#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dl6 s SER 2 N 0.00 6.15 0.35 1.61 0.01 -1.26 -5.05 113.70 115.51 2dl6 s SER 2 Ca 0.00 -0.97 -0.28 0.00 1.31 0.00 0.00 55.95 56.01 2dl6 s SER 2 Cb 0.00 -2.19 -0.11 0.00 0.21 0.00 0.00 66.02 63.93 2dl6 s SER 2 CO 0.00 -0.57 1.45 -0.55 0.41 0.00 0.00 173.24 173.98 2dl6 s SER 3 N 2.04 6.47 -0.46 2.44 0.15 -1.26 -4.97 113.70 118.12 2dl6 s SER 3 Ca 0.07 2.93 -0.16 0.00 0.70 0.00 0.00 55.95 59.49 2dl6 s SER 3 Cb -0.20 -2.66 0.05 0.00 -1.71 0.00 0.00 66.02 61.50 2dl6 s SER 3 CO 0.10 -0.78 0.43 -0.83 1.20 0.00 0.00 173.24 173.36 2dl6 s GLY 4 N -0.15 1.96 0.02 9.45 0.00 -1.26 -4.95 107.32 112.40 2dl6 s GLY 4 Ca 0.53 -1.87 -0.25 0.00 0.00 0.00 0.00 44.72 43.14 2dl6 s GLY 4 CO 0.58 1.12 1.40 1.76 0.00 0.00 0.00 173.10 177.97 2dl6 h SER 5 N 8.77 -0.07 -5.06 1.64 0.02 -2.07 -3.48 113.55 113.30 2dl6 h SER 5 Ca -0.28 -0.28 0.09 0.00 -0.84 0.00 0.00 61.79 60.48 2dl6 h SER 5 Cb 1.11 0.02 -0.06 0.00 0.14 0.00 0.00 62.40 63.61 2dl6 h SER 5 CO 0.85 0.25 0.28 -0.44 -1.14 0.00 0.00 176.83 176.63 2dl6 s SER 6 N -5.42 -0.25 0.08 3.07 0.01 -1.26 -5.13 113.70 104.80 2dl6 s SER 6 Ca -0.15 -0.55 -0.26 0.00 1.31 0.00 0.00 55.95 56.30 2dl6 s SER 6 Cb 0.03 0.68 -0.14 0.00 0.21 0.00 0.00 66.02 66.80 2dl6 s SER 6 CO 0.65 -1.25 0.59 0.61 0.41 0.00 0.00 173.24 174.25 2dl6 n GLY 7 N -0.46 -0.82 3.67 3.44 0.00 -1.26 -4.76 105.19 105.00 2dl6 n GLY 7 Ca -0.05 0.41 -0.42 0.00 0.00 0.00 0.00 46.02 45.96 2dl6 n GLY 7 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2dl6 s GLU 8 N -0.41 4.20 1.05 1.61 -1.05 -1.26 -4.99 118.70 117.84 2dl6 s GLU 8 Ca 0.58 2.20 -0.14 0.00 -0.15 0.00 0.00 54.97 57.46 2dl6 s GLU 8 Cb -0.83 -3.84 0.22 0.00 -0.44 0.00 0.00 34.13 29.24 2dl6 s GLU 8 CO 0.43 -0.78 1.10 -1.25 0.95 0.00 0.00 175.26 175.70 2dl6 s PRO 9 N 3.49 -0.00 -0.18 -4.83 0.04 -1.26 -5.02 135.00 127.24 2dl6 s PRO 9 Ca 0.72 0.37 -0.07 0.00 0.04 0.00 0.00 61.00 62.07 2dl6 s PRO 9 Cb -0.35 -1.70 -0.22 0.00 0.04 0.00 0.00 34.50 32.28 2dl6 s PRO 9 CO 0.30 -2.99 0.14 -1.71 0.04 0.00 0.00 177.00 172.77 2dl6 n ASN 10 N -4.33 2.04 -4.93 6.66 2.85 -1.26 -4.84 115.26 111.45 2dl6 n ASN 10 Ca 0.07 0.16 -0.24 0.00 -0.11 0.00 0.00 54.58 54.45 2dl6 n ASN 10 Cb 0.58 -0.76 0.01 0.00 1.24 0.00 0.00 39.78 40.85 2dl6 n ASN 10 CO 0.00 0.00 0.00 -1.38 -2.11 0.00 0.00 177.26 173.77 2dl6 s HIS 11 N -2.52 1.66 -1.99 1.20 -3.43 -1.26 -5.03 115.29 103.92 2dl6 s HIS 11 Ca -0.28 -0.79 0.22 0.00 -0.80 0.00 0.00 55.06 53.41 2dl6 s HIS 11 Cb 0.08 -2.00 0.59 0.00 -1.43 0.00 0.00 32.58 29.82 2dl6 s HIS 11 CO 0.68 -0.60 1.50 1.47 -2.00 0.00 0.00 174.74 175.79 2dl6 n LEU 12 N -1.85 3.82 -4.55 5.38 -0.00 -1.26 -5.00 117.00 113.54 2dl6 n LEU 12 Ca 0.03 -1.91 -0.38 0.00 -0.00 0.00 0.00 56.01 53.74 2dl6 n LEU 12 Cb 0.63 -0.44 0.05 0.00 -0.00 0.00 0.00 43.42 43.66 2dl6 n LEU 12 CO 0.39 0.93 0.34 0.47 -0.00 0.00 0.00 177.39 179.53 2dl6 n ASP 13 N 1.56 -0.00 -4.46 1.45 9.92 -1.26 -5.02 116.55 118.74 2dl6 n ASP 13 Ca 0.23 0.78 -0.29 0.00 -0.53 0.00 0.00 54.79 54.98 2dl6 n ASP 13 Cb 0.61 -1.29 -0.08 0.00 -0.64 0.00 0.00 41.12 39.72 2dl6 n ASP 13 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 2dl6 s VAL 14 N -1.60 0.93 0.11 2.53 -7.23 -1.26 -5.13 120.40 108.75 2dl6 s VAL 14 Ca 0.73 -2.00 -0.27 0.00 -1.81 0.00 0.00 61.98 58.62 2dl6 s VAL 14 Cb -0.43 -2.27 -0.06 0.00 0.56 0.00 0.00 36.38 34.17 2dl6 s VAL 14 CO 0.50 0.00 0.86 -0.62 -0.31 0.00 0.00 175.10 175.53 2dl6 s ASP 15 N -3.75 7.40 0.23 4.85 2.15 -1.26 -4.94 116.67 121.35 2dl6 s ASP 15 Ca 0.15 1.66 -0.05 0.00 0.43 0.00 0.00 52.55 54.75 2dl6 s ASP 15 Cb 0.02 -2.53 0.43 0.00 -0.30 0.00 0.00 42.92 40.54 2dl6 s ASP 15 CO 0.09 0.04 1.28 0.18 -0.17 0.00 0.00 175.17 176.58 2dl6 n LEU 16 N 2.45 -0.25 -0.31 -1.34 4.77 -1.26 0.22 117.00 121.28 2dl6 n LEU 16 Ca -0.01 1.40 0.02 0.00 -0.03 0.00 0.00 56.01 57.39 2dl6 n LEU 16 Cb 0.49 -0.44 0.16 0.00 -2.33 0.00 0.00 43.42 41.30 2dl6 n LEU 16 CO 0.49 -1.36 1.18 -0.33 -1.33 0.00 0.00 177.39 176.04 2dl6 h GLU 17 N 0.00 0.89 -6.59 3.23 4.39 -1.98 -3.30 114.58 111.23 2dl6 h GLU 17 Ca 0.42 -0.05 -0.59 0.00 0.34 0.00 0.00 59.36 59.47 2dl6 h GLU 17 Cb 0.69 -0.20 0.09 0.00 -0.10 0.00 0.00 28.75 29.23 2dl6 h GLU 17 CO -0.83 0.59 0.52 2.41 -1.16 0.00 0.00 179.01 180.54 2dl6 n THR 18 N -4.66 1.25 -2.37 1.13 -1.04 0.61 -4.87 114.28 104.33 2dl6 n THR 18 Ca 0.13 -0.31 -0.26 0.00 -2.04 0.00 0.00 64.05 61.57 2dl6 n THR 18 Cb 0.22 -1.39 0.13 0.00 -1.82 0.00 0.00 70.33 67.47 2dl6 n THR 18 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 2dl6 s ARG 19 N -0.81 1.35 -0.15 -2.82 1.81 -1.26 -2.97 118.95 114.10 2dl6 s ARG 19 Ca 0.65 -0.88 -0.04 0.00 -1.72 0.00 0.00 55.73 53.74 2dl6 s ARG 19 Cb -0.66 -2.17 0.06 0.00 -0.45 0.00 0.00 34.95 31.74 2dl6 s ARG 19 CO 0.53 -1.76 0.14 0.42 -0.68 0.00 0.00 175.30 173.95 2dl6 s ILE 20 N -3.39 -0.20 0.36 1.52 -1.09 -1.02 -4.77 121.20 112.61 2dl6 s ILE 20 Ca 0.69 0.03 -0.27 0.00 -2.23 0.00 0.00 60.65 58.86 2dl6 s ILE 20 Cb -0.05 -0.50 -0.09 0.00 -1.58 0.00 0.00 42.46 40.24 2dl6 s ILE 20 CO 0.47 -0.12 1.21 -2.16 -1.23 0.00 0.00 174.94 173.11 2dl6 s PRO 21 N 2.23 4.25 -0.07 2.79 0.04 -1.26 -4.23 135.00 138.75 2dl6 s PRO 21 Ca 0.04 1.97 -0.09 0.00 0.04 0.00 0.00 61.00 62.97 2dl6 s PRO 21 Cb -0.15 -2.90 0.02 0.00 0.04 0.00 0.00 34.50 31.51 2dl6 s PRO 21 CO -0.09 -0.19 0.24 0.14 0.04 0.00 0.00 177.00 177.14 2dl6 s VAL 22 N -1.27 0.02 -0.24 -0.36 -7.23 -1.11 -3.20 120.40 107.01 2dl6 s VAL 22 Ca 0.52 -0.13 -0.08 0.00 -1.81 0.00 0.00 61.98 60.48 2dl6 s VAL 22 Cb -0.34 -0.38 -0.04 0.00 0.56 0.00 0.00 36.38 36.18 2dl6 s VAL 22 CO 0.44 -0.07 0.10 -0.51 -0.31 0.00 0.00 175.10 174.75 2dl6 s ILE 23 N -0.19 4.68 1.07 -0.62 2.07 0.43 -0.18 121.20 128.45 2dl6 s ILE 23 Ca -0.03 -0.05 -0.12 0.00 -1.41 0.00 0.00 60.65 59.04 2dl6 s ILE 23 Cb -0.03 -3.18 0.22 0.00 0.13 0.00 0.00 42.46 39.60 2dl6 s ILE 23 CO 0.01 0.34 1.03 -3.20 -1.91 0.00 0.00 174.94 171.21 2dl6 n ASN 24 N 4.63 -0.90 -0.03 4.50 4.05 0.82 -1.36 115.26 126.97 2dl6 n ASN 24 Ca -0.16 0.09 -0.02 0.00 0.45 0.00 0.00 54.58 54.95 2dl6 n ASN 24 Cb 0.52 -1.34 -0.06 0.00 1.23 0.00 0.00 39.78 40.13 2dl6 n ASN 24 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 177.26 174.50 2dl6 n LYS 25 N -4.53 2.23 0.18 1.20 5.02 -0.80 -3.85 118.16 117.61 2dl6 n LYS 25 Ca 0.07 -0.02 -0.08 0.00 -2.02 0.00 0.00 58.31 56.26 2dl6 n LYS 25 Cb 0.53 -1.19 -0.04 0.00 -0.02 0.00 0.00 35.03 34.32 2dl6 n LYS 25 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2dl6 h VAL 26 N 0.00 0.00 0.07 -0.18 2.07 -1.94 -3.40 116.25 112.87 2dl6 h VAL 26 Ca -0.15 -0.58 -0.37 0.00 0.82 0.00 0.00 66.70 66.43 2dl6 h VAL 26 Cb 1.20 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.93 2dl6 h VAL 26 CO 0.01 0.00 -2.11 -0.67 0.02 0.00 0.00 177.57 174.81 2dl6 n ASP 27 N -5.00 2.05 -0.09 0.57 -0.08 -1.26 -5.04 116.55 107.70 2dl6 n ASP 27 Ca -0.06 0.13 0.00 0.00 -1.51 0.00 0.00 54.79 53.34 2dl6 n ASP 27 Cb 0.20 -0.73 0.00 0.00 2.34 0.00 0.00 41.12 42.93 2dl6 n ASP 27 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2dl6 n GLY 28 N 2.00 0.65 3.44 0.27 0.00 -1.25 -5.06 105.19 105.24 2dl6 n GLY 28 Ca -0.37 -0.32 -0.33 0.00 0.00 0.00 0.00 46.02 45.00 2dl6 n GLY 28 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dl6 s THR 29 N -1.50 3.11 -0.45 2.61 2.01 -1.26 -4.81 115.64 115.36 2dl6 s THR 29 Ca 0.00 -0.68 -0.18 0.00 0.31 0.00 0.00 61.69 61.14 2dl6 s THR 29 Cb 0.00 -2.26 0.03 0.00 0.01 0.00 0.00 72.50 70.29 2dl6 s THR 29 CO 0.00 0.56 0.48 -0.22 -0.69 0.00 0.00 174.62 174.76 2dl6 s LEU 30 N -0.29 4.95 0.20 4.42 2.96 -1.26 -0.13 118.68 129.53 2dl6 s LEU 30 Ca 0.02 -0.77 -0.30 0.00 -0.22 0.00 0.00 54.13 52.86 2dl6 s LEU 30 Cb -0.13 -2.40 -0.08 0.00 0.50 0.00 0.00 46.19 44.08 2dl6 s LEU 30 CO 0.03 -0.66 1.02 -0.76 -1.32 0.00 0.00 176.35 174.65 2dl6 s LEU 31 N 2.23 4.55 0.15 -0.68 1.43 0.74 -4.91 118.68 122.20 2dl6 s LEU 31 Ca 0.12 2.01 0.02 0.00 -1.03 0.00 0.00 54.13 55.25 2dl6 s LEU 31 Cb -0.18 -3.61 -0.04 0.00 0.03 0.00 0.00 46.19 42.39 2dl6 s LEU 31 CO 0.13 -0.05 -0.01 0.68 0.23 0.00 0.00 176.35 177.32 2dl6 s VAL 32 N -0.64 0.64 0.00 -1.59 -7.23 -1.26 -2.73 120.40 107.59 2dl6 s VAL 32 Ca 0.45 -1.96 0.00 0.00 -1.81 0.00 0.00 61.98 58.66 2dl6 s VAL 32 Cb -0.27 -2.01 0.00 0.00 0.56 0.00 0.00 36.38 34.66 2dl6 s VAL 32 CO 0.34 -0.57 0.00 0.61 -0.31 0.00 0.00 175.10 175.17 2dl6 n GLY 33 N -0.18 1.79 0.26 2.32 0.00 -1.26 -1.55 105.19 106.57 2dl6 n GLY 33 Ca -0.08 -0.34 0.05 0.00 0.00 0.00 0.00 46.02 45.65 2dl6 n GLY 33 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2dl6 h GLU 34 N 0.00 0.23 -1.30 1.61 4.11 -1.98 0.43 114.58 117.67 2dl6 h GLU 34 Ca 0.00 -0.01 0.44 0.00 0.07 0.00 0.00 59.36 59.86 2dl6 h GLU 34 Cb 0.00 -0.05 -0.12 0.00 0.50 0.00 0.00 28.75 29.08 2dl6 h GLU 34 CO 0.00 0.15 0.85 -0.25 0.07 0.00 0.00 179.01 179.83 2dl6 n ASP 35 N -5.19 0.18 -4.91 3.06 8.00 -0.60 -4.28 116.55 112.81 2dl6 n ASP 35 Ca 0.13 1.24 -0.29 0.00 0.71 0.00 0.00 54.79 56.58 2dl6 n ASP 35 Cb 0.44 -0.61 -0.03 0.00 -0.02 0.00 0.00 41.12 40.90 2dl6 n ASP 35 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2dl6 s ALA 36 N -5.07 3.67 1.10 2.24 0.00 0.14 -4.80 121.76 119.04 2dl6 s ALA 36 Ca -0.07 -0.59 -0.08 0.00 0.00 0.00 0.00 51.96 51.22 2dl6 s ALA 36 Cb 0.28 -2.24 0.12 0.00 0.00 0.00 0.00 23.12 21.28 2dl6 s ALA 36 CO 0.75 0.32 0.43 -0.35 0.00 0.00 0.00 175.76 176.92 2dl6 n PRO 37 N -0.78 -1.87 -4.46 0.00 -0.04 -1.26 -4.67 135.00 121.92 2dl6 n PRO 37 Ca -0.02 -0.69 -0.32 0.00 -0.04 0.00 0.00 63.50 62.42 2dl6 n PRO 37 Cb 0.54 -0.65 -0.10 0.00 -0.04 0.00 0.00 33.50 33.24 2dl6 n PRO 37 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2dl6 s ARG 38 N -3.98 2.53 0.45 0.54 0.52 -1.26 -2.43 118.95 115.31 2dl6 s ARG 38 Ca 0.28 -0.74 0.26 0.00 -0.52 0.00 0.00 55.73 55.01 2dl6 s ARG 38 Cb -0.03 -2.49 1.29 0.00 0.52 0.00 0.00 34.95 34.24 2dl6 s ARG 38 CO 0.22 0.60 1.75 -0.09 0.02 0.00 0.00 175.30 177.79 2dl6 h ARG 39 N 4.50 0.22 0.62 3.54 9.65 -1.60 1.63 114.38 132.95 2dl6 h ARG 39 Ca -0.48 -0.01 -0.03 0.00 -1.10 0.00 0.00 59.98 58.35 2dl6 h ARG 39 Cb 1.17 -0.05 0.01 0.00 -1.39 0.00 0.00 29.97 29.70 2dl6 h ARG 39 CO 0.53 0.15 -0.30 0.00 2.80 0.00 0.00 179.97 183.15 2dl6 h ALA 40 N 1.55 -0.84 -0.41 2.80 0.00 -1.87 -3.08 119.26 117.42 2dl6 h ALA 40 Ca 0.63 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.33 2dl6 h ALA 40 Cb 1.93 0.32 0.00 0.00 0.00 0.00 0.00 17.79 20.04 2dl6 h ALA 40 CO -0.24 -0.87 0.00 -0.85 0.00 0.00 0.00 179.25 177.30 2dl6 n GLU 41 N -5.38 2.72 -0.16 0.00 0.28 -0.35 -4.25 120.64 113.50 2dl6 n GLU 41 Ca -0.12 -1.79 -0.10 0.00 -0.16 0.00 0.00 57.16 55.00 2dl6 n GLU 41 Cb 0.36 -1.66 0.00 0.00 1.43 0.00 0.00 31.44 31.57 2dl6 n GLU 41 CO 0.00 0.00 0.00 1.25 -0.16 0.00 0.00 177.13 178.22 2dl6 h LEU 42 N 2.56 0.79 0.67 -1.84 5.85 0.24 -0.11 115.31 123.47 2dl6 h LEU 42 Ca 0.00 -0.29 -0.03 0.00 0.84 0.00 0.00 57.88 58.40 2dl6 h LEU 42 Cb 1.00 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.82 2dl6 h LEU 42 CO 0.15 0.88 -0.38 -0.33 -0.34 0.00 0.00 178.44 178.42 2dl6 h GLU 43 N 0.67 -0.94 -0.31 1.25 5.08 -1.75 0.13 114.58 118.71 2dl6 h GLU 43 Ca 0.14 0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.55 2dl6 h GLU 43 Cb 0.45 0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.90 2dl6 h GLU 43 CO 0.02 -0.62 0.13 0.52 -1.00 0.00 0.00 179.01 178.05 2dl6 h MET 44 N -0.97 0.43 -0.42 2.33 2.86 -1.84 -2.17 114.93 115.15 2dl6 h MET 44 Ca -0.09 -0.05 -0.12 0.00 -2.06 0.00 0.00 59.70 57.38 2dl6 h MET 44 Cb 0.77 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.33 2dl6 h MET 44 CO 0.11 0.36 -0.23 2.35 1.06 0.00 0.00 176.91 180.55 2dl6 h TRP 45 N 0.44 0.97 0.00 -0.22 7.01 -0.66 -2.53 115.95 120.96 2dl6 h TRP 45 Ca 0.11 -0.23 0.00 0.00 2.11 0.00 0.00 58.89 60.88 2dl6 h TRP 45 Cb 0.08 -0.23 0.00 0.00 -2.10 0.00 0.00 29.16 26.92 2dl6 h TRP 45 CO 0.00 1.00 0.00 -0.07 -2.79 0.00 0.00 178.44 176.58 2dl6 h LEU 46 N 0.74 0.00 0.06 0.65 3.38 -0.11 0.42 115.31 120.45 2dl6 h LEU 46 Ca 0.10 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 2dl6 h LEU 46 Cb 0.77 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.52 2dl6 h LEU 46 CO 0.06 0.00 -0.03 1.56 0.09 0.00 0.00 178.44 180.12 2dl6 h GLN 47 N 0.00 -0.08 -0.00 1.13 4.20 -1.17 -2.13 115.11 117.05 2dl6 h GLN 47 Ca 0.00 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.72 2dl6 h GLN 47 Cb 0.38 0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.18 2dl6 h GLN 47 CO 0.00 0.21 -0.84 0.41 -0.67 0.00 0.00 178.83 177.94 2dl6 n GLY 48 N -0.34 -0.69 1.26 3.46 0.00 -1.16 -4.38 105.19 103.34 2dl6 n GLY 48 Ca -0.08 -0.51 -0.08 0.00 0.00 0.00 0.00 46.02 45.35 2dl6 n GLY 48 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2dl6 n HIS 49 N -1.41 1.27 0.94 1.61 8.25 0.15 -4.74 115.22 121.29 2dl6 n HIS 49 Ca 0.03 -1.83 0.08 0.00 -0.26 0.00 0.00 57.72 55.74 2dl6 n HIS 49 Cb 0.28 -0.37 0.45 0.00 1.12 0.00 0.00 29.99 31.47 2dl6 n HIS 49 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2dl6 n PRO 50 N -0.97 0.46 0.00 -0.41 -0.04 -0.80 -3.01 135.00 130.22 2dl6 n PRO 50 Ca 0.32 0.02 0.07 0.00 -0.04 0.00 0.00 63.50 63.87 2dl6 n PRO 50 Cb 0.85 -1.50 0.42 0.00 -0.04 0.00 0.00 33.50 33.23 2dl6 n PRO 50 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2dl6 n GLU 51 N -1.03 0.37 -3.94 0.54 0.28 -1.26 -4.72 120.64 110.87 2dl6 n GLU 51 Ca 0.11 0.06 -0.24 0.00 -0.16 0.00 0.00 57.16 56.93 2dl6 n GLU 51 Cb 0.06 -1.50 -0.05 0.00 1.43 0.00 0.00 31.44 31.38 2dl6 n GLU 51 CO 0.00 0.00 0.00 -0.06 -0.16 0.00 0.00 177.13 176.91 2dl6 s PHE 52 N -2.22 2.46 -0.10 -1.84 0.40 -1.16 -1.91 117.98 113.60 2dl6 s PHE 52 Ca 0.19 -0.61 -0.04 0.00 -0.60 0.00 0.00 56.93 55.87 2dl6 s PHE 52 Cb 0.10 -2.01 0.05 0.00 0.51 0.00 0.00 43.02 41.67 2dl6 s PHE 52 CO 0.19 -0.01 0.21 0.00 0.70 0.00 0.00 175.22 176.31 2dl6 s ALA 53 N -2.60 -0.40 0.04 5.36 0.00 -0.46 -4.92 121.76 118.77 2dl6 s ALA 53 Ca 0.41 0.82 -0.35 0.00 0.00 0.00 0.00 51.96 52.83 2dl6 s ALA 53 Cb 0.01 -0.71 -0.14 0.00 0.00 0.00 0.00 23.12 22.27 2dl6 s ALA 53 CO 0.23 -0.36 1.63 0.28 0.00 0.00 0.00 175.76 177.54 2dl6 n VAL 54 N 4.70 0.19 -1.66 0.00 0.31 -1.26 -0.42 118.33 120.19 2dl6 n VAL 54 Ca -0.17 -0.03 -0.50 0.00 -0.01 0.00 0.00 64.34 63.63 2dl6 n VAL 54 Cb 0.51 -1.46 -0.05 0.00 -0.91 0.00 0.00 33.84 31.93 2dl6 n VAL 54 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2dl6 n ASP 55 N 4.31 2.69 0.18 4.52 2.03 -1.19 -4.85 116.55 124.24 2dl6 n ASP 55 Ca 0.20 1.07 0.04 0.00 0.52 0.00 0.00 54.79 56.61 2dl6 n ASP 55 Cb 0.26 -1.31 0.34 0.00 -0.72 0.00 0.00 41.12 39.69 2dl6 n ASP 55 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2dl6 h PRO 56 N 6.52 0.00 -0.28 -0.67 0.13 -1.95 -2.87 132.00 132.88 2dl6 h PRO 56 Ca -0.47 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.51 2dl6 h PRO 56 Cb 1.29 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.41 2dl6 h PRO 56 CO 0.88 0.41 -0.45 0.00 -0.23 0.00 0.00 178.00 178.61 2dl6 h ARG 57 N 0.00 0.70 -0.37 0.86 -0.00 -2.01 -2.76 114.38 110.80 2dl6 h ARG 57 Ca -0.00 -0.39 -0.16 0.00 -0.50 0.00 0.00 59.98 58.93 2dl6 h ARG 57 Cb 0.80 0.02 -0.01 0.00 0.00 0.00 0.00 29.97 30.79 2dl6 h ARG 57 CO 0.05 1.00 -0.39 0.35 0.00 0.00 0.00 179.97 180.99 2dl6 h PHE 58 N 0.56 1.11 0.73 3.04 3.04 -1.92 -2.96 116.94 120.55 2dl6 h PHE 58 Ca 0.04 -0.34 -0.03 0.00 3.98 0.00 0.00 57.97 61.61 2dl6 h PHE 58 Cb 0.99 -0.23 0.00 0.00 2.56 0.00 0.00 35.95 39.28 2dl6 h PHE 58 CO 0.05 1.17 -0.38 -0.07 -2.02 0.00 0.00 178.31 177.06 2dl6 h LEU 59 N 0.74 -0.91 -0.67 0.59 3.38 -1.47 -3.13 115.31 113.85 2dl6 h LEU 59 Ca 0.06 0.04 0.11 0.00 0.09 0.00 0.00 57.88 58.18 2dl6 h LEU 59 Cb 0.99 0.24 -0.12 0.00 0.09 0.00 0.00 40.66 41.86 2dl6 h LEU 59 CO 0.10 -0.62 -0.35 0.00 0.09 0.00 0.00 178.44 177.66 2dl6 h ALA 60 N -1.47 -0.02 -0.72 1.53 0.00 -1.58 -1.30 119.26 115.70 2dl6 h ALA 60 Ca -0.10 0.18 0.09 0.00 0.00 0.00 0.00 54.91 55.08 2dl6 h ALA 60 Cb 0.78 0.84 -0.10 0.00 0.00 0.00 0.00 17.79 19.31 2dl6 h ALA 60 CO 0.15 -0.67 -0.35 0.98 0.00 0.00 0.00 179.25 179.36 2dl6 n TYR 61 N -5.44 -0.13 0.11 0.00 9.36 -1.12 -0.37 117.16 119.58 2dl6 n TYR 61 Ca 0.05 0.89 -0.13 0.00 3.32 0.00 0.00 57.90 62.03 2dl6 n TYR 61 Cb 0.36 -0.67 -0.08 0.00 -0.63 0.00 0.00 39.34 38.32 2dl6 n TYR 61 CO 0.00 0.00 0.00 0.52 0.22 0.00 0.00 176.86 177.60 2dl6 h MET 62 N 0.00 -0.60 -0.69 2.98 2.86 -1.24 -2.36 114.93 115.88 2dl6 h MET 62 Ca 0.19 0.04 0.14 0.00 -2.06 0.00 0.00 59.70 58.01 2dl6 h MET 62 Cb 0.37 0.14 -0.13 0.00 0.06 0.00 0.00 31.60 32.03 2dl6 h MET 62 CO -0.70 -0.40 -0.16 0.93 1.06 0.00 0.00 176.91 177.64 2dl6 h GLU 63 N -0.63 0.01 -0.90 1.72 4.39 -0.64 0.20 114.58 118.73 2dl6 h GLU 63 Ca -0.01 -0.00 0.24 0.00 0.34 0.00 0.00 59.36 59.92 2dl6 h GLU 63 Cb 0.61 -0.00 -0.13 0.00 -0.10 0.00 0.00 28.75 29.12 2dl6 h GLU 63 CO -0.19 0.00 0.36 -0.44 -1.16 0.00 0.00 179.01 177.58 2dl6 h ASP 64 N 0.01 0.23 -0.72 1.42 3.32 -0.34 0.24 116.42 120.58 2dl6 h ASP 64 Ca 0.34 0.17 0.11 0.00 0.02 0.00 0.00 57.03 57.67 2dl6 h ASP 64 Cb 0.52 0.18 -0.08 0.00 0.22 0.00 0.00 39.33 40.17 2dl6 h ASP 64 CO -0.70 -0.08 0.33 0.03 -1.72 0.00 0.00 179.24 177.10 2dl6 h ARG 65 N 0.32 0.51 -0.56 3.56 3.08 -0.18 0.35 114.38 121.46 2dl6 h ARG 65 Ca 0.58 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.60 2dl6 h ARG 65 Cb 1.16 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 31.09 2dl6 h ARG 65 CO -0.58 0.34 0.00 -2.13 -1.07 0.00 0.00 179.97 176.52 2dl6 n ARG 66 N -4.93 1.98 -0.06 0.04 0.63 0.80 -3.68 116.66 111.44 2dl6 n ARG 66 Ca 0.12 -1.02 -0.08 0.00 -0.92 0.00 0.00 57.85 55.96 2dl6 n ARG 66 Cb 0.33 -1.48 -0.07 0.00 0.45 0.00 0.00 32.46 31.69 2dl6 n ARG 66 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 2dl6 n LYS 67 N 0.24 1.07 -0.32 -0.14 4.76 0.11 -4.66 118.16 119.23 2dl6 n LYS 67 Ca 0.09 0.05 0.01 0.00 -2.87 0.00 0.00 58.31 55.58 2dl6 n LYS 67 Cb 0.40 -1.26 0.06 0.00 -1.84 0.00 0.00 35.03 32.39 2dl6 n LYS 67 CO 0.00 0.00 0.00 0.94 -1.37 0.00 0.00 177.40 176.97 2dl6 n GLN 68 N -2.69 -0.16 -3.79 1.97 0.00 -0.65 -4.58 117.38 107.47 2dl6 n GLN 68 Ca -0.21 1.30 -0.12 0.00 -0.00 0.00 0.00 57.00 57.97 2dl6 n GLN 68 Cb 0.78 -1.93 -0.08 0.00 0.00 0.00 0.00 30.24 29.01 2dl6 n GLN 68 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.06 177.21 2dl6 s LYS 69 N -5.86 0.70 0.45 3.69 -0.14 -1.26 -5.17 119.74 112.15 2dl6 s LYS 69 Ca -0.12 -0.42 0.01 0.00 -1.36 0.00 0.00 55.97 54.08 2dl6 s LYS 69 Cb 0.19 0.30 0.00 0.00 -1.68 0.00 0.00 37.83 36.64 2dl6 s LYS 69 CO 0.61 -0.20 0.66 1.67 -0.76 0.00 0.00 175.35 177.33 2dl6 s TRP 70 N -2.03 3.15 1.01 3.18 1.48 -1.26 -4.90 118.94 119.57 2dl6 s TRP 70 Ca -0.09 0.14 -0.17 0.00 -1.06 0.00 0.00 56.10 54.93 2dl6 s TRP 70 Cb -0.03 -2.35 0.22 0.00 -1.16 0.00 0.00 33.47 30.15 2dl6 s TRP 70 CO -0.00 -0.40 1.27 1.14 -4.06 0.00 0.00 176.95 174.89 2dl6 s GLN 71 N -4.54 0.24 0.35 3.25 -2.07 -1.26 -5.06 119.66 110.57 2dl6 s GLN 71 Ca 0.49 -0.31 -0.04 0.00 -1.82 0.00 0.00 55.36 53.69 2dl6 s GLN 71 Cb -0.10 -1.79 -0.04 0.00 -1.09 0.00 0.00 33.01 29.99 2dl6 s GLN 71 CO 0.37 -2.70 0.62 0.50 -1.32 0.00 0.00 175.29 172.77 2dl6 s ARG 72 N -5.76 3.59 0.80 9.60 3.52 -1.26 -5.10 118.95 124.34 2dl6 s ARG 72 Ca 0.73 0.01 -0.08 0.00 -0.13 0.00 0.00 55.73 56.25 2dl6 s ARG 72 Cb -0.05 -2.57 0.13 0.00 -1.56 0.00 0.00 34.95 30.90 2dl6 s ARG 72 CO 0.54 0.09 1.12 0.00 -0.81 0.00 0.00 175.30 176.23 2dl6 s LYS 74 N -5.44 1.50 -0.06 0.00 -2.85 -1.26 -5.01 119.74 106.62 2dl6 s LYS 74 Ca 0.67 -0.21 0.09 0.00 -1.00 0.00 0.00 55.97 55.53 2dl6 s LYS 74 Cb -0.06 -1.97 0.20 0.00 -2.06 0.00 0.00 37.83 33.93 2dl6 s LYS 74 CO 0.47 -1.83 1.13 0.36 0.10 0.00 0.00 175.35 175.58 2dl6 n LYS 75 N -3.39 2.44 -3.85 1.78 2.85 -1.26 -4.99 118.16 111.74 2dl6 n LYS 75 Ca 0.11 -2.07 -0.35 0.00 -1.05 0.00 0.00 58.31 54.96 2dl6 n LYS 75 Cb 0.60 -1.29 -0.05 0.00 -0.65 0.00 0.00 35.03 33.64 2dl6 n LYS 75 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 177.40 178.56 2dl6 s ASN 76 N -1.69 6.42 -1.33 -5.58 2.47 -1.26 -4.37 114.94 109.60 2dl6 s ASN 76 Ca 0.18 0.45 -0.08 0.00 0.42 0.00 0.00 52.86 53.84 2dl6 s ASN 76 Cb 0.14 -2.05 0.01 0.00 -1.45 0.00 0.00 41.25 37.90 2dl6 s ASN 76 CO 0.04 0.29 1.16 0.59 -3.72 0.00 0.00 177.10 175.47 2dl6 n ASN 77 N 1.24 -5.89 -0.07 -4.21 3.02 -1.26 -4.93 115.26 103.16 2dl6 n ASN 77 Ca -0.13 -0.55 -0.16 0.00 -0.03 0.00 0.00 54.58 53.72 2dl6 n ASN 77 Cb 0.53 -5.02 -0.13 0.00 -0.61 0.00 0.00 39.78 34.56 2dl6 n ASN 77 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 2dl6 h SER 78 N -2.61 0.03 0.00 6.41 0.02 -1.95 -3.49 113.55 111.96 2dl6 h SER 78 Ca -0.57 -0.91 0.00 0.00 -0.84 0.00 0.00 61.79 59.47 2dl6 h SER 78 Cb 1.36 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.90 2dl6 h SER 78 CO 0.55 1.11 0.00 0.61 -1.14 0.00 0.00 176.83 177.96 2dl6 n GLY 79 N 1.58 1.98 3.58 -3.77 0.00 -1.26 -5.18 105.19 102.13 2dl6 n GLY 79 Ca -0.14 0.03 -0.30 0.00 0.00 0.00 0.00 46.02 45.61 2dl6 n GLY 79 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dl6 s PRO 80 N -0.86 -1.57 -0.18 1.61 0.04 -1.26 -5.02 135.00 127.76 2dl6 s PRO 80 Ca 0.00 -0.19 -0.18 0.00 0.04 0.00 0.00 61.00 60.67 2dl6 s PRO 80 Cb 0.00 -1.57 -0.21 0.00 0.04 0.00 0.00 34.50 32.76 2dl6 s PRO 80 CO 0.00 -3.92 0.27 1.03 0.04 0.00 0.00 177.00 174.42 2dl6 h SER 81 N -2.72 0.11 -3.93 6.66 0.87 -2.07 -3.47 113.55 109.00 2dl6 h SER 81 Ca -0.43 -0.63 -0.53 0.00 -1.23 0.00 0.00 61.79 58.98 2dl6 h SER 81 Cb 1.28 -0.04 0.08 0.00 -0.44 0.00 0.00 62.40 63.29 2dl6 h SER 81 CO 0.29 1.58 0.65 -0.44 -0.53 0.00 0.00 176.83 178.37 2dl6 s SER 82 N -6.91 6.45 0.00 6.23 0.01 -1.26 -5.35 113.70 112.87 2dl6 s SER 82 Ca -0.27 2.73 0.00 0.00 1.31 0.00 0.00 55.95 59.72 2dl6 s SER 82 Cb 0.06 -2.65 0.00 0.00 0.21 0.00 0.00 66.02 63.64 2dl6 s SER 82 CO 0.64 -0.76 0.00 0.61 0.41 0.00 0.00 173.24 174.14