#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dil n SER 2 N 0.00 7.30 -0.34 1.61 7.64 -1.26 -4.77 113.62 123.79 2dil n SER 2 Ca 0.00 -3.79 0.04 0.00 1.01 0.00 0.00 58.87 56.13 2dil n SER 2 Cb 0.00 -0.91 0.12 0.00 -1.01 0.00 0.00 64.21 62.40 2dil n SER 2 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2dil h SER 3 N 2.23 -0.95 0.00 6.43 0.02 -2.10 -3.44 113.55 115.74 2dil h SER 3 Ca 0.57 0.29 0.00 0.00 -0.84 0.00 0.00 61.79 61.80 2dil h SER 3 Cb 0.74 0.61 0.00 0.00 0.14 0.00 0.00 62.40 63.89 2dil h SER 3 CO 1.46 -0.31 0.00 0.61 -1.14 0.00 0.00 176.83 177.45 2dil n GLY 4 N -1.58 3.25 3.85 -3.77 0.00 -1.26 -5.15 105.19 100.52 2dil n GLY 4 Ca 0.14 -0.07 -0.36 0.00 0.00 0.00 0.00 46.02 45.73 2dil n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dil s SER 5 N 0.00 6.70 -1.03 1.61 1.04 -1.26 -5.03 113.70 115.72 2dil s SER 5 Ca 0.00 0.84 -0.12 0.00 0.48 0.00 0.00 55.95 57.15 2dil s SER 5 Cb 0.00 -2.20 0.24 0.00 0.10 0.00 0.00 66.02 64.16 2dil s SER 5 CO 0.00 0.27 1.06 -0.55 0.98 0.00 0.00 173.24 175.00 2dil s SER 6 N -1.36 7.09 -0.36 7.02 0.15 -1.26 -4.80 113.70 120.17 2dil s SER 6 Ca 0.27 -3.16 -0.32 0.00 0.70 0.00 0.00 55.95 53.44 2dil s SER 6 Cb -0.15 -2.25 0.05 0.00 -1.71 0.00 0.00 66.02 61.96 2dil s SER 6 CO 0.14 -0.48 0.54 0.61 1.20 0.00 0.00 173.24 175.26 2dil n GLY 7 N 3.44 0.16 3.13 9.45 0.00 -1.26 -4.98 105.19 115.13 2dil n GLY 7 Ca 0.23 0.95 -0.10 0.00 0.00 0.00 0.00 46.02 47.09 2dil n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dil s ALA 8 N -1.20 -0.96 -0.38 4.61 0.00 -1.26 -5.11 121.76 117.47 2dil s ALA 8 Ca 0.32 1.23 -0.39 0.00 0.00 0.00 0.00 51.96 53.11 2dil s ALA 8 Cb -0.03 -1.29 -0.14 0.00 0.00 0.00 0.00 23.12 21.65 2dil s ALA 8 CO 0.71 -0.81 2.07 1.04 0.00 0.00 0.00 175.76 178.77 2dil n GLN 9 N 5.37 0.79 -2.72 0.00 3.00 -1.26 -4.88 117.38 117.68 2dil n GLN 9 Ca -0.07 0.24 -0.42 0.00 -0.01 0.00 0.00 57.00 56.74 2dil n GLN 9 Cb 0.50 -2.11 -0.03 0.00 0.00 0.00 0.00 30.24 28.60 2dil n GLN 9 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.06 175.85 2dil s GLU 10 N 5.51 4.41 -0.18 -1.09 0.41 -1.26 -4.47 118.70 122.03 2dil s GLU 10 Ca 1.10 1.33 -0.05 0.00 -0.41 0.00 0.00 54.97 56.94 2dil s GLU 10 Cb -1.09 -3.54 -0.03 0.00 -1.78 0.00 0.00 34.13 27.69 2dil s GLU 10 CO 0.58 -0.30 0.00 0.71 -0.49 0.00 0.00 175.26 175.77 2dil s TYR 11 N 1.96 3.08 -0.19 1.61 1.51 -1.13 -2.74 117.35 121.45 2dil s TYR 11 Ca 0.47 -0.29 -0.09 0.00 -1.01 0.00 0.00 57.07 56.15 2dil s TYR 11 Cb -0.18 -2.05 -0.05 0.00 -0.11 0.00 0.00 41.96 39.57 2dil s TYR 11 CO 0.18 -0.10 0.11 0.50 -1.11 0.00 0.00 175.55 175.12 2dil s ARG 12 N 0.69 4.10 0.74 -0.62 3.52 -1.22 -2.59 118.95 123.57 2dil s ARG 12 Ca 0.00 -0.26 -0.15 0.00 -0.13 0.00 0.00 55.73 55.18 2dil s ARG 12 Cb -0.14 -3.34 0.02 0.00 -1.56 0.00 0.00 34.95 29.93 2dil s ARG 12 CO 0.02 0.30 1.00 0.00 -0.81 0.00 0.00 175.30 175.81 2dil n ALA 13 N 3.48 -0.23 -0.06 6.12 0.00 -1.09 -2.16 120.51 126.57 2dil n ALA 13 Ca -0.16 -0.22 -0.08 0.00 0.00 0.00 0.00 53.44 52.98 2dil n ALA 13 Cb 0.52 -2.13 -0.07 0.00 0.00 0.00 0.00 19.45 17.77 2dil n ALA 13 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2dil n LEU 14 N -1.92 2.16 -3.84 0.00 4.77 -1.16 -3.39 117.00 113.62 2dil n LEU 14 Ca 0.13 -0.05 -0.10 0.00 -0.03 0.00 0.00 56.01 55.96 2dil n LEU 14 Cb 0.50 -0.26 -0.08 0.00 -2.33 0.00 0.00 43.42 41.25 2dil n LEU 14 CO 0.49 0.59 -0.08 -0.31 -1.33 0.00 0.00 177.39 176.75 2dil s TYR 15 N -2.26 0.08 -0.60 -1.77 2.02 -1.26 -4.48 117.35 109.07 2dil s TYR 15 Ca -0.14 -0.39 -0.27 0.00 -0.37 0.00 0.00 57.07 55.90 2dil s TYR 15 Cb 0.04 -0.02 -0.01 0.00 -0.40 0.00 0.00 41.96 41.57 2dil s TYR 15 CO 0.34 -0.50 1.67 0.16 -1.57 0.00 0.00 175.55 175.65 2dil s ASP 16 N -2.46 5.64 -0.16 2.29 -4.77 -1.26 -3.93 116.67 112.01 2dil s ASP 16 Ca -0.00 0.29 -0.19 0.00 -3.30 0.00 0.00 52.55 49.34 2dil s ASP 16 Cb 0.02 -2.54 -0.03 0.00 -1.09 0.00 0.00 42.92 39.28 2dil s ASP 16 CO -0.07 -2.10 0.53 -0.47 0.70 0.00 0.00 175.17 173.76 2dil s TYR 17 N 7.74 3.43 -0.61 2.11 5.04 -0.98 -4.92 117.35 129.16 2dil s TYR 17 Ca 0.60 0.86 -0.17 0.00 -2.44 0.00 0.00 57.07 55.92 2dil s TYR 17 Cb -0.12 -2.65 0.14 0.00 0.35 0.00 0.00 41.96 39.67 2dil s TYR 17 CO 0.22 -0.01 0.62 0.99 -1.34 0.00 0.00 175.55 176.03 2dil s THR 18 N 1.28 5.15 0.07 4.34 2.01 -1.26 -2.59 115.64 124.63 2dil s THR 18 Ca 0.26 -1.51 -0.30 0.00 0.31 0.00 0.00 61.69 60.45 2dil s THR 18 Cb -0.15 -4.42 -0.09 0.00 0.01 0.00 0.00 72.50 67.85 2dil s THR 18 CO 0.10 -0.99 1.88 0.00 -0.69 0.00 0.00 174.62 174.92 2dil s ALA 19 N 1.72 3.66 0.08 7.40 0.00 -1.26 -4.89 121.76 128.47 2dil s ALA 19 Ca 0.09 1.34 -0.19 0.00 0.00 0.00 0.00 51.96 53.20 2dil s ALA 19 Cb -0.24 -3.80 -0.09 0.00 0.00 0.00 0.00 23.12 18.99 2dil s ALA 19 CO 0.02 -1.40 1.52 1.96 0.00 0.00 0.00 175.76 177.86 2dil h GLN 20 N 9.63 0.42 -6.81 0.00 7.50 -1.94 -3.44 115.11 120.48 2dil h GLN 20 Ca -0.47 -0.13 -0.49 0.00 0.50 0.00 0.00 58.65 58.05 2dil h GLN 20 Cb 1.22 -0.04 -0.01 0.00 0.05 0.00 0.00 27.48 28.71 2dil h GLN 20 CO 0.94 0.59 0.11 -0.80 -1.50 0.00 0.00 178.83 178.18 2dil s ASN 21 N -5.91 6.61 0.52 1.46 0.01 -1.26 -4.97 114.94 111.40 2dil s ASN 21 Ca -0.14 1.19 0.33 0.00 -0.71 0.00 0.00 52.86 53.54 2dil s ASN 21 Cb 0.07 -2.34 1.37 0.00 0.41 0.00 0.00 41.25 40.76 2dil s ASN 21 CO 0.74 -0.33 1.97 1.55 -1.51 0.00 0.00 177.10 179.52 2dil h PRO 22 N 1.61 0.00 -0.03 -0.60 0.13 -2.04 -3.12 132.00 127.96 2dil h PRO 22 Ca -0.47 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.60 2dil h PRO 22 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2dil h PRO 22 CO 0.64 0.00 -0.18 -0.44 -0.23 0.00 0.00 178.00 177.79 2dil h ASP 23 N 0.00 0.21 -3.81 1.44 5.19 -1.96 -3.46 116.42 114.03 2dil h ASP 23 Ca 0.00 -0.69 -0.48 0.00 -0.62 0.00 0.00 57.03 55.24 2dil h ASP 23 Cb 0.47 -0.06 0.19 0.00 0.18 0.00 0.00 39.33 40.11 2dil h ASP 23 CO 0.00 0.87 0.15 -1.61 -3.12 0.00 0.00 179.24 175.52 2dil s GLU 24 N -3.46 0.32 0.27 3.56 8.01 -1.18 -4.33 118.70 121.88 2dil s GLU 24 Ca -0.16 1.04 0.09 0.00 0.01 0.00 0.00 54.97 55.95 2dil s GLU 24 Cb 0.02 -1.68 -0.04 0.00 -4.31 0.00 0.00 34.13 28.11 2dil s GLU 24 CO 0.73 -2.95 0.03 -0.51 0.01 0.00 0.00 175.26 172.57 2dil s LEU 25 N -6.73 3.27 -0.34 1.80 1.43 -1.23 -4.83 118.68 112.06 2dil s LEU 25 Ca 0.66 -0.60 -0.10 0.00 -1.03 0.00 0.00 54.13 53.06 2dil s LEU 25 Cb -0.22 -1.79 0.01 0.00 0.03 0.00 0.00 46.19 44.21 2dil s LEU 25 CO 0.60 -0.02 0.18 1.51 0.23 0.00 0.00 176.35 178.86 2dil s ASP 26 N -3.70 5.66 0.89 2.29 -4.77 -1.26 -4.20 116.67 111.57 2dil s ASP 26 Ca 0.32 -0.72 -0.12 0.00 -3.30 0.00 0.00 52.55 48.73 2dil s ASP 26 Cb -0.06 -2.02 0.12 0.00 -1.09 0.00 0.00 42.92 39.87 2dil s ASP 26 CO 0.21 -0.28 1.14 -0.76 0.70 0.00 0.00 175.17 176.18 2dil s LEU 27 N 1.60 2.13 -0.28 2.11 1.43 -1.07 -4.84 118.68 119.76 2dil s LEU 27 Ca 0.04 0.95 -0.08 0.00 -1.03 0.00 0.00 54.13 54.01 2dil s LEU 27 Cb -0.18 -3.33 0.13 0.00 0.03 0.00 0.00 46.19 42.85 2dil s LEU 27 CO 0.07 -2.41 0.61 -0.55 0.23 0.00 0.00 176.35 174.30 2dil s SER 28 N -4.11 -1.02 -0.34 2.29 0.15 -1.25 -2.31 113.70 107.11 2dil s SER 28 Ca 0.63 1.39 -0.41 0.00 0.70 0.00 0.00 55.95 58.26 2dil s SER 28 Cb -0.14 2.13 -0.16 0.00 -1.71 0.00 0.00 66.02 66.14 2dil s SER 28 CO 0.53 -0.23 1.79 0.00 1.20 0.00 0.00 173.24 176.53 2dil n ALA 29 N 5.44 -0.25 0.00 5.45 0.00 -1.26 -1.31 120.51 128.58 2dil n ALA 29 Ca -0.10 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.69 2dil n ALA 29 Cb 0.49 -2.19 0.00 0.00 0.00 0.00 0.00 19.45 17.75 2dil n ALA 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dil n GLY 30 N 4.62 1.13 3.94 0.00 0.00 -1.22 -4.97 105.19 108.70 2dil n GLY 30 Ca 0.31 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.06 2dil n GLY 30 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2dil s ASP 31 N -1.95 6.34 -0.31 1.61 -1.08 -0.42 -4.94 116.67 115.92 2dil s ASP 31 Ca 0.00 0.18 0.03 0.00 -0.52 0.00 0.00 52.55 52.24 2dil s ASP 31 Cb 0.00 -1.91 0.08 0.00 -1.46 0.00 0.00 42.92 39.63 2dil s ASP 31 CO 0.00 0.06 -0.01 -0.63 0.52 0.00 0.00 175.17 175.11 2dil s ILE 32 N -1.72 2.33 0.28 4.11 -1.09 -1.26 -2.67 121.20 121.17 2dil s ILE 32 Ca 0.35 -1.97 0.09 0.00 -2.23 0.00 0.00 60.65 56.89 2dil s ILE 32 Cb -0.11 -2.55 -0.04 0.00 -1.58 0.00 0.00 42.46 38.18 2dil s ILE 32 CO 0.28 -0.33 0.01 -0.76 -1.23 0.00 0.00 174.94 172.92 2dil s LEU 33 N 1.02 3.20 -0.23 2.97 1.02 -1.07 -4.96 118.68 120.63 2dil s LEU 33 Ca 0.01 -0.66 -0.01 0.00 0.02 0.00 0.00 54.13 53.49 2dil s LEU 33 Cb -0.20 -1.72 0.02 0.00 0.02 0.00 0.00 46.19 44.32 2dil s LEU 33 CO -0.06 -0.04 -0.09 -1.61 0.02 0.00 0.00 176.35 174.57 2dil s GLU 34 N -3.69 2.89 -0.28 1.70 2.02 -1.23 -2.85 118.70 117.26 2dil s GLU 34 Ca 0.32 -0.93 -0.29 0.00 0.02 0.00 0.00 54.97 54.09 2dil s GLU 34 Cb -0.06 -2.89 0.01 0.00 0.10 0.00 0.00 34.13 31.30 2dil s GLU 34 CO 0.20 -0.35 1.11 0.54 0.02 0.00 0.00 175.26 176.78 2dil s VAL 35 N 1.32 4.50 -0.10 2.63 0.11 -1.26 -2.02 120.40 125.58 2dil s VAL 35 Ca 0.01 1.76 -0.21 0.00 -2.93 0.00 0.00 61.98 60.61 2dil s VAL 35 Cb -0.16 -4.32 -0.28 0.00 -1.53 0.00 0.00 36.38 30.09 2dil s VAL 35 CO -0.06 -0.36 0.68 0.40 -3.33 0.00 0.00 175.10 172.43 2dil h ILE 36 N 5.65 1.33 -3.88 7.04 1.08 -0.76 -3.48 117.51 124.49 2dil h ILE 36 Ca -0.21 -2.42 -0.22 0.00 -0.39 0.00 0.00 64.86 61.62 2dil h ILE 36 Cb 1.07 2.96 -0.24 0.00 -3.07 0.00 0.00 36.82 37.53 2dil h ILE 36 CO 1.01 0.65 -0.72 -0.22 -0.69 0.00 0.00 178.15 178.19 2dil s LEU 37 N -7.82 2.13 -0.27 1.44 0.20 -1.23 -5.04 118.68 108.09 2dil s LEU 37 Ca -0.18 -0.28 -0.08 0.00 0.69 0.00 0.00 54.13 54.28 2dil s LEU 37 Cb 0.02 -0.01 -0.02 0.00 -0.43 0.00 0.00 46.19 45.74 2dil s LEU 37 CO 0.76 -0.14 0.09 -1.61 -0.29 0.00 0.00 176.35 175.17 2dil s GLU 38 N -0.79 3.59 -0.17 1.98 2.02 -1.26 -2.28 118.70 121.79 2dil s GLU 38 Ca -0.07 -0.53 -0.10 0.00 0.02 0.00 0.00 54.97 54.29 2dil s GLU 38 Cb -0.05 -3.40 -0.05 0.00 0.10 0.00 0.00 34.13 30.73 2dil s GLU 38 CO -0.00 -0.24 0.16 0.20 0.02 0.00 0.00 175.26 175.39 2dil s GLY 39 N 1.62 2.10 0.16 -1.39 0.00 -1.23 -4.99 107.32 103.58 2dil s GLY 39 Ca 0.06 -0.64 -0.14 0.00 0.00 0.00 0.00 44.72 44.00 2dil s GLY 39 CO 0.05 0.04 1.72 -2.09 0.00 0.00 0.00 173.10 172.82 2dil h GLU 40 N 6.20 0.76 -1.26 2.90 4.81 -1.98 -2.62 114.58 123.37 2dil h GLU 40 Ca -0.45 -0.13 0.40 0.00 -0.13 0.00 0.00 59.36 59.06 2dil h GLU 40 Cb 1.17 -0.13 -0.12 0.00 0.63 0.00 0.00 28.75 30.30 2dil h GLU 40 CO 0.71 0.65 0.81 -0.44 -0.73 0.00 0.00 179.01 180.01 2dil h ASP 41 N 0.69 0.28 0.00 1.04 3.32 -2.05 -3.43 116.42 116.26 2dil h ASP 41 Ca 0.17 0.13 0.00 0.00 0.02 0.00 0.00 57.03 57.35 2dil h ASP 41 Cb 0.16 0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.82 2dil h ASP 41 CO -0.02 -0.14 0.00 0.61 -1.72 0.00 0.00 179.24 177.97 2dil n GLY 42 N -1.51 1.36 3.09 2.75 0.00 -0.99 -5.11 105.19 104.79 2dil n GLY 42 Ca 0.35 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.03 2dil n GLY 42 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2dil s TRP 43 N -1.64 3.55 -0.05 1.61 0.52 -1.24 -3.90 118.94 117.79 2dil s TRP 43 Ca 0.00 -2.49 -0.20 0.00 0.02 0.00 0.00 56.10 53.43 2dil s TRP 43 Cb 0.00 -2.76 -0.05 0.00 -1.15 0.00 0.00 33.47 29.51 2dil s TRP 43 CO 0.00 -0.92 0.57 -1.58 0.02 0.00 0.00 176.95 175.04 2dil s TRP 44 N 1.08 3.61 -0.41 -1.98 0.52 0.00 -3.49 118.94 118.27 2dil s TRP 44 Ca 0.05 1.10 -0.21 0.00 0.02 0.00 0.00 56.10 57.06 2dil s TRP 44 Cb -0.21 -2.61 0.02 0.00 -1.15 0.00 0.00 33.47 29.52 2dil s TRP 44 CO -0.05 0.26 0.66 0.99 0.02 0.00 0.00 176.95 178.83 2dil s THR 45 N 0.19 4.82 0.13 2.01 2.01 -0.96 -1.93 115.64 121.90 2dil s THR 45 Ca 0.30 0.30 0.08 0.00 0.31 0.00 0.00 61.69 62.68 2dil s THR 45 Cb -0.17 -4.18 -0.04 0.00 0.01 0.00 0.00 72.50 68.12 2dil s THR 45 CO 0.15 -0.52 -0.18 0.68 -0.69 0.00 0.00 174.62 174.06 2dil s VAL 46 N 2.84 1.63 -0.16 3.82 -7.23 -1.16 0.05 120.40 120.20 2dil s VAL 46 Ca 0.24 -1.73 -0.05 0.00 -1.81 0.00 0.00 61.98 58.63 2dil s VAL 46 Cb -0.14 -1.65 -0.03 0.00 0.56 0.00 0.00 36.38 35.12 2dil s VAL 46 CO 0.18 -0.27 0.00 -0.70 -0.31 0.00 0.00 175.10 174.01 2dil s GLU 47 N -2.47 3.76 -0.01 4.82 -6.30 -0.86 -3.00 118.70 114.64 2dil s GLU 47 Ca 0.11 -0.45 -0.01 0.00 -2.50 0.00 0.00 54.97 52.12 2dil s GLU 47 Cb -0.07 -3.02 0.01 0.00 0.00 0.00 0.00 34.13 31.05 2dil s GLU 47 CO 0.05 0.28 0.03 0.50 0.02 0.00 0.00 175.26 176.14 2dil s ARG 48 N 0.30 0.02 -1.60 4.30 3.52 0.15 -3.51 118.95 122.12 2dil s ARG 48 Ca -0.01 0.08 -0.13 0.00 -0.13 0.00 0.00 55.73 55.54 2dil s ARG 48 Cb -0.13 -0.05 0.10 0.00 -1.56 0.00 0.00 34.95 33.32 2dil s ARG 48 CO 0.02 -0.04 0.70 -1.71 -0.81 0.00 0.00 175.30 173.45 2dil n ASN 49 N 3.34 -2.58 -1.76 -2.12 5.15 -1.26 0.71 115.26 116.74 2dil n ASN 49 Ca -0.16 -0.99 -0.18 0.00 -0.60 0.00 0.00 54.58 52.66 2dil n ASN 49 Cb 0.58 -2.95 -0.04 0.00 -0.53 0.00 0.00 39.78 36.84 2dil n ASN 49 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2dil n GLY 50 N -1.61 0.48 3.34 8.20 0.00 -1.26 -4.99 105.19 109.34 2dil n GLY 50 Ca -0.04 -0.15 -0.20 0.00 0.00 0.00 0.00 46.02 45.62 2dil n GLY 50 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2dil s GLN 51 N -4.33 1.29 -0.06 1.61 -1.52 0.22 -5.15 119.66 111.72 2dil s GLN 51 Ca 0.00 -1.48 0.06 0.00 -1.95 0.00 0.00 55.36 51.99 2dil s GLN 51 Cb 0.00 -1.23 -0.01 0.00 -0.22 0.00 0.00 33.01 31.55 2dil s GLN 51 CO 0.00 0.23 -0.25 0.50 -0.25 0.00 0.00 175.29 175.53 2dil s ARG 52 N -3.14 2.55 0.38 2.91 3.52 -1.26 -0.67 118.95 123.24 2dil s ARG 52 Ca 0.18 -0.89 -0.12 0.00 -0.13 0.00 0.00 55.73 54.77 2dil s ARG 52 Cb -0.04 -2.14 0.04 0.00 -1.56 0.00 0.00 34.95 31.25 2dil s ARG 52 CO 0.07 0.36 0.71 0.20 -0.81 0.00 0.00 175.30 175.83 2dil s GLY 53 N -0.12 0.66 -0.13 8.12 0.00 -1.16 -4.96 107.32 109.72 2dil s GLY 53 Ca -0.05 -0.95 0.03 0.00 0.00 0.00 0.00 44.72 43.75 2dil s GLY 53 CO 0.04 -0.49 -0.22 -1.36 0.00 0.00 0.00 173.10 171.08 2dil s PHE 54 N -2.48 2.60 0.04 1.90 0.40 -1.26 -2.98 117.98 116.21 2dil s PHE 54 Ca 0.19 -1.29 0.02 0.00 -0.60 0.00 0.00 56.93 55.25 2dil s PHE 54 Cb -0.04 -1.77 -0.02 0.00 0.51 0.00 0.00 43.02 41.69 2dil s PHE 54 CO 0.14 -0.58 -0.07 0.14 0.70 0.00 0.00 175.22 175.55 2dil s VAL 55 N 0.78 0.47 0.36 -0.44 -7.23 -0.81 -3.51 120.40 110.01 2dil s VAL 55 Ca -0.08 -1.13 -0.27 0.00 -1.81 0.00 0.00 61.98 58.69 2dil s VAL 55 Cb -0.16 -0.64 -0.09 0.00 0.56 0.00 0.00 36.38 36.05 2dil s VAL 55 CO -0.01 -0.45 1.21 -2.16 -0.31 0.00 0.00 175.10 173.38 2dil s PRO 56 N -1.77 4.24 0.35 4.82 0.04 -1.26 -0.82 135.00 140.61 2dil s PRO 56 Ca -0.09 1.97 0.14 0.00 0.04 0.00 0.00 61.00 63.06 2dil s PRO 56 Cb -0.09 -2.89 0.65 0.00 0.04 0.00 0.00 34.50 32.21 2dil s PRO 56 CO -0.00 -0.20 1.76 0.78 0.04 0.00 0.00 177.00 179.38 2dil h GLY 57 N 3.07 0.00 0.30 0.56 0.00 -1.95 -2.98 103.07 102.07 2dil h GLY 57 Ca -0.48 0.00 0.15 0.00 0.00 0.00 0.00 47.33 46.99 2dil h GLY 57 CO 0.64 0.00 0.71 1.76 0.00 0.00 0.00 176.54 179.65 2dil h SER 58 N 0.00 0.00 -0.83 0.19 0.02 -1.92 1.02 113.55 112.03 2dil h SER 58 Ca -0.00 0.00 -0.46 0.00 -0.84 0.00 0.00 61.79 60.48 2dil h SER 58 Cb 0.81 0.00 -0.26 0.00 0.14 0.00 0.00 62.40 63.09 2dil h SER 58 CO 0.06 0.00 0.45 -1.22 -1.14 0.00 0.00 176.83 174.98 2dil n TYR 59 N -3.35 2.60 -4.05 3.45 4.01 -1.13 -4.95 117.16 113.74 2dil n TYR 59 Ca 0.10 -1.99 -0.13 0.00 -0.16 0.00 0.00 57.90 55.72 2dil n TYR 59 Cb 0.89 -0.89 -0.11 0.00 -0.31 0.00 0.00 39.34 38.91 2dil n TYR 59 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2dil s LEU 60 N -3.38 2.25 -0.36 7.72 1.43 0.35 -2.97 118.68 123.71 2dil s LEU 60 Ca 0.55 -0.53 0.01 0.00 -1.03 0.00 0.00 54.13 53.13 2dil s LEU 60 Cb 0.46 -0.13 0.11 0.00 0.03 0.00 0.00 46.19 46.66 2dil s LEU 60 CO 0.06 -0.21 0.14 -0.70 0.23 0.00 0.00 176.35 175.87 2dil s GLU 61 N -1.52 0.99 -0.33 1.70 2.12 -0.92 -4.90 118.70 115.84 2dil s GLU 61 Ca -0.10 -1.48 -0.37 0.00 0.36 0.00 0.00 54.97 53.37 2dil s GLU 61 Cb -0.10 -2.24 -0.13 0.00 0.26 0.00 0.00 34.13 31.92 2dil s GLU 61 CO 0.00 -1.04 2.05 1.17 -0.54 0.00 0.00 175.26 176.90 2dil n LYS 62 N 4.33 1.03 -2.19 4.30 4.81 -1.26 -3.38 118.16 125.80 2dil n LYS 62 Ca 0.02 0.32 -0.42 0.00 -0.87 0.00 0.00 58.31 57.36 2dil n LYS 62 Cb 0.39 -2.27 -0.03 0.00 0.02 0.00 0.00 35.03 33.15 2dil n LYS 62 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2dil s LEU 63 N 6.01 4.30 0.23 3.14 1.43 -1.11 -4.88 118.68 127.80 2dil s LEU 63 Ca 1.07 2.09 0.02 0.00 -1.03 0.00 0.00 54.13 56.28 2dil s LEU 63 Cb -0.98 -3.55 0.59 0.00 0.03 0.00 0.00 46.19 42.28 2dil s LEU 63 CO 0.56 -0.78 1.14 -1.20 0.23 0.00 0.00 176.35 176.30 2dil n SER 64 N 6.00 -0.06 0.00 2.29 7.64 -1.26 -4.77 113.62 123.46 2dil n SER 64 Ca 0.14 1.24 0.00 0.00 1.01 0.00 0.00 58.87 61.26 2dil n SER 64 Cb 0.43 -0.46 0.00 0.00 -1.01 0.00 0.00 64.21 63.17 2dil n SER 64 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dil n GLY 65 N -1.35 0.66 3.56 0.23 0.00 -1.26 -5.00 105.19 102.04 2dil n GLY 65 Ca 0.18 -0.65 -0.27 0.00 0.00 0.00 0.00 46.02 45.28 2dil n GLY 65 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dil s PRO 66 N -0.42 2.54 -0.09 1.61 0.04 -1.26 -4.95 135.00 132.47 2dil s PRO 66 Ca 0.00 -0.43 -0.03 0.00 0.04 0.00 0.00 61.00 60.58 2dil s PRO 66 Cb 0.00 -5.09 -0.03 0.00 0.04 0.00 0.00 34.50 29.41 2dil s PRO 66 CO 0.00 -3.48 0.03 0.45 0.04 0.00 0.00 177.00 174.04 2dil s SER 67 N 7.78 5.48 -0.15 6.66 0.15 -1.26 -5.08 113.70 127.28 2dil s SER 67 Ca 0.70 0.21 -0.29 0.00 0.70 0.00 0.00 55.95 57.27 2dil s SER 67 Cb -0.06 -1.60 -0.01 0.00 -1.71 0.00 0.00 66.02 62.64 2dil s SER 67 CO 0.02 0.38 1.11 -0.55 1.20 0.00 0.00 173.24 175.40 2dil s SER 68 N -0.90 7.09 0.00 5.45 0.15 -1.26 -5.31 113.70 118.92 2dil s SER 68 Ca 0.13 1.57 0.27 0.00 0.70 0.00 0.00 55.95 58.62 2dil s SER 68 Cb -0.11 -2.55 0.79 0.00 -1.71 0.00 0.00 66.02 62.44 2dil s SER 68 CO 0.03 -0.62 1.60 0.61 1.20 0.00 0.00 173.24 176.05