#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dl6 h SER 2 N 0.00 -0.23 0.71 1.61 0.87 -2.10 -3.38 113.55 111.04 2dl6 h SER 2 Ca 0.00 0.01 -0.03 0.00 -1.23 0.00 0.00 61.79 60.54 2dl6 h SER 2 Cb 0.00 0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.02 2dl6 h SER 2 CO 0.00 0.14 -0.40 0.28 -0.53 0.00 0.00 176.83 176.32 2dl6 h SER 3 N -0.88 -0.98 0.00 6.23 0.02 -2.12 -3.48 113.55 112.34 2dl6 h SER 3 Ca -0.03 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 2dl6 h SER 3 Cb 0.21 0.27 0.00 0.00 0.14 0.00 0.00 62.40 63.02 2dl6 h SER 3 CO 0.05 -0.64 0.00 0.61 -1.14 0.00 0.00 176.83 175.71 2dl6 n GLY 4 N -1.55 2.41 3.02 -3.77 0.00 -1.26 -5.15 105.19 98.89 2dl6 n GLY 4 Ca -0.14 0.20 -0.04 0.00 0.00 0.00 0.00 46.02 46.04 2dl6 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dl6 s SER 5 N 2.00 -0.40 0.19 1.61 1.04 -1.26 -2.43 113.70 114.45 2dl6 s SER 5 Ca 0.00 0.50 -0.17 0.00 0.48 0.00 0.00 55.95 56.77 2dl6 s SER 5 Cb 0.00 1.53 0.17 0.00 0.10 0.00 0.00 66.02 67.82 2dl6 s SER 5 CO 0.00 -0.28 1.62 -1.28 0.98 0.00 0.00 173.24 174.28 2dl6 h SER 6 N 8.11 -0.71 0.00 7.02 0.87 -2.01 -3.48 113.55 123.35 2dl6 h SER 6 Ca -0.21 0.18 0.00 0.00 -1.23 0.00 0.00 61.79 60.53 2dl6 h SER 6 Cb 1.16 0.41 0.00 0.00 -0.44 0.00 0.00 62.40 63.53 2dl6 h SER 6 CO 0.26 -0.23 0.00 0.61 -0.53 0.00 0.00 176.83 176.94 2dl6 n GLY 7 N -1.41 -0.34 3.83 5.77 0.00 -1.26 -5.11 105.19 106.66 2dl6 n GLY 7 Ca 0.05 0.13 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 2dl6 n GLY 7 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2dl6 s GLU 8 N 0.00 4.10 0.13 1.61 2.02 -1.26 -4.96 118.70 120.33 2dl6 s GLU 8 Ca 0.00 0.64 0.19 0.00 0.02 0.00 0.00 54.97 55.82 2dl6 s GLU 8 Cb 0.00 -3.00 0.80 0.00 0.10 0.00 0.00 34.13 32.03 2dl6 s GLU 8 CO 0.00 0.50 1.58 -0.35 0.02 0.00 0.00 175.26 177.01 2dl6 n PRO 9 N 1.01 0.10 -3.64 0.39 -0.04 -1.26 -4.78 135.00 126.79 2dl6 n PRO 9 Ca -0.06 0.34 -0.13 0.00 -0.04 0.00 0.00 63.50 63.61 2dl6 n PRO 9 Cb 0.51 -1.69 -0.06 0.00 -0.04 0.00 0.00 33.50 32.23 2dl6 n PRO 9 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 2dl6 s ASN 10 N -3.62 -0.33 0.40 3.54 3.84 -1.26 -5.18 114.94 112.33 2dl6 s ASN 10 Ca 0.05 0.05 0.07 0.00 0.21 0.00 0.00 52.86 53.24 2dl6 s ASN 10 Cb 0.09 0.45 -0.07 0.00 -0.55 0.00 0.00 41.25 41.17 2dl6 s ASN 10 CO 0.32 -0.68 0.05 -1.00 -2.79 0.00 0.00 177.10 173.00 2dl6 s HIS 11 N -2.49 2.54 -0.05 0.43 3.76 -1.26 -5.14 115.29 113.08 2dl6 s HIS 11 Ca -0.05 -0.62 -0.02 0.00 -0.15 0.00 0.00 55.06 54.22 2dl6 s HIS 11 Cb -0.01 -1.79 0.03 0.00 1.11 0.00 0.00 32.58 31.92 2dl6 s HIS 11 CO -0.02 0.38 0.05 -0.51 -0.85 0.00 0.00 174.74 173.79 2dl6 s LEU 12 N -3.76 0.22 -0.05 0.89 1.43 -1.26 -5.00 118.68 111.15 2dl6 s LEU 12 Ca 0.37 0.05 0.17 0.00 -1.03 0.00 0.00 54.13 53.69 2dl6 s LEU 12 Cb 0.07 -0.19 0.57 0.00 0.03 0.00 0.00 46.19 46.67 2dl6 s LEU 12 CO 0.19 -0.24 1.48 -0.67 0.23 0.00 0.00 176.35 177.35 2dl6 n ASP 13 N 5.27 3.95 -3.58 2.29 2.03 -1.26 -5.01 116.55 120.24 2dl6 n ASP 13 Ca -0.04 -2.24 -0.24 0.00 0.52 0.00 0.00 54.79 52.79 2dl6 n ASP 13 Cb 0.50 -0.45 0.21 0.00 -0.72 0.00 0.00 41.12 40.65 2dl6 n ASP 13 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 2dl6 n VAL 14 N 0.97 0.00 -4.09 5.18 0.24 -1.26 -5.01 118.33 114.37 2dl6 n VAL 14 Ca 0.21 -0.08 -0.27 0.00 -2.04 0.00 0.00 64.34 62.16 2dl6 n VAL 14 Cb 0.68 -0.70 -0.06 0.00 -1.47 0.00 0.00 33.84 32.29 2dl6 n VAL 14 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2dl6 s ASP 15 N -2.37 5.46 0.33 -1.34 2.15 -1.26 -5.01 116.67 114.62 2dl6 s ASP 15 Ca 0.50 -0.12 0.04 0.00 0.43 0.00 0.00 52.55 53.40 2dl6 s ASP 15 Cb -0.10 -1.41 0.65 0.00 -0.30 0.00 0.00 42.92 41.76 2dl6 s ASP 15 CO 0.46 0.09 1.90 -0.07 -0.17 0.00 0.00 175.17 177.38 2dl6 h LEU 16 N 2.63 0.79 -1.24 -1.34 3.38 -1.96 0.22 115.31 117.80 2dl6 h LEU 16 Ca -0.47 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.51 2dl6 h LEU 16 Cb 1.19 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.79 2dl6 h LEU 16 CO 0.63 0.48 0.00 -1.84 0.09 0.00 0.00 178.44 177.80 2dl6 n GLU 17 N -4.52 1.75 -4.07 1.13 0.28 -1.26 -4.02 120.64 109.93 2dl6 n GLU 17 Ca 0.14 -0.74 -0.35 0.00 -0.16 0.00 0.00 57.16 56.06 2dl6 n GLU 17 Cb 0.29 -1.46 -0.12 0.00 1.43 0.00 0.00 31.44 31.57 2dl6 n GLU 17 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 2dl6 s THR 18 N -1.57 3.99 0.74 3.84 2.01 0.78 -5.05 115.64 120.37 2dl6 s THR 18 Ca 0.13 -0.30 -0.13 0.00 0.31 0.00 0.00 61.69 61.71 2dl6 s THR 18 Cb 0.09 -2.80 0.04 0.00 0.01 0.00 0.00 72.50 69.83 2dl6 s THR 18 CO 0.06 0.43 1.11 -0.13 -0.69 0.00 0.00 174.62 175.40 2dl6 s ARG 19 N 0.98 2.36 -0.14 4.92 1.81 -1.26 -3.02 118.95 124.61 2dl6 s ARG 19 Ca 0.02 1.33 -0.02 0.00 -1.72 0.00 0.00 55.73 55.33 2dl6 s ARG 19 Cb -0.14 -1.90 0.04 0.00 -0.45 0.00 0.00 34.95 32.50 2dl6 s ARG 19 CO 0.02 -1.58 0.00 0.42 -0.68 0.00 0.00 175.30 173.48 2dl6 s ILE 20 N -2.60 0.60 0.62 1.52 -1.09 -0.86 -4.86 121.20 114.53 2dl6 s ILE 20 Ca 0.65 -0.30 -0.16 0.00 -2.23 0.00 0.00 60.65 58.61 2dl6 s ILE 20 Cb -0.20 -0.89 -0.02 0.00 -1.58 0.00 0.00 42.46 39.78 2dl6 s ILE 20 CO 0.50 0.06 1.12 -2.16 -1.23 0.00 0.00 174.94 173.23 2dl6 s PRO 21 N 1.85 2.98 -0.21 2.79 0.04 -1.26 -4.31 135.00 136.88 2dl6 s PRO 21 Ca 0.02 1.46 -0.19 0.00 0.04 0.00 0.00 61.00 62.34 2dl6 s PRO 21 Cb -0.15 -1.97 0.06 0.00 0.04 0.00 0.00 34.50 32.48 2dl6 s PRO 21 CO -0.07 -1.12 0.56 0.14 0.04 0.00 0.00 177.00 176.56 2dl6 s VAL 22 N -2.16 -0.00 -0.35 -0.36 -7.23 -1.18 -3.50 120.40 105.62 2dl6 s VAL 22 Ca 0.69 0.01 -0.08 0.00 -1.81 0.00 0.00 61.98 60.79 2dl6 s VAL 22 Cb -0.22 -0.79 0.04 0.00 0.56 0.00 0.00 36.38 35.97 2dl6 s VAL 22 CO 0.37 0.00 0.14 -0.51 -0.31 0.00 0.00 175.10 174.79 2dl6 s ILE 23 N 0.49 3.98 0.79 -0.62 2.07 0.58 -0.75 121.20 127.74 2dl6 s ILE 23 Ca -0.02 -1.10 -0.15 0.00 -1.41 0.00 0.00 60.65 57.98 2dl6 s ILE 23 Cb -0.04 -3.26 0.00 0.00 0.13 0.00 0.00 42.46 39.29 2dl6 s ILE 23 CO -0.02 -0.22 0.64 -3.20 -1.91 0.00 0.00 174.94 170.24 2dl6 n ASN 24 N 4.86 -0.91 -0.08 4.50 4.05 0.67 -3.17 115.26 125.17 2dl6 n ASN 24 Ca -0.12 0.53 -0.10 0.00 0.45 0.00 0.00 54.58 55.34 2dl6 n ASN 24 Cb 0.45 -1.28 -0.11 0.00 1.23 0.00 0.00 39.78 40.07 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 -1.47 1.12 0.43 1.20 4.76 -1.21 -3.35 118.16 119.63 2dl6 n LYS 25 Ca 0.10 0.04 -0.17 0.00 -2.87 0.00 0.00 58.31 55.41 2dl6 n LYS 25 Cb 0.51 -1.38 -0.08 0.00 -1.84 0.00 0.00 35.03 32.24 2dl6 n LYS 25 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 2dl6 h VAL 26 N 0.00 0.00 0.04 -0.18 2.07 -1.93 -3.38 116.25 112.87 2dl6 h VAL 26 Ca -0.41 -0.05 -0.38 0.00 0.82 0.00 0.00 66.70 66.67 2dl6 h VAL 26 Cb 1.82 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 31.54 2dl6 h VAL 26 CO -0.01 0.00 -2.23 -0.67 0.02 0.00 0.00 177.57 174.68 2dl6 n ASP 27 N -5.06 2.01 0.00 0.57 2.03 -1.26 -5.04 116.55 109.80 2dl6 n ASP 27 Ca -0.13 0.10 0.00 0.00 0.52 0.00 0.00 54.79 55.27 2dl6 n ASP 27 Cb 0.43 -0.67 0.00 0.00 -0.72 0.00 0.00 41.12 40.16 2dl6 n ASP 27 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2dl6 n GLY 28 N 1.94 1.27 3.80 0.27 0.00 -1.21 -5.06 105.19 106.20 2dl6 n GLY 28 Ca -0.42 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.23 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 -2.00 5.23 -0.25 2.61 2.01 -1.26 -4.74 115.64 117.24 2dl6 s THR 29 Ca 0.00 0.63 -0.10 0.00 0.31 0.00 0.00 61.69 62.53 2dl6 s THR 29 Cb 0.00 -3.63 -0.05 0.00 0.01 0.00 0.00 72.50 68.83 2dl6 s THR 29 CO 0.00 0.50 0.15 -0.22 -0.69 0.00 0.00 174.62 174.36 2dl6 s LEU 30 N -0.38 3.96 -0.16 4.42 2.96 -1.26 -0.24 118.68 127.98 2dl6 s LEU 30 Ca 0.20 0.01 -0.19 0.00 -0.22 0.00 0.00 54.13 53.93 2dl6 s LEU 30 Cb -0.14 -2.08 -0.03 0.00 0.50 0.00 0.00 46.19 44.44 2dl6 s LEU 30 CO 0.08 0.01 0.54 -0.76 -1.32 0.00 0.00 176.35 174.90 2dl6 s LEU 31 N 1.38 4.21 0.02 -0.68 1.43 0.07 -4.95 118.68 120.16 2dl6 s LEU 31 Ca 0.07 0.79 -0.04 0.00 -1.03 0.00 0.00 54.13 53.93 2dl6 s LEU 31 Cb -0.15 -2.77 -0.01 0.00 0.03 0.00 0.00 46.19 43.30 2dl6 s LEU 31 CO 0.07 -0.13 0.05 0.68 0.23 0.00 0.00 176.35 177.26 2dl6 s VAL 32 N 1.25 0.11 0.00 -1.59 -7.23 -1.26 -3.13 120.40 108.54 2dl6 s VAL 32 Ca 0.27 -0.92 0.00 0.00 -1.81 0.00 0.00 61.98 59.52 2dl6 s VAL 32 Cb -0.16 -0.52 0.00 0.00 0.56 0.00 0.00 36.38 36.27 2dl6 s VAL 32 CO 0.11 -0.51 0.00 0.61 -0.31 0.00 0.00 175.10 175.00 2dl6 n GLY 33 N 1.30 1.59 0.07 2.32 0.00 -1.26 -3.27 105.19 105.94 2dl6 n GLY 33 Ca -0.22 -0.51 -0.08 0.00 0.00 0.00 0.00 46.02 45.21 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 0.02 -0.89 1.61 9.09 -1.99 -3.29 114.58 119.13 2dl6 h GLU 34 Ca 0.00 -0.04 0.14 0.00 0.05 0.00 0.00 59.36 59.51 2dl6 h GLU 34 Cb 0.00 0.01 -0.07 0.00 -1.65 0.00 0.00 28.75 27.04 2dl6 h GLU 34 CO 0.00 0.95 0.57 -0.44 0.05 0.00 0.00 179.01 180.14 2dl6 h ASP 35 N 0.01 0.68 -3.62 3.06 3.32 -1.94 -3.40 116.42 114.51 2dl6 h ASP 35 Ca -0.06 0.04 -0.51 0.00 0.02 0.00 0.00 57.03 56.52 2dl6 h ASP 35 Cb 1.82 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 41.25 2dl6 h ASP 35 CO 0.13 0.35 0.29 0.00 -1.72 0.00 0.00 179.24 178.28 2dl6 s ALA 36 N -5.70 3.36 1.25 3.45 0.00 -1.24 -4.86 121.76 118.02 2dl6 s ALA 36 Ca -0.10 0.51 -0.21 0.00 0.00 0.00 0.00 51.96 52.16 2dl6 s ALA 36 Cb 0.22 -3.13 0.31 0.00 0.00 0.00 0.00 23.12 20.52 2dl6 s ALA 36 CO 0.79 0.18 1.11 -1.25 0.00 0.00 0.00 175.76 176.59 2dl6 s PRO 37 N -0.87 -1.65 0.26 0.00 0.04 -1.26 -4.65 135.00 126.88 2dl6 s PRO 37 Ca 0.40 -0.21 0.06 0.00 0.04 0.00 0.00 61.00 61.29 2dl6 s PRO 37 Cb -0.24 -1.56 -0.03 0.00 0.04 0.00 0.00 34.50 32.71 2dl6 s PRO 37 CO 0.29 -3.96 0.35 1.03 0.04 0.00 0.00 177.00 174.75 2dl6 s ARG 38 N -5.52 3.27 0.09 4.56 0.52 -1.26 -2.03 118.95 118.58 2dl6 s ARG 38 Ca 0.72 -0.87 -0.23 0.00 -0.52 0.00 0.00 55.73 54.83 2dl6 s ARG 38 Cb -0.07 -2.81 -0.15 0.00 0.52 0.00 0.00 34.95 32.44 2dl6 s ARG 38 CO 0.56 0.35 1.73 -0.09 0.02 0.00 0.00 175.30 177.86 2dl6 h ARG 39 N 1.18 -0.02 -0.42 3.54 9.65 -1.67 0.84 114.38 127.47 2dl6 h ARG 39 Ca -0.50 0.00 0.07 0.00 -1.10 0.00 0.00 59.98 58.46 2dl6 h ARG 39 Cb 1.24 0.00 -0.09 0.00 -1.39 0.00 0.00 29.97 29.73 2dl6 h ARG 39 CO 0.59 -0.00 -0.41 0.00 2.80 0.00 0.00 179.97 182.95 2dl6 h ALA 40 N 0.95 -0.36 0.00 2.80 0.00 -1.84 -0.51 119.26 120.29 2dl6 h ALA 40 Ca -0.00 0.08 -0.13 0.00 0.00 0.00 0.00 54.91 54.85 2dl6 h ALA 40 Cb 0.03 0.86 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 2dl6 h ALA 40 CO 0.00 -0.83 -0.64 1.05 0.00 0.00 0.00 179.25 178.83 2dl6 h GLU 41 N -0.30 0.00 -1.33 0.00 4.11 -1.87 -3.26 114.58 111.93 2dl6 h GLU 41 Ca 0.15 0.00 0.41 0.00 0.07 0.00 0.00 59.36 59.99 2dl6 h GLU 41 Cb 0.57 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.75 2dl6 h GLU 41 CO -0.58 0.64 0.93 -0.11 0.07 0.00 0.00 179.01 179.96 2dl6 n LEU 42 N -3.61 0.06 0.21 3.06 7.94 0.29 0.13 117.00 125.07 2dl6 n LEU 42 Ca -0.01 0.85 -0.14 0.00 -1.11 0.00 0.00 56.01 55.61 2dl6 n LEU 42 Cb 0.67 -0.42 -0.08 0.00 0.53 0.00 0.00 43.42 44.12 2dl6 n LEU 42 CO 0.42 -0.88 0.50 -0.08 -1.11 0.00 0.00 177.39 176.24 2dl6 h GLU 43 N 0.00 -0.53 0.00 1.96 4.81 -1.61 0.28 114.58 119.49 2dl6 h GLU 43 Ca 0.69 0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.92 2dl6 h GLU 43 Cb 2.59 0.12 -0.01 0.00 0.63 0.00 0.00 28.75 32.08 2dl6 h GLU 43 CO -0.13 -0.22 -0.18 0.00 -0.73 0.00 0.00 179.01 177.75 2dl6 h MET 44 N -0.88 0.00 0.00 1.92 -0.00 0.75 -3.12 114.93 113.61 2dl6 h MET 44 Ca -0.06 0.00 -0.01 0.00 -0.00 0.00 0.00 59.70 59.63 2dl6 h MET 44 Cb 0.55 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.16 2dl6 h MET 44 CO 0.09 0.18 -0.04 2.35 -0.00 0.00 0.00 176.91 179.49 2dl6 h TRP 45 N 0.00 0.03 0.00 -0.10 7.01 -0.35 -3.23 115.95 119.31 2dl6 h TRP 45 Ca -0.00 -0.02 0.00 0.00 2.11 0.00 0.00 58.89 60.98 2dl6 h TRP 45 Cb 0.76 -0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.81 2dl6 h TRP 45 CO 0.00 0.93 0.01 1.28 -2.79 0.00 0.00 178.44 177.87 2dl6 n LEU 46 N -4.63 0.54 0.29 0.65 4.77 0.97 0.58 117.00 120.18 2dl6 n LEU 46 Ca -0.10 0.75 -0.15 0.00 -0.03 0.00 0.00 56.01 56.48 2dl6 n LEU 46 Cb 0.46 -0.82 -0.08 0.00 -2.33 0.00 0.00 43.42 40.65 2dl6 n LEU 46 CO 0.35 -0.94 0.51 1.56 -1.33 0.00 0.00 177.39 177.54 2dl6 h GLN 47 N 0.00 -0.72 -0.01 3.23 4.20 -1.56 -2.77 115.11 117.48 2dl6 h GLN 47 Ca 0.00 0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.76 2dl6 h GLN 47 Cb 0.03 0.16 0.00 0.00 0.30 0.00 0.00 27.48 27.97 2dl6 h GLN 47 CO 0.00 -0.42 -0.25 0.41 -0.67 0.00 0.00 178.83 177.91 2dl6 n GLY 48 N -0.74 0.05 0.74 3.46 0.00 -1.01 -4.39 105.19 103.30 2dl6 n GLY 48 Ca -0.11 -0.48 0.03 0.00 0.00 0.00 0.00 46.02 45.46 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 0.17 0.30 0.98 1.61 8.25 0.20 -4.73 115.22 122.00 2dl6 n HIS 49 Ca 0.08 -1.51 0.06 0.00 -0.26 0.00 0.00 57.72 56.08 2dl6 n HIS 49 Cb 0.37 -0.31 0.33 0.00 1.12 0.00 0.00 29.99 31.49 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 -1.13 0.49 0.00 -0.41 -0.04 -1.04 -3.14 135.00 129.73 2dl6 n PRO 50 Ca 0.23 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.75 2dl6 n PRO 50 Cb 0.78 -1.35 0.35 0.00 -0.04 0.00 0.00 33.50 33.24 2dl6 n PRO 50 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2dl6 n GLU 51 N -0.85 0.23 -3.67 0.54 -0.58 -1.26 -4.72 120.64 110.32 2dl6 n GLU 51 Ca 0.08 0.13 -0.24 0.00 -0.42 0.00 0.00 57.16 56.71 2dl6 n GLU 51 Cb 0.04 -1.50 0.01 0.00 -0.57 0.00 0.00 31.44 29.42 2dl6 n GLU 51 CO 0.00 0.00 0.00 -0.06 -0.48 0.00 0.00 177.13 176.59 2dl6 s PHE 52 N -2.46 1.64 -0.17 -0.32 0.40 -1.19 -3.35 117.98 112.53 2dl6 s PHE 52 Ca 0.14 -0.79 -0.08 0.00 -0.60 0.00 0.00 56.93 55.60 2dl6 s PHE 52 Cb 0.09 -2.00 0.07 0.00 0.51 0.00 0.00 43.02 41.69 2dl6 s PHE 52 CO 0.19 -0.61 0.39 0.00 0.70 0.00 0.00 175.22 175.90 2dl6 s ALA 53 N -2.73 -1.02 0.17 5.36 0.00 -1.19 -4.90 121.76 117.45 2dl6 s ALA 53 Ca 0.41 1.45 -0.34 0.00 0.00 0.00 0.00 51.96 53.48 2dl6 s ALA 53 Cb -0.03 -1.03 -0.14 0.00 0.00 0.00 0.00 23.12 21.91 2dl6 s ALA 53 CO 0.26 -0.43 1.51 0.28 0.00 0.00 0.00 175.76 177.38 2dl6 n VAL 54 N 4.67 0.18 -1.68 0.00 0.31 -1.26 -0.31 118.33 120.24 2dl6 n VAL 54 Ca -0.18 -0.05 -0.45 0.00 -0.01 0.00 0.00 64.34 63.66 2dl6 n VAL 54 Cb 0.53 -1.43 -0.04 0.00 -0.91 0.00 0.00 33.84 31.99 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 3.06 3.48 0.04 4.52 2.03 -1.23 -4.81 116.55 123.66 2dl6 n ASP 55 Ca 0.16 1.05 -0.05 0.00 0.52 0.00 0.00 54.79 56.47 2dl6 n ASP 55 Cb 0.28 -1.47 0.15 0.00 -0.72 0.00 0.00 41.12 39.35 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 6.91 0.40 -0.63 -0.67 0.13 -1.96 -3.13 132.00 133.05 2dl6 h PRO 56 Ca -0.45 -0.21 -0.07 0.00 -0.87 0.00 0.00 66.00 64.40 2dl6 h PRO 56 Cb 1.24 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.35 2dl6 h PRO 56 CO 0.92 0.77 0.13 0.00 -0.23 0.00 0.00 178.00 179.59 2dl6 h ARG 57 N 0.33 1.03 0.00 0.86 2.47 -2.01 -2.47 114.38 114.58 2dl6 h ARG 57 Ca 0.02 -0.26 -0.02 0.00 -1.26 0.00 0.00 59.98 58.46 2dl6 h ARG 57 Cb 0.91 -0.13 -0.00 0.00 -1.65 0.00 0.00 29.97 29.10 2dl6 h ARG 57 CO 0.08 0.94 -0.11 0.35 0.56 0.00 0.00 179.97 181.80 2dl6 h PHE 58 N 0.94 0.00 0.12 3.04 3.57 -1.94 -3.14 116.94 119.53 2dl6 h PHE 58 Ca 0.19 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.69 2dl6 h PHE 58 Cb 0.40 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.14 2dl6 h PHE 58 CO 0.03 0.11 -0.06 -0.07 -2.23 0.00 0.00 178.31 176.09 2dl6 h LEU 59 N 0.00 -0.14 -1.09 0.59 3.38 -1.42 -3.22 115.31 113.41 2dl6 h LEU 59 Ca -0.00 0.00 0.36 0.00 0.09 0.00 0.00 57.88 58.33 2dl6 h LEU 59 Cb 0.19 0.04 -0.09 0.00 0.09 0.00 0.00 40.66 40.89 2dl6 h LEU 59 CO 0.01 -0.03 0.73 0.00 0.09 0.00 0.00 178.44 179.24 2dl6 n ALA 60 N -2.18 1.07 0.08 1.53 0.00 -1.05 0.18 120.51 120.13 2dl6 n ALA 60 Ca -0.02 0.57 -0.13 0.00 0.00 0.00 0.00 53.44 53.87 2dl6 n ALA 60 Cb 0.06 -0.76 -0.07 0.00 0.00 0.00 0.00 19.45 18.68 2dl6 n ALA 60 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 2dl6 h TYR 61 N 0.00 -0.12 0.23 0.00 5.03 -1.56 -2.54 116.97 118.02 2dl6 h TYR 61 Ca 0.63 -0.00 -0.33 0.00 2.58 0.00 0.00 58.73 61.61 2dl6 h TYR 61 Cb 2.18 0.04 0.03 0.00 1.55 0.00 0.00 36.73 40.54 2dl6 h TYR 61 CO -0.00 -0.07 -1.47 0.00 -1.32 0.00 0.00 178.16 175.30 2dl6 h MET 62 N -0.12 0.50 -1.07 1.82 -0.00 0.18 -3.30 114.93 112.94 2dl6 h MET 62 Ca -0.01 -0.85 0.29 0.00 -0.00 0.00 0.00 59.70 59.14 2dl6 h MET 62 Cb 0.10 0.32 -0.10 0.00 -0.00 0.00 0.00 31.60 31.91 2dl6 h MET 62 CO 0.01 1.41 0.68 1.49 -0.00 0.00 0.00 176.91 180.49 2dl6 h GLU 63 N 0.14 0.35 -0.21 -0.10 4.57 -0.72 0.15 114.58 118.76 2dl6 h GLU 63 Ca -0.24 -0.02 -0.04 0.00 -1.18 0.00 0.00 59.36 57.87 2dl6 h GLU 63 Cb 2.14 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 30.65 2dl6 h GLU 63 CO 0.26 0.23 -0.02 0.22 -1.18 0.00 0.00 179.01 178.52 2dl6 h ASP 64 N 0.36 0.39 -0.40 1.04 3.58 -1.53 -2.63 116.42 117.24 2dl6 h ASP 64 Ca 0.64 -0.33 0.04 0.00 0.42 0.00 0.00 57.03 57.79 2dl6 h ASP 64 Cb 1.64 -0.10 -0.05 0.00 1.72 0.00 0.00 39.33 42.54 2dl6 h ASP 64 CO -0.35 0.63 -0.24 0.54 -2.88 0.00 0.00 179.24 176.95 2dl6 n ARG 65 N -4.65 -0.18 0.02 0.28 1.74 0.52 -0.86 116.66 113.53 2dl6 n ARG 65 Ca -0.04 1.05 -0.12 0.00 -0.77 0.00 0.00 57.85 57.97 2dl6 n ARG 65 Cb 0.25 -1.55 -0.07 0.00 -1.02 0.00 0.00 32.46 30.08 2dl6 n ARG 65 CO 0.00 0.00 0.00 0.07 -1.52 0.00 0.00 177.63 176.18 2dl6 h ARG 66 N 0.00 0.06 -0.91 5.56 0.11 -1.62 -2.86 114.38 114.71 2dl6 h ARG 66 Ca 0.06 -0.01 0.27 0.00 0.10 0.00 0.00 59.98 60.41 2dl6 h ARG 66 Cb 0.16 -0.01 -0.17 0.00 1.11 0.00 0.00 29.97 31.06 2dl6 h ARG 66 CO -0.38 0.11 0.08 1.63 0.10 0.00 0.00 179.97 181.51 2dl6 n LYS 67 N -5.02 -0.07 -1.74 0.08 4.76 -0.04 -4.41 118.16 111.71 2dl6 n LYS 67 Ca -0.06 1.35 -0.36 0.00 -2.87 0.00 0.00 58.31 56.37 2dl6 n LYS 67 Cb 0.06 -2.19 0.07 0.00 -1.84 0.00 0.00 35.03 31.13 2dl6 n LYS 67 CO 0.00 0.00 0.00 -1.14 -1.37 0.00 0.00 177.40 174.89 2dl6 s GLN 68 N -5.82 2.56 0.20 1.97 0.74 -0.26 -5.04 119.66 114.01 2dl6 s GLN 68 Ca -0.11 1.94 -0.10 0.00 0.05 0.00 0.00 55.36 57.14 2dl6 s GLN 68 Cb 0.27 -1.86 -0.01 0.00 1.10 0.00 0.00 33.01 32.51 2dl6 s GLN 68 CO 0.71 -1.56 0.35 -1.59 -0.55 0.00 0.00 175.29 172.66 2dl6 s LYS 69 N -3.49 1.32 0.31 1.67 -2.85 -1.26 -5.01 119.74 110.43 2dl6 s LYS 69 Ca 0.79 -1.24 0.10 0.00 -1.00 0.00 0.00 55.97 54.62 2dl6 s LYS 69 Cb -0.34 0.41 -0.06 0.00 -2.06 0.00 0.00 37.83 35.78 2dl6 s LYS 69 CO 0.39 -0.51 -0.13 -1.58 0.10 0.00 0.00 175.35 173.62 2dl6 s TRP 70 N -4.00 2.27 0.07 1.78 0.23 -1.26 -5.11 118.94 112.91 2dl6 s TRP 70 Ca 0.21 -0.47 -0.30 0.00 -2.03 0.00 0.00 56.10 53.51 2dl6 s TRP 70 Cb 0.02 -1.19 -0.06 0.00 0.03 0.00 0.00 33.47 32.28 2dl6 s TRP 70 CO 0.05 0.58 1.16 -1.14 0.96 0.00 0.00 176.95 178.56 2dl6 s GLN 71 N -3.59 4.47 0.65 4.98 -0.44 -1.26 -5.03 119.66 119.44 2dl6 s GLN 71 Ca 0.31 1.72 -0.11 0.00 -2.50 0.00 0.00 55.36 54.78 2dl6 s GLN 71 Cb -0.00 -3.35 -0.01 0.00 -1.64 0.00 0.00 33.01 28.01 2dl6 s GLN 71 CO 0.15 -0.19 1.04 1.03 0.50 0.00 0.00 175.29 177.82 2dl6 s ARG 72 N 0.88 3.18 0.11 1.67 0.52 -1.26 -5.07 118.95 118.98 2dl6 s ARG 72 Ca 0.57 0.53 -0.02 0.00 -0.52 0.00 0.00 55.73 56.28 2dl6 s ARG 72 Cb -0.28 -2.08 -0.05 0.00 0.52 0.00 0.00 34.95 33.06 2dl6 s ARG 72 CO 0.30 -0.80 0.31 0.00 0.02 0.00 0.00 175.30 175.13 2dl6 s LYS 74 N -2.67 0.01 0.32 0.00 -2.85 -1.26 -5.09 119.74 108.20 2dl6 s LYS 74 Ca 0.38 0.05 -0.18 0.00 -1.00 0.00 0.00 55.97 55.22 2dl6 s LYS 74 Cb -0.12 -1.73 0.05 0.00 -2.06 0.00 0.00 37.83 33.97 2dl6 s LYS 74 CO 0.26 -2.92 0.82 -1.59 0.10 0.00 0.00 175.35 172.03 2dl6 s LYS 75 N -5.39 1.96 0.32 1.78 0.00 -1.26 -5.16 119.74 111.99 2dl6 s LYS 75 Ca 0.69 -1.23 -0.23 0.00 0.00 0.00 0.00 55.97 55.20 2dl6 s LYS 75 Cb -0.11 0.57 -0.10 0.00 0.00 0.00 0.00 37.83 38.19 2dl6 s LYS 75 CO 0.55 -0.91 0.89 -0.80 0.00 0.00 0.00 175.35 175.08 2dl6 s ASN 76 N -3.08 7.19 0.07 0.03 0.01 -1.26 -5.00 114.94 112.90 2dl6 s ASN 76 Ca 0.15 1.70 -0.37 0.00 -0.71 0.00 0.00 52.86 53.64 2dl6 s ASN 76 Cb -0.05 -2.53 -0.19 0.00 0.41 0.00 0.00 41.25 38.89 2dl6 s ASN 76 CO 0.09 -0.11 1.57 -1.13 -1.51 0.00 0.00 177.10 176.01 2dl6 h ASN 77 N 2.95 -1.26 -5.10 -1.22 -1.24 -2.07 -3.47 115.58 104.17 2dl6 h ASN 77 Ca -0.47 0.08 0.05 0.00 0.71 0.00 0.00 56.30 56.66 2dl6 h ASN 77 Cb 1.19 0.38 -0.02 0.00 0.73 0.00 0.00 38.32 40.59 2dl6 h ASN 77 CO 0.64 -0.74 0.33 -0.44 -1.29 0.00 0.00 177.43 175.94 2dl6 s SER 78 N -4.20 -0.07 0.00 1.15 0.01 -1.26 -5.14 113.70 104.18 2dl6 s SER 78 Ca -0.19 -0.87 0.00 0.00 1.31 0.00 0.00 55.95 56.20 2dl6 s SER 78 Cb 0.03 0.73 0.00 0.00 0.21 0.00 0.00 66.02 66.99 2dl6 s SER 78 CO 0.60 -1.42 0.00 0.61 0.41 0.00 0.00 173.24 173.44 2dl6 n GLY 79 N -0.54 0.26 3.68 3.44 0.00 -1.26 -5.15 105.19 105.63 2dl6 n GLY 79 Ca -0.06 0.08 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 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 0.12 0.54 0.00 1.61 0.04 -1.26 -5.06 135.00 130.99 2dl6 s PRO 80 Ca 0.00 0.56 0.05 0.00 0.04 0.00 0.00 61.00 61.66 2dl6 s PRO 80 Cb 0.00 -1.75 -0.03 0.00 0.04 0.00 0.00 34.50 32.76 2dl6 s PRO 80 CO 0.00 -2.67 -0.15 -1.54 0.04 0.00 0.00 177.00 172.68 2dl6 s SER 81 N -3.45 4.01 1.27 6.66 1.04 -1.26 -5.13 113.70 116.84 2dl6 s SER 81 Ca 0.65 -0.30 -0.20 0.00 0.48 0.00 0.00 55.95 56.59 2dl6 s SER 81 Cb -0.18 -0.77 0.31 0.00 0.10 0.00 0.00 66.02 65.47 2dl6 s SER 81 CO 0.57 0.29 1.04 -0.44 0.98 0.00 0.00 173.24 175.69 2dl6 s SER 82 N -1.17 0.31 0.00 7.02 0.01 -1.26 -5.34 113.70 113.26 2dl6 s SER 82 Ca 0.14 0.81 0.31 0.00 1.31 0.00 0.00 55.95 58.52 2dl6 s SER 82 Cb -0.11 -1.17 1.63 0.00 0.21 0.00 0.00 66.02 66.59 2dl6 s SER 82 CO 0.04 -4.52 2.07 0.61 0.41 0.00 0.00 173.24 171.85