#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3li6 n GLU 3 N 0.00 -1.26 0.08 0.00 -0.58 -1.26 -4.91 120.64 112.70 3li6 n GLU 3 Ca 0.00 1.01 -0.21 0.00 -0.42 0.00 0.00 57.16 57.54 3li6 n GLU 3 Cb 0.00 -5.32 -0.14 0.00 -0.57 0.00 0.00 31.44 25.40 3li6 n GLU 3 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3li6 h ALA 4 N 0.30 -0.08 -0.40 0.62 0.00 -2.06 -1.45 119.26 116.19 3li6 h ALA 4 Ca -0.37 -0.74 0.00 0.00 0.00 0.00 0.00 54.91 53.80 3li6 h ALA 4 Cb 1.19 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.07 3li6 h ALA 4 CO 0.50 0.50 0.26 1.25 0.00 0.00 0.00 179.25 181.77 3li6 h LEU 5 N -0.11 0.46 -1.01 0.00 5.85 -1.99 -2.11 115.31 116.40 3li6 h LEU 5 Ca -0.17 -0.02 0.11 0.00 0.84 0.00 0.00 57.88 58.64 3li6 h LEU 5 Cb 1.79 -0.12 -0.08 0.00 0.37 0.00 0.00 40.66 42.62 3li6 h LEU 5 CO 0.19 0.34 0.64 0.15 -0.34 0.00 0.00 178.44 179.42 3li6 h PHE 6 N 0.54 1.15 0.00 1.25 3.04 -1.95 0.28 116.94 121.25 3li6 h PHE 6 Ca 0.15 0.03 -0.07 0.00 3.98 0.00 0.00 57.97 62.06 3li6 h PHE 6 Cb -0.06 -0.37 -0.01 0.00 2.56 0.00 0.00 35.95 38.08 3li6 h PHE 6 CO -0.05 0.48 -0.32 0.87 -2.02 0.00 0.00 178.31 177.27 3li6 h LYS 7 N 1.03 0.00 -0.07 1.11 1.57 -1.06 -1.07 116.57 118.08 3li6 h LYS 7 Ca 0.49 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 59.06 3li6 h LYS 7 Cb 0.44 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.76 3li6 h LYS 7 CO -0.25 0.32 -0.75 1.49 -0.57 0.00 0.00 179.45 179.69 3li6 h GLU 8 N 0.00 0.63 -0.07 3.15 4.81 0.20 -3.18 114.58 120.11 3li6 h GLU 8 Ca -0.00 -0.59 -0.17 0.00 -0.13 0.00 0.00 59.36 58.47 3li6 h GLU 8 Cb 0.76 0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.27 3li6 h GLU 8 CO 0.04 1.20 -0.70 0.82 -0.73 0.00 0.00 179.01 179.64 3li6 h ILE 9 N 0.27 1.39 -0.55 2.32 2.04 -1.21 -3.38 117.51 118.38 3li6 h ILE 9 Ca -0.08 -2.13 -0.63 0.00 1.00 0.00 0.00 64.86 63.02 3li6 h ILE 9 Cb 1.41 2.10 -0.06 0.00 -0.74 0.00 0.00 36.82 39.53 3li6 h ILE 9 CO 0.15 0.63 2.25 -0.67 0.00 0.00 0.00 178.15 180.51 3li6 n ASP 10 N -3.83 4.26 -0.08 1.72 2.03 -0.41 -4.74 116.55 115.51 3li6 n ASP 10 Ca -0.04 -2.85 -0.03 0.00 0.52 0.00 0.00 54.79 52.39 3li6 n ASP 10 Cb 0.69 -1.69 0.20 0.00 -0.72 0.00 0.00 41.12 39.59 3li6 n ASP 10 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 3li6 h VAL 11 N 5.24 1.23 -0.00 5.18 2.07 -1.78 -2.43 116.25 125.76 3li6 h VAL 11 Ca 0.44 -0.95 0.00 0.00 0.82 0.00 0.00 66.70 67.00 3li6 h VAL 11 Cb 0.82 0.91 0.00 0.00 -1.52 0.00 0.00 31.29 31.49 3li6 h VAL 11 CO 1.55 0.33 -0.23 -0.46 0.02 0.00 0.00 177.57 178.79 3li6 n ASN 12 N -4.23 0.66 -1.51 0.57 6.94 -1.26 -4.96 115.26 111.47 3li6 n ASN 12 Ca 0.02 -0.57 -0.14 0.00 -0.02 0.00 0.00 54.58 53.87 3li6 n ASN 12 Cb 0.29 0.04 -0.01 0.00 -2.36 0.00 0.00 39.78 37.73 3li6 n ASN 12 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3li6 n GLY 13 N 1.36 0.01 0.45 4.83 0.00 -0.92 -4.90 105.19 106.01 3li6 n GLY 13 Ca 0.12 -0.31 0.09 0.00 0.00 0.00 0.00 46.02 45.91 3li6 n GLY 13 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3li6 n ASP 14 N -0.60 1.33 -0.12 1.61 5.75 -1.26 -4.90 116.55 118.36 3li6 n ASP 14 Ca -0.16 -1.74 -0.02 0.00 -0.01 0.00 0.00 54.79 52.86 3li6 n ASP 14 Cb 0.60 -0.11 -0.01 0.00 -1.03 0.00 0.00 41.12 40.58 3li6 n ASP 14 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3li6 n GLY 15 N 1.02 0.52 2.84 6.12 0.00 -1.26 -5.01 105.19 109.41 3li6 n GLY 15 Ca 0.14 -0.68 -0.14 0.00 0.00 0.00 0.00 46.02 45.34 3li6 n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3li6 s ALA 16 N -2.02 -0.05 -0.32 4.61 0.00 -1.26 -5.12 121.76 117.59 3li6 s ALA 16 Ca 0.00 0.38 -0.17 0.00 0.00 0.00 0.00 51.96 52.16 3li6 s ALA 16 Cb 0.00 -0.27 -0.01 0.00 0.00 0.00 0.00 23.12 22.83 3li6 s ALA 16 CO 0.00 -0.11 0.48 0.08 0.00 0.00 0.00 175.76 176.21 3li6 s VAL 17 N 0.91 5.06 0.63 0.00 1.01 -1.26 -4.87 120.40 121.89 3li6 s VAL 17 Ca -0.07 0.43 -0.03 0.00 0.00 0.00 0.00 61.98 62.31 3li6 s VAL 17 Cb -0.10 -3.89 0.05 0.00 0.00 0.00 0.00 36.38 32.44 3li6 s VAL 17 CO -0.03 -0.10 0.90 -0.94 0.00 0.00 0.00 175.10 174.93 3li6 s SER 18 N 1.70 5.06 0.28 3.32 1.04 -1.26 -4.96 113.70 118.88 3li6 s SER 18 Ca 0.18 0.27 -0.01 0.00 0.48 0.00 0.00 55.95 56.87 3li6 s SER 18 Cb -0.16 -1.05 0.40 0.00 0.10 0.00 0.00 66.02 65.32 3li6 s SER 18 CO 0.12 -1.37 1.85 0.22 0.98 0.00 0.00 173.24 175.04 3li6 h TYR 19 N -0.29 0.89 -0.69 5.02 3.20 -2.00 -2.48 116.97 120.63 3li6 h TYR 19 Ca -0.44 -0.06 -0.01 0.00 3.14 0.00 0.00 58.73 61.36 3li6 h TYR 19 Cb 1.30 -0.27 -0.03 0.00 1.54 0.00 0.00 36.73 39.27 3li6 h TYR 19 CO 0.36 0.71 0.37 1.49 -1.64 0.00 0.00 178.16 179.45 3li6 h GLU 20 N 0.86 0.96 -0.26 1.82 4.81 -1.99 -0.97 114.58 119.81 3li6 h GLU 20 Ca 0.20 -0.11 -0.13 0.00 -0.13 0.00 0.00 59.36 59.18 3li6 h GLU 20 Cb 0.22 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.40 3li6 h GLU 20 CO -0.01 0.73 -0.38 0.93 -0.73 0.00 0.00 179.01 179.55 3li6 h GLU 21 N 0.95 0.60 0.13 1.92 5.08 -1.82 0.48 114.58 121.91 3li6 h GLU 21 Ca 0.24 -0.30 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 3li6 h GLU 21 Cb 0.04 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.30 3li6 h GLU 21 CO -0.04 0.88 -0.06 0.28 -1.00 0.00 0.00 179.01 179.08 3li6 h VAL 22 N 0.50 0.91 -0.41 3.13 2.07 -1.25 0.24 116.25 121.44 3li6 h VAL 22 Ca 0.05 -0.11 0.08 0.00 0.82 0.00 0.00 66.70 67.54 3li6 h VAL 22 Cb 0.88 0.98 -0.08 0.00 -1.52 0.00 0.00 31.29 31.55 3li6 h VAL 22 CO 0.08 0.03 -0.10 0.50 0.02 0.00 0.00 177.57 178.10 3li6 h LYS 23 N -0.22 0.00 -0.01 1.57 3.64 -0.72 -0.51 116.57 120.33 3li6 h LYS 23 Ca -0.02 -0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.29 3li6 h LYS 23 Cb 0.17 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.98 3li6 h LYS 23 CO 0.03 0.00 -0.35 0.00 -2.27 0.00 0.00 179.45 176.86 3li6 h ALA 24 N 1.41 1.40 -0.02 5.00 0.00 -0.70 -2.61 119.26 123.74 3li6 h ALA 24 Ca 0.20 -0.32 -0.25 0.00 0.00 0.00 0.00 54.91 54.53 3li6 h ALA 24 Cb 0.30 -0.06 0.02 0.00 0.00 0.00 0.00 17.79 18.04 3li6 h ALA 24 CO -0.42 0.45 -0.98 0.35 0.00 0.00 0.00 179.25 178.65 3li6 h PHE 25 N 0.02 0.96 -0.08 0.00 3.04 0.14 -2.61 116.94 118.40 3li6 h PHE 25 Ca -0.00 -0.51 -0.07 0.00 3.98 0.00 0.00 57.97 61.37 3li6 h PHE 25 Cb 0.62 -0.12 -0.01 0.00 2.56 0.00 0.00 35.95 39.01 3li6 h PHE 25 CO 0.00 1.34 -0.27 0.28 -2.02 0.00 0.00 178.31 177.64 3li6 h VAL 26 N 0.38 1.23 -0.13 1.41 2.07 -0.77 -0.25 116.25 120.19 3li6 h VAL 26 Ca -0.11 -1.09 -0.15 0.00 0.82 0.00 0.00 66.70 66.17 3li6 h VAL 26 Cb 1.63 1.48 0.01 0.00 -1.52 0.00 0.00 31.29 32.88 3li6 h VAL 26 CO 0.19 0.32 -0.52 0.28 0.02 0.00 0.00 177.57 177.86 3li6 h SER 27 N 0.13 0.68 -0.91 0.57 0.02 -1.50 -1.82 113.55 110.73 3li6 h SER 27 Ca 0.02 -0.62 0.07 0.00 -0.84 0.00 0.00 61.79 60.42 3li6 h SER 27 Cb 0.56 -0.20 -0.07 0.00 0.14 0.00 0.00 62.40 62.83 3li6 h SER 27 CO 0.04 1.19 0.57 0.50 -1.14 0.00 0.00 176.83 177.99 3li6 h LYS 28 N 0.21 0.97 0.40 3.45 3.64 -1.11 -0.98 116.57 123.16 3li6 h LYS 28 Ca -0.03 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.27 3li6 h LYS 28 Cb 1.16 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.76 3li6 h LYS 28 CO 0.11 0.64 -0.19 0.87 -2.27 0.00 0.00 179.45 178.61 3li6 h LYS 29 N 1.00 -0.52 -0.41 1.90 1.57 -1.00 -1.83 116.57 117.29 3li6 h LYS 29 Ca 0.41 0.04 0.09 0.00 -1.87 0.00 0.00 60.65 59.31 3li6 h LYS 29 Cb 0.23 0.12 -0.09 0.00 0.08 0.00 0.00 32.23 32.57 3li6 h LYS 29 CO -0.19 -0.30 -0.24 0.00 -0.57 0.00 0.00 179.45 178.14 3li6 h ARG 30 N -0.60 -0.16 -0.56 3.15 3.08 -0.67 -1.26 114.38 117.36 3li6 h ARG 30 Ca -0.05 0.01 -0.06 0.00 0.07 0.00 0.00 59.98 59.94 3li6 h ARG 30 Cb 0.45 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.51 3li6 h ARG 30 CO 0.09 -0.11 0.09 0.00 -1.07 0.00 0.00 179.97 178.98 3li6 h ALA 31 N 1.04 1.11 -0.66 0.04 0.00 -1.17 -0.49 119.26 119.14 3li6 h ALA 31 Ca 0.20 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 3li6 h ALA 31 Cb 0.47 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 3li6 h ALA 31 CO -0.51 0.58 0.10 0.82 0.00 0.00 0.00 179.25 180.24 3li6 h ILE 32 N 0.84 1.26 -0.02 0.00 2.04 -0.73 0.13 117.51 121.04 3li6 h ILE 32 Ca 0.18 -1.05 -0.14 0.00 1.00 0.00 0.00 64.86 64.85 3li6 h ILE 32 Cb 0.37 0.65 -0.02 0.00 -0.74 0.00 0.00 36.82 37.08 3li6 h ILE 32 CO 0.01 0.39 -0.61 0.50 0.00 0.00 0.00 178.15 178.44 3li6 h LYS 33 N 1.03 0.09 -0.30 2.37 3.11 -0.79 -1.79 116.57 120.29 3li6 h LYS 33 Ca 0.20 -0.06 -0.17 0.00 -2.81 0.00 0.00 60.65 57.81 3li6 h LYS 33 Cb 0.45 0.01 -0.00 0.00 -1.00 0.00 0.00 32.23 31.69 3li6 h LYS 33 CO 0.01 0.68 -0.47 -0.97 -2.81 0.00 0.00 179.45 175.89 3li6 h ASN 34 N 0.07 0.88 0.07 4.20 -1.24 -0.83 -1.97 115.58 116.76 3li6 h ASN 34 Ca -0.01 -0.44 -0.01 0.00 0.71 0.00 0.00 56.30 56.55 3li6 h ASN 34 Cb 1.10 -0.25 -0.00 0.00 0.73 0.00 0.00 38.32 39.90 3li6 h ASN 34 CO 0.09 1.21 -0.06 -0.33 -1.29 0.00 0.00 177.43 177.05 3li6 h GLU 35 N 0.64 0.00 0.13 6.67 4.39 -0.41 -2.11 114.58 123.89 3li6 h GLU 35 Ca 0.03 0.00 -0.36 0.00 0.34 0.00 0.00 59.36 59.38 3li6 h GLU 35 Cb 1.05 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.69 3li6 h GLU 35 CO 0.10 0.06 -1.94 1.96 -1.16 0.00 0.00 179.01 178.03 3li6 h GLN 36 N 0.00 0.27 0.30 2.33 4.20 -1.14 -2.39 115.11 118.68 3li6 h GLN 36 Ca -0.00 -0.46 -0.01 0.00 0.06 0.00 0.00 58.65 58.25 3li6 h GLN 36 Cb 0.11 0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.05 3li6 h GLN 36 CO 0.01 1.22 -0.21 1.25 -0.67 0.00 0.00 178.83 180.43 3li6 h LEU 37 N 0.02 -0.53 -1.37 1.46 5.85 -1.38 -1.82 115.31 117.55 3li6 h LEU 37 Ca -0.41 0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.35 3li6 h LEU 37 Cb 2.01 0.16 -0.03 0.00 0.37 0.00 0.00 40.66 43.17 3li6 h LEU 37 CO 0.08 -0.32 0.43 0.25 -0.34 0.00 0.00 178.44 178.54 3li6 h LEU 38 N -0.50 0.74 -0.66 2.25 6.46 -1.52 -1.91 115.31 120.17 3li6 h LEU 38 Ca -0.03 -0.02 -0.14 0.00 -0.12 0.00 0.00 57.88 57.58 3li6 h LEU 38 Cb 0.43 -0.19 -0.02 0.00 -0.73 0.00 0.00 40.66 40.15 3li6 h LEU 38 CO 0.01 0.54 -0.64 -0.61 -0.62 0.00 0.00 178.44 177.12 3li6 h GLN 39 N 0.88 0.00 -0.06 1.25 5.75 -1.29 -2.00 115.11 119.64 3li6 h GLN 39 Ca 0.24 0.00 -0.22 0.00 -0.15 0.00 0.00 58.65 58.51 3li6 h GLN 39 Cb -0.10 0.00 0.02 0.00 1.07 0.00 0.00 27.48 28.47 3li6 h GLN 39 CO -0.05 0.64 -0.84 1.25 -2.65 0.00 0.00 178.83 177.19 3li6 h LEU 40 N 0.00 0.83 -0.60 -2.39 5.85 -0.59 -0.46 115.31 117.94 3li6 h LEU 40 Ca -0.01 -0.70 -0.01 0.00 0.84 0.00 0.00 57.88 58.00 3li6 h LEU 40 Cb 1.17 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.92 3li6 h LEU 40 CO 0.08 1.41 0.32 0.40 -0.34 0.00 0.00 178.44 180.32 3li6 h ILE 41 N 0.33 1.20 -0.46 4.05 2.04 -1.36 -1.38 117.51 121.93 3li6 h ILE 41 Ca -0.09 -0.52 -0.01 0.00 1.00 0.00 0.00 64.86 65.24 3li6 h ILE 41 Cb 1.49 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 37.99 3li6 h ILE 41 CO 0.17 0.22 0.26 0.15 0.00 0.00 0.00 178.15 178.94 3li6 h PHE 42 N 0.82 0.62 0.00 1.37 3.57 -1.31 -0.63 116.94 121.39 3li6 h PHE 42 Ca 0.21 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.70 3li6 h PHE 42 Cb 0.06 -0.20 -0.00 0.00 2.79 0.00 0.00 35.95 38.60 3li6 h PHE 42 CO -0.01 0.46 -0.01 -0.22 -2.23 0.00 0.00 178.31 176.30 3li6 h LYS 43 N 0.60 0.00 0.18 1.11 3.64 -0.77 0.15 116.57 121.49 3li6 h LYS 43 Ca 0.16 0.00 -0.34 0.00 -1.27 0.00 0.00 60.65 59.20 3li6 h LYS 43 Cb 0.04 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 31.87 3li6 h LYS 43 CO -0.03 0.01 -1.68 1.03 -2.27 0.00 0.00 179.45 176.52 3li6 h SER 44 N 0.00 0.60 -0.09 4.20 0.87 -0.25 -3.30 113.55 115.59 3li6 h SER 44 Ca -0.00 -0.85 -0.18 0.00 -1.23 0.00 0.00 61.79 59.53 3li6 h SER 44 Cb 0.03 -0.20 -0.00 0.00 -0.44 0.00 0.00 62.40 61.79 3li6 h SER 44 CO 0.00 1.71 -0.60 0.40 -0.53 0.00 0.00 176.83 177.81 3li6 h ILE 45 N 0.11 1.30 0.00 2.23 2.04 -0.76 -3.35 117.51 119.07 3li6 h ILE 45 Ca -0.31 -1.83 -0.35 0.00 1.00 0.00 0.00 64.86 63.36 3li6 h ILE 45 Cb 2.09 1.78 0.02 0.00 -0.74 0.00 0.00 36.82 39.97 3li6 h ILE 45 CO 0.19 0.58 2.43 -0.67 0.00 0.00 0.00 178.15 180.67 3li6 n ASP 46 N -3.96 4.28 -0.36 1.72 2.03 0.50 -4.76 116.55 116.00 3li6 n ASP 46 Ca -0.04 -2.31 -0.10 0.00 0.52 0.00 0.00 54.79 52.86 3li6 n ASP 46 Cb 0.64 -1.03 -0.09 0.00 -0.72 0.00 0.00 41.12 39.92 3li6 n ASP 46 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3li6 h ALA 47 N 6.59 -0.48 0.00 -1.67 0.00 -1.79 0.39 119.26 122.29 3li6 h ALA 47 Ca 0.44 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.45 3li6 h ALA 47 Cb 0.17 1.33 0.00 0.00 0.00 0.00 0.00 17.79 19.29 3li6 h ALA 47 CO 1.43 -0.85 0.00 -0.40 0.00 0.00 0.00 179.25 179.43 3li6 n ASP 48 N -4.96 0.00 -1.35 0.00 5.68 -1.26 -4.86 116.55 109.80 3li6 n ASP 48 Ca 0.02 -0.80 -0.16 0.00 -0.50 0.00 0.00 54.79 53.34 3li6 n ASP 48 Cb 0.23 0.00 -0.07 0.00 -1.14 0.00 0.00 41.12 40.14 3li6 n ASP 48 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3li6 n GLY 49 N 0.24 1.56 0.46 6.12 0.00 0.14 -4.84 105.19 108.86 3li6 n GLY 49 Ca 0.11 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.16 3li6 n GLY 49 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3li6 n ASN 50 N -1.06 1.27 0.00 1.61 6.94 -1.26 -4.90 115.26 117.86 3li6 n ASN 50 Ca -0.16 -2.05 0.00 0.00 -0.02 0.00 0.00 54.58 52.34 3li6 n ASN 50 Cb 0.59 -0.22 0.00 0.00 -2.36 0.00 0.00 39.78 37.79 3li6 n ASN 50 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3li6 n GLY 51 N 0.66 0.97 3.10 4.83 0.00 -1.26 -5.02 105.19 108.47 3li6 n GLY 51 Ca 0.06 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.99 3li6 n GLY 51 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3li6 s GLU 52 N -0.54 0.55 -0.34 1.61 4.04 -1.26 -5.13 118.70 117.62 3li6 s GLU 52 Ca 0.00 -0.66 -0.12 0.00 0.04 0.00 0.00 54.97 54.23 3li6 s GLU 52 Cb 0.00 0.22 -0.00 0.00 0.02 0.00 0.00 34.13 34.36 3li6 s GLU 52 CO 0.00 -0.13 0.21 0.42 -1.84 0.00 0.00 175.26 173.92 3li6 s ILE 53 N -2.25 4.96 0.83 1.83 1.01 -1.26 -4.90 121.20 121.42 3li6 s ILE 53 Ca -0.08 -0.42 -0.06 0.00 0.00 0.00 0.00 60.65 60.08 3li6 s ILE 53 Cb -0.03 -3.59 0.17 0.00 0.01 0.00 0.00 42.46 39.02 3li6 s ILE 53 CO -0.03 -0.05 1.14 1.51 0.00 0.00 0.00 174.94 177.51 3li6 s ASP 54 N 1.66 3.72 0.32 3.58 1.47 -1.26 -4.84 116.67 121.32 3li6 s ASP 54 Ca 0.05 -0.25 0.11 0.00 1.18 0.00 0.00 52.55 53.64 3li6 s ASP 54 Cb -0.18 0.08 0.55 0.00 -0.34 0.00 0.00 42.92 43.03 3li6 s ASP 54 CO 0.08 -2.31 1.73 1.56 0.68 0.00 0.00 175.17 176.92 3li6 h GLN 55 N -1.01 0.05 -0.23 2.11 4.20 -1.98 -0.82 115.11 117.43 3li6 h GLN 55 Ca -0.38 -0.02 -0.07 0.00 0.06 0.00 0.00 58.65 58.23 3li6 h GLN 55 Cb 1.24 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.02 3li6 h GLN 55 CO 0.36 0.50 -0.15 -0.91 -0.67 0.00 0.00 178.83 177.96 3li6 h ASN 56 N 0.04 0.52 -0.53 1.46 2.35 -1.98 0.37 115.58 117.81 3li6 h ASN 56 Ca -0.00 -0.44 0.00 0.00 -0.55 0.00 0.00 56.30 55.31 3li6 h ASN 56 Cb 0.83 -0.15 -0.03 0.00 0.05 0.00 0.00 38.32 39.03 3li6 h ASN 56 CO 0.06 0.85 0.33 -0.33 -1.65 0.00 0.00 177.43 176.69 3li6 h GLU 57 N 0.20 0.71 -0.25 0.81 5.08 -1.86 -0.72 114.58 118.56 3li6 h GLU 57 Ca 0.05 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 3li6 h GLU 57 Cb 0.67 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 3li6 h GLU 57 CO 0.04 0.50 0.11 0.35 -1.00 0.00 0.00 179.01 179.01 3li6 h PHE 58 N 0.72 0.36 0.01 4.33 3.57 -1.10 -2.40 116.94 122.42 3li6 h PHE 58 Ca 0.19 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.67 3li6 h PHE 58 Cb -0.04 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 38.59 3li6 h PHE 58 CO -0.03 0.36 -0.01 0.00 -2.23 0.00 0.00 178.31 176.40 3li6 h ALA 59 N 0.97 -0.02 -0.49 2.41 0.00 -0.73 0.64 119.26 122.05 3li6 h ALA 59 Ca 0.08 -0.00 0.10 0.00 0.00 0.00 0.00 54.91 55.09 3li6 h ALA 59 Cb 0.14 0.01 -0.10 0.00 0.00 0.00 0.00 17.79 17.84 3li6 h ALA 59 CO -0.01 -0.51 -0.23 0.87 0.00 0.00 0.00 179.25 179.37 3li6 h LYS 60 N -0.02 -0.12 0.07 0.00 1.57 -1.13 -2.47 116.57 114.48 3li6 h LYS 60 Ca 0.00 0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3li6 h LYS 60 Cb 0.02 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.36 3li6 h LYS 60 CO -0.00 -0.08 -0.03 0.35 -0.57 0.00 0.00 179.45 179.12 3li6 h PHE 61 N -0.12 -0.08 0.00 -1.35 3.57 -0.86 -3.05 116.94 115.05 3li6 h PHE 61 Ca 0.23 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.72 3li6 h PHE 61 Cb 0.48 0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.24 3li6 h PHE 61 CO -0.50 -0.04 0.00 0.98 -2.23 0.00 0.00 178.31 176.52 3li6 n TYR 62 N -5.12 0.78 -3.25 0.41 9.36 0.16 -2.63 117.16 116.86 3li6 n TYR 62 Ca -0.08 0.37 -0.46 0.00 3.32 0.00 0.00 57.90 61.06 3li6 n TYR 62 Cb 0.07 -1.10 -0.05 0.00 -0.63 0.00 0.00 39.34 37.63 3li6 n TYR 62 CO 0.00 0.00 0.00 0.20 0.22 0.00 0.00 176.86 177.28 3li6 s GLY 63 N -3.56 2.06 0.00 2.98 0.00 -1.12 -4.20 107.32 103.49 3li6 s GLY 63 Ca -0.01 -2.54 0.00 0.00 0.00 0.00 0.00 44.72 42.17 3li6 s GLY 63 CO 0.26 1.32 0.00 1.44 0.00 0.00 0.00 173.10 176.12 3li6 n SER 64 N 5.42 1.41 0.00 1.64 7.64 -1.08 -4.92 113.62 123.73 3li6 n SER 64 Ca -0.09 -0.37 0.00 0.00 1.01 0.00 0.00 58.87 59.42 3li6 n SER 64 Cb 0.41 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.61 3li6 n SER 64 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03