 0.00 23.12 18.91 2yun s ALA 12 CO 0.02 -2.54 1.38 -0.07 0.00 0.00 0.00 175.76 174.55 2yun h LEU 13 N 12.18 0.88 -8.52 0.00 3.38 0.35 -1.14 115.31 122.43 2yun h LEU 13 Ca -0.26 -0.53 -0.69 0.00 0.09 0.00 0.00 57.88 56.49 2yun h LEU 13 Cb 1.09 -0.25 -0.31 0.00 0.09 0.00 0.00 40.66 41.28 2yun h LEU 13 CO 1.13 1.24 -0.89 -0.31 0.09 0.00 0.00 178.44 179.71 2yun s TYR 14 N -4.13 2.37 -0.09 1.13 1.51 -1.09 -4.73 117.35 112.33 2yun s TYR 14 Ca -0.11 -0.62 -0.29 0.00 -1.01 0.00 0.00 57.07 55.04 2yun s TYR 14 Cb 0.09 -1.55 -0.06 0.00 -0.11 0.00 0.00 41.96 40.34 2yun s TYR 14 CO 0.87 -0.15 1.83 -1.54 -1.11 0.00 0.00 175.55 175.44 2yun s SER 15 N -0.32 6.35 0.15 2.29 1.04 -1.26 -4.63 113.70 117.33 2yun s SER 15 Ca 0.01 2.17 0.06 0.00 0.48 0.00 0.00 55.95 58.68 2yun s SER 15 Cb -0.12 -2.53 -0.04 0.00 0.10 0.00 0.00 66.02 63.43 2yun s SER 15 CO 0.02 -1.20 0.03 0.12 0.98 0.00 0.00 173.24 173.19 2yun s PHE 16 N 5.08 2.94 -0.06 5.02 5.36 -0.13 -4.92 117.98 131.27 2yun s PHE 16 Ca 0.82 -0.09 0.05 0.00 -0.96 0.00 0.00 56.93 56.75 2yun s PHE 16 Cb -0.34 -1.44 -0.01 0.00 -0.34 0.00 0.00 43.02 40.89 2yun s PHE 16 CO 0.34 0.51 -0.21 1.14 -1.46 0.00 0.00 175.22 175.54 2yun s GLN 17 N -2.81 2.24 -0.33 10.12 -2.07 -1.26 -0.13 119.66 125.41 2yun s GLN 17 Ca 0.28 -0.76 -0.25 0.00 -1.82 0.00 0.00 55.36 52.81 2yun s GLN 17 Cb -0.10 -1.89 0.01 0.00 -1.09 0.00 0.00 33.01 29.94 2yun s GLN 17 CO 0.19 0.29 0.85 0.00 -1.32 0.00 0.00 175.29 175.31 2yun s ALA 18 N -0.00 3.48 0.15 2.60 0.00 -1.25 -4.87 121.76 121.87 2yun s ALA 18 Ca -0.05 -0.44 -0.14 0.00 0.00 0.00 0.00 51.96 51.32 2yun s ALA 18 Cb -0.13 -3.41 0.03 0.00 0.00 0.00 0.00 23.12 19.61 2yun s ALA 18 CO 0.04 -1.39 1.74 -0.09 0.00 0.00 0.00 175.76 176.05 2yun h ARG 19 N 8.27 0.69 0.00 0.00 1.12 -1.91 -3.46 114.38 119.09 2yun h ARG 19 Ca -0.24 -0.10 -0.34 0.00 -1.11 0.00 0.00 59.98 58.19 2yun h ARG 19 Cb 1.09 -0.13 -0.08 0.00 -0.01 0.00 0.00 29.97 30.84 2yun h ARG 19 CO 0.93 0.58 -0.29 0.00 -3.11 0.00 0.00 179.97 178.08 2yun n GLN 20 N -4.63 0.64 -0.24 0.20 10.64 -1.26 -5.03 117.38 117.70 2yun n GLN 20 Ca 0.02 -2.15 -0.04 0.00 -1.83 0.00 0.00 57.00 52.99 2yun n GLN 20 Cb 0.11 1.25 0.12 0.00 -0.86 0.00 0.00 30.24 30.86 2yun n GLN 20 CO 0.00 0.00 0.00 0.38 -1.83 0.00 0.00 177.06 175.61 2yun h ASP 21 N 1.06 0.99 -0.64 2.61 2.03 -2.01 -2.34 116.42 118.12 2yun h ASP 21 Ca -0.19 -0.15 0.12 0.00 -0.73 0.00 0.00 57.03 56.07 2yun h ASP 21 Cb 0.76 -0.26 -0.04 0.00 -0.83 0.00 0.00 39.33 38.96 2yun h ASP 21 CO 0.30 0.89 0.43 0.44 -1.03 0.00 0.00 179.24 180.27 2yun h ASP 22 N 1.05 0.35 -3.73 4.15 3.32 -1.96 -3.42 116.42 116.17 2yun h ASP 22 Ca 0.24 0.01 -0.46 0.00 0.02 0.00 0.00 57.03 56.85 2yun h ASP 22 Cb 0.22 -0.06 0.08 0.00 0.22 0.00 0.00 39.33 39.79 2yun h ASP 22 CO -0.02 0.20 0.23 -1.61 -1.72 0.00 0.00 179.24 176.33 2yun s GLU 23 N -5.37 2.12 -0.02 3.56 2.02 -0.88 -0.68 118.70 119.45 2yun s GLU 23 Ca -0.08 -0.28 0.05 0.00 0.02 0.00 0.00 54.97 54.68 2yun s GLU 23 Cb 0.20 -2.16 -0.01 0.00 0.10 0.00 0.00 34.13 32.26 2yun s GLU 23 CO 0.75 -1.30 -0.17 -1.17 0.02 0.00 0.00 175.26 173.40 2yun s LEU 24 N -5.27 2.02 0.15 1.80 0.20 -0.99 -4.30 118.68 112.28 2yun s LEU 24 Ca 0.61 -0.30 -0.23 0.00 0.69 0.00 0.00 54.13 54.89 2yun s LEU 24 Cb -0.10 -0.86 -0.08 0.00 -0.43 0.00 0.00 46.19 44.72 2yun s LEU 24 CO 0.45 0.20 0.72 0.21 -0.29 0.00 0.00 176.35 177.64 2yun s ASN 25 N -0.35 7.28 0.10 3.68 3.84 -1.26 -3.90 114.94 124.33 2yun s ASN 25 Ca 0.06 1.53 0.05 0.00 0.21 0.00 0.00 52.86 54.71 2yun s ASN 25 Cb -0.07 -2.46 -0.03 0.00 -0.55 0.00 0.00 41.25 38.14 2yun s ASN 25 CO -0.00 0.20 -0.13 -0.76 -2.79 0.00 0.00 177.10 173.62 2yun s LEU 26 N -1.24 2.37 0.04 3.21 1.43 0.81 -4.93 118.68 120.38 2yun s LEU 26 Ca 0.35 -0.76 0.03 0.00 -1.03 0.00 0.00 54.13 52.72 2yun s LEU 26 Cb -0.22 -0.46 -0.02 0.00 0.03 0.00 0.00 46.19 45.53 2yun s LEU 26 CO 0.24 -0.17 -0.09 -0.70 0.23 0.00 0.00 176.35 175.86 2yun s GLU 27 N -2.47 0.61 -0.38 1.70 2.12 -1.26 -0.95 118.70 118.08 2yun s GLU 27 Ca 0.05 -0.75 -0.32 0.00 0.36 0.00 0.00 54.97 54.30 2yun s GLU 27 Cb -0.06 -0.46 -0.10 0.00 0.26 0.00 0.00 34.13 33.77 2yun s GLU 27 CO 0.02 0.10 2.26 1.17 -0.54 0.00 0.00 175.26 178.26 2yun n LYS 28 N 1.57 1.19 -0.86 4.30 4.81 -1.26 -1.45 118.16 126.46 2yun n LYS 28 Ca -0.21 0.29 0.00 0.00 -0.87 0.00 0.00 58.31 57.51 2yun n LYS 28 Cb 0.55 -2.69 0.00 0.00 0.02 0.00 0.00 35.03 32.91 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 6.32 1.01 3.24 3.14 0.00 -0.43 -5.02 105.19 113.45 2yun n GLY 29 Ca 0.40 -0.24 -0.33 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.35 3.46 -0.16 1.61 1.11 -0.53 -4.90 116.67 114.91 2yun s ASP 30 Ca 0.00 -0.51 -0.22 0.00 0.18 0.00 0.00 52.55 52.00 2yun s ASP 30 Cb 0.00 -1.51 -0.02 0.00 1.07 0.00 0.00 42.92 42.45 2yun s ASP 30 CO 0.00 0.10 0.69 -0.63 1.18 0.00 0.00 175.17 176.51 2yun s ILE 31 N 0.71 4.99 -0.09 0.77 -1.09 -1.26 -0.94 121.20 124.29 2yun s ILE 31 Ca -0.08 1.35 0.01 0.00 -2.23 0.00 0.00 60.65 59.70 2yun s ILE 31 Cb -0.16 -4.01 -0.02 0.00 -1.58 0.00 0.00 42.46 36.69 2yun s ILE 31 CO 0.01 0.12 -0.12 -0.69 -1.23 0.00 0.00 174.94 173.03 2yun s VAL 32 N 1.72 3.17 -0.76 2.92 1.01 -0.34 -4.69 120.40 123.43 2yun s VAL 32 Ca 0.33 -0.65 -0.26 0.00 0.00 0.00 0.00 61.98 61.39 2yun s VAL 32 Cb -0.16 -2.29 0.04 0.00 0.00 0.00 0.00 36.38 33.96 2yun s VAL 32 CO 0.12 0.56 1.27 -0.63 0.00 0.00 0.00 175.10 176.42 2yun s ILE 33 N -0.26 3.79 0.04 2.22 1.01 0.98 -2.95 121.20 126.05 2yun s ILE 33 Ca 0.02 0.23 -0.34 0.00 0.00 0.00 0.00 60.65 60.57 2yun s ILE 33 Cb -0.13 -4.91 -0.12 0.00 0.01 0.00 0.00 42.46 37.30 2yun s ILE 33 CO 0.03 -1.83 1.75 -0.38 0.00 0.00 0.00 174.94 174.50 2yun n ILE 34 N 6.38 0.31 -0.06 2.92 5.41 0.92 -2.73 119.36 132.51 2yun n ILE 34 Ca 0.05 -0.06 -0.13 0.00 1.00 0.00 0.00 62.75 63.61 2yun n ILE 34 Cb 0.49 -1.77 -0.04 0.00 -0.71 0.00 0.00 39.64 37.61 2yun n ILE 34 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 176.55 177.96 2yun n HIS 35 N 5.16 0.00 -3.76 1.39 8.25 0.11 -3.31 115.22 123.06 2yun n HIS 35 Ca 0.20 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.53 2yun n HIS 35 Cb 0.30 -0.45 -0.11 0.00 1.12 0.00 0.00 29.99 30.85 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 -2.27 0.34 -0.04 -0.41 2.02 -0.08 -5.00 118.70 113.27 2yun s GLU 36 Ca -0.18 0.44 0.06 0.00 0.02 0.00 0.00 54.97 55.31 2yun s GLU 36 Cb 0.07 0.14 0.09 0.00 0.10 0.00 0.00 34.13 34.53 2yun s GLU 36 CO 0.23 -0.06 1.03 1.63 0.02 0.00 0.00 175.26 178.11 2yun n LYS 37 N 3.07 0.48 -0.03 1.61 5.02 -1.26 0.56 118.16 127.61 2yun n LYS 37 Ca -0.14 -1.50 0.23 0.00 -2.02 0.00 0.00 58.31 54.88 2yun n LYS 37 Cb 0.57 -0.83 0.59 0.00 -0.02 0.00 0.00 35.03 35.35 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 -7.53 1.97 -0.00 -1.96 -3.41 116.57 105.64 2yun h LYS 38 Ca 0.00 0.00 -0.48 0.00 -0.00 0.00 0.00 60.65 60.17 2yun h LYS 38 Cb 1.24 0.00 0.10 0.00 -0.00 0.00 0.00 32.23 33.57 2yun h LYS 38 CO 0.00 0.00 0.38 -2.00 -0.00 0.00 0.00 179.45 177.83 2yun s GLU 39 N -4.49 2.09 -0.63 0.07 2.56 -1.26 -5.01 118.70 112.03 2yun s GLU 39 Ca -0.03 0.31 -0.17 0.00 0.00 0.00 0.00 54.97 55.07 2yun s GLU 39 Cb 0.14 -1.95 0.13 0.00 2.00 0.00 0.00 34.13 34.45 2yun s GLU 39 CO 0.48 -1.55 0.68 -1.21 -0.56 0.00 0.00 175.26 173.11 2yun s GLU 40 N -5.41 3.14 0.00 4.30 2.02 -1.26 -4.37 118.70 117.11 2yun s GLU 40 Ca 0.61 -1.62 0.00 0.00 0.02 0.00 0.00 54.97 53.98 2yun s GLU 40 Cb -0.12 -4.34 0.00 0.00 0.10 0.00 0.00 34.13 29.77 2yun s GLU 40 CO 0.51 -1.46 0.00 0.41 0.02 0.00 0.00 175.26 174.74 2yun n GLY 41 N 5.11 2.77 3.51 -1.39 0.00 -1.26 -4.99 105.19 108.93 2yun n GLY 41 Ca -0.06 -0.10 -0.43 0.00 0.00 0.00 0.00 46.02 45.44 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 -1.78 2.92 0.23 1.61 0.52 -1.26 0.14 118.94 121.31 2yun s TRP 42 Ca 0.00 -0.11 -0.04 0.00 0.02 0.00 0.00 56.10 55.97 2yun s TRP 42 Cb 0.00 -3.80 -0.05 0.00 -1.15 0.00 0.00 33.47 28.46 2yun s TRP 42 CO 0.00 -1.16 0.48 -1.58 0.02 0.00 0.00 176.95 174.71 2yun s TRP 43 N 3.40 3.47 -0.09 -1.98 0.52 0.56 -4.19 118.94 120.62 2yun s TRP 43 Ca 0.26 0.58 0.03 0.00 0.02 0.00 0.00 56.10 56.99 2yun s TRP 43 Cb -0.14 -2.04 0.01 0.00 -1.15 0.00 0.00 33.47 30.14 2yun s TRP 43 CO 0.18 0.28 -0.17 0.12 0.02 0.00 0.00 176.95 177.38 2yun s PHE 44 N -1.93 1.98 -0.03 -1.98 5.36 0.19 -1.14 117.98 120.44 2yun s PHE 44 Ca 0.42 -0.83 -0.12 0.00 -0.96 0.00 0.00 56.93 55.44 2yun s PHE 44 Cb -0.11 -1.39 0.04 0.00 -0.34 0.00 0.00 43.02 41.22 2yun s PHE 44 CO 0.28 -0.39 0.55 0.41 -1.46 0.00 0.00 175.22 174.60 2yun n GLY 45 N 3.85 0.33 3.50 13.12 0.00 -1.09 0.09 105.19 124.99 2yun n GLY 45 Ca -0.20 -0.90 -0.32 0.00 0.00 0.00 0.00 46.02 44.60 2yun n GLY 45 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yun s SER 46 N -2.20 4.09 0.00 1.61 0.15 -1.11 -1.63 113.70 114.62 2yun s SER 46 Ca 0.13 -0.26 0.00 0.00 0.70 0.00 0.00 55.95 56.52 2yun s SER 46 Cb -0.00 -0.82 0.00 0.00 -1.71 0.00 0.00 66.02 63.49 2yun s SER 46 CO -0.01 0.30 0.00 -0.11 1.20 0.00 0.00 173.24 174.62 2yun n LEU 47 N 1.86 0.33 -2.31 3.45 7.94 -0.83 -0.01 117.00 127.42 2yun n LEU 47 Ca -0.16 0.05 -0.26 0.00 -1.11 0.00 0.00 56.01 54.52 2yun n LEU 47 Cb 0.52 -0.24 0.01 0.00 0.53 0.00 0.00 43.42 44.24 2yun n LEU 47 CO 0.27 -0.24 0.24 0.59 -1.11 0.00 0.00 177.39 177.14 2yun n ASN 48 N -1.82 4.90 0.00 1.96 3.02 -1.26 -4.71 115.26 117.35 2yun n ASN 48 Ca 0.00 -3.74 0.00 0.00 -0.03 0.00 0.00 54.58 50.81 2yun n ASN 48 Cb 0.00 -0.44 0.00 0.00 -0.61 0.00 0.00 39.78 38.73 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 -0.58 0.54 3.13 7.41 0.00 -1.26 -5.07 105.19 109.37 2yun n GLY 49 Ca 0.42 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.12 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 -0.89 2.80 0.28 1.61 -0.14 -1.26 -5.09 119.74 117.06 2yun s LYS 50 Ca 0.00 -0.77 -0.02 0.00 -1.36 0.00 0.00 55.97 53.82 2yun s LYS 50 Cb 0.00 -2.31 -0.04 0.00 -1.68 0.00 0.00 37.83 33.80 2yun s LYS 50 CO 0.00 -0.05 0.50 0.15 -0.76 0.00 0.00 175.35 175.19 2yun s LYS 51 N 0.91 3.54 0.00 1.68 1.02 -1.26 -1.96 119.74 123.68 2yun s LYS 51 Ca -0.06 -0.23 0.00 0.00 0.02 0.00 0.00 55.97 55.70 2yun s LYS 51 Cb -0.15 -2.72 0.00 0.00 -0.52 0.00 0.00 37.83 34.44 2yun s LYS 51 CO -0.03 0.26 0.00 0.41 -0.92 0.00 0.00 175.35 175.07 2yun n GLY 52 N -1.13 -1.11 3.33 -3.33 0.00 -0.65 -4.86 105.19 97.44 2yun n GLY 52 Ca -0.04 -0.83 -0.38 0.00 0.00 0.00 0.00 46.02 44.77 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 -3.00 3.20 0.16 1.61 3.76 0.15 -2.68 115.29 118.50 2yun s HIS 53 Ca 0.00 -1.11 0.10 0.00 -0.15 0.00 0.00 55.06 53.91 2yun s HIS 53 Cb 0.00 -2.30 -0.04 0.00 1.11 0.00 0.00 32.58 31.35 2yun s HIS 53 CO 0.00 -0.64 -0.23 -0.59 -0.85 0.00 0.00 174.74 172.43 2yun s PHE 54 N 1.48 2.15 0.53 1.40 -0.12 -0.29 -2.35 117.98 120.79 2yun s PHE 54 Ca 0.01 -0.39 -0.20 0.00 -0.05 0.00 0.00 56.93 56.30 2yun s PHE 54 Cb -0.18 -1.10 -0.06 0.00 -0.63 0.00 0.00 43.02 41.04 2yun s PHE 54 CO 0.04 0.39 1.13 -1.25 -0.05 0.00 0.00 175.22 175.48 2yun s PRO 55 N -2.45 3.40 -0.01 1.99 0.04 -1.26 -0.33 135.00 136.39 2yun s PRO 55 Ca 0.16 1.63 0.07 0.00 0.04 0.00 0.00 61.00 62.90 2yun s PRO 55 Cb -0.08 -2.05 -0.24 0.00 0.04 0.00 0.00 34.50 32.17 2yun s PRO 55 CO 0.08 -0.81 0.79 0.00 0.04 0.00 0.00 177.00 177.09 2yun h ALA 56 N 1.29 0.58 0.00 8.56 0.00 0.84 -3.31 119.26 127.22 2yun h ALA 56 Ca -0.50 -1.30 0.00 0.00 0.00 0.00 0.00 54.91 53.11 2yun h ALA 56 Cb 1.26 0.35 0.00 0.00 0.00 0.00 0.00 17.79 19.40 2yun h ALA 56 CO 0.57 1.43 0.00 0.00 0.00 0.00 0.00 179.25 181.25 2yun n ALA 57 N -2.57 1.29 -0.06 0.00 0.00 -1.26 -1.51 120.51 116.40 2yun n ALA 57 Ca -0.15 -0.02 -0.04 0.00 0.00 0.00 0.00 53.44 53.23 2yun n ALA 57 Cb 1.03 -1.10 -0.15 0.00 0.00 0.00 0.00 19.45 19.22 2yun n ALA 57 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2yun n TYR 58 N -1.51 0.22 -4.24 0.00 4.02 -1.24 -4.90 117.16 109.51 2yun n TYR 58 Ca 0.02 0.07 -0.28 0.00 -0.01 0.00 0.00 57.90 57.70 2yun n TYR 58 Cb 0.07 -0.92 -0.09 0.00 -0.02 0.00 0.00 39.34 38.38 2yun n TYR 58 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 2yun s VAL 59 N -2.78 3.40 -0.14 -0.72 -7.23 -0.57 0.10 120.40 112.46 2yun s VAL 59 Ca -0.08 -1.42 0.01 0.00 -1.81 0.00 0.00 61.98 58.68 2yun s VAL 59 Cb 0.08 -2.65 0.02 0.00 0.56 0.00 0.00 36.38 34.39 2yun s VAL 59 CO 0.84 -0.01 -0.17 -0.70 -0.31 0.00 0.00 175.10 174.76 2yun s GLU 60 N -2.58 2.52 0.29 4.82 2.12 0.21 -4.82 118.70 121.26 2yun s GLU 60 Ca 0.24 -0.65 -0.29 0.00 0.36 0.00 0.00 54.97 54.63 2yun s GLU 60 Cb -0.10 -2.18 -0.14 0.00 0.26 0.00 0.00 34.13 31.97 2yun s GLU 60 CO 0.15 -0.15 1.11 -1.91 -0.54 0.00 0.00 175.26 173.93 2yun n GLU 61 N 4.48 1.56 -4.24 4.30 2.13 -1.26 -1.66 120.64 125.94 2yun n GLU 61 Ca -0.19 0.55 -0.19 0.00 0.66 0.00 0.00 57.16 57.99 2yun n GLU 61 Cb 0.51 -1.99 -0.12 0.00 0.27 0.00 0.00 31.44 30.11 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 0.11 2.36 1.09 4.31 1.43 0.23 -4.85 118.68 123.36 2yun s LEU 62 Ca 0.60 -0.75 -0.15 0.00 -1.03 0.00 0.00 54.13 52.79 2yun s LEU 62 Cb -0.68 -0.62 0.23 0.00 0.03 0.00 0.00 46.19 45.15 2yun s LEU 62 CO 0.59 -0.09 1.10 -2.16 0.23 0.00 0.00 176.35 176.02 2yun s PRO 63 N -2.35 -0.28 0.24 1.29 0.04 -1.26 -4.11 135.00 128.56 2yun s PRO 63 Ca 0.07 0.28 -0.29 0.00 0.04 0.00 0.00 61.00 61.09 2yun s PRO 63 Cb -0.07 -1.67 -0.15 0.00 0.04 0.00 0.00 34.50 32.64 2yun s PRO 63 CO 0.03 -3.16 0.87 0.43 0.04 0.00 0.00 177.00 175.21 2yun n SER 64 N -4.43 0.42 -4.34 6.66 7.64 -1.26 -4.86 113.62 113.44 2yun n SER 64 Ca 0.08 1.16 -0.20 0.00 1.01 0.00 0.00 58.87 60.92 2yun n SER 64 Cb 0.58 -1.16 -0.10 0.00 -1.01 0.00 0.00 64.21 62.52 2yun n SER 64 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 2yun s ASN 65 N -0.62 1.92 -0.23 6.43 -0.87 -1.26 -5.16 114.94 115.16 2yun s ASN 65 Ca 0.63 -1.42 -0.28 0.00 -1.57 0.00 0.00 52.86 50.23 2yun s ASN 65 Cb -0.81 0.09 0.13 0.00 -0.02 0.00 0.00 41.25 40.65 2yun s ASN 65 CO 0.58 -0.70 1.07 0.00 -2.57 0.00 0.00 177.10 175.48 2yun s ALA 66 N -3.48 -1.99 0.15 0.60 0.00 -1.26 -5.13 121.76 110.66 2yun s ALA 66 Ca 0.36 1.73 0.09 0.00 0.00 0.00 0.00 51.96 54.14 2yun s ALA 66 Cb 0.08 -1.14 -0.04 0.00 0.00 0.00 0.00 23.12 22.01 2yun s ALA 66 CO 0.15 -0.26 -0.15 0.20 0.00 0.00 0.00 175.76 175.70 2yun s GLY 67 N -0.48 1.72 0.02 0.00 0.00 -1.26 -5.07 107.32 102.25 2yun s GLY 67 Ca 0.02 -1.44 -0.39 0.00 0.00 0.00 0.00 44.72 42.91 2yun s GLY 67 CO -0.04 -1.44 1.19 -2.01 0.00 0.00 0.00 173.10 170.80 2yun n ASN 68 N 0.41 0.65 -4.76 1.64 5.15 -1.26 -4.87 115.26 112.21 2yun n ASN 68 Ca -0.13 1.14 -0.37 0.00 -0.60 0.00 0.00 54.58 54.62 2yun n ASN 68 Cb 0.54 -1.02 0.01 0.00 -0.53 0.00 0.00 39.78 38.78 2yun n ASN 68 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 2yun s THR 69 N 0.26 2.81 0.39 -0.44 -1.32 -1.26 -4.95 115.64 111.14 2yun s THR 69 Ca 0.89 0.60 -0.26 0.00 -1.21 0.00 0.00 61.69 61.71 2yun s THR 69 Cb -1.15 -3.30 -0.11 0.00 -1.51 0.00 0.00 72.50 66.43 2yun s THR 69 CO 0.54 -0.02 1.23 0.00 -2.21 0.00 0.00 174.62 174.16 2yun n ALA 70 N -0.71 1.07 -1.88 11.08 0.00 -1.26 -4.90 120.51 123.91 2yun n ALA 70 Ca 0.09 0.30 -0.42 0.00 0.00 0.00 0.00 53.44 53.40 2yun n ALA 70 Cb 0.47 -2.23 -0.02 0.00 0.00 0.00 0.00 19.45 17.67 2yun n ALA 70 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2yun s THR 71 N -1.17 2.57 0.29 0.00 -4.23 -1.26 -5.02 115.64 106.81 2yun s THR 71 Ca 0.59 0.45 0.12 0.00 -1.18 0.00 0.00 61.69 61.67 2yun s THR 71 Cb -0.54 -3.29 -0.05 0.00 1.34 0.00 0.00 72.50 69.96 2yun s THR 71 CO 0.59 0.06 -0.17 -1.59 -0.54 0.00 0.00 174.62 172.97 2yun s LYS 72 N 0.19 1.76 -0.64 3.99 0.00 -1.26 -5.10 119.74 118.68 2yun s LYS 72 Ca 0.64 -1.75 0.05 0.00 0.00 0.00 0.00 55.97 54.90 2yun s LYS 72 Cb -0.43 -1.80 0.16 0.00 0.00 0.00 0.00 37.83 35.75 2yun s LYS 72 CO 0.39 0.31 0.41 0.00 0.00 0.00 0.00 175.35 176.47 2yun s ALA 73 N -2.50 3.63 -1.40 0.59 0.00 -1.26 -4.84 121.76 115.97 2yun s ALA 73 Ca 0.30 -3.64 -0.04 0.00 0.00 0.00 0.00 51.96 48.59 2yun s ALA 73 Cb -0.04 -2.16 0.00 0.00 0.00 0.00 0.00 23.12 20.91 2yun s ALA 73 CO 0.16 -2.07 0.37 0.43 0.00 0.00 0.00 175.76 174.65 2yun n SER 74 N 2.38 -0.66 -4.83 0.00 7.64 -1.26 -4.92 113.62 111.98 2yun n SER 74 Ca 0.14 -1.09 -0.34 0.00 1.01 0.00 0.00 58.87 58.60 2yun n SER 74 Cb 0.34 -2.68 -0.06 0.00 -1.01 0.00 0.00 64.21 60.80 2yun n SER 74 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2yun s GLY 75 N -4.25 2.46 0.20 0.23 0.00 -1.26 -5.03 107.32 99.66 2yun s GLY 75 Ca 0.07 0.24 -0.30 0.00 0.00 0.00 0.00 44.72 44.72 2yun s GLY 75 CO 0.92 0.52 1.30 2.56 0.00 0.00 0.00 173.10 178.40 2yun s PRO 76 N -2.76 4.39 -1.40 2.90 0.04 -1.26 -3.14 135.00 133.78 2yun s PRO 76 Ca 0.54 2.04 -0.09 0.00 0.04 0.00 0.00 61.00 63.53 2yun s PRO 76 Cb -0.12 -3.20 0.03 0.00 0.04 0.00 0.00 34.50 31.25 2yun s PRO 76 CO 0.17 -0.25 1.08 0.43 0.04 0.00 0.00 177.00 178.47 2yun n SER 77 N 2.64 -5.16 -0.01 6.66 7.64 -1.26 -4.91 113.62 119.22 2yun n SER 77 Ca 0.06 -0.64 -0.17 0.00 1.01 0.00 0.00 58.87 59.13 2yun n SER 77 Cb 0.43 -4.62 -0.10 0.00 -1.01 0.00 0.00 64.21 58.91 2yun n SER 77 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 2yun h SER 78 N -2.39 0.57 0.00 6.43 0.87 -1.97 -3.56 113.55 113.50 2yun h SER 78 Ca -0.58 -0.69 0.00 0.00 -1.23 0.00 0.00 61.79 59.29 2yun h SER 78 Cb 1.37 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 63.16 2yun h SER 78 CO 0.59 1.18 0.00 0.61 -0.53 0.00 0.00 176.83 178.68