#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2da1 s SER 2 N 0.00 6.63 -0.46 1.61 0.15 -1.26 -5.01 113.70 115.36 2da1 s SER 2 Ca 0.00 0.58 0.04 0.00 0.70 0.00 0.00 55.95 57.26 2da1 s SER 2 Cb 0.00 -2.40 0.12 0.00 -1.71 0.00 0.00 66.02 62.03 2da1 s SER 2 CO 0.00 -0.64 0.19 -0.44 1.20 0.00 0.00 173.24 173.55 2da1 s SER 3 N 1.68 4.49 -0.55 5.45 0.01 -1.26 -5.03 113.70 118.49 2da1 s SER 3 Ca 0.32 -2.73 0.04 0.00 1.31 0.00 0.00 55.95 54.89 2da1 s SER 3 Cb -0.14 -1.64 0.14 0.00 0.21 0.00 0.00 66.02 64.59 2da1 s SER 3 CO 0.14 -0.28 0.31 -0.83 0.41 0.00 0.00 173.24 172.98 2da1 s GLY 4 N 0.13 2.41 -0.09 3.44 0.00 -1.26 -5.06 107.32 106.88 2da1 s GLY 4 Ca 0.15 -3.28 -0.23 0.00 0.00 0.00 0.00 44.72 41.36 2da1 s GLY 4 CO -0.03 1.13 0.54 -0.56 0.00 0.00 0.00 173.10 174.19 2da1 s SER 5 N -0.44 -0.51 -0.57 1.64 0.01 -1.26 -5.11 113.70 107.47 2da1 s SER 5 Ca 0.19 0.67 -0.27 0.00 1.31 0.00 0.00 55.95 57.85 2da1 s SER 5 Cb -0.20 0.66 -0.01 0.00 0.21 0.00 0.00 66.02 66.68 2da1 s SER 5 CO -0.04 -0.44 1.76 -0.44 0.41 0.00 0.00 173.24 174.49 2da1 s SER 6 N -0.77 5.53 0.00 2.44 0.01 -1.26 -4.12 113.70 115.53 2da1 s SER 6 Ca -0.08 0.44 0.00 0.00 1.31 0.00 0.00 55.95 57.62 2da1 s SER 6 Cb -0.03 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.67 2da1 s SER 6 CO 0.06 -2.15 0.00 0.61 0.41 0.00 0.00 173.24 172.16 2da1 n GLY 7 N 5.58 0.02 3.25 3.44 0.00 -1.26 -5.15 105.19 111.06 2da1 n GLY 7 Ca 0.19 -0.04 -0.19 0.00 0.00 0.00 0.00 46.02 45.98 2da1 n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2da1 s LYS 8 N -1.26 1.03 0.02 1.61 1.02 -1.26 -5.16 119.74 115.75 2da1 s LYS 8 Ca 0.00 -1.22 0.00 0.00 0.02 0.00 0.00 55.97 54.78 2da1 s LYS 8 Cb 0.00 -0.98 -0.02 0.00 -0.52 0.00 0.00 37.83 36.31 2da1 s LYS 8 CO 0.00 0.20 -0.04 -0.98 -0.92 0.00 0.00 175.35 173.61 2da1 s ARG 9 N -2.51 0.32 1.13 1.68 3.03 -1.26 -4.98 118.95 116.36 2da1 s ARG 9 Ca 0.08 -0.57 -0.17 0.00 2.03 0.00 0.00 55.73 57.11 2da1 s ARG 9 Cb -0.06 0.03 0.25 0.00 -1.03 0.00 0.00 34.95 34.14 2da1 s ARG 9 CO 0.03 -0.03 1.10 -1.25 -1.13 0.00 0.00 175.30 174.03 2da1 s PRO 10 N -1.31 -0.67 0.48 3.89 0.04 -1.26 -5.08 135.00 131.09 2da1 s PRO 10 Ca -0.13 0.14 0.06 0.00 0.04 0.00 0.00 61.00 61.11 2da1 s PRO 10 Cb -0.09 -1.64 -0.00 0.00 0.04 0.00 0.00 34.50 32.80 2da1 s PRO 10 CO -0.01 -3.38 0.29 0.50 0.04 0.00 0.00 177.00 174.44 2da1 s ARG 11 N -5.24 2.28 -0.49 4.56 3.52 -1.26 -5.01 118.95 117.31 2da1 s ARG 11 Ca 0.69 -1.92 -0.42 0.00 -0.13 0.00 0.00 55.73 53.94 2da1 s ARG 11 Cb -0.13 -2.05 -0.18 0.00 -1.56 0.00 0.00 34.95 31.02 2da1 s ARG 11 CO 0.57 -0.37 2.17 0.25 -0.81 0.00 0.00 175.30 177.10 2da1 n THR 12 N -1.52 0.03 -3.64 4.11 -2.24 -1.26 -4.86 114.28 104.89 2da1 n THR 12 Ca -0.02 -0.04 -0.06 0.00 -2.27 0.00 0.00 64.05 61.66 2da1 n THR 12 Cb 0.64 -0.67 -0.07 0.00 -2.10 0.00 0.00 70.33 68.14 2da1 n THR 12 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2da1 s ARG 13 N 6.13 0.40 0.09 -0.78 3.00 -1.26 -5.17 118.95 121.36 2da1 s ARG 13 Ca 1.19 0.55 0.05 0.00 -1.00 0.00 0.00 55.73 56.52 2da1 s ARG 13 Cb -1.40 0.16 -0.04 0.00 0.00 0.00 0.00 34.95 33.67 2da1 s ARG 13 CO 0.63 -0.06 -0.02 0.42 0.00 0.00 0.00 175.30 176.27 2da1 s ILE 14 N 0.62 3.92 0.69 4.11 1.01 -1.26 -5.13 121.20 125.16 2da1 s ILE 14 Ca -0.01 -1.02 0.02 0.00 0.00 0.00 0.00 60.65 59.64 2da1 s ILE 14 Cb -0.04 -2.86 0.12 0.00 0.01 0.00 0.00 42.46 39.69 2da1 s ILE 14 CO -0.10 0.13 0.95 0.42 0.00 0.00 0.00 174.94 176.33 2da1 s THR 15 N -1.29 2.12 0.12 2.92 -4.23 -1.26 -4.92 115.64 109.10 2da1 s THR 15 Ca 0.25 -0.70 -0.03 0.00 -1.18 0.00 0.00 61.69 60.03 2da1 s THR 15 Cb -0.12 -2.42 -0.20 0.00 1.34 0.00 0.00 72.50 71.11 2da1 s THR 15 CO 0.17 0.00 1.28 0.44 -0.54 0.00 0.00 174.62 175.98 2da1 h ASP 16 N -0.36 0.43 1.25 3.99 5.19 -2.00 -0.31 116.42 124.62 2da1 h ASP 16 Ca -0.34 -0.38 -0.04 0.00 -0.62 0.00 0.00 57.03 55.65 2da1 h ASP 16 Cb 1.27 -0.14 -0.01 0.00 0.18 0.00 0.00 39.33 40.64 2da1 h ASP 16 CO 0.40 1.20 -0.18 0.44 -3.12 0.00 0.00 179.24 177.98 2da1 h ASP 17 N 0.16 0.00 0.23 6.45 5.19 -2.01 -2.39 116.42 124.06 2da1 h ASP 17 Ca -0.08 0.00 -0.34 0.00 -0.62 0.00 0.00 57.03 55.99 2da1 h ASP 17 Cb 1.66 0.00 -0.05 0.00 0.18 0.00 0.00 39.33 41.12 2da1 h ASP 17 CO 0.17 0.18 -2.03 0.00 -3.12 0.00 0.00 179.24 174.44 2da1 n GLN 18 N -3.24 0.68 -0.03 3.56 6.02 -1.20 -4.21 117.38 118.95 2da1 n GLN 18 Ca 0.01 0.20 -0.13 0.00 -0.01 0.00 0.00 57.00 57.08 2da1 n GLN 18 Cb 0.47 -1.68 -0.08 0.00 1.02 0.00 0.00 30.24 29.97 2da1 n GLN 18 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 2da1 h LEU 19 N 0.02 0.18 -0.86 1.08 5.85 -1.05 -3.16 115.31 117.36 2da1 h LEU 19 Ca -0.41 -0.44 0.22 0.00 0.84 0.00 0.00 57.88 58.09 2da1 h LEU 19 Cb 2.06 -0.05 -0.13 0.00 0.37 0.00 0.00 40.66 42.90 2da1 h LEU 19 CO 0.05 0.58 0.27 0.08 -0.34 0.00 0.00 178.44 179.08 2da1 h ARG 20 N -0.23 0.25 -0.86 1.25 0.11 -1.63 0.51 114.38 113.79 2da1 h ARG 20 Ca 0.02 -0.02 0.06 0.00 0.10 0.00 0.00 59.98 60.14 2da1 h ARG 20 Cb 0.52 -0.06 -0.05 0.00 1.11 0.00 0.00 29.97 31.49 2da1 h ARG 20 CO 0.01 0.17 0.56 0.28 0.10 0.00 0.00 179.97 181.09 2da1 h VAL 21 N 0.26 1.07 0.02 0.08 2.07 -1.72 -0.82 116.25 117.22 2da1 h VAL 21 Ca 0.54 -0.34 -0.22 0.00 0.82 0.00 0.00 66.70 67.50 2da1 h VAL 21 Cb 1.06 0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 30.83 2da1 h VAL 21 CO -0.61 0.18 -0.95 -0.07 0.02 0.00 0.00 177.57 176.14 2da1 h LEU 22 N 0.98 0.37 -0.24 2.57 3.38 -0.13 -3.26 115.31 118.97 2da1 h LEU 22 Ca 0.36 -0.31 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 2da1 h LEU 22 Cb 0.18 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 2da1 h LEU 22 CO -0.13 1.13 0.07 0.03 0.09 0.00 0.00 178.44 179.63 2da1 h ARG 23 N 0.14 0.38 -0.96 1.13 2.47 0.04 -1.86 114.38 115.72 2da1 h ARG 23 Ca -0.07 -0.08 0.15 0.00 -1.26 0.00 0.00 59.98 58.72 2da1 h ARG 23 Cb 1.60 -0.05 -0.10 0.00 -1.65 0.00 0.00 29.97 29.77 2da1 h ARG 23 CO 0.15 0.47 0.57 1.96 0.56 0.00 0.00 179.97 183.68 2da1 h GLN 24 N 0.22 0.77 -0.34 0.04 1.08 -1.25 -0.86 115.11 114.77 2da1 h GLN 24 Ca 0.08 -0.05 -0.17 0.00 -1.45 0.00 0.00 58.65 57.06 2da1 h GLN 24 Cb 0.25 -0.17 -0.00 0.00 -0.05 0.00 0.00 27.48 27.50 2da1 h GLN 24 CO -0.00 0.51 -0.44 1.88 -0.95 0.00 0.00 178.83 179.83 2da1 h TYR 25 N 0.80 1.10 -0.41 2.96 -1.99 -1.55 -3.17 116.97 114.71 2da1 h TYR 25 Ca 0.52 -0.36 0.05 0.00 2.00 0.00 0.00 58.73 60.94 2da1 h TYR 25 Cb 0.69 -0.22 -0.08 0.00 2.00 0.00 0.00 36.73 39.12 2da1 h TYR 25 CO -0.03 1.18 -0.55 0.35 -0.00 0.00 0.00 178.16 179.11 2da1 h PHE 26 N 0.70 -1.69 0.13 4.88 3.57 -0.31 0.16 116.94 124.38 2da1 h PHE 26 Ca 0.04 0.08 0.02 0.00 3.53 0.00 0.00 57.97 61.64 2da1 h PHE 26 Cb 1.04 0.79 -0.05 0.00 2.79 0.00 0.00 35.95 40.53 2da1 h PHE 26 CO 0.07 -0.49 -0.44 0.22 -2.23 0.00 0.00 178.31 175.44 2da1 h ASP 27 N -0.40 -1.29 -0.99 0.41 3.58 -1.58 -1.50 116.42 114.65 2da1 h ASP 27 Ca 0.08 0.14 0.25 0.00 0.42 0.00 0.00 57.03 57.92 2da1 h ASP 27 Cb 0.60 0.48 -0.13 0.00 1.72 0.00 0.00 39.33 42.00 2da1 h ASP 27 CO -0.60 -0.50 0.56 0.40 -2.88 0.00 0.00 179.24 176.22 2da1 h ILE 28 N -0.67 0.50 -2.28 2.25 2.04 -1.37 -3.40 117.51 114.56 2da1 h ILE 28 Ca 0.02 -0.18 -0.04 0.00 1.00 0.00 0.00 64.86 65.65 2da1 h ILE 28 Cb 0.70 -0.07 -0.23 0.00 -0.74 0.00 0.00 36.82 36.47 2da1 h ILE 28 CO -0.25 0.10 -0.11 0.54 0.00 0.00 0.00 178.15 178.43 2da1 s ASN 29 N -5.16 -0.74 0.06 1.72 4.22 0.52 -5.07 114.94 110.49 2da1 s ASN 29 Ca -0.11 1.24 -0.13 0.00 -2.14 0.00 0.00 52.86 51.73 2da1 s ASN 29 Cb 0.27 1.13 -0.03 0.00 1.28 0.00 0.00 41.25 43.91 2da1 s ASN 29 CO 0.79 -0.22 1.11 0.59 -2.04 0.00 0.00 177.10 177.33 2da1 n ASN 30 N 4.10 -0.43 -4.31 3.54 5.03 -1.12 -3.93 115.26 118.14 2da1 n ASN 30 Ca -0.20 1.20 -0.30 0.00 0.87 0.00 0.00 54.58 56.15 2da1 n ASN 30 Cb 0.57 -0.34 -0.15 0.00 -1.02 0.00 0.00 39.78 38.85 2da1 n ASN 30 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 2da1 s SER 31 N -4.11 2.99 0.94 6.41 0.15 -1.26 -4.68 113.70 114.13 2da1 s SER 31 Ca -0.05 -0.53 -0.12 0.00 0.70 0.00 0.00 55.95 55.96 2da1 s SER 31 Cb 0.04 -0.29 0.15 0.00 -1.71 0.00 0.00 66.02 64.21 2da1 s SER 31 CO 0.25 0.27 1.09 -2.16 1.20 0.00 0.00 173.24 173.89 2da1 s PRO 32 N -0.97 0.91 0.15 5.44 0.04 -1.26 -5.06 135.00 134.24 2da1 s PRO 32 Ca 0.10 0.70 0.06 0.00 0.04 0.00 0.00 61.00 61.90 2da1 s PRO 32 Cb -0.10 -1.78 -0.04 0.00 0.04 0.00 0.00 34.50 32.63 2da1 s PRO 32 CO 0.01 -2.45 0.06 -1.54 0.04 0.00 0.00 177.00 173.12 2da1 s SER 33 N -3.43 5.18 0.57 6.66 1.04 -1.26 -4.82 113.70 117.63 2da1 s SER 33 Ca 0.64 -0.22 0.38 0.00 0.48 0.00 0.00 55.95 57.24 2da1 s SER 33 Cb -0.18 -1.26 1.32 0.00 0.10 0.00 0.00 66.02 66.00 2da1 s SER 33 CO 0.57 0.10 1.40 -0.62 0.98 0.00 0.00 173.24 175.68 2da1 n GLU 34 N -0.04 0.01 0.13 4.02 1.02 -1.26 0.23 120.64 124.75 2da1 n GLU 34 Ca -0.09 1.03 -0.24 0.00 -0.02 0.00 0.00 57.16 57.84 2da1 n GLU 34 Cb 0.54 -2.47 -0.16 0.00 -0.02 0.00 0.00 31.44 29.34 2da1 n GLU 34 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2da1 h GLU 35 N 0.00 0.49 -0.01 3.49 4.39 -2.00 -3.27 114.58 117.68 2da1 h GLU 35 Ca 0.72 -0.84 -0.01 0.00 0.34 0.00 0.00 59.36 59.56 2da1 h GLU 35 Cb 3.32 0.31 0.00 0.00 -0.10 0.00 0.00 28.75 32.29 2da1 h GLU 35 CO -0.01 1.40 -0.05 1.96 -1.16 0.00 0.00 179.01 181.16 2da1 h GLN 36 N 0.05 0.04 -1.13 2.33 1.08 0.26 -2.70 115.11 115.04 2da1 h GLN 36 Ca -0.25 -0.04 0.33 0.00 -1.45 0.00 0.00 58.65 57.25 2da1 h GLN 36 Cb 2.08 0.01 -0.05 0.00 -0.05 0.00 0.00 27.48 29.47 2da1 h GLN 36 CO 0.25 0.74 0.82 0.82 -0.95 0.00 0.00 178.83 180.50 2da1 h ILE 37 N -0.64 0.43 0.00 2.54 2.04 -0.76 0.11 117.51 121.23 2da1 h ILE 37 Ca -0.00 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.85 2da1 h ILE 37 Cb 0.75 0.43 -0.00 0.00 -0.74 0.00 0.00 36.82 37.25 2da1 h ILE 37 CO 0.01 0.00 -0.03 0.50 0.00 0.00 0.00 178.15 178.63 2da1 h LYS 38 N 0.00 0.00 -0.85 2.37 3.11 -1.60 -2.50 116.57 117.10 2da1 h LYS 38 Ca 0.54 0.00 0.16 0.00 -2.81 0.00 0.00 60.65 58.54 2da1 h LYS 38 Cb 2.17 0.00 -0.06 0.00 -1.00 0.00 0.00 32.23 33.34 2da1 h LYS 38 CO -0.01 0.58 0.56 1.05 -2.81 0.00 0.00 179.45 178.82 2da1 h GLU 39 N -1.00 0.52 -0.06 1.90 4.11 -0.88 -1.45 114.58 117.73 2da1 h GLU 39 Ca -0.01 -0.03 -0.12 0.00 0.07 0.00 0.00 59.36 59.27 2da1 h GLU 39 Cb 0.59 -0.12 0.01 0.00 0.50 0.00 0.00 28.75 29.73 2da1 h GLU 39 CO -0.00 0.34 -0.44 0.52 0.07 0.00 0.00 179.01 179.50 2da1 h MET 40 N 0.53 0.40 -1.15 1.06 2.86 -0.96 -1.83 114.93 115.83 2da1 h MET 40 Ca 0.43 -0.35 0.33 0.00 -2.06 0.00 0.00 59.70 58.05 2da1 h MET 40 Cb 0.88 0.08 -0.05 0.00 0.06 0.00 0.00 31.60 32.57 2da1 h MET 40 CO -0.18 1.00 0.82 0.00 1.06 0.00 0.00 176.91 179.61 2da1 h ALA 41 N 0.40 2.98 0.08 6.32 0.00 -0.79 0.14 119.26 128.39 2da1 h ALA 41 Ca -0.04 -0.02 -0.35 0.00 0.00 0.00 0.00 54.91 54.50 2da1 h ALA 41 Cb 1.11 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.95 2da1 h ALA 41 CO 0.09 -1.33 -1.99 -3.47 0.00 0.00 0.00 179.25 172.55 2da1 n ASP 42 N -4.25 1.69 -0.07 0.00 2.03 -1.07 -0.82 116.55 114.06 2da1 n ASP 42 Ca 0.25 0.22 0.03 0.00 0.52 0.00 0.00 54.79 55.82 2da1 n ASP 42 Cb 1.19 -0.53 0.38 0.00 -0.72 0.00 0.00 41.12 41.44 2da1 n ASP 42 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 2da1 h LYS 43 N 0.04 0.66 0.00 -0.67 1.57 0.07 -3.29 116.57 114.95 2da1 h LYS 43 Ca -0.41 -0.04 -0.31 0.00 -1.87 0.00 0.00 60.65 58.02 2da1 h LYS 43 Cb 2.03 -0.15 -0.05 0.00 0.08 0.00 0.00 32.23 34.14 2da1 h LYS 43 CO 0.07 0.44 -2.09 -1.13 -0.57 0.00 0.00 179.45 176.17 2da1 n SER 44 N -4.46 1.83 0.00 0.86 3.41 0.07 -5.04 113.62 110.29 2da1 n SER 44 Ca 0.05 0.11 0.00 0.00 -0.26 0.00 0.00 58.87 58.78 2da1 n SER 44 Cb 0.07 -0.47 0.00 0.00 -0.26 0.00 0.00 64.21 63.55 2da1 n SER 44 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2da1 n GLY 45 N 2.08 1.37 3.81 5.00 0.00 0.00 -4.98 105.19 112.48 2da1 n GLY 45 Ca -0.37 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.32 2da1 n GLY 45 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2da1 s LEU 46 N 0.00 3.90 1.23 0.99 1.43 -1.04 -4.89 118.68 120.29 2da1 s LEU 46 Ca 0.00 1.81 -0.20 0.00 -1.03 0.00 0.00 54.13 54.71 2da1 s LEU 46 Cb 0.00 -4.54 0.30 0.00 0.03 0.00 0.00 46.19 41.98 2da1 s LEU 46 CO 0.00 -0.57 1.11 -2.16 0.23 0.00 0.00 176.35 174.96 2da1 s PRO 47 N -3.19 -1.42 0.27 1.29 0.04 -1.26 -4.16 135.00 126.57 2da1 s PRO 47 Ca 0.64 -0.14 0.15 0.00 0.04 0.00 0.00 61.00 61.70 2da1 s PRO 47 Cb -0.13 -1.58 0.06 0.00 0.04 0.00 0.00 34.50 32.89 2da1 s PRO 47 CO 0.17 -3.83 1.41 1.96 0.04 0.00 0.00 177.00 176.75 2da1 h GLN 48 N -2.66 0.00 0.02 4.56 4.20 -1.95 -2.92 115.11 116.36 2da1 h GLN 48 Ca -0.44 0.00 -0.24 0.00 0.06 0.00 0.00 58.65 58.03 2da1 h GLN 48 Cb 1.29 0.00 0.01 0.00 0.30 0.00 0.00 27.48 29.08 2da1 h GLN 48 CO 0.31 0.48 -1.01 1.57 -0.67 0.00 0.00 178.83 179.51 2da1 h LYS 49 N 0.00 0.48 -0.01 1.46 2.10 -1.97 -2.33 116.57 116.29 2da1 h LYS 49 Ca -0.01 -0.54 -0.01 0.00 -2.00 0.00 0.00 60.65 58.08 2da1 h LYS 49 Cb 1.39 0.16 0.00 0.00 -0.90 0.00 0.00 32.23 32.88 2da1 h LYS 49 CO 0.06 1.19 -0.03 0.28 -2.00 0.00 0.00 179.45 178.95 2da1 h VAL 50 N 0.26 1.46 0.50 0.07 2.07 -1.94 -2.72 116.25 115.95 2da1 h VAL 50 Ca -0.10 -1.40 -0.02 0.00 0.82 0.00 0.00 66.70 65.99 2da1 h VAL 50 Cb 1.66 2.37 0.00 0.00 -1.52 0.00 0.00 31.29 33.81 2da1 h VAL 50 CO 0.18 0.37 -0.24 0.40 0.02 0.00 0.00 177.57 178.30 2da1 h ILE 51 N -0.52 0.51 -0.58 4.57 2.04 -1.62 -0.89 117.51 121.01 2da1 h ILE 51 Ca -0.00 -0.08 0.12 0.00 1.00 0.00 0.00 64.86 65.89 2da1 h ILE 51 Cb 0.62 0.55 -0.11 0.00 -0.74 0.00 0.00 36.82 37.14 2da1 h ILE 51 CO 0.01 0.02 -0.12 0.11 0.00 0.00 0.00 178.15 178.17 2da1 h LYS 52 N -0.72 0.02 0.62 2.37 1.57 -1.53 -1.51 116.57 117.39 2da1 h LYS 52 Ca -0.07 -0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 2da1 h LYS 52 Cb 0.54 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.84 2da1 h LYS 52 CO 0.11 0.01 -0.32 0.45 -0.57 0.00 0.00 179.45 179.13 2da1 h HIS 53 N 0.02 -0.84 -0.96 -1.35 3.86 -1.36 -2.36 115.15 112.16 2da1 h HIS 53 Ca 0.28 -0.02 0.31 0.00 -1.16 0.00 0.00 60.37 59.78 2da1 h HIS 53 Cb 0.44 0.28 -0.15 0.00 1.06 0.00 0.00 27.41 29.04 2da1 h HIS 53 CO -0.45 -0.51 0.42 2.35 0.86 0.00 0.00 177.93 180.60 2da1 h TRP 54 N -0.87 0.66 -0.53 2.45 7.01 -0.48 0.91 115.95 125.11 2da1 h TRP 54 Ca -0.08 0.04 -0.08 0.00 2.11 0.00 0.00 58.89 60.88 2da1 h TRP 54 Cb 0.68 -0.13 -0.02 0.00 -2.10 0.00 0.00 29.16 27.58 2da1 h TRP 54 CO -0.05 -0.25 -0.00 0.74 -2.79 0.00 0.00 178.44 176.09 2da1 h PHE 55 N 0.22 0.96 0.19 2.65 0.04 -0.95 -0.46 116.94 119.59 2da1 h PHE 55 Ca 0.69 -0.15 -0.01 0.00 2.80 0.00 0.00 57.97 61.30 2da1 h PHE 55 Cb 1.56 -0.26 0.00 0.00 2.20 0.00 0.00 35.95 39.45 2da1 h PHE 55 CO -0.13 0.87 -0.09 -0.09 -0.60 0.00 0.00 178.31 178.27 2da1 h ARG 56 N 0.83 -0.25 -0.40 1.51 2.43 0.12 0.62 114.38 119.24 2da1 h ARG 56 Ca 0.15 0.02 0.06 0.00 -0.81 0.00 0.00 59.98 59.40 2da1 h ARG 56 Cb 0.50 0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 30.05 2da1 h ARG 56 CO 0.02 0.15 0.10 -0.91 -1.51 0.00 0.00 179.97 177.83 2da1 h ASN 57 N -0.87 0.06 0.25 -3.80 4.21 -0.57 0.38 115.58 115.24 2da1 h ASN 57 Ca -0.03 0.06 -0.01 0.00 1.21 0.00 0.00 56.30 57.53 2da1 h ASN 57 Cb 0.51 0.07 0.00 0.00 -1.12 0.00 0.00 38.32 37.78 2da1 h ASN 57 CO 0.04 0.07 -0.12 0.74 -1.29 0.00 0.00 177.43 176.87 2da1 h THR 58 N 0.24 0.80 0.46 2.81 2.02 -1.17 -2.39 112.91 115.68 2da1 h THR 58 Ca 0.19 -0.67 -0.02 0.00 0.77 0.00 0.00 66.41 66.69 2da1 h THR 58 Cb 0.21 1.16 -0.01 0.00 -1.74 0.00 0.00 68.15 67.77 2da1 h THR 58 CO -0.23 0.14 -0.41 0.25 0.37 0.00 0.00 175.52 175.64 2da1 h LEU 59 N -0.70 -1.09 -0.87 2.58 5.85 -0.70 -1.24 115.31 119.13 2da1 h LEU 59 Ca -0.03 0.08 0.23 0.00 0.84 0.00 0.00 57.88 59.00 2da1 h LEU 59 Cb 0.48 0.35 -0.14 0.00 0.37 0.00 0.00 40.66 41.72 2da1 h LEU 59 CO 0.06 -0.55 0.19 0.15 -0.34 0.00 0.00 178.44 177.94 2da1 h PHE 60 N -0.85 0.27 -0.93 1.25 3.04 -0.36 0.60 116.94 119.96 2da1 h PHE 60 Ca -0.06 0.05 0.00 0.00 3.98 0.00 0.00 57.97 61.95 2da1 h PHE 60 Cb 0.72 0.02 -0.05 0.00 2.56 0.00 0.00 35.95 39.21 2da1 h PHE 60 CO -0.18 -0.24 0.59 -0.22 -2.02 0.00 0.00 178.31 176.24 2da1 h LYS 61 N 0.17 1.24 0.00 1.11 3.64 -1.02 0.55 116.57 122.27 2da1 h LYS 61 Ca 0.54 -0.09 -0.11 0.00 -1.27 0.00 0.00 60.65 59.72 2da1 h LYS 61 Cb 1.09 -0.27 -0.02 0.00 -0.41 0.00 0.00 32.23 32.62 2da1 h LYS 61 CO -0.68 0.84 -0.51 0.93 -2.27 0.00 0.00 179.45 177.75 2da1 h GLU 62 N 1.27 0.00 0.04 1.90 4.39 0.13 0.33 114.58 122.64 2da1 h GLU 62 Ca 0.34 0.00 -0.23 0.00 0.34 0.00 0.00 59.36 59.81 2da1 h GLU 62 Cb -0.11 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 28.56 2da1 h GLU 62 CO -0.07 0.51 -0.93 0.00 -1.16 0.00 0.00 179.01 177.37 2da1 h ARG 63 N 0.00 0.56 0.00 2.33 2.47 0.02 -3.35 114.38 116.41 2da1 h ARG 63 Ca -0.01 -0.66 -0.00 0.00 -1.26 0.00 0.00 59.98 58.06 2da1 h ARG 63 Cb 0.99 0.20 0.00 0.00 -1.65 0.00 0.00 29.97 29.51 2da1 h ARG 63 CO 0.07 1.26 -0.00 -0.56 0.56 0.00 0.00 179.97 181.30 2da1 h GLN 64 N 0.15 -0.00 -6.50 0.04 -0.00 -0.90 -3.46 115.11 104.44 2da1 h GLN 64 Ca -0.13 0.00 -0.53 0.00 -0.00 0.00 0.00 58.65 57.99 2da1 h GLN 64 Cb 1.62 0.00 0.23 0.00 -0.00 0.00 0.00 27.48 29.32 2da1 h GLN 64 CO 0.18 0.76 -1.11 -1.13 -0.00 0.00 0.00 178.83 177.53 2da1 n SER 65 N -4.73 -3.40 0.00 0.06 3.41 0.10 -4.80 113.62 104.26 2da1 n SER 65 Ca -0.09 0.23 0.00 0.00 -0.26 0.00 0.00 58.87 58.75 2da1 n SER 65 Cb 0.37 -1.02 0.00 0.00 -0.26 0.00 0.00 64.21 63.30 2da1 n SER 65 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2da1 n GLY 66 N 2.25 -1.92 0.20 5.00 0.00 -1.26 -4.73 105.19 104.73 2da1 n GLY 66 Ca 0.03 -2.21 -0.04 0.00 0.00 0.00 0.00 46.02 43.80 2da1 n GLY 66 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2da1 h PRO 67 N 4.03 0.31 -6.48 1.61 0.13 -1.99 -3.45 132.00 126.16 2da1 h PRO 67 Ca 0.00 -0.17 -0.58 0.00 -0.87 0.00 0.00 66.00 64.39 2da1 h PRO 67 Cb 0.00 0.01 0.18 0.00 0.13 0.00 0.00 31.00 31.32 2da1 h PRO 67 CO 0.00 0.71 -0.53 0.45 -0.23 0.00 0.00 178.00 178.40 2da1 n SER 68 N -3.99 -1.56 -3.43 1.44 2.88 -1.26 -5.00 113.62 102.69 2da1 n SER 68 Ca -0.02 0.66 -0.09 0.00 -1.33 0.00 0.00 58.87 58.10 2da1 n SER 68 Cb 0.52 -1.14 -0.01 0.00 -0.75 0.00 0.00 64.21 62.84 2da1 n SER 68 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2da1 s SER 69 N -1.24 -0.03 0.00 -3.46 0.01 -1.26 -4.97 113.70 102.74 2da1 s SER 69 Ca 0.65 -0.94 0.00 0.00 1.31 0.00 0.00 55.95 56.97 2da1 s SER 69 Cb -0.41 0.76 0.00 0.00 0.21 0.00 0.00 66.02 66.58 2da1 s SER 69 CO 0.58 -1.47 0.00 0.61 0.41 0.00 0.00 173.24 173.37