#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 1.69 0.06 1.61 7.64 -1.26 -4.97 113.62 118.40 2da1 n SER 2 Ca 0.00 0.14 0.00 0.00 1.01 0.00 0.00 58.87 60.02 2da1 n SER 2 Cb 0.00 -0.49 0.00 0.00 -1.01 0.00 0.00 64.21 62.71 2da1 n SER 2 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2da1 n SER 3 N -3.63 0.63 0.00 6.43 3.41 -1.26 -5.11 113.62 114.09 2da1 n SER 3 Ca -0.36 0.19 0.00 0.00 -0.26 0.00 0.00 58.87 58.44 2da1 n SER 3 Cb 0.79 -0.11 0.00 0.00 -0.26 0.00 0.00 64.21 64.62 2da1 n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2da1 n GLY 4 N 2.98 0.52 3.64 5.00 0.00 -1.26 -5.11 105.19 110.97 2da1 n GLY 4 Ca 0.00 0.09 -0.03 0.00 0.00 0.00 0.00 46.02 46.08 2da1 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2da1 s SER 5 N 0.00 -0.32 -0.06 1.61 1.04 -1.26 -5.07 113.70 109.64 2da1 s SER 5 Ca 0.00 0.55 -0.30 0.00 0.48 0.00 0.00 55.95 56.69 2da1 s SER 5 Cb 0.00 0.89 -0.04 0.00 0.10 0.00 0.00 66.02 66.97 2da1 s SER 5 CO 0.00 -0.09 1.34 -0.94 0.98 0.00 0.00 173.24 174.53 2da1 s SER 6 N 0.78 6.90 -0.30 7.02 1.04 -1.26 -4.99 113.70 122.89 2da1 s SER 6 Ca -0.03 1.95 -0.03 0.00 0.48 0.00 0.00 55.95 58.32 2da1 s SER 6 Cb -0.04 -2.55 0.10 0.00 0.10 0.00 0.00 66.02 63.63 2da1 s SER 6 CO -0.12 -0.72 0.12 -0.83 0.98 0.00 0.00 173.24 172.67 2da1 s GLY 7 N 1.96 0.75 0.05 7.32 0.00 -1.26 -4.96 107.32 111.17 2da1 s GLY 7 Ca 0.61 -1.34 0.00 0.00 0.00 0.00 0.00 44.72 43.98 2da1 s GLY 7 CO 0.23 1.87 0.00 0.28 0.00 0.00 0.00 173.10 175.48 2da1 n LYS 8 N 5.07 0.00 -1.36 2.90 4.01 -1.26 -5.07 118.16 122.45 2da1 n LYS 8 Ca -0.04 0.00 -0.35 0.00 -0.51 0.00 0.00 58.31 57.41 2da1 n LYS 8 Cb 0.42 -0.46 0.10 0.00 -0.51 0.00 0.00 35.03 34.59 2da1 n LYS 8 CO 0.00 0.00 0.00 1.03 -1.11 0.00 0.00 177.40 177.32 2da1 s ARG 9 N -2.00 1.99 1.07 1.97 0.52 -1.26 -5.00 118.95 116.24 2da1 s ARG 9 Ca 0.00 1.88 -0.14 0.00 -0.52 0.00 0.00 55.73 56.95 2da1 s ARG 9 Cb 0.00 -1.80 0.22 0.00 0.52 0.00 0.00 34.95 33.89 2da1 s ARG 9 CO 0.00 -1.98 1.10 -1.25 0.02 0.00 0.00 175.30 173.19 2da1 s PRO 10 N -3.84 -0.14 0.21 3.54 0.04 -1.26 -4.92 135.00 128.63 2da1 s PRO 10 Ca 0.77 0.32 -0.19 0.00 0.04 0.00 0.00 61.00 61.94 2da1 s PRO 10 Cb -0.32 -1.69 0.19 0.00 0.04 0.00 0.00 34.50 32.72 2da1 s PRO 10 CO 0.46 -3.07 1.57 0.00 0.04 0.00 0.00 177.00 176.00 2da1 h ARG 11 N -2.13 -0.07 -6.12 4.56 3.08 -2.04 -3.41 114.38 108.24 2da1 h ARG 11 Ca -0.52 0.01 -0.55 0.00 0.07 0.00 0.00 59.98 58.98 2da1 h ARG 11 Cb 1.32 0.02 0.23 0.00 0.08 0.00 0.00 29.97 31.62 2da1 h ARG 11 CO 0.51 -0.05 -1.59 0.25 -1.07 0.00 0.00 179.97 178.02 2da1 n THR 12 N -5.46 0.06 -3.64 2.04 -2.24 -1.26 -5.01 114.28 98.77 2da1 n THR 12 Ca 0.07 -0.46 -0.08 0.00 -2.27 0.00 0.00 64.05 61.31 2da1 n THR 12 Cb 0.38 -0.10 -0.07 0.00 -2.10 0.00 0.00 70.33 68.44 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 -2.12 0.59 0.13 -0.78 3.52 -1.26 -5.05 118.95 113.98 2da1 s ARG 13 Ca 0.45 0.84 -0.21 0.00 -0.13 0.00 0.00 55.73 56.67 2da1 s ARG 13 Cb -0.22 0.21 -0.07 0.00 -1.56 0.00 0.00 34.95 33.31 2da1 s ARG 13 CO 0.79 -0.09 0.66 0.42 -0.81 0.00 0.00 175.30 176.26 2da1 s ILE 14 N 0.86 4.60 0.41 4.11 1.01 -1.26 -5.08 121.20 125.85 2da1 s ILE 14 Ca -0.04 1.37 0.08 0.00 0.00 0.00 0.00 60.65 62.07 2da1 s ILE 14 Cb -0.05 -3.97 0.00 0.00 0.01 0.00 0.00 42.46 38.46 2da1 s ILE 14 CO -0.10 0.49 0.53 0.28 0.00 0.00 0.00 174.94 176.14 2da1 s THR 15 N -1.19 3.00 0.47 2.92 -1.32 -1.26 -4.91 115.64 113.34 2da1 s THR 15 Ca 0.33 -1.06 0.14 0.00 -1.21 0.00 0.00 61.69 59.90 2da1 s THR 15 Cb -0.20 -3.02 0.22 0.00 -1.51 0.00 0.00 72.50 67.99 2da1 s THR 15 CO 0.22 -0.01 2.05 0.44 -2.21 0.00 0.00 174.62 175.11 2da1 h ASP 16 N 0.72 0.04 0.79 8.08 3.32 -1.98 0.20 116.42 127.59 2da1 h ASP 16 Ca -0.41 -0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.55 2da1 h ASP 16 Cb 1.28 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.80 2da1 h ASP 16 CO 0.48 0.14 -0.41 0.44 -1.72 0.00 0.00 179.24 178.16 2da1 h ASP 17 N 0.04 0.00 0.07 6.45 5.19 -2.00 -2.51 116.42 123.65 2da1 h ASP 17 Ca 0.01 0.00 -0.30 0.00 -0.62 0.00 0.00 57.03 56.12 2da1 h ASP 17 Cb 0.19 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.67 2da1 h ASP 17 CO 0.01 0.41 -1.62 1.56 -3.12 0.00 0.00 179.24 176.48 2da1 h GLN 18 N 0.00 0.14 -0.35 3.56 4.20 -1.63 -3.37 115.11 117.66 2da1 h GLN 18 Ca -0.00 -0.24 0.04 0.00 0.06 0.00 0.00 58.65 58.51 2da1 h GLN 18 Cb 0.92 0.09 -0.04 0.00 0.30 0.00 0.00 27.48 28.74 2da1 h GLN 18 CO 0.05 1.11 0.10 1.25 -0.67 0.00 0.00 178.83 180.68 2da1 h LEU 19 N -0.46 0.09 -1.04 1.46 5.85 -0.72 -1.79 115.31 118.70 2da1 h LEU 19 Ca -0.38 0.04 0.28 0.00 0.84 0.00 0.00 57.88 58.66 2da1 h LEU 19 Cb 1.67 0.04 -0.13 0.00 0.37 0.00 0.00 40.66 42.61 2da1 h LEU 19 CO -0.06 0.09 0.60 0.08 -0.34 0.00 0.00 178.44 178.81 2da1 h ARG 20 N 0.24 0.44 -0.21 1.25 0.11 -1.64 0.83 114.38 115.40 2da1 h ARG 20 Ca 0.16 -0.03 -0.06 0.00 0.10 0.00 0.00 59.98 60.15 2da1 h ARG 20 Cb 0.15 -0.10 -0.01 0.00 1.11 0.00 0.00 29.97 31.12 2da1 h ARG 20 CO -0.18 0.29 -0.14 0.28 0.10 0.00 0.00 179.97 180.33 2da1 h VAL 21 N 0.45 1.21 0.04 0.08 2.07 -1.49 -0.11 116.25 118.50 2da1 h VAL 21 Ca 0.68 -0.91 -0.24 0.00 0.82 0.00 0.00 66.70 67.05 2da1 h VAL 21 Cb 1.46 1.20 -0.02 0.00 -1.52 0.00 0.00 31.29 32.41 2da1 h VAL 21 CO -0.52 0.29 -1.15 -0.07 0.02 0.00 0.00 177.57 176.15 2da1 h LEU 22 N 0.32 0.14 0.07 2.57 3.38 0.63 -3.28 115.31 119.14 2da1 h LEU 22 Ca 0.06 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 2da1 h LEU 22 Cb 0.44 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.15 2da1 h LEU 22 CO 0.03 1.12 -0.03 0.03 0.09 0.00 0.00 178.44 179.67 2da1 h ARG 23 N 0.02 -0.09 -0.76 1.13 2.47 -0.36 -2.79 114.38 114.00 2da1 h ARG 23 Ca -0.08 0.01 0.17 0.00 -1.26 0.00 0.00 59.98 58.82 2da1 h ARG 23 Cb 1.86 0.02 -0.13 0.00 -1.65 0.00 0.00 29.97 30.06 2da1 h ARG 23 CO 0.15 0.46 0.01 1.96 0.56 0.00 0.00 179.97 183.10 2da1 h GLN 24 N -0.73 0.10 -0.28 0.04 1.08 -1.16 0.45 115.11 114.61 2da1 h GLN 24 Ca -0.01 -0.01 -0.07 0.00 -1.45 0.00 0.00 58.65 57.12 2da1 h GLN 24 Cb 0.59 -0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.98 2da1 h GLN 24 CO 0.02 0.07 -0.12 1.88 -0.95 0.00 0.00 178.83 179.73 2da1 h TYR 25 N 0.10 0.50 -0.65 2.96 -1.99 -1.62 -3.04 116.97 113.22 2da1 h TYR 25 Ca 0.42 -0.07 0.13 0.00 2.00 0.00 0.00 58.73 61.21 2da1 h TYR 25 Cb 0.74 -0.13 -0.12 0.00 2.00 0.00 0.00 36.73 39.21 2da1 h TYR 25 CO -0.42 0.57 -0.17 0.35 -0.00 0.00 0.00 178.16 178.49 2da1 h PHE 26 N 0.43 -0.37 0.65 4.88 3.57 0.20 0.47 116.94 126.77 2da1 h PHE 26 Ca 0.08 0.06 -0.03 0.00 3.53 0.00 0.00 57.97 61.62 2da1 h PHE 26 Cb 0.47 0.27 -0.01 0.00 2.79 0.00 0.00 35.95 39.46 2da1 h PHE 26 CO 0.01 -0.29 -0.42 0.22 -2.23 0.00 0.00 178.31 175.61 2da1 h ASP 27 N -0.01 -1.07 -0.32 0.41 1.82 -1.43 -3.09 116.42 112.74 2da1 h ASP 27 Ca 0.31 0.06 0.06 0.00 -0.39 0.00 0.00 57.03 57.08 2da1 h ASP 27 Cb 0.48 0.32 -0.08 0.00 0.68 0.00 0.00 39.33 40.73 2da1 h ASP 27 CO -0.68 -0.64 -0.40 0.40 -1.61 0.00 0.00 179.24 176.31 2da1 h ILE 28 N -1.02 0.15 -3.34 2.25 5.03 -1.41 -3.41 117.51 115.77 2da1 h ILE 28 Ca -0.08 0.00 -0.29 0.00 -0.12 0.00 0.00 64.86 64.37 2da1 h ILE 28 Cb 0.83 0.15 -0.34 0.00 -3.03 0.00 0.00 36.82 34.43 2da1 h ILE 28 CO 0.07 0.00 -0.67 0.21 -0.68 0.00 0.00 178.15 177.08 2da1 s ASN 29 N -5.01 0.24 0.01 1.72 2.47 0.08 -5.07 114.94 109.38 2da1 s ASN 29 Ca -0.15 0.18 -0.01 0.00 0.42 0.00 0.00 52.86 53.30 2da1 s ASN 29 Cb 0.11 0.06 -0.00 0.00 -1.45 0.00 0.00 41.25 39.97 2da1 s ASN 29 CO 0.65 -0.17 0.77 0.59 -3.72 0.00 0.00 177.10 175.23 2da1 n ASN 30 N 4.50 -0.05 -4.51 -4.21 5.03 -1.18 -4.09 115.26 110.76 2da1 n ASN 30 Ca -0.21 0.79 -0.31 0.00 0.87 0.00 0.00 54.58 55.71 2da1 n ASN 30 Cb 0.51 -0.36 -0.12 0.00 -1.02 0.00 0.00 39.78 38.78 2da1 n ASN 30 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.26 174.99 2da1 s SER 31 N -3.14 4.12 0.59 6.41 0.01 -1.26 -4.63 113.70 115.80 2da1 s SER 31 Ca -0.01 -0.30 -0.18 0.00 1.31 0.00 0.00 55.95 56.78 2da1 s SER 31 Cb 0.00 -0.80 -0.03 0.00 0.21 0.00 0.00 66.02 65.40 2da1 s SER 31 CO 0.03 0.27 1.12 -2.16 0.41 0.00 0.00 173.24 172.91 2da1 s PRO 32 N -1.36 3.12 0.25 12.44 0.04 -1.26 -5.04 135.00 143.18 2da1 s PRO 32 Ca 0.15 1.51 -0.03 0.00 0.04 0.00 0.00 61.00 62.67 2da1 s PRO 32 Cb -0.11 -1.98 -0.05 0.00 0.04 0.00 0.00 34.50 32.40 2da1 s PRO 32 CO 0.06 -1.02 0.48 0.45 0.04 0.00 0.00 177.00 177.01 2da1 s SER 33 N -2.12 6.42 0.61 6.66 0.15 -1.26 -4.73 113.70 119.42 2da1 s SER 33 Ca 0.70 0.58 0.27 0.00 0.70 0.00 0.00 55.95 58.20 2da1 s SER 33 Cb -0.22 -2.08 0.95 0.00 -1.71 0.00 0.00 66.02 62.95 2da1 s SER 33 CO 0.33 -0.12 1.32 -0.33 1.20 0.00 0.00 173.24 175.64 2da1 h GLU 34 N 1.87 0.00 0.20 5.44 5.08 -1.99 1.91 114.58 127.09 2da1 h GLU 34 Ca -0.48 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 57.53 2da1 h GLU 34 Cb 1.19 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.45 2da1 h GLU 34 CO 0.67 0.00 -1.69 0.93 -1.00 0.00 0.00 179.01 177.92 2da1 h GLU 35 N 0.00 0.42 -0.10 2.33 4.39 -2.00 -3.30 114.58 116.32 2da1 h GLU 35 Ca 0.51 -0.73 -0.15 0.00 0.34 0.00 0.00 59.36 59.33 2da1 h GLU 35 Cb 2.95 0.27 0.01 0.00 -0.10 0.00 0.00 28.75 31.87 2da1 h GLU 35 CO -0.01 1.34 -0.51 1.96 -1.16 0.00 0.00 179.01 180.64 2da1 h GLN 36 N 0.12 0.53 -0.66 2.33 1.08 0.25 -2.40 115.11 116.36 2da1 h GLN 36 Ca -0.32 -0.43 0.17 0.00 -1.45 0.00 0.00 58.65 56.62 2da1 h GLN 36 Cb 2.12 0.09 -0.03 0.00 -0.05 0.00 0.00 27.48 29.60 2da1 h GLN 36 CO 0.20 1.06 0.46 0.82 -0.95 0.00 0.00 178.83 180.42 2da1 h ILE 37 N 0.13 0.71 0.00 2.54 2.04 -0.75 0.94 117.51 123.13 2da1 h ILE 37 Ca -0.03 -0.03 -0.03 0.00 1.00 0.00 0.00 64.86 65.76 2da1 h ILE 37 Cb 1.16 0.60 -0.00 0.00 -0.74 0.00 0.00 36.82 37.83 2da1 h ILE 37 CO 0.11 0.02 -0.18 0.50 0.00 0.00 0.00 178.15 178.60 2da1 h LYS 38 N 0.10 0.00 -0.80 2.37 1.63 -1.62 -2.01 116.57 116.24 2da1 h LYS 38 Ca 0.32 0.00 0.13 0.00 -0.85 0.00 0.00 60.65 60.25 2da1 h LYS 38 Cb 1.11 0.00 -0.06 0.00 -0.60 0.00 0.00 32.23 32.68 2da1 h LYS 38 CO -0.03 0.78 0.53 1.05 -3.45 0.00 0.00 179.45 178.32 2da1 h GLU 39 N -1.00 0.56 0.02 1.90 4.11 -0.89 -2.34 114.58 116.94 2da1 h GLU 39 Ca -0.04 -0.03 -0.04 0.00 0.07 0.00 0.00 59.36 59.31 2da1 h GLU 39 Cb 0.83 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.96 2da1 h GLU 39 CO -0.03 0.37 -0.16 0.52 0.07 0.00 0.00 179.01 179.78 2da1 h MET 40 N 0.58 0.08 -1.45 1.06 2.86 -0.95 -2.55 114.93 114.55 2da1 h MET 40 Ca 0.39 -0.11 0.42 0.00 -2.06 0.00 0.00 59.70 58.34 2da1 h MET 40 Cb 0.71 0.04 -0.06 0.00 0.06 0.00 0.00 31.60 32.35 2da1 h MET 40 CO -0.15 0.97 1.17 0.00 1.06 0.00 0.00 176.91 179.95 2da1 h ALA 41 N 0.12 3.36 0.08 6.32 0.00 -0.81 0.51 119.26 128.84 2da1 h ALA 41 Ca -0.03 -0.05 -0.37 0.00 0.00 0.00 0.00 54.91 54.46 2da1 h ALA 41 Cb 1.04 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.91 2da1 h ALA 41 CO 0.03 -1.91 -2.14 -3.47 0.00 0.00 0.00 179.25 171.76 2da1 n ASP 42 N -3.82 2.08 -0.36 0.00 -0.08 -1.08 -1.37 116.55 111.91 2da1 n ASP 42 Ca 0.32 0.11 0.04 0.00 -1.51 0.00 0.00 54.79 53.75 2da1 n ASP 42 Cb 1.62 -0.73 0.20 0.00 2.34 0.00 0.00 41.12 44.55 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 0.02 1.08 0.01 -0.67 1.57 0.36 -3.17 116.57 115.77 2da1 h LYS 43 Ca -0.47 -0.06 -0.39 0.00 -1.87 0.00 0.00 60.65 57.85 2da1 h LYS 43 Cb 1.98 -0.24 -0.06 0.00 0.08 0.00 0.00 32.23 33.98 2da1 h LYS 43 CO 0.02 0.71 -2.42 -1.13 -0.57 0.00 0.00 179.45 176.07 2da1 n SER 44 N -4.53 1.99 0.00 0.86 3.41 0.02 -5.02 113.62 110.36 2da1 n SER 44 Ca 0.16 -0.06 0.00 0.00 -0.26 0.00 0.00 58.87 58.72 2da1 n SER 44 Cb 0.23 -0.50 0.00 0.00 -0.26 0.00 0.00 64.21 63.68 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 2.14 0.83 3.86 5.00 0.00 -0.47 -4.99 105.19 111.56 2da1 n GLY 45 Ca -0.45 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.25 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 3.98 1.17 0.99 1.43 -0.85 -4.91 118.68 120.50 2da1 s LEU 46 Ca 0.00 1.19 -0.18 0.00 -1.03 0.00 0.00 54.13 54.11 2da1 s LEU 46 Cb 0.00 -4.03 0.27 0.00 0.03 0.00 0.00 46.19 42.47 2da1 s LEU 46 CO 0.00 -0.27 1.11 -2.16 0.23 0.00 0.00 176.35 175.26 2da1 s PRO 47 N -3.31 -1.00 0.41 1.29 0.04 -1.26 -4.17 135.00 127.00 2da1 s PRO 47 Ca 0.53 0.01 0.23 0.00 0.04 0.00 0.00 61.00 61.81 2da1 s PRO 47 Cb -0.10 -1.62 0.40 0.00 0.04 0.00 0.00 34.50 33.22 2da1 s PRO 47 CO 0.23 -3.58 1.63 1.96 0.04 0.00 0.00 177.00 177.28 2da1 h GLN 48 N -2.49 0.00 0.19 4.56 4.20 -1.94 -2.99 115.11 116.64 2da1 h GLN 48 Ca -0.46 0.00 -0.33 0.00 0.06 0.00 0.00 58.65 57.92 2da1 h GLN 48 Cb 1.30 0.00 0.02 0.00 0.30 0.00 0.00 27.48 29.10 2da1 h GLN 48 CO 0.38 0.00 -1.52 1.57 -0.67 0.00 0.00 178.83 178.59 2da1 h LYS 49 N 0.00 0.41 -0.12 1.46 2.10 -1.97 -2.93 116.57 115.52 2da1 h LYS 49 Ca 0.00 -0.70 -0.04 0.00 -2.00 0.00 0.00 60.65 57.90 2da1 h LYS 49 Cb 0.96 0.26 -0.00 0.00 -0.90 0.00 0.00 32.23 32.55 2da1 h LYS 49 CO 0.00 1.32 -0.10 0.28 -2.00 0.00 0.00 179.45 178.95 2da1 h VAL 50 N 0.11 1.34 0.61 0.07 2.07 -1.94 -2.34 116.25 116.17 2da1 h VAL 50 Ca -0.26 -1.21 -0.03 0.00 0.82 0.00 0.00 66.70 66.02 2da1 h VAL 50 Cb 2.10 1.88 0.01 0.00 -1.52 0.00 0.00 31.29 33.75 2da1 h VAL 50 CO 0.22 0.35 -0.29 0.40 0.02 0.00 0.00 177.57 178.27 2da1 h ILE 51 N -0.10 0.38 -0.26 4.57 2.04 -1.67 -0.80 117.51 121.66 2da1 h ILE 51 Ca 0.02 -0.11 0.06 0.00 1.00 0.00 0.00 64.86 65.84 2da1 h ILE 51 Cb 0.60 0.42 -0.08 0.00 -0.74 0.00 0.00 36.82 37.02 2da1 h ILE 51 CO 0.02 0.02 -0.32 0.11 0.00 0.00 0.00 178.15 177.98 2da1 h LYS 52 N -0.89 -0.31 -0.10 2.37 1.57 -1.61 -1.43 116.57 116.18 2da1 h LYS 52 Ca -0.08 0.02 0.04 0.00 -1.87 0.00 0.00 60.65 58.76 2da1 h LYS 52 Cb 0.65 0.07 -0.05 0.00 0.08 0.00 0.00 32.23 32.98 2da1 h LYS 52 CO 0.14 -0.21 -0.19 1.25 -0.57 0.00 0.00 179.45 179.87 2da1 h HIS 53 N -0.32 -0.50 -0.62 -1.35 2.76 -1.39 -2.25 115.15 111.48 2da1 h HIS 53 Ca 0.13 0.02 0.12 0.00 -2.20 0.00 0.00 60.37 58.45 2da1 h HIS 53 Cb 0.54 0.24 -0.12 0.00 1.55 0.00 0.00 27.41 29.61 2da1 h HIS 53 CO -0.47 -0.27 -0.17 2.35 -1.30 0.00 0.00 177.93 178.07 2da1 h TRP 54 N -0.26 -0.37 -0.75 5.26 7.01 -0.46 0.41 115.95 126.79 2da1 h TRP 54 Ca 0.09 0.06 0.10 0.00 2.11 0.00 0.00 58.89 61.24 2da1 h TRP 54 Cb 0.38 0.26 -0.05 0.00 -2.10 0.00 0.00 29.16 27.65 2da1 h TRP 54 CO -0.29 -0.28 0.49 0.74 -2.79 0.00 0.00 178.44 176.32 2da1 h PHE 55 N -0.01 0.70 0.22 2.65 0.04 -0.73 -0.18 116.94 119.64 2da1 h PHE 55 Ca 0.30 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 61.07 2da1 h PHE 55 Cb 0.47 -0.23 0.00 0.00 2.20 0.00 0.00 35.95 38.39 2da1 h PHE 55 CO -0.52 0.33 -0.11 -0.09 -0.60 0.00 0.00 178.31 177.32 2da1 h ARG 56 N 0.65 -0.29 -1.15 1.51 9.65 0.14 0.35 114.38 125.24 2da1 h ARG 56 Ca 0.35 0.02 0.33 0.00 -1.10 0.00 0.00 59.98 59.57 2da1 h ARG 56 Cb 0.48 0.07 -0.07 0.00 -1.39 0.00 0.00 29.97 29.06 2da1 h ARG 56 CO -0.13 -0.19 0.80 -0.97 2.80 0.00 0.00 179.97 182.28 2da1 h ASN 57 N -0.81 0.17 0.00 -3.80 -1.24 -0.57 0.40 115.58 109.73 2da1 h ASN 57 Ca -0.03 0.04 -0.06 0.00 0.71 0.00 0.00 56.30 56.95 2da1 h ASN 57 Cb 0.23 0.01 -0.01 0.00 0.73 0.00 0.00 38.32 39.28 2da1 h ASN 57 CO 0.05 0.02 -0.44 0.74 -1.29 0.00 0.00 177.43 176.51 2da1 h THR 58 N 0.14 0.82 0.17 -3.57 2.02 -1.08 -3.32 112.91 108.10 2da1 h THR 58 Ca 0.60 -1.75 0.01 0.00 0.77 0.00 0.00 66.41 66.04 2da1 h THR 58 Cb 2.04 1.69 -0.04 0.00 -1.74 0.00 0.00 68.15 70.10 2da1 h THR 58 CO -0.14 0.28 -0.33 0.25 0.37 0.00 0.00 175.52 175.95 2da1 h LEU 59 N -1.00 -0.94 -1.00 2.58 5.85 0.60 -1.75 115.31 119.65 2da1 h LEU 59 Ca -0.10 0.10 0.33 0.00 0.84 0.00 0.00 57.88 59.06 2da1 h LEU 59 Cb 0.77 0.35 -0.15 0.00 0.37 0.00 0.00 40.66 41.99 2da1 h LEU 59 CO -0.06 -0.43 0.55 0.15 -0.34 0.00 0.00 178.44 178.31 2da1 h PHE 60 N -0.59 0.88 0.20 1.25 3.04 -0.42 0.21 116.94 121.52 2da1 h PHE 60 Ca 0.02 0.04 -0.01 0.00 3.98 0.00 0.00 57.97 62.00 2da1 h PHE 60 Cb 0.60 -0.22 0.00 0.00 2.56 0.00 0.00 35.95 38.89 2da1 h PHE 60 CO -0.27 -0.23 -0.10 0.87 -2.02 0.00 0.00 178.31 176.57 2da1 h LYS 61 N 0.27 -0.26 -0.31 1.11 1.79 -1.42 -2.31 116.57 115.43 2da1 h LYS 61 Ca 0.74 0.02 0.08 0.00 -2.18 0.00 0.00 60.65 59.31 2da1 h LYS 61 Cb 1.74 0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 32.43 2da1 h LYS 61 CO -0.64 -0.15 0.22 0.93 -1.08 0.00 0.00 179.45 178.73 2da1 h GLU 62 N -0.30 0.06 0.00 3.15 4.39 -0.34 0.12 114.58 121.65 2da1 h GLU 62 Ca -0.03 -0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.64 2da1 h GLU 62 Cb 0.23 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.87 2da1 h GLU 62 CO 0.05 0.04 -0.13 0.00 -1.16 0.00 0.00 179.01 177.80 2da1 h ARG 63 N 0.06 0.00 -6.28 2.33 2.47 -0.73 -3.45 114.38 108.78 2da1 h ARG 63 Ca 0.15 0.00 -0.59 0.00 -1.26 0.00 0.00 59.98 58.28 2da1 h ARG 63 Cb 0.51 0.00 0.18 0.00 -1.65 0.00 0.00 29.97 29.01 2da1 h ARG 63 CO -0.01 0.13 -0.77 0.00 0.56 0.00 0.00 179.97 179.88 2da1 n GLN 64 N -3.45 0.26 -3.66 0.04 10.64 0.42 -4.98 117.38 116.65 2da1 n GLN 64 Ca -0.01 0.10 -0.29 0.00 -1.83 0.00 0.00 57.00 54.97 2da1 n GLN 64 Cb 0.29 -1.38 -0.15 0.00 -0.86 0.00 0.00 30.24 28.15 2da1 n GLN 64 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.06 175.68 2da1 s SER 65 N -1.11 3.80 0.03 2.61 0.15 -1.26 -5.09 113.70 112.82 2da1 s SER 65 Ca 0.63 -1.64 0.02 0.00 0.70 0.00 0.00 55.95 55.65 2da1 s SER 65 Cb -0.45 -0.70 -0.04 0.00 -1.71 0.00 0.00 66.02 63.12 2da1 s SER 65 CO 0.60 -0.41 0.04 -0.83 1.20 0.00 0.00 173.24 173.85 2da1 s GLY 66 N 1.64 1.96 0.77 9.45 0.00 -1.26 -5.11 107.32 114.77 2da1 s GLY 66 Ca 0.11 -0.96 -0.11 0.00 0.00 0.00 0.00 44.72 43.76 2da1 s GLY 66 CO -0.25 -0.87 1.09 2.56 0.00 0.00 0.00 173.10 175.63 2da1 s PRO 67 N -1.89 2.28 -0.10 2.90 0.04 -1.26 -5.05 135.00 131.91 2da1 s PRO 67 Ca 0.24 1.18 -0.00 0.00 0.04 0.00 0.00 61.00 62.45 2da1 s PRO 67 Cb -0.12 -1.90 -0.03 0.00 0.04 0.00 0.00 34.50 32.50 2da1 s PRO 67 CO 0.15 -1.63 -0.08 0.45 0.04 0.00 0.00 177.00 175.93 2da1 s SER 68 N -3.35 4.48 -0.20 6.66 0.15 -1.26 -5.10 113.70 115.08 2da1 s SER 68 Ca 0.61 -0.14 -0.04 0.00 0.70 0.00 0.00 55.95 57.09 2da1 s SER 68 Cb -0.17 -1.39 0.10 0.00 -1.71 0.00 0.00 66.02 62.85 2da1 s SER 68 CO 0.55 0.27 0.29 -0.94 1.20 0.00 0.00 173.24 174.61 2da1 s SER 69 N -0.25 0.69 0.00 5.45 1.04 -1.26 -5.37 113.70 114.00 2da1 s SER 69 Ca 0.03 0.17 0.00 0.00 0.48 0.00 0.00 55.95 56.63 2da1 s SER 69 Cb -0.13 0.74 0.00 0.00 0.10 0.00 0.00 66.02 66.74 2da1 s SER 69 CO 0.03 -0.29 0.00 0.61 0.98 0.00 0.00 173.24 174.56