#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 -0.43 -0.00 1.61 0.01 -1.26 -5.14 113.70 108.49 2da1 s SER 2 Ca 0.00 0.42 -0.30 0.00 1.31 0.00 0.00 55.95 57.38 2da1 s SER 2 Cb 0.00 0.44 -0.04 0.00 0.21 0.00 0.00 66.02 66.64 2da1 s SER 2 CO 0.00 -0.52 1.10 -0.55 0.41 0.00 0.00 173.24 173.68 2da1 s SER 3 N -1.22 7.20 0.00 2.44 0.15 -1.26 -4.71 113.70 116.30 2da1 s SER 3 Ca -0.12 1.79 0.00 0.00 0.70 0.00 0.00 55.95 58.32 2da1 s SER 3 Cb -0.03 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.71 2da1 s SER 3 CO 0.07 -0.41 0.00 0.61 1.20 0.00 0.00 173.24 174.70 2da1 n GLY 4 N 3.12 1.18 0.24 9.45 0.00 -1.26 -4.77 105.19 113.14 2da1 n GLY 4 Ca 0.08 -0.62 -0.14 0.00 0.00 0.00 0.00 46.02 45.34 2da1 n GLY 4 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2da1 h SER 5 N 0.00 -0.44 -0.64 1.61 0.02 -1.98 -3.16 113.55 108.96 2da1 h SER 5 Ca 0.00 -0.11 0.10 0.00 -0.84 0.00 0.00 61.79 60.95 2da1 h SER 5 Cb 0.00 0.11 -0.08 0.00 0.14 0.00 0.00 62.40 62.58 2da1 h SER 5 CO 0.00 -0.13 0.23 0.28 -1.14 0.00 0.00 176.83 176.07 2da1 h SER 6 N -0.77 0.21 -3.26 3.07 0.02 -2.00 -3.42 113.55 107.41 2da1 h SER 6 Ca -0.05 0.09 -0.47 0.00 -0.84 0.00 0.00 61.79 60.52 2da1 h SER 6 Cb 0.52 0.07 0.05 0.00 0.14 0.00 0.00 62.40 63.18 2da1 h SER 6 CO 0.09 0.12 0.07 -0.83 -1.14 0.00 0.00 176.83 175.13 2da1 s GLY 7 N -3.21 1.62 -0.20 -3.77 0.00 -1.19 -5.05 107.32 95.52 2da1 s GLY 7 Ca -0.13 -0.89 -0.15 0.00 0.00 0.00 0.00 44.72 43.55 2da1 s GLY 7 CO 0.75 -0.63 -0.33 0.28 0.00 0.00 0.00 173.10 173.16 2da1 n LYS 8 N -2.41 0.51 -3.46 2.90 5.02 -1.26 -4.80 118.16 114.66 2da1 n LYS 8 Ca 0.04 0.21 -0.30 0.00 -2.02 0.00 0.00 58.31 56.24 2da1 n LYS 8 Cb 0.58 -1.39 -0.04 0.00 -0.02 0.00 0.00 35.03 34.16 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 -2.71 3.66 -0.07 1.97 1.81 -1.26 -5.01 118.95 117.34 2da1 s ARG 9 Ca -0.30 0.02 -0.30 0.00 -1.72 0.00 0.00 55.73 53.43 2da1 s ARG 9 Cb 0.07 -2.71 -0.05 0.00 -0.45 0.00 0.00 34.95 31.82 2da1 s ARG 9 CO 0.42 0.31 1.51 -1.25 -0.68 0.00 0.00 175.30 175.60 2da1 s PRO 10 N -3.17 4.21 -0.26 3.54 0.04 -1.26 -4.98 135.00 133.13 2da1 s PRO 10 Ca 0.44 2.01 -0.28 0.00 0.04 0.00 0.00 61.00 63.21 2da1 s PRO 10 Cb -0.11 -3.84 0.01 0.00 0.04 0.00 0.00 34.50 30.60 2da1 s PRO 10 CO 0.27 -0.76 1.02 0.50 0.04 0.00 0.00 177.00 178.06 2da1 s ARG 11 N 3.56 4.19 -0.10 4.56 6.06 -1.26 -5.02 118.95 130.94 2da1 s ARG 11 Ca 0.67 1.20 -0.24 0.00 -2.50 0.00 0.00 55.73 54.86 2da1 s ARG 11 Cb -0.30 -3.67 -0.03 0.00 0.06 0.00 0.00 34.95 31.01 2da1 s ARG 11 CO 0.25 -0.69 0.75 -0.08 -2.50 0.00 0.00 175.30 173.03 2da1 s THR 12 N 3.28 4.99 -0.30 4.11 -1.32 -1.26 -5.02 115.64 120.11 2da1 s THR 12 Ca 0.43 1.53 -0.09 0.00 -1.21 0.00 0.00 61.69 62.35 2da1 s THR 12 Cb -0.14 -4.08 0.17 0.00 -1.51 0.00 0.00 72.50 66.94 2da1 s THR 12 CO 0.09 0.17 0.84 -0.60 -2.21 0.00 0.00 174.62 172.91 2da1 s ARG 13 N 1.25 0.38 -0.01 7.08 3.52 -1.26 -5.16 118.95 124.75 2da1 s ARG 13 Ca 0.38 0.76 -0.01 0.00 -0.13 0.00 0.00 55.73 56.73 2da1 s ARG 13 Cb -0.18 0.44 -0.04 0.00 -1.56 0.00 0.00 34.95 33.61 2da1 s ARG 13 CO 0.17 -0.34 0.12 0.42 -0.81 0.00 0.00 175.30 174.87 2da1 s ILE 14 N 2.82 5.02 0.54 4.11 1.01 -1.26 -5.12 121.20 128.32 2da1 s ILE 14 Ca 0.06 -0.31 0.08 0.00 0.00 0.00 0.00 60.65 60.48 2da1 s ILE 14 Cb -0.11 -3.32 0.05 0.00 0.01 0.00 0.00 42.46 39.09 2da1 s ILE 14 CO -0.17 0.34 0.59 0.28 0.00 0.00 0.00 174.94 175.98 2da1 s THR 15 N -1.25 2.03 0.25 2.92 -1.32 -1.26 -4.96 115.64 112.06 2da1 s THR 15 Ca 0.25 -1.23 0.12 0.00 -1.21 0.00 0.00 61.69 59.61 2da1 s THR 15 Cb -0.12 -2.26 0.00 0.00 -1.51 0.00 0.00 72.50 68.60 2da1 s THR 15 CO 0.16 0.00 1.63 -0.78 -2.21 0.00 0.00 174.62 173.42 2da1 h ASP 16 N 0.51 0.00 1.06 8.08 3.58 -1.99 -0.54 116.42 127.11 2da1 h ASP 16 Ca -0.34 0.00 -0.07 0.00 0.42 0.00 0.00 57.03 57.04 2da1 h ASP 16 Cb 1.29 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.33 2da1 h ASP 16 CO 0.49 0.58 -0.33 0.44 -2.88 0.00 0.00 179.24 177.54 2da1 h ASP 17 N 0.00 0.00 0.14 2.28 3.32 -2.00 -2.32 116.42 117.83 2da1 h ASP 17 Ca -0.01 0.00 -0.36 0.00 0.02 0.00 0.00 57.03 56.68 2da1 h ASP 17 Cb 1.06 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.59 2da1 h ASP 17 CO 0.07 0.33 -2.04 0.00 -1.72 0.00 0.00 179.24 175.88 2da1 n GLN 18 N -3.39 0.74 -0.21 3.56 6.02 -1.10 -4.06 117.38 118.94 2da1 n GLN 18 Ca 0.01 0.25 -0.08 0.00 -0.01 0.00 0.00 57.00 57.16 2da1 n GLN 18 Cb 0.53 -1.69 0.03 0.00 1.02 0.00 0.00 30.24 30.12 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 0.06 0.93 -0.68 1.08 5.85 -1.13 -2.92 115.31 118.49 2da1 h LEU 19 Ca -0.43 -0.25 0.10 0.00 0.84 0.00 0.00 57.88 58.14 2da1 h LEU 19 Cb 2.02 -0.25 -0.07 0.00 0.37 0.00 0.00 40.66 42.73 2da1 h LEU 19 CO 0.07 0.94 0.31 0.08 -0.34 0.00 0.00 178.44 179.49 2da1 h ARG 20 N 0.89 0.50 -0.51 1.25 0.11 -1.60 0.92 114.38 115.95 2da1 h ARG 20 Ca 0.19 -0.03 0.04 0.00 0.10 0.00 0.00 59.98 60.28 2da1 h ARG 20 Cb 0.38 -0.11 -0.03 0.00 1.11 0.00 0.00 29.97 31.32 2da1 h ARG 20 CO 0.01 0.33 0.34 0.28 0.10 0.00 0.00 179.97 181.03 2da1 h VAL 21 N 0.52 1.03 0.03 0.08 2.07 -1.66 -0.62 116.25 117.70 2da1 h VAL 21 Ca 0.35 -0.18 -0.22 0.00 0.82 0.00 0.00 66.70 67.46 2da1 h VAL 21 Cb 0.41 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 30.61 2da1 h VAL 21 CO -0.30 0.10 -1.03 -0.07 0.02 0.00 0.00 177.57 176.29 2da1 h LEU 22 N 0.53 0.12 0.12 2.57 3.38 -0.96 -3.32 115.31 117.75 2da1 h LEU 22 Ca 0.21 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 2da1 h LEU 22 Cb 0.16 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2da1 h LEU 22 CO -0.05 1.07 -0.06 0.03 0.09 0.00 0.00 178.44 179.52 2da1 h ARG 23 N 0.03 -0.15 -0.90 1.13 2.47 0.15 -2.42 114.38 114.69 2da1 h ARG 23 Ca -0.04 0.01 0.22 0.00 -1.26 0.00 0.00 59.98 58.91 2da1 h ARG 23 Cb 1.76 0.03 -0.16 0.00 -1.65 0.00 0.00 29.97 29.95 2da1 h ARG 23 CO 0.15 0.24 -0.00 1.96 0.56 0.00 0.00 179.97 182.87 2da1 h GLN 24 N -0.58 0.05 -0.07 0.04 4.20 -1.28 0.93 115.11 118.40 2da1 h GLN 24 Ca -0.02 -0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.57 2da1 h GLN 24 Cb 0.46 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.22 2da1 h GLN 24 CO 0.03 0.03 -0.50 1.88 -0.67 0.00 0.00 178.83 179.60 2da1 h TYR 25 N 0.05 0.23 -0.15 2.96 0.05 -1.65 -3.23 116.97 115.23 2da1 h TYR 25 Ca 0.51 -0.07 0.03 0.00 0.05 0.00 0.00 58.73 59.25 2da1 h TYR 25 Cb 0.98 -0.05 -0.06 0.00 1.01 0.00 0.00 36.73 38.61 2da1 h TYR 25 CO -0.49 0.65 -0.53 0.35 -1.05 0.00 0.00 178.16 177.08 2da1 h PHE 26 N 0.15 -1.59 -0.05 4.88 3.57 0.14 0.51 116.94 124.55 2da1 h PHE 26 Ca 0.01 0.06 0.03 0.00 3.53 0.00 0.00 57.97 61.60 2da1 h PHE 26 Cb 0.93 0.71 -0.04 0.00 2.79 0.00 0.00 35.95 40.34 2da1 h PHE 26 CO 0.01 -0.53 -0.21 0.22 -2.23 0.00 0.00 178.31 175.57 2da1 h ASP 27 N -0.56 -0.63 -0.62 0.41 3.58 -1.56 -1.01 116.42 116.03 2da1 h ASP 27 Ca 0.03 0.10 0.12 0.00 0.42 0.00 0.00 57.03 57.70 2da1 h ASP 27 Cb 0.66 0.27 -0.04 0.00 1.72 0.00 0.00 39.33 41.94 2da1 h ASP 27 CO -0.44 -0.27 0.42 0.40 -2.88 0.00 0.00 179.24 176.47 2da1 h ILE 28 N -0.31 0.83 -1.79 2.25 2.04 -1.44 -3.40 117.51 115.69 2da1 h ILE 28 Ca 0.07 -0.11 0.09 0.00 1.00 0.00 0.00 64.86 65.91 2da1 h ILE 28 Cb 0.41 0.49 -0.20 0.00 -0.74 0.00 0.00 36.82 36.78 2da1 h ILE 28 CO -0.23 0.06 -0.14 0.54 0.00 0.00 0.00 178.15 178.38 2da1 s ASN 29 N -6.16 -1.16 0.07 1.72 4.22 0.17 -5.06 114.94 108.74 2da1 s ASN 29 Ca -0.07 1.43 -0.14 0.00 -2.14 0.00 0.00 52.86 51.94 2da1 s ASN 29 Cb 0.20 2.26 -0.03 0.00 1.28 0.00 0.00 41.25 44.96 2da1 s ASN 29 CO 0.75 -0.22 0.94 0.59 -2.04 0.00 0.00 177.10 177.12 2da1 n ASN 30 N 5.43 -0.47 -4.39 3.54 3.02 -0.90 -3.94 115.26 117.55 2da1 n ASN 30 Ca -0.10 1.05 -0.31 0.00 -0.03 0.00 0.00 54.58 55.19 2da1 n ASN 30 Cb 0.49 -0.23 -0.14 0.00 -0.61 0.00 0.00 39.78 39.29 2da1 n ASN 30 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2da1 s SER 31 N -4.48 3.45 0.93 6.41 0.15 -1.26 -4.69 113.70 114.20 2da1 s SER 31 Ca -0.05 -0.44 -0.12 0.00 0.70 0.00 0.00 55.95 56.04 2da1 s SER 31 Cb 0.05 -0.48 0.15 0.00 -1.71 0.00 0.00 66.02 64.02 2da1 s SER 31 CO 0.28 0.29 1.09 -2.16 1.20 0.00 0.00 173.24 173.94 2da1 s PRO 32 N -1.01 1.02 0.16 5.44 0.04 -1.26 -5.07 135.00 134.32 2da1 s PRO 32 Ca 0.12 0.74 0.07 0.00 0.04 0.00 0.00 61.00 61.96 2da1 s PRO 32 Cb -0.10 -1.79 -0.04 0.00 0.04 0.00 0.00 34.50 32.61 2da1 s PRO 32 CO 0.02 -2.38 0.01 -1.54 0.04 0.00 0.00 177.00 173.15 2da1 s SER 33 N -3.43 4.87 0.49 6.66 1.04 -1.26 -4.83 113.70 117.24 2da1 s SER 33 Ca 0.64 -0.34 0.43 0.00 0.48 0.00 0.00 55.95 57.16 2da1 s SER 33 Cb -0.18 -1.08 1.54 0.00 0.10 0.00 0.00 66.02 66.40 2da1 s SER 33 CO 0.57 0.10 1.42 -0.62 0.98 0.00 0.00 173.24 175.69 2da1 n GLU 34 N -0.03 -0.01 0.03 4.02 1.02 -1.26 0.23 120.64 124.64 2da1 n GLU 34 Ca -0.10 1.01 -0.19 0.00 -0.02 0.00 0.00 57.16 57.87 2da1 n GLU 34 Cb 0.55 -2.28 -0.12 0.00 -0.02 0.00 0.00 31.44 29.57 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 0.50 0.03 3.49 4.39 -2.00 -3.25 114.58 117.73 2da1 h GLU 35 Ca 0.85 -0.58 -0.00 0.00 0.34 0.00 0.00 59.36 59.97 2da1 h GLU 35 Cb 3.30 0.17 0.00 0.00 -0.10 0.00 0.00 28.75 32.13 2da1 h GLU 35 CO -0.08 1.21 -0.01 1.96 -1.16 0.00 0.00 179.01 180.92 2da1 h GLN 36 N 0.03 -0.04 -1.16 2.33 4.20 0.26 -2.55 115.11 118.19 2da1 h GLN 36 Ca -0.11 0.00 0.34 0.00 0.06 0.00 0.00 58.65 58.94 2da1 h GLN 36 Cb 1.52 0.01 -0.05 0.00 0.30 0.00 0.00 27.48 29.26 2da1 h GLN 36 CO 0.16 0.56 0.95 0.82 -0.67 0.00 0.00 178.83 180.65 2da1 h ILE 37 N -0.68 0.25 0.00 2.54 2.04 -0.66 0.14 117.51 121.13 2da1 h ILE 37 Ca -0.00 0.00 -0.10 0.00 1.00 0.00 0.00 64.86 65.75 2da1 h ILE 37 Cb 0.62 0.30 -0.02 0.00 -0.74 0.00 0.00 36.82 36.98 2da1 h ILE 37 CO 0.01 0.00 -0.57 0.50 0.00 0.00 0.00 178.15 178.09 2da1 h LYS 38 N 0.00 0.00 -0.45 2.37 1.63 -1.58 -2.79 116.57 115.76 2da1 h LYS 38 Ca 0.55 0.00 0.12 0.00 -0.85 0.00 0.00 60.65 60.47 2da1 h LYS 38 Cb 2.45 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 34.06 2da1 h LYS 38 CO -0.01 0.93 0.32 1.05 -3.45 0.00 0.00 179.45 178.29 2da1 h GLU 39 N -1.00 0.03 0.04 1.90 4.11 -0.47 -2.13 114.58 117.05 2da1 h GLU 39 Ca -0.15 -0.00 -0.05 0.00 0.07 0.00 0.00 59.36 59.22 2da1 h GLU 39 Cb 1.08 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 30.33 2da1 h GLU 39 CO -0.09 0.02 -0.22 0.52 0.07 0.00 0.00 179.01 179.31 2da1 h MET 40 N 0.03 0.08 -1.02 1.06 2.86 -0.97 -2.22 114.93 114.75 2da1 h MET 40 Ca 0.21 -0.14 0.30 0.00 -2.06 0.00 0.00 59.70 58.01 2da1 h MET 40 Cb 0.81 0.05 -0.04 0.00 0.06 0.00 0.00 31.60 32.48 2da1 h MET 40 CO -0.01 1.05 0.84 0.00 1.06 0.00 0.00 176.91 179.86 2da1 h ALA 41 N 0.04 2.90 0.09 6.32 0.00 -1.10 0.19 119.26 127.71 2da1 h ALA 41 Ca -0.04 -0.04 -0.37 0.00 0.00 0.00 0.00 54.91 54.47 2da1 h ALA 41 Cb 1.16 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 19.00 2da1 h ALA 41 CO 0.04 -1.37 -2.09 -3.47 0.00 0.00 0.00 179.25 172.37 2da1 n ASP 42 N -3.91 2.09 -0.32 0.00 -0.08 -1.05 -0.86 116.55 112.43 2da1 n ASP 42 Ca 0.22 0.14 -0.00 0.00 -1.51 0.00 0.00 54.79 53.64 2da1 n ASP 42 Cb 1.18 -0.77 0.17 0.00 2.34 0.00 0.00 41.12 44.04 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 1.17 0.00 -0.67 1.57 -0.15 -3.28 116.57 115.23 2da1 h LYS 43 Ca -0.46 -0.07 -0.38 0.00 -1.87 0.00 0.00 60.65 57.87 2da1 h LYS 43 Cb 1.98 -0.26 -0.06 0.00 0.08 0.00 0.00 32.23 33.97 2da1 h LYS 43 CO 0.04 0.78 -2.35 -1.13 -0.57 0.00 0.00 179.45 176.21 2da1 n SER 44 N -4.41 2.01 0.00 0.86 3.41 0.41 -5.03 113.62 110.87 2da1 n SER 44 Ca 0.11 0.05 0.00 0.00 -0.26 0.00 0.00 58.87 58.77 2da1 n SER 44 Cb 0.04 -0.52 0.00 0.00 -0.26 0.00 0.00 64.21 63.48 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 2.00 1.16 3.80 5.00 0.00 -0.04 -5.04 105.19 112.07 2da1 n GLY 45 Ca -0.44 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.23 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 1.16 0.99 1.43 -1.10 -4.89 118.68 120.17 2da1 s LEU 46 Ca 0.00 1.90 -0.18 0.00 -1.03 0.00 0.00 54.13 54.82 2da1 s LEU 46 Cb 0.00 -4.51 0.27 0.00 0.03 0.00 0.00 46.19 41.97 2da1 s LEU 46 CO 0.00 -0.67 1.11 -2.16 0.23 0.00 0.00 176.35 174.85 2da1 s PRO 47 N -3.13 -0.87 0.39 1.29 0.04 -1.26 -4.10 135.00 127.36 2da1 s PRO 47 Ca 0.65 0.06 0.21 0.00 0.04 0.00 0.00 61.00 61.96 2da1 s PRO 47 Cb -0.16 -1.63 0.34 0.00 0.04 0.00 0.00 34.50 33.10 2da1 s PRO 47 CO 0.20 -3.51 1.59 1.96 0.04 0.00 0.00 177.00 177.28 2da1 h GLN 48 N -2.44 0.00 0.17 4.56 4.20 -1.96 -2.85 115.11 116.79 2da1 h GLN 48 Ca -0.47 0.00 -0.30 0.00 0.06 0.00 0.00 58.65 57.94 2da1 h GLN 48 Cb 1.30 0.00 0.03 0.00 0.30 0.00 0.00 27.48 29.11 2da1 h GLN 48 CO 0.40 0.18 -1.26 1.57 -0.67 0.00 0.00 178.83 179.04 2da1 h LYS 49 N 0.00 0.55 -0.39 1.46 2.10 -1.98 -2.01 116.57 116.32 2da1 h LYS 49 Ca -0.00 -0.82 -0.15 0.00 -2.00 0.00 0.00 60.65 57.67 2da1 h LYS 49 Cb 1.08 0.29 -0.01 0.00 -0.90 0.00 0.00 32.23 32.69 2da1 h LYS 49 CO 0.02 1.38 -0.36 0.28 -2.00 0.00 0.00 179.45 178.77 2da1 h VAL 50 N 0.14 1.27 0.21 0.07 2.07 -1.94 -2.31 116.25 115.75 2da1 h VAL 50 Ca -0.21 -1.53 -0.01 0.00 0.82 0.00 0.00 66.70 65.77 2da1 h VAL 50 Cb 1.96 1.38 0.00 0.00 -1.52 0.00 0.00 31.29 33.11 2da1 h VAL 50 CO 0.24 0.51 -0.10 0.40 0.02 0.00 0.00 177.57 178.64 2da1 h ILE 51 N 0.74 0.81 -0.79 4.57 2.04 -1.61 -1.83 117.51 121.45 2da1 h ILE 51 Ca 0.06 -0.94 0.15 0.00 1.00 0.00 0.00 64.86 65.13 2da1 h ILE 51 Cb 0.96 1.30 -0.10 0.00 -0.74 0.00 0.00 36.82 38.23 2da1 h ILE 51 CO 0.09 0.19 0.35 0.11 0.00 0.00 0.00 178.15 178.89 2da1 h LYS 52 N -0.81 0.48 0.66 2.37 1.57 -1.44 -1.86 116.57 117.54 2da1 h LYS 52 Ca -0.03 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.69 2da1 h LYS 52 Cb 0.51 -0.11 0.01 0.00 0.08 0.00 0.00 32.23 32.72 2da1 h LYS 52 CO 0.05 0.32 -0.32 1.25 -0.57 0.00 0.00 179.45 180.18 2da1 h HIS 53 N 0.50 -0.82 -0.94 -1.35 2.76 -1.45 -2.69 115.15 111.15 2da1 h HIS 53 Ca 0.44 -0.02 0.25 0.00 -2.20 0.00 0.00 60.37 58.84 2da1 h HIS 53 Cb 0.67 0.27 -0.17 0.00 1.55 0.00 0.00 27.41 29.73 2da1 h HIS 53 CO -0.14 -0.48 0.04 2.35 -1.30 0.00 0.00 177.93 178.40 2da1 h TRP 54 N -1.13 -0.02 -0.83 5.26 7.01 -0.89 1.08 115.95 126.43 2da1 h TRP 54 Ca -0.09 0.07 -0.01 0.00 2.11 0.00 0.00 58.89 60.96 2da1 h TRP 54 Cb 0.72 0.16 -0.04 0.00 -2.10 0.00 0.00 29.16 27.90 2da1 h TRP 54 CO 0.00 -0.38 0.47 0.74 -2.79 0.00 0.00 178.44 176.48 2da1 h PHE 55 N 0.04 1.12 0.25 2.65 0.04 -1.30 0.23 116.94 119.97 2da1 h PHE 55 Ca 0.57 -0.02 -0.01 0.00 2.80 0.00 0.00 57.97 61.31 2da1 h PHE 55 Cb 1.14 -0.36 0.00 0.00 2.20 0.00 0.00 35.95 38.93 2da1 h PHE 55 CO -0.47 0.77 -0.12 -0.09 -0.60 0.00 0.00 178.31 177.80 2da1 h ARG 56 N 1.16 -0.32 -0.23 1.51 9.65 0.13 -0.45 114.38 125.84 2da1 h ARG 56 Ca 0.30 0.02 0.03 0.00 -1.10 0.00 0.00 59.98 59.23 2da1 h ARG 56 Cb 0.00 0.07 -0.03 0.00 -1.39 0.00 0.00 29.97 28.62 2da1 h ARG 56 CO -0.05 0.03 0.02 -0.91 2.80 0.00 0.00 179.97 181.86 2da1 h ASN 57 N -0.92 -0.04 0.42 -3.80 4.21 -0.40 0.50 115.58 115.56 2da1 h ASN 57 Ca -0.03 0.04 -0.02 0.00 1.21 0.00 0.00 56.30 57.50 2da1 h ASN 57 Cb 0.50 0.07 0.00 0.00 -1.12 0.00 0.00 38.32 37.77 2da1 h ASN 57 CO 0.06 0.01 -0.20 0.74 -1.29 0.00 0.00 177.43 176.75 2da1 h THR 58 N 0.10 0.58 0.74 2.81 2.02 -0.63 -0.64 112.91 117.89 2da1 h THR 58 Ca 0.10 -0.20 -0.03 0.00 0.77 0.00 0.00 66.41 67.05 2da1 h THR 58 Cb 0.12 0.68 0.00 0.00 -1.74 0.00 0.00 68.15 67.21 2da1 h THR 58 CO -0.16 0.04 -0.40 0.25 0.37 0.00 0.00 175.52 175.62 2da1 h LEU 59 N -0.69 -0.97 -0.92 2.58 5.85 -0.94 0.16 115.31 120.38 2da1 h LEU 59 Ca -0.06 0.04 0.24 0.00 0.84 0.00 0.00 57.88 58.95 2da1 h LEU 59 Cb 0.50 0.27 -0.13 0.00 0.37 0.00 0.00 40.66 41.66 2da1 h LEU 59 CO 0.10 -0.64 0.40 0.15 -0.34 0.00 0.00 178.44 178.10 2da1 h PHE 60 N -1.04 0.65 -0.05 1.25 3.04 -0.07 0.16 116.94 120.88 2da1 h PHE 60 Ca -0.10 0.04 -0.01 0.00 3.98 0.00 0.00 57.97 61.88 2da1 h PHE 60 Cb 0.82 -0.14 -0.00 0.00 2.56 0.00 0.00 35.95 39.18 2da1 h PHE 60 CO -0.01 -0.10 0.00 0.87 -2.02 0.00 0.00 178.31 177.05 2da1 h LYS 61 N 0.36 0.09 -1.01 1.11 1.57 -0.86 -2.93 116.57 114.89 2da1 h LYS 61 Ca 0.59 -0.03 0.25 0.00 -1.87 0.00 0.00 60.65 59.60 2da1 h LYS 61 Cb 1.19 -0.01 -0.08 0.00 0.08 0.00 0.00 32.23 33.40 2da1 h LYS 61 CO -0.57 0.37 0.66 0.93 -0.57 0.00 0.00 179.45 180.28 2da1 h GLU 62 N -0.20 0.36 -0.13 3.15 4.39 0.13 0.51 114.58 122.79 2da1 h GLU 62 Ca 0.01 -0.02 0.01 0.00 0.34 0.00 0.00 59.36 59.70 2da1 h GLU 62 Cb 0.33 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.89 2da1 h GLU 62 CO 0.00 0.24 0.09 0.00 -1.16 0.00 0.00 179.01 178.18 2da1 h ARG 63 N 0.37 0.13 -5.46 2.33 2.47 -1.16 -3.44 114.38 109.61 2da1 h ARG 63 Ca 0.56 -0.01 -0.51 0.00 -1.26 0.00 0.00 59.98 58.76 2da1 h ARG 63 Cb 1.47 -0.03 0.20 0.00 -1.65 0.00 0.00 29.97 29.97 2da1 h ARG 63 CO -0.24 0.08 -1.51 0.00 0.56 0.00 0.00 179.97 178.86 2da1 n GLN 64 N -4.52 0.00 0.01 0.04 10.64 0.18 -4.96 117.38 118.77 2da1 n GLN 64 Ca -0.01 0.00 -0.02 0.00 -1.83 0.00 0.00 57.00 55.15 2da1 n GLN 64 Cb 0.12 -0.91 -0.01 0.00 -0.86 0.00 0.00 30.24 28.58 2da1 n GLN 64 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.06 175.68 2da1 n SER 65 N 2.92 0.53 -0.87 2.61 2.88 -1.26 -5.10 113.62 115.32 2da1 n SER 65 Ca 0.01 0.07 0.12 0.00 -1.33 0.00 0.00 58.87 57.74 2da1 n SER 65 Cb 0.49 -0.17 -0.03 0.00 -0.75 0.00 0.00 64.21 63.74 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 3.05 -1.85 0.17 0.46 0.00 -1.26 -4.38 105.19 101.37 2da1 n GLY 66 Ca -0.03 -1.29 -0.13 0.00 0.00 0.00 0.00 46.02 44.57 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 -0.82 0.50 -4.84 1.61 0.13 -2.07 -3.42 132.00 123.10 2da1 h PRO 67 Ca -0.00 -0.26 -0.67 0.00 -0.87 0.00 0.00 66.00 64.19 2da1 h PRO 67 Cb 0.80 0.01 -0.27 0.00 0.13 0.00 0.00 31.00 31.67 2da1 h PRO 67 CO 0.01 0.84 -0.65 -1.54 -0.23 0.00 0.00 178.00 176.43 2da1 s SER 68 N -6.30 4.94 0.81 1.44 1.04 -1.26 -5.10 113.70 109.27 2da1 s SER 68 Ca -0.13 -0.69 -0.12 0.00 0.48 0.00 0.00 55.95 55.49 2da1 s SER 68 Cb 0.07 -1.84 0.08 0.00 0.10 0.00 0.00 66.02 64.43 2da1 s SER 68 CO 0.78 -0.16 1.15 -0.55 0.98 0.00 0.00 173.24 175.44 2da1 s SER 69 N 1.47 4.47 0.00 7.02 0.15 -1.26 -5.07 113.70 120.48 2da1 s SER 69 Ca 0.03 0.92 0.00 0.00 0.70 0.00 0.00 55.95 57.60 2da1 s SER 69 Cb -0.17 -1.50 0.00 0.00 -1.71 0.00 0.00 66.02 62.64 2da1 s SER 69 CO 0.01 -1.94 0.00 0.61 1.20 0.00 0.00 173.24 173.12