#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2da1 n SER 2 N 0.00 -0.46 -4.56 1.61 2.88 -1.26 -3.71 113.62 108.12 2da1 n SER 2 Ca 0.00 1.38 -0.39 0.00 -1.33 0.00 0.00 58.87 58.53 2da1 n SER 2 Cb 0.00 -0.34 -0.03 0.00 -0.75 0.00 0.00 64.21 63.09 2da1 n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2da1 s SER 3 N -5.27 5.40 0.00 -3.46 0.15 -1.26 -4.94 113.70 104.33 2da1 s SER 3 Ca -0.11 0.56 0.00 0.00 0.70 0.00 0.00 55.95 57.10 2da1 s SER 3 Cb 0.18 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.96 2da1 s SER 3 CO 0.58 -2.23 0.00 0.61 1.20 0.00 0.00 173.24 173.40 2da1 n GLY 4 N 5.63 4.82 3.68 9.45 0.00 -1.24 -5.04 105.19 122.49 2da1 n GLY 4 Ca 0.21 -2.05 -0.51 0.00 0.00 0.00 0.00 46.02 43.67 2da1 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2da1 n SER 5 N -0.23 2.90 -4.68 1.61 7.64 -1.26 -4.87 113.62 114.73 2da1 n SER 5 Ca 0.00 1.03 -0.42 0.00 1.01 0.00 0.00 58.87 60.49 2da1 n SER 5 Cb 0.00 -1.29 -0.03 0.00 -1.01 0.00 0.00 64.21 61.88 2da1 n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2da1 s SER 6 N 3.16 6.66 0.00 6.43 0.15 -1.26 -4.53 113.70 124.31 2da1 s SER 6 Ca 0.92 2.37 0.00 0.00 0.70 0.00 0.00 55.95 59.94 2da1 s SER 6 Cb -0.83 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 60.92 2da1 s SER 6 CO 0.54 -0.86 0.00 0.61 1.20 0.00 0.00 173.24 174.73 2da1 n GLY 7 N 3.96 -1.49 3.10 9.45 0.00 -1.26 -5.15 105.19 113.80 2da1 n GLY 7 Ca 0.16 0.57 -0.35 0.00 0.00 0.00 0.00 46.02 46.39 2da1 n GLY 7 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2da1 n LYS 8 N 0.00 -0.11 -4.20 1.61 5.02 -1.26 -4.98 118.16 114.23 2da1 n LYS 8 Ca 0.00 -0.02 -0.28 0.00 -2.02 0.00 0.00 58.31 55.98 2da1 n LYS 8 Cb 0.00 -1.21 -0.09 0.00 -0.02 0.00 0.00 35.03 33.72 2da1 n LYS 8 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2da1 s ARG 9 N -2.40 2.30 0.31 1.97 1.81 -1.26 -5.03 118.95 116.65 2da1 s ARG 9 Ca 0.44 -1.04 0.10 0.00 -1.72 0.00 0.00 55.73 53.51 2da1 s ARG 9 Cb -0.16 -2.36 0.50 0.00 -0.45 0.00 0.00 34.95 32.48 2da1 s ARG 9 CO 0.78 0.49 1.70 -1.00 -0.68 0.00 0.00 175.30 176.59 2da1 h PRO 10 N 3.20 0.09 -6.86 3.54 0.13 -2.04 -3.46 132.00 126.58 2da1 h PRO 10 Ca -0.48 -0.04 -0.57 0.00 -0.87 0.00 0.00 66.00 64.04 2da1 h PRO 10 Cb 1.18 0.00 -0.23 0.00 0.13 0.00 0.00 31.00 32.09 2da1 h PRO 10 CO 0.56 0.55 -0.88 -2.13 -0.23 0.00 0.00 178.00 175.87 2da1 n ARG 11 N -3.97 -2.31 -1.95 0.86 0.63 -1.26 -4.89 116.66 103.77 2da1 n ARG 11 Ca -0.02 0.28 -0.33 0.00 -0.92 0.00 0.00 57.85 56.86 2da1 n ARG 11 Cb 0.51 -4.72 0.03 0.00 0.45 0.00 0.00 32.46 28.73 2da1 n ARG 11 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 2da1 s THR 12 N -3.53 3.38 -0.28 5.15 -4.23 -1.26 -5.06 115.64 109.80 2da1 s THR 12 Ca 0.55 0.69 -0.13 0.00 -1.18 0.00 0.00 61.69 61.62 2da1 s THR 12 Cb -0.31 -3.22 0.10 0.00 1.34 0.00 0.00 72.50 70.42 2da1 s THR 12 CO 0.96 -0.35 0.65 -0.60 -0.54 0.00 0.00 174.62 174.74 2da1 s ARG 13 N -3.89 0.62 0.37 3.99 3.52 -1.26 -5.16 118.95 117.13 2da1 s ARG 13 Ca 0.67 1.30 -0.25 0.00 -0.13 0.00 0.00 55.73 57.32 2da1 s ARG 13 Cb -0.20 0.46 -0.09 0.00 -1.56 0.00 0.00 34.95 33.56 2da1 s ARG 13 CO 0.37 -0.18 1.02 0.42 -0.81 0.00 0.00 175.30 176.12 2da1 s ILE 14 N 2.22 3.86 0.40 4.11 1.01 -1.26 -5.06 121.20 126.47 2da1 s ILE 14 Ca -0.08 1.49 0.08 0.00 0.00 0.00 0.00 60.65 62.13 2da1 s ILE 14 Cb -0.09 -3.80 -0.03 0.00 0.01 0.00 0.00 42.46 38.56 2da1 s ILE 14 CO -0.19 0.07 0.33 0.28 0.00 0.00 0.00 174.94 175.43 2da1 s THR 15 N -1.62 2.79 0.50 2.92 -1.32 -1.26 -4.94 115.64 112.72 2da1 s THR 15 Ca 0.54 -1.41 0.14 0.00 -1.21 0.00 0.00 61.69 59.76 2da1 s THR 15 Cb -0.22 -3.03 0.27 0.00 -1.51 0.00 0.00 72.50 68.02 2da1 s THR 15 CO 0.27 -0.04 2.13 0.44 -2.21 0.00 0.00 174.62 175.21 2da1 h ASP 16 N 1.14 0.08 0.87 8.08 3.32 -1.98 0.41 116.42 128.35 2da1 h ASP 16 Ca -0.42 -0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.56 2da1 h ASP 16 Cb 1.26 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.78 2da1 h ASP 16 CO 0.59 0.06 -0.34 0.44 -1.72 0.00 0.00 179.24 178.28 2da1 h ASP 17 N 0.10 0.00 0.24 6.45 3.32 -2.00 -1.32 116.42 123.20 2da1 h ASP 17 Ca 0.03 0.00 -0.33 0.00 0.02 0.00 0.00 57.03 56.74 2da1 h ASP 17 Cb -0.01 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.48 2da1 h ASP 17 CO -0.01 0.34 -2.05 0.00 -1.72 0.00 0.00 179.24 175.80 2da1 n GLN 18 N -3.50 0.66 -0.03 3.56 6.02 -0.20 -4.21 117.38 119.69 2da1 n GLN 18 Ca -0.00 0.16 -0.15 0.00 -0.01 0.00 0.00 57.00 57.00 2da1 n GLN 18 Cb 0.49 -1.66 -0.10 0.00 1.02 0.00 0.00 30.24 29.99 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 0.00 0.30 -1.32 1.08 5.85 -0.24 -3.21 115.31 117.78 2da1 h LEU 19 Ca -0.42 -0.66 0.25 0.00 0.84 0.00 0.00 57.88 57.88 2da1 h LEU 19 Cb 2.11 -0.09 -0.09 0.00 0.37 0.00 0.00 40.66 42.96 2da1 h LEU 19 CO 0.05 0.92 0.65 0.08 -0.34 0.00 0.00 178.44 179.79 2da1 h ARG 20 N -0.29 0.44 -0.74 1.25 0.11 -1.44 0.28 114.38 113.98 2da1 h ARG 20 Ca -0.02 -0.03 -0.06 0.00 0.10 0.00 0.00 59.98 59.97 2da1 h ARG 20 Cb 0.91 -0.10 -0.03 0.00 1.11 0.00 0.00 29.97 31.86 2da1 h ARG 20 CO 0.05 0.29 0.21 0.28 0.10 0.00 0.00 179.97 180.90 2da1 h VAL 21 N 0.45 1.26 -0.16 0.08 2.07 -1.72 -1.64 116.25 116.59 2da1 h VAL 21 Ca 0.58 -0.94 -0.21 0.00 0.82 0.00 0.00 66.70 66.94 2da1 h VAL 21 Cb 1.37 0.47 0.01 0.00 -1.52 0.00 0.00 31.29 31.62 2da1 h VAL 21 CO -0.30 0.37 -0.73 -0.07 0.02 0.00 0.00 177.57 176.86 2da1 h LEU 22 N 1.11 0.92 -0.48 2.57 3.38 -0.58 -3.25 115.31 118.97 2da1 h LEU 22 Ca 0.24 -0.62 0.00 0.00 0.09 0.00 0.00 57.88 57.59 2da1 h LEU 22 Cb 0.34 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 2da1 h LEU 22 CO -0.00 1.39 0.32 0.03 0.09 0.00 0.00 178.44 180.26 2da1 h ARG 23 N 0.50 0.63 -0.60 1.13 2.47 -0.80 -1.06 114.38 116.65 2da1 h ARG 23 Ca -0.05 -0.04 0.12 0.00 -1.26 0.00 0.00 59.98 58.76 2da1 h ARG 23 Cb 1.36 -0.14 -0.10 0.00 -1.65 0.00 0.00 29.97 29.44 2da1 h ARG 23 CO 0.15 0.42 0.04 1.96 0.56 0.00 0.00 179.97 183.10 2da1 h GLN 24 N 0.65 0.15 -0.07 0.04 1.08 -1.34 0.53 115.11 116.15 2da1 h GLN 24 Ca 0.18 -0.01 -0.13 0.00 -1.45 0.00 0.00 58.65 57.24 2da1 h GLN 24 Cb -0.07 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.31 2da1 h GLN 24 CO -0.04 0.10 -0.53 1.88 -0.95 0.00 0.00 178.83 179.29 2da1 h TYR 25 N 0.15 0.23 -0.55 2.96 0.05 -1.52 -3.15 116.97 115.15 2da1 h TYR 25 Ca 0.32 -0.08 0.09 0.00 0.05 0.00 0.00 58.73 59.11 2da1 h TYR 25 Cb 0.50 -0.04 -0.07 0.00 1.01 0.00 0.00 36.73 38.13 2da1 h TYR 25 CO -0.33 0.68 0.15 0.35 -1.05 0.00 0.00 178.16 177.96 2da1 h PHE 26 N 0.14 0.25 0.17 4.88 3.57 0.43 0.14 116.94 126.52 2da1 h PHE 26 Ca 0.00 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.52 2da1 h PHE 26 Cb 0.98 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.70 2da1 h PHE 26 CO 0.01 0.03 -0.08 0.22 -2.23 0.00 0.00 178.31 176.27 2da1 h ASP 27 N 0.30 -0.19 -0.41 0.41 1.82 -1.41 -2.64 116.42 114.31 2da1 h ASP 27 Ca 0.28 -0.13 0.12 0.00 -0.39 0.00 0.00 57.03 56.91 2da1 h ASP 27 Cb 0.36 0.05 -0.02 0.00 0.68 0.00 0.00 39.33 40.40 2da1 h ASP 27 CO -0.32 0.02 0.31 0.40 -1.61 0.00 0.00 179.24 178.03 2da1 h ILE 28 N -0.39 0.74 -1.84 2.25 2.04 -1.43 -3.42 117.51 115.46 2da1 h ILE 28 Ca -0.02 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.85 2da1 h ILE 28 Cb 0.30 0.78 -0.23 0.00 -0.74 0.00 0.00 36.82 36.94 2da1 h ILE 28 CO 0.04 0.00 0.22 0.54 0.00 0.00 0.00 178.15 178.94 2da1 s ASN 29 N -6.29 -0.69 0.00 1.72 4.22 -0.01 -5.08 114.94 108.81 2da1 s ASN 29 Ca -0.05 1.24 0.00 0.00 -2.14 0.00 0.00 52.86 51.91 2da1 s ASN 29 Cb 0.19 1.27 0.00 0.00 1.28 0.00 0.00 41.25 43.99 2da1 s ASN 29 CO 0.70 -0.21 0.96 0.59 -2.04 0.00 0.00 177.10 177.10 2da1 n ASN 30 N 3.07 0.00 -4.51 3.54 5.03 -1.19 -3.91 115.26 117.28 2da1 n ASN 30 Ca -0.16 0.96 -0.32 0.00 0.87 0.00 0.00 54.58 55.94 2da1 n ASN 30 Cb 0.56 -0.46 -0.12 0.00 -1.02 0.00 0.00 39.78 38.74 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 -2.78 4.18 0.93 6.41 0.15 -1.26 -4.71 113.70 116.61 2da1 s SER 31 Ca 0.00 -0.23 -0.12 0.00 0.70 0.00 0.00 55.95 56.30 2da1 s SER 31 Cb 0.00 -0.87 0.15 0.00 -1.71 0.00 0.00 66.02 63.59 2da1 s SER 31 CO 0.00 0.30 1.09 -2.16 1.20 0.00 0.00 173.24 173.68 2da1 s PRO 32 N -1.14 1.02 0.17 5.44 0.04 -1.26 -5.07 135.00 134.21 2da1 s PRO 32 Ca 0.14 0.74 0.08 0.00 0.04 0.00 0.00 61.00 62.00 2da1 s PRO 32 Cb -0.11 -1.79 -0.04 0.00 0.04 0.00 0.00 34.50 32.60 2da1 s PRO 32 CO 0.04 -2.38 -0.06 -1.54 0.04 0.00 0.00 177.00 173.10 2da1 s SER 33 N -3.43 4.45 0.41 6.66 1.04 -1.26 -4.84 113.70 116.73 2da1 s SER 33 Ca 0.64 -0.50 0.35 0.00 0.48 0.00 0.00 55.95 56.92 2da1 s SER 33 Cb -0.18 -0.84 1.31 0.00 0.10 0.00 0.00 66.02 66.42 2da1 s SER 33 CO 0.57 0.10 1.24 -0.62 0.98 0.00 0.00 173.24 175.51 2da1 n GLU 34 N 0.01 -0.01 -0.02 4.02 1.02 -1.26 0.23 120.64 124.63 2da1 n GLU 34 Ca -0.10 0.90 -0.16 0.00 -0.02 0.00 0.00 57.16 57.78 2da1 n GLU 34 Cb 0.55 -1.98 -0.11 0.00 -0.02 0.00 0.00 31.44 29.88 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 0.25 -0.06 3.49 3.07 -2.00 -3.15 114.58 116.18 2da1 h GLU 35 Ca 0.73 -0.27 -0.02 0.00 -0.50 0.00 0.00 59.36 59.30 2da1 h GLU 35 Cb 2.75 0.07 -0.00 0.00 -0.84 0.00 0.00 28.75 30.73 2da1 h GLU 35 CO -0.13 0.97 -0.05 1.96 -1.40 0.00 0.00 179.01 180.37 2da1 h GLN 36 N -0.36 0.14 -0.50 2.33 1.08 0.26 -1.96 115.11 116.10 2da1 h GLN 36 Ca -0.04 -0.07 0.14 0.00 -1.45 0.00 0.00 58.65 57.23 2da1 h GLN 36 Cb 1.10 -0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.51 2da1 h GLN 36 CO 0.07 0.55 0.52 0.82 -0.95 0.00 0.00 178.83 179.85 2da1 h ILE 37 N -0.27 0.35 0.00 2.54 2.04 -0.71 0.66 117.51 122.12 2da1 h ILE 37 Ca 0.01 0.00 -0.09 0.00 1.00 0.00 0.00 64.86 65.78 2da1 h ILE 37 Cb 0.52 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 2da1 h ILE 37 CO 0.01 0.00 -0.55 0.50 0.00 0.00 0.00 178.15 178.11 2da1 h LYS 38 N 0.00 0.00 -0.78 2.37 1.63 -1.47 -2.68 116.57 115.64 2da1 h LYS 38 Ca 0.24 0.00 0.13 0.00 -0.85 0.00 0.00 60.65 60.17 2da1 h LYS 38 Cb 1.28 0.00 -0.05 0.00 -0.60 0.00 0.00 32.23 32.86 2da1 h LYS 38 CO -0.00 0.74 0.52 1.05 -3.45 0.00 0.00 179.45 178.31 2da1 h GLU 39 N -1.00 0.54 0.00 1.90 4.11 -0.53 -2.30 114.58 117.31 2da1 h GLU 39 Ca -0.14 -0.03 -0.02 0.00 0.07 0.00 0.00 59.36 59.24 2da1 h GLU 39 Cb 0.93 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.06 2da1 h GLU 39 CO -0.08 0.36 -0.09 0.52 0.07 0.00 0.00 179.01 179.79 2da1 h MET 40 N 0.56 0.05 -1.17 1.06 2.86 -1.05 -1.95 114.93 115.29 2da1 h MET 40 Ca 0.38 -0.06 0.34 0.00 -2.06 0.00 0.00 59.70 58.30 2da1 h MET 40 Cb 0.69 0.02 -0.05 0.00 0.06 0.00 0.00 31.60 32.32 2da1 h MET 40 CO -0.14 0.86 1.02 0.00 1.06 0.00 0.00 176.91 179.71 2da1 h ALA 41 N 0.20 3.05 0.02 6.32 0.00 -1.05 0.11 119.26 127.92 2da1 h ALA 41 Ca -0.01 -0.04 -0.34 0.00 0.00 0.00 0.00 54.91 54.52 2da1 h ALA 41 Cb 0.89 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.72 2da1 h ALA 41 CO 0.02 -1.62 -1.90 -3.47 0.00 0.00 0.00 179.25 172.27 2da1 n ASP 42 N -3.73 1.95 -0.16 0.00 -0.08 -1.07 -0.87 116.55 112.59 2da1 n ASP 42 Ca 0.26 0.30 0.21 0.00 -1.51 0.00 0.00 54.79 54.05 2da1 n ASP 42 Cb 1.39 -0.85 0.61 0.00 2.34 0.00 0.00 41.12 44.62 2da1 n ASP 42 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 2da1 h LYS 43 N -0.71 0.19 0.00 -0.67 1.57 -0.10 -2.87 116.57 113.99 2da1 h LYS 43 Ca -0.49 -0.01 -0.24 0.00 -1.87 0.00 0.00 60.65 58.04 2da1 h LYS 43 Cb 1.59 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 33.81 2da1 h LYS 43 CO -0.21 0.13 -1.90 -1.13 -0.57 0.00 0.00 179.45 175.76 2da1 n SER 44 N -4.41 2.53 0.00 0.86 3.41 0.17 -5.03 113.62 111.16 2da1 n SER 44 Ca 0.16 -0.06 0.00 0.00 -0.26 0.00 0.00 58.87 58.71 2da1 n SER 44 Cb 0.72 0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.69 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 2.60 0.65 3.83 5.00 0.00 -0.05 -5.01 105.19 112.21 2da1 n GLY 45 Ca -0.26 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.42 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 4.04 1.09 0.99 1.43 -0.79 -4.89 118.68 120.55 2da1 s LEU 46 Ca 0.00 1.55 -0.15 0.00 -1.03 0.00 0.00 54.13 54.49 2da1 s LEU 46 Cb 0.00 -4.28 0.23 0.00 0.03 0.00 0.00 46.19 42.17 2da1 s LEU 46 CO 0.00 -0.26 1.10 -2.16 0.23 0.00 0.00 176.35 175.26 2da1 s PRO 47 N -2.94 -0.33 0.30 1.29 0.04 -1.26 -4.10 135.00 127.99 2da1 s PRO 47 Ca 0.57 0.26 0.15 0.00 0.04 0.00 0.00 61.00 62.02 2da1 s PRO 47 Cb -0.11 -1.67 0.31 0.00 0.04 0.00 0.00 34.50 33.08 2da1 s PRO 47 CO 0.16 -3.18 1.56 1.96 0.04 0.00 0.00 177.00 177.54 2da1 h GLN 48 N -2.21 0.00 -0.12 4.56 4.20 -1.95 -2.82 115.11 116.77 2da1 h GLN 48 Ca -0.51 0.00 -0.22 0.00 0.06 0.00 0.00 58.65 57.98 2da1 h GLN 48 Cb 1.32 0.00 0.01 0.00 0.30 0.00 0.00 27.48 29.11 2da1 h GLN 48 CO 0.48 0.53 -0.79 1.57 -0.67 0.00 0.00 178.83 179.96 2da1 h LYS 49 N 0.00 0.75 -0.22 1.46 2.10 -1.97 -1.59 116.57 117.10 2da1 h LYS 49 Ca -0.01 -0.64 -0.05 0.00 -2.00 0.00 0.00 60.65 57.95 2da1 h LYS 49 Cb 1.21 0.14 -0.01 0.00 -0.90 0.00 0.00 32.23 32.67 2da1 h LYS 49 CO 0.07 1.25 -0.05 0.28 -2.00 0.00 0.00 179.45 179.00 2da1 h VAL 50 N 0.47 1.28 0.50 0.07 2.07 -1.93 -2.47 116.25 116.23 2da1 h VAL 50 Ca -0.06 -1.04 -0.02 0.00 0.82 0.00 0.00 66.70 66.39 2da1 h VAL 50 Cb 1.43 1.51 0.00 0.00 -1.52 0.00 0.00 31.29 32.71 2da1 h VAL 50 CO 0.16 0.32 -0.24 0.40 0.02 0.00 0.00 177.57 178.23 2da1 h ILE 51 N 0.16 0.38 -0.72 4.57 2.04 -1.57 -1.57 117.51 120.80 2da1 h ILE 51 Ca 0.06 -0.41 0.15 0.00 1.00 0.00 0.00 64.86 65.66 2da1 h ILE 51 Cb 0.50 0.52 -0.13 0.00 -0.74 0.00 0.00 36.82 36.97 2da1 h ILE 51 CO 0.02 0.05 -0.11 0.11 0.00 0.00 0.00 178.15 178.22 2da1 h LYS 52 N -0.96 0.03 0.70 2.37 1.57 -1.37 -1.37 116.57 117.55 2da1 h LYS 52 Ca -0.07 -0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.67 2da1 h LYS 52 Cb 0.61 -0.01 0.01 0.00 0.08 0.00 0.00 32.23 32.92 2da1 h LYS 52 CO 0.11 0.02 -0.34 1.25 -0.57 0.00 0.00 179.45 179.93 2da1 h HIS 53 N 0.03 -0.87 -0.89 -1.35 2.76 -1.44 -2.30 115.15 111.09 2da1 h HIS 53 Ca 0.36 -0.02 0.21 0.00 -2.20 0.00 0.00 60.37 58.72 2da1 h HIS 53 Cb 0.59 0.29 -0.17 0.00 1.55 0.00 0.00 27.41 29.67 2da1 h HIS 53 CO -0.52 -0.54 -0.11 1.87 -1.30 0.00 0.00 177.93 177.33 2da1 n TRP 54 N -4.64 0.44 -0.30 5.26 -0.00 -0.59 0.18 117.44 117.78 2da1 n TRP 54 Ca -0.12 1.08 -0.04 0.00 -0.00 0.00 0.00 57.50 58.42 2da1 n TRP 54 Cb 0.37 -1.09 0.07 0.00 -0.00 0.00 0.00 31.31 30.67 2da1 n TRP 54 CO 0.00 0.00 0.00 0.74 -0.00 0.00 0.00 177.69 178.43 2da1 h PHE 55 N 0.00 1.09 0.30 5.87 -1.00 -1.16 -1.38 116.94 120.66 2da1 h PHE 55 Ca 0.48 -0.01 -0.01 0.00 2.81 0.00 0.00 57.97 61.24 2da1 h PHE 55 Cb 0.87 -0.36 0.00 0.00 3.61 0.00 0.00 35.95 40.07 2da1 h PHE 55 CO -0.58 0.74 -0.14 -0.09 -1.61 0.00 0.00 178.31 176.62 2da1 h ARG 56 N 1.13 -0.38 -0.57 1.51 2.43 0.25 0.24 114.38 118.99 2da1 h ARG 56 Ca 0.30 0.03 0.12 0.00 -0.81 0.00 0.00 59.98 59.61 2da1 h ARG 56 Cb -0.03 0.09 -0.10 0.00 -0.42 0.00 0.00 29.97 29.50 2da1 h ARG 56 CO -0.05 -0.04 -0.06 -0.97 -1.51 0.00 0.00 179.97 177.34 2da1 h ASN 57 N -0.83 -0.37 0.45 -3.80 -1.24 -0.35 0.39 115.58 109.84 2da1 h ASN 57 Ca -0.04 0.15 -0.02 0.00 0.71 0.00 0.00 56.30 57.10 2da1 h ASN 57 Cb 0.52 0.29 0.00 0.00 0.73 0.00 0.00 38.32 39.86 2da1 h ASN 57 CO 0.07 -0.14 -0.22 0.74 -1.29 0.00 0.00 177.43 176.59 2da1 h THR 58 N 0.07 0.10 -0.31 -3.57 2.02 -1.29 -3.09 112.91 106.83 2da1 h THR 58 Ca 0.29 -0.57 0.04 0.00 0.77 0.00 0.00 66.41 66.94 2da1 h THR 58 Cb 0.46 0.15 -0.08 0.00 -1.74 0.00 0.00 68.15 66.94 2da1 h THR 58 CO -0.53 0.02 -0.54 0.25 0.37 0.00 0.00 175.52 175.09 2da1 h LEU 59 N -1.13 -1.78 -1.18 2.58 5.85 -0.30 0.15 115.31 119.50 2da1 h LEU 59 Ca -0.06 0.23 0.36 0.00 0.84 0.00 0.00 57.88 59.25 2da1 h LEU 59 Cb 0.50 0.72 -0.14 0.00 0.37 0.00 0.00 40.66 42.11 2da1 h LEU 59 CO 0.10 -0.43 0.67 0.15 -0.34 0.00 0.00 178.44 178.59 2da1 h PHE 60 N -0.46 0.75 -0.25 1.25 3.04 -0.34 1.28 116.94 122.21 2da1 h PHE 60 Ca 0.06 0.03 -0.10 0.00 3.98 0.00 0.00 57.97 61.95 2da1 h PHE 60 Cb 0.63 -0.20 -0.01 0.00 2.56 0.00 0.00 35.95 38.93 2da1 h PHE 60 CO -0.67 -0.18 -0.27 -0.22 -2.02 0.00 0.00 178.31 174.95 2da1 h LYS 61 N 0.23 0.48 -0.07 1.11 3.64 -0.64 -2.24 116.57 119.08 2da1 h LYS 61 Ca 0.75 -0.19 -0.23 0.00 -1.27 0.00 0.00 60.65 59.72 2da1 h LYS 61 Cb 1.99 -0.02 0.01 0.00 -0.41 0.00 0.00 32.23 33.80 2da1 h LYS 61 CO -0.52 0.71 -0.87 0.93 -2.27 0.00 0.00 179.45 177.43 2da1 h GLU 62 N 0.42 0.61 -0.48 1.90 4.39 0.23 0.75 114.58 122.39 2da1 h GLU 62 Ca 0.06 -0.57 -0.07 0.00 0.34 0.00 0.00 59.36 59.12 2da1 h GLU 62 Cb 0.70 0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 29.47 2da1 h GLU 62 CO 0.05 1.18 0.03 0.00 -1.16 0.00 0.00 179.01 179.12 2da1 h ARG 63 N 0.38 0.79 0.20 2.33 2.47 -0.82 -3.09 114.38 116.64 2da1 h ARG 63 Ca -0.07 -0.20 -0.34 0.00 -1.26 0.00 0.00 59.98 58.11 2da1 h ARG 63 Cb 1.50 -0.10 0.02 0.00 -1.65 0.00 0.00 29.97 29.74 2da1 h ARG 63 CO 0.17 0.78 -1.63 -0.56 0.56 0.00 0.00 179.97 179.28 2da1 h GLN 64 N 0.74 0.43 -5.07 0.04 -0.00 -1.41 -3.47 115.11 106.36 2da1 h GLN 64 Ca 0.15 -0.73 -0.69 0.00 -0.00 0.00 0.00 58.65 57.38 2da1 h GLN 64 Cb 0.41 0.27 0.03 0.00 -0.00 0.00 0.00 27.48 28.19 2da1 h GLN 64 CO 0.01 1.34 0.20 0.45 -0.00 0.00 0.00 178.83 180.83 2da1 n SER 65 N -3.62 0.28 0.00 0.06 2.88 0.25 -4.67 113.62 108.81 2da1 n SER 65 Ca -0.21 0.99 0.00 0.00 -1.33 0.00 0.00 58.87 58.32 2da1 n SER 65 Cb 1.08 -0.77 0.00 0.00 -0.75 0.00 0.00 64.21 63.77 2da1 n SER 65 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2da1 n GLY 66 N 1.86 3.22 0.00 0.46 0.00 -1.26 -4.80 105.19 104.67 2da1 n GLY 66 Ca 0.20 -1.94 0.08 0.00 0.00 0.00 0.00 46.02 44.35 2da1 n GLY 66 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2da1 n PRO 67 N -1.21 0.49 -2.39 1.61 -0.04 -1.26 -4.74 135.00 127.45 2da1 n PRO 67 Ca 0.00 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.03 2da1 n PRO 67 Cb 0.00 -1.49 -0.02 0.00 -0.04 0.00 0.00 33.50 31.94 2da1 n PRO 67 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2da1 s SER 68 N -1.99 6.96 0.19 3.54 0.01 -1.26 -4.93 113.70 116.23 2da1 s SER 68 Ca 0.23 1.82 -0.19 0.00 1.31 0.00 0.00 55.95 59.12 2da1 s SER 68 Cb 0.11 -2.55 0.15 0.00 0.21 0.00 0.00 66.02 63.94 2da1 s SER 68 CO 0.18 -0.69 1.59 0.77 0.41 0.00 0.00 173.24 175.50 2da1 h SER 69 N 7.91 -1.07 0.00 2.44 4.64 -1.93 -3.48 113.55 122.05 2da1 h SER 69 Ca -0.32 0.22 0.00 0.00 -0.47 0.00 0.00 61.79 61.23 2da1 h SER 69 Cb 1.14 0.55 0.00 0.00 -0.31 0.00 0.00 62.40 63.78 2da1 h SER 69 CO 0.92 -0.29 0.00 0.61 -0.87 0.00 0.00 176.83 177.20