#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2da4 s SER 2 N 0.00 7.24 -0.79 1.61 0.15 -1.26 -4.91 113.70 115.74 2da4 s SER 2 Ca 0.00 1.67 -0.28 0.00 0.70 0.00 0.00 55.95 58.03 2da4 s SER 2 Cb 0.00 -2.51 -0.16 0.00 -1.71 0.00 0.00 66.02 61.64 2da4 s SER 2 CO 0.00 -0.01 2.56 -0.24 1.20 0.00 0.00 173.24 176.76 2da4 n SER 3 N 0.71 1.11 0.00 5.45 2.88 -1.26 -4.34 113.62 118.17 2da4 n SER 3 Ca -0.00 -0.17 0.00 0.00 -1.33 0.00 0.00 58.87 57.37 2da4 n SER 3 Cb 0.50 -1.20 0.00 0.00 -0.75 0.00 0.00 64.21 62.76 2da4 n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2da4 n GLY 4 N 6.28 -2.76 3.51 0.46 0.00 -1.26 -4.95 105.19 106.46 2da4 n GLY 4 Ca 0.54 -1.20 -0.38 0.00 0.00 0.00 0.00 46.02 44.97 2da4 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2da4 s SER 5 N -2.02 5.72 0.14 1.61 1.04 -1.26 -5.00 113.70 113.94 2da4 s SER 5 Ca 0.00 -0.28 -0.31 0.00 0.48 0.00 0.00 55.95 55.84 2da4 s SER 5 Cb 0.00 -2.05 -0.07 0.00 0.10 0.00 0.00 66.02 64.00 2da4 s SER 5 CO 0.00 -0.13 1.56 0.28 0.98 0.00 0.00 173.24 175.93 2da4 h SER 6 N 8.36 -1.72 0.00 7.02 0.02 -1.94 -3.48 113.55 121.81 2da4 h SER 6 Ca -0.34 0.24 0.00 0.00 -0.84 0.00 0.00 61.79 60.85 2da4 h SER 6 Cb 1.17 0.72 0.00 0.00 0.14 0.00 0.00 62.40 64.43 2da4 h SER 6 CO 0.59 -0.39 0.00 0.61 -1.14 0.00 0.00 176.83 176.50 2da4 n GLY 7 N -1.39 -0.47 3.84 -3.77 0.00 -1.26 -5.13 105.19 97.02 2da4 n GLY 7 Ca -0.02 0.24 -0.37 0.00 0.00 0.00 0.00 46.02 45.86 2da4 n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2da4 s ALA 8 N -1.00 3.71 0.60 4.61 0.00 -1.26 -5.09 121.76 123.32 2da4 s ALA 8 Ca 0.00 -0.26 -0.05 0.00 0.00 0.00 0.00 51.96 51.65 2da4 s ALA 8 Cb 0.00 -2.35 0.02 0.00 0.00 0.00 0.00 23.12 20.79 2da4 s ALA 8 CO 0.00 0.50 0.89 -0.48 0.00 0.00 0.00 175.76 176.68 2da4 s LEU 9 N -1.27 3.19 0.15 0.00 0.05 -1.26 -5.05 118.68 114.49 2da4 s LEU 9 Ca 0.26 0.57 0.00 0.00 0.05 0.00 0.00 54.13 55.01 2da4 s LEU 9 Cb -0.16 -3.37 0.00 0.00 -2.05 0.00 0.00 46.19 40.61 2da4 s LEU 9 CO 0.14 -1.14 0.00 1.67 -0.55 0.00 0.00 176.35 176.47 2da4 n GLN 10 N -2.58 0.00 -3.75 1.48 -0.06 -1.26 -5.11 117.38 106.09 2da4 n GLN 10 Ca 0.05 0.00 -0.12 0.00 -2.00 0.00 0.00 57.00 54.93 2da4 n GLN 10 Cb 0.58 -0.29 -0.12 0.00 -4.06 0.00 0.00 30.24 26.35 2da4 n GLN 10 CO 0.00 0.00 0.00 0.16 -0.20 0.00 0.00 177.06 177.02 2da4 s ASP 11 N -5.54 -0.27 0.46 1.69 -4.77 -1.26 -5.17 116.67 101.81 2da4 s ASP 11 Ca 0.00 0.52 0.06 0.00 -3.30 0.00 0.00 52.55 49.83 2da4 s ASP 11 Cb 0.00 0.46 -0.03 0.00 -1.09 0.00 0.00 42.92 42.26 2da4 s ASP 11 CO 0.00 -0.13 0.17 -0.13 0.70 0.00 0.00 175.17 175.78 2da4 s ARG 12 N 0.76 2.20 -0.42 2.11 0.52 -1.26 -5.10 118.95 117.76 2da4 s ARG 12 Ca -0.05 -2.02 -0.16 0.00 -0.52 0.00 0.00 55.73 52.98 2da4 s ARG 12 Cb -0.06 -1.88 0.02 0.00 0.52 0.00 0.00 34.95 33.55 2da4 s ARG 12 CO -0.05 -0.26 0.35 0.99 0.02 0.00 0.00 175.30 176.35 2da4 s THR 13 N -2.70 5.20 0.18 0.02 2.01 -1.26 -5.07 115.64 114.02 2da4 s THR 13 Ca 0.32 -0.58 -0.02 0.00 0.31 0.00 0.00 61.69 61.72 2da4 s THR 13 Cb 0.03 -3.97 -0.05 0.00 0.01 0.00 0.00 72.50 68.52 2da4 s THR 13 CO 0.18 -0.36 0.38 -1.10 -0.69 0.00 0.00 174.62 173.03 2da4 s GLN 14 N 1.83 3.54 0.18 4.92 -1.52 -1.26 -5.08 119.66 122.27 2da4 s GLN 14 Ca 0.07 -0.27 -0.25 0.00 -1.95 0.00 0.00 55.36 52.96 2da4 s GLN 14 Cb -0.19 -2.85 -0.08 0.00 -0.22 0.00 0.00 33.01 29.67 2da4 s GLN 14 CO 0.11 0.43 0.79 -0.06 -0.25 0.00 0.00 175.29 176.30 2da4 s PHE 15 N -1.79 3.88 0.30 0.91 0.40 -1.26 -5.04 117.98 115.38 2da4 s PHE 15 Ca 0.39 1.63 -0.29 0.00 -0.60 0.00 0.00 56.93 58.07 2da4 s PHE 15 Cb -0.11 -2.77 -0.10 0.00 0.51 0.00 0.00 43.02 40.55 2da4 s PHE 15 CO 0.28 0.49 1.11 -1.12 0.70 0.00 0.00 175.22 176.68 2da4 s SER 16 N -1.21 7.15 0.28 1.36 0.01 -1.26 -4.78 113.70 115.25 2da4 s SER 16 Ca 0.37 2.29 -0.05 0.00 1.31 0.00 0.00 55.95 59.87 2da4 s SER 16 Cb -0.23 -2.62 0.54 0.00 0.21 0.00 0.00 66.02 63.92 2da4 s SER 16 CO 0.26 -0.22 1.51 0.47 0.41 0.00 0.00 173.24 175.66 2da4 n ASP 17 N 1.00 -0.27 0.17 2.44 9.92 -1.26 0.01 116.55 128.56 2da4 n ASP 17 Ca -0.00 1.65 -0.14 0.00 -0.53 0.00 0.00 54.79 55.77 2da4 n ASP 17 Cb 0.45 -0.53 -0.07 0.00 -0.64 0.00 0.00 41.12 40.33 2da4 n ASP 17 CO 0.00 0.00 0.00 0.03 0.13 0.00 0.00 177.20 177.36 2da4 h ARG 18 N 0.00 -0.42 -0.18 -1.24 3.08 -2.01 -1.89 114.38 111.73 2da4 h ARG 18 Ca 0.50 0.03 0.05 0.00 0.07 0.00 0.00 59.98 60.63 2da4 h ARG 18 Cb 0.87 0.09 -0.05 0.00 0.08 0.00 0.00 29.97 30.96 2da4 h ARG 18 CO -0.97 -0.28 -0.13 -0.44 -1.07 0.00 0.00 179.97 177.08 2da4 h ASP 19 N -0.43 -0.42 -0.34 7.04 3.32 -0.78 -2.56 116.42 122.24 2da4 h ASP 19 Ca -0.02 0.09 0.08 0.00 0.02 0.00 0.00 57.03 57.20 2da4 h ASP 19 Cb 0.38 0.22 -0.08 0.00 0.22 0.00 0.00 39.33 40.06 2da4 h ASP 19 CO 0.00 -0.17 -0.23 -0.07 -1.72 0.00 0.00 179.24 177.05 2da4 h LEU 20 N -0.13 -0.78 -0.77 1.55 3.38 -0.67 -1.50 115.31 116.39 2da4 h LEU 20 Ca 0.11 0.16 0.19 0.00 0.09 0.00 0.00 57.88 58.42 2da4 h LEU 20 Cb 0.30 0.39 -0.14 0.00 0.09 0.00 0.00 40.66 41.29 2da4 h LEU 20 CO -0.26 -0.26 -0.07 0.00 0.09 0.00 0.00 178.44 177.93 2da4 n ALA 21 N -2.87 0.31 0.26 1.53 0.00 -0.72 0.32 120.51 119.33 2da4 n ALA 21 Ca 0.01 0.83 -0.16 0.00 0.00 0.00 0.00 53.44 54.13 2da4 n ALA 21 Cb 0.30 -0.56 -0.08 0.00 0.00 0.00 0.00 19.45 19.10 2da4 n ALA 21 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2da4 h THR 22 N 0.00 0.51 0.31 0.00 2.02 -1.30 -1.64 112.91 112.80 2da4 h THR 22 Ca 0.43 -0.21 -0.00 0.00 0.77 0.00 0.00 66.41 67.39 2da4 h THR 22 Cb 0.80 0.60 -0.03 0.00 -1.74 0.00 0.00 68.15 67.78 2da4 h THR 22 CO -0.75 0.04 -0.48 -0.07 0.37 0.00 0.00 175.52 174.63 2da4 h LEU 23 N -0.77 -1.37 -1.25 2.58 3.38 -0.01 -1.60 115.31 116.26 2da4 h LEU 23 Ca -0.07 0.13 0.27 0.00 0.09 0.00 0.00 57.88 58.30 2da4 h LEU 23 Cb 0.55 0.48 -0.11 0.00 0.09 0.00 0.00 40.66 41.68 2da4 h LEU 23 CO 0.11 -0.57 0.65 0.50 0.09 0.00 0.00 178.44 179.22 2da4 h LYS 24 N -0.83 0.42 -0.56 1.13 3.64 -0.85 0.14 116.57 119.66 2da4 h LYS 24 Ca -0.04 -0.03 0.08 0.00 -1.27 0.00 0.00 60.65 59.40 2da4 h LYS 24 Cb 0.76 -0.09 -0.07 0.00 -0.41 0.00 0.00 32.23 32.42 2da4 h LYS 24 CO -0.15 0.28 0.21 -0.22 -2.27 0.00 0.00 179.45 177.30 2da4 h LYS 25 N 0.43 0.39 -0.28 1.90 3.64 -0.29 -1.60 116.57 120.76 2da4 h LYS 25 Ca 0.62 -0.02 -0.13 0.00 -1.27 0.00 0.00 60.65 59.85 2da4 h LYS 25 Cb 1.48 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 33.20 2da4 h LYS 25 CO -0.36 0.25 -0.37 1.88 -2.27 0.00 0.00 179.45 178.58 2da4 h TYR 26 N 0.40 0.75 -0.85 1.91 -1.99 -0.48 -2.93 116.97 113.78 2da4 h TYR 26 Ca 0.28 -0.21 0.22 0.00 2.00 0.00 0.00 58.73 61.01 2da4 h TYR 26 Cb 0.32 -0.16 -0.05 0.00 2.00 0.00 0.00 36.73 38.83 2da4 h TYR 26 CO -0.16 0.91 0.59 2.35 -0.00 0.00 0.00 178.16 181.85 2da4 h TRP 27 N 0.53 0.29 -0.33 4.88 2.91 -0.61 0.27 115.95 123.90 2da4 h TRP 27 Ca 0.05 0.01 0.09 0.00 1.13 0.00 0.00 58.89 60.18 2da4 h TRP 27 Cb 0.88 -0.09 -0.01 0.00 -0.51 0.00 0.00 29.16 29.43 2da4 h TRP 27 CO 0.04 0.08 0.35 0.22 -1.03 0.00 0.00 178.44 178.10 2da4 h ASP 28 N 0.22 0.00 -0.65 2.65 3.58 -1.30 0.28 116.42 121.19 2da4 h ASP 28 Ca 0.43 0.00 -0.29 0.00 0.42 0.00 0.00 57.03 57.58 2da4 h ASP 28 Cb 1.33 0.00 -0.18 0.00 1.72 0.00 0.00 39.33 42.20 2da4 h ASP 28 CO -0.10 0.00 0.37 0.59 -2.88 0.00 0.00 179.24 177.23 2da4 n ASN 29 N -3.75 3.72 -0.74 2.28 3.02 0.94 -4.83 115.26 115.90 2da4 n ASN 29 Ca 0.05 -3.05 -0.10 0.00 -0.03 0.00 0.00 54.58 51.45 2da4 n ASN 29 Cb 0.51 -0.72 -0.04 0.00 -0.61 0.00 0.00 39.78 38.92 2da4 n ASN 29 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2da4 n GLY 30 N -0.45 1.10 0.35 7.41 0.00 0.97 -4.86 105.19 109.72 2da4 n GLY 30 Ca 0.38 -0.45 0.18 0.00 0.00 0.00 0.00 46.02 46.13 2da4 n GLY 30 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2da4 h MET 31 N 0.06 0.00 -1.45 1.61 4.05 -1.57 -2.00 114.93 115.64 2da4 h MET 31 Ca -0.20 0.00 0.42 0.00 -0.28 0.00 0.00 59.70 59.64 2da4 h MET 31 Cb 0.70 0.00 -0.06 0.00 -0.80 0.00 0.00 31.60 31.44 2da4 h MET 31 CO 0.29 0.00 1.14 0.00 0.23 0.00 0.00 176.91 178.57 2da4 h THR 32 N 0.00 0.16 -3.99 -0.77 1.03 -1.88 -3.40 112.91 104.06 2da4 h THR 32 Ca 0.07 0.00 -0.51 0.00 -0.01 0.00 0.00 66.41 65.96 2da4 h THR 32 Cb 0.69 0.18 0.07 0.00 -1.07 0.00 0.00 68.15 68.01 2da4 h THR 32 CO -0.00 0.00 0.51 -0.44 -0.01 0.00 0.00 175.52 175.58 2da4 s SER 33 N -4.30 6.20 -0.21 0.00 0.01 -0.76 -4.60 113.70 110.04 2da4 s SER 33 Ca -0.05 2.38 0.04 0.00 1.31 0.00 0.00 55.95 59.63 2da4 s SER 33 Cb 0.22 -2.61 -0.20 0.00 0.21 0.00 0.00 66.02 63.64 2da4 s SER 33 CO 0.76 -0.90 -0.03 0.18 0.41 0.00 0.00 173.24 173.67 2da4 n LEU 34 N -0.34 2.26 -3.03 2.44 4.77 -1.26 -4.68 117.00 117.15 2da4 n LEU 34 Ca 0.06 -0.03 -0.28 0.00 -0.03 0.00 0.00 56.01 55.74 2da4 n LEU 34 Cb 0.47 -0.63 0.01 0.00 -2.33 0.00 0.00 43.42 40.94 2da4 n LEU 34 CO 0.49 0.82 -0.50 0.61 -1.33 0.00 0.00 177.39 177.48 2da4 n GLY 35 N 2.08 -2.39 0.33 -0.72 0.00 -1.26 -3.91 105.19 99.33 2da4 n GLY 35 Ca -0.40 -0.16 0.14 0.00 0.00 0.00 0.00 46.02 45.60 2da4 n GLY 35 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2da4 h SER 36 N -0.06 -0.38 -0.84 1.61 0.87 -1.98 0.28 113.55 113.06 2da4 h SER 36 Ca -0.30 0.26 0.32 0.00 -1.23 0.00 0.00 61.79 60.84 2da4 h SER 36 Cb 1.03 0.44 -0.11 0.00 -0.44 0.00 0.00 62.40 63.32 2da4 h SER 36 CO 0.29 -0.32 0.50 1.33 -0.53 0.00 0.00 176.83 178.10 2da4 n VAL 37 N -5.44 -0.24 -0.09 2.23 0.24 -1.26 0.14 118.33 113.91 2da4 n VAL 37 Ca 0.23 1.36 -0.14 0.00 -2.04 0.00 0.00 64.34 63.75 2da4 n VAL 37 Cb 0.75 -2.21 -0.14 0.00 -1.47 0.00 0.00 33.84 30.76 2da4 n VAL 37 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2da4 n ARG 39 N -3.03 -0.05 -0.02 0.00 0.63 0.37 0.98 116.66 115.53 2da4 n ARG 39 Ca -0.35 1.29 -0.09 0.00 -0.92 0.00 0.00 57.85 57.77 2da4 n ARG 39 Cb 1.08 -2.34 -0.03 0.00 0.45 0.00 0.00 32.46 31.61 2da4 n ARG 39 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 2da4 h GLU 40 N 0.00 -0.01 -0.46 -0.14 5.08 -1.68 -2.19 114.58 115.18 2da4 h GLU 40 Ca 0.81 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 59.16 2da4 h GLU 40 Cb 2.20 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 31.43 2da4 h GLU 40 CO -0.69 -0.01 0.25 0.87 -1.00 0.00 0.00 179.01 178.44 2da4 h LYS 41 N -0.01 0.63 -0.90 2.33 1.79 0.36 -2.66 116.57 118.12 2da4 h LYS 41 Ca 0.08 -0.07 0.17 0.00 -2.18 0.00 0.00 60.65 58.65 2da4 h LYS 41 Cb 0.13 -0.13 -0.10 0.00 -1.58 0.00 0.00 32.23 30.56 2da4 h LYS 41 CO -0.17 0.50 0.47 0.82 -1.08 0.00 0.00 179.45 179.98 2da4 h ILE 42 N 0.60 0.67 -0.38 1.86 2.04 -0.99 0.35 117.51 121.66 2da4 h ILE 42 Ca 0.16 -0.21 0.11 0.00 1.00 0.00 0.00 64.86 65.92 2da4 h ILE 42 Cb 0.05 0.01 -0.02 0.00 -0.74 0.00 0.00 36.82 36.12 2da4 h ILE 42 CO -0.03 0.11 0.38 -0.33 0.00 0.00 0.00 178.15 178.29 2da4 h GLU 43 N 0.61 0.00 0.00 2.37 4.39 -1.03 0.01 114.58 120.93 2da4 h GLU 43 Ca 0.51 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.21 2da4 h GLU 43 Cb 0.81 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.46 2da4 h GLU 43 CO -0.40 0.00 -0.13 0.00 -1.16 0.00 0.00 179.01 177.31 2da4 h ALA 44 N 1.59 0.00 -0.33 3.43 0.00 -0.38 -2.93 119.26 120.64 2da4 h ALA 44 Ca 0.18 -0.15 0.10 0.00 0.00 0.00 0.00 54.91 55.04 2da4 h ALA 44 Cb 0.95 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 2da4 h ALA 44 CO -0.00 0.13 0.50 -0.24 0.00 0.00 0.00 179.25 179.64 2da4 h VAL 45 N -0.81 0.23 0.14 0.00 3.04 -1.18 0.16 116.25 117.83 2da4 h VAL 45 Ca 0.00 0.00 -0.20 0.00 -1.01 0.00 0.00 66.70 65.49 2da4 h VAL 45 Cb 0.13 0.58 0.02 0.00 -2.01 0.00 0.00 31.29 30.01 2da4 h VAL 45 CO 0.00 0.00 -0.92 0.00 -1.01 0.00 0.00 177.57 175.64 2da4 h ALA 46 N 1.32 -0.06 0.00 3.17 0.00 -1.12 -3.01 119.26 119.57 2da4 h ALA 46 Ca 0.16 -0.76 -0.03 0.00 0.00 0.00 0.00 54.91 54.28 2da4 h ALA 46 Cb 1.15 0.16 -0.00 0.00 0.00 0.00 0.00 17.79 19.09 2da4 h ALA 46 CO -0.00 0.45 -0.13 0.00 0.00 0.00 0.00 179.25 179.57 2da4 h THR 47 N -0.35 0.30 0.12 0.00 1.03 -0.69 0.22 112.91 113.54 2da4 h THR 47 Ca -0.17 -0.92 -0.30 0.00 -0.01 0.00 0.00 66.41 65.02 2da4 h THR 47 Cb 1.67 1.71 0.03 0.00 -1.07 0.00 0.00 68.15 70.49 2da4 h THR 47 CO 0.14 0.13 -1.24 -0.08 -0.01 0.00 0.00 175.52 174.45 2da4 h GLU 48 N 0.00 0.62 -0.01 0.00 4.57 -0.89 -3.23 114.58 115.65 2da4 h GLU 48 Ca -0.00 -0.82 0.00 0.00 -1.18 0.00 0.00 59.36 57.36 2da4 h GLU 48 Cb 0.70 0.27 0.00 0.00 -0.16 0.00 0.00 28.75 29.56 2da4 h GLU 48 CO 0.02 1.37 -0.23 1.28 -1.18 0.00 0.00 179.01 180.28 2da4 n LEU 49 N -3.78 0.81 -2.59 1.64 4.77 -1.14 -4.94 117.00 111.77 2da4 n LEU 49 Ca -0.13 -0.15 -0.16 0.00 -0.03 0.00 0.00 56.01 55.53 2da4 n LEU 49 Cb 0.98 -0.16 0.05 0.00 -2.33 0.00 0.00 43.42 41.97 2da4 n LEU 49 CO 0.58 0.15 0.15 -3.20 -1.33 0.00 0.00 177.39 173.75 2da4 n ASN 50 N -0.81 -5.01 -4.16 -1.43 5.15 -0.44 -5.02 115.26 103.54 2da4 n ASN 50 Ca 0.12 -0.35 -0.24 0.00 -0.60 0.00 0.00 54.58 53.51 2da4 n ASN 50 Cb 0.33 -3.62 -0.15 0.00 -0.53 0.00 0.00 39.78 35.80 2da4 n ASN 50 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 2da4 s VAL 51 N -3.20 1.33 0.09 3.44 -7.23 -0.06 -5.03 120.40 109.74 2da4 s VAL 51 Ca 0.39 -0.73 -0.37 0.00 -1.81 0.00 0.00 61.98 59.46 2da4 s VAL 51 Cb -0.17 -1.11 -0.17 0.00 0.56 0.00 0.00 36.38 35.49 2da4 s VAL 51 CO 0.48 0.37 1.35 -0.67 -0.31 0.00 0.00 175.10 176.31 2da4 n ASP 52 N 2.64 1.69 -0.31 4.85 2.03 -1.26 -4.39 116.55 121.79 2da4 n ASP 52 Ca -0.15 1.12 -0.01 0.00 0.52 0.00 0.00 54.79 56.27 2da4 n ASP 52 Cb 0.54 -1.20 0.05 0.00 -0.72 0.00 0.00 41.12 39.79 2da4 n ASP 52 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2da4 h GLU 54 N -0.05 0.06 -1.00 0.00 4.81 -1.97 0.87 114.58 117.29 2da4 h GLU 54 Ca 0.33 -0.00 0.22 0.00 -0.13 0.00 0.00 59.36 59.77 2da4 h GLU 54 Cb 0.60 -0.01 -0.12 0.00 0.63 0.00 0.00 28.75 29.85 2da4 h GLU 54 CO -0.88 0.04 0.60 0.82 -0.73 0.00 0.00 179.01 178.86 2da4 h ILE 55 N 0.06 0.63 0.10 2.32 2.04 -0.62 0.13 117.51 122.17 2da4 h ILE 55 Ca 0.62 -0.23 -0.00 0.00 1.00 0.00 0.00 64.86 66.24 2da4 h ILE 55 Cb 1.33 -0.11 0.00 0.00 -0.74 0.00 0.00 36.82 37.30 2da4 h ILE 55 CO -0.83 0.12 -0.05 0.58 0.00 0.00 0.00 178.15 177.98 2da4 h VAL 56 N 0.68 0.00 -1.19 1.67 2.07 0.69 -2.59 116.25 117.58 2da4 h VAL 56 Ca 0.61 -0.82 0.37 0.00 0.82 0.00 0.00 66.70 67.68 2da4 h VAL 56 Cb 1.05 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 30.69 2da4 h VAL 56 CO -0.43 0.00 0.75 -0.09 0.02 0.00 0.00 177.57 177.83 2da4 h ARG 57 N -0.96 0.19 -0.08 1.57 2.43 -1.04 0.45 114.38 116.94 2da4 h ARG 57 Ca -0.01 -0.01 -0.15 0.00 -0.81 0.00 0.00 59.98 59.00 2da4 h ARG 57 Cb 0.10 -0.04 0.01 0.00 -0.42 0.00 0.00 29.97 29.62 2da4 h ARG 57 CO 0.02 0.13 -0.52 1.15 -1.51 0.00 0.00 179.97 179.24 2da4 h THR 58 N 0.20 1.38 -0.96 0.20 2.02 -0.85 -3.25 112.91 111.65 2da4 h THR 58 Ca 0.75 -1.88 0.01 0.00 0.77 0.00 0.00 66.41 66.06 2da4 h THR 58 Cb 2.15 2.29 -0.05 0.00 -1.74 0.00 0.00 68.15 70.80 2da4 h THR 58 CO -0.42 0.56 0.64 -0.25 0.37 0.00 0.00 175.52 176.42 2da4 h TRP 59 N 0.06 1.20 0.10 3.16 7.01 0.22 -2.65 115.95 125.06 2da4 h TRP 59 Ca -0.04 0.03 0.01 0.00 2.11 0.00 0.00 58.89 60.99 2da4 h TRP 59 Cb 1.18 -0.41 -0.03 0.00 -2.10 0.00 0.00 29.16 27.80 2da4 h TRP 59 CO 0.12 0.75 -0.33 0.82 -2.79 0.00 0.00 178.44 177.00 2da4 h ILE 60 N 1.29 0.00 -0.81 2.65 2.04 -1.05 -2.36 117.51 119.27 2da4 h ILE 60 Ca 0.36 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.36 2da4 h ILE 60 Cb -0.12 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 35.87 2da4 h ILE 60 CO -0.08 0.00 0.39 1.23 0.00 0.00 0.00 178.15 179.69 2da4 h GLY 61 N -0.49 1.30 -0.44 5.37 0.00 -1.59 -1.24 103.07 105.97 2da4 h GLY 61 Ca -0.01 -0.22 0.24 0.00 0.00 0.00 0.00 47.33 47.34 2da4 h GLY 61 CO -0.17 -0.05 0.25 3.43 0.00 0.00 0.00 176.54 180.00 2da4 h ASN 62 N 0.57 0.03 0.47 0.19 4.21 -1.06 -0.75 115.58 119.25 2da4 h ASN 62 Ca 0.44 0.19 -0.02 0.00 1.21 0.00 0.00 56.30 58.12 2da4 h ASN 62 Cb 0.63 0.26 0.00 0.00 -1.12 0.00 0.00 38.32 38.09 2da4 h ASN 62 CO -0.37 -0.15 -0.23 -0.09 -1.29 0.00 0.00 177.43 175.31 2da4 h ARG 63 N 0.22 -0.61 -0.92 0.81 9.65 -0.96 -2.14 114.38 120.42 2da4 h ARG 63 Ca 0.56 0.04 0.27 0.00 -1.10 0.00 0.00 59.98 59.75 2da4 h ARG 63 Cb 1.12 0.14 -0.15 0.00 -1.39 0.00 0.00 29.97 29.69 2da4 h ARG 63 CO -0.65 -0.33 0.27 0.00 2.80 0.00 0.00 179.97 182.06 2da4 h ARG 64 N -0.82 0.16 -0.51 0.20 3.08 -1.06 0.54 114.38 115.98 2da4 h ARG 64 Ca -0.07 -0.01 -0.09 0.00 0.07 0.00 0.00 59.98 59.88 2da4 h ARG 64 Cb 0.57 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.56 2da4 h ARG 64 CO 0.11 0.11 -0.04 -0.09 -1.07 0.00 0.00 179.97 178.99 2da4 h ARG 65 N 0.17 0.93 0.38 0.04 1.12 -1.21 -2.51 114.38 113.30 2da4 h ARG 65 Ca 0.61 -0.32 -0.02 0.00 -1.11 0.00 0.00 59.98 59.14 2da4 h ARG 65 Cb 1.30 -0.07 0.00 0.00 -0.01 0.00 0.00 29.97 31.19 2da4 h ARG 65 CO -0.71 0.97 -0.18 0.87 -3.11 0.00 0.00 179.97 177.81 2da4 h LYS 66 N 0.79 -0.49 -0.29 0.20 1.57 0.64 -0.96 116.57 118.02 2da4 h LYS 66 Ca 0.14 0.03 0.07 0.00 -1.87 0.00 0.00 60.65 59.02 2da4 h LYS 66 Cb 0.57 0.11 -0.08 0.00 0.08 0.00 0.00 32.23 32.92 2da4 h LYS 66 CO 0.03 -0.26 -0.24 1.88 -0.57 0.00 0.00 179.45 180.29 2da4 h TYR 67 N -0.63 -0.64 -0.18 -1.35 0.05 -0.85 -2.03 116.97 111.34 2da4 h TYR 67 Ca -0.05 0.04 0.03 0.00 0.05 0.00 0.00 58.73 58.80 2da4 h TYR 67 Cb 0.46 0.33 -0.03 0.00 1.01 0.00 0.00 36.73 38.49 2da4 h TYR 67 CO -0.02 -0.32 -0.04 -0.09 -1.05 0.00 0.00 178.16 176.65 2da4 h ARG 68 N -0.22 0.01 -1.19 4.88 9.65 -0.56 -0.12 114.38 126.83 2da4 h ARG 68 Ca 0.15 -0.00 0.42 0.00 -1.10 0.00 0.00 59.98 59.46 2da4 h ARG 68 Cb 0.46 -0.00 -0.15 0.00 -1.39 0.00 0.00 29.97 28.89 2da4 h ARG 68 CO -0.42 0.01 0.72 -0.07 2.80 0.00 0.00 179.97 183.00 2da4 h LEU 69 N 0.01 0.30 0.00 3.80 3.38 -0.42 1.84 115.31 124.21 2da4 h LEU 69 Ca 0.08 0.19 -0.14 0.00 0.09 0.00 0.00 57.88 58.10 2da4 h LEU 69 Cb 0.12 0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 2da4 h LEU 69 CO -0.17 -0.28 -1.08 -0.03 0.09 0.00 0.00 178.44 176.97 2da4 h MET 70 N 0.07 0.00 0.00 1.13 4.05 -1.14 -3.48 114.93 115.57 2da4 h MET 70 Ca 0.83 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 60.25 2da4 h MET 70 Cb 2.40 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 33.20 2da4 h MET 70 CO -0.57 0.37 0.00 0.41 0.23 0.00 0.00 176.91 177.35 2da4 n GLY 71 N 1.33 1.29 3.55 1.39 0.00 0.62 -5.08 105.19 108.29 2da4 n GLY 71 Ca -0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.59 2da4 n GLY 71 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2da4 s ILE 72 N -0.21 3.26 -1.17 -0.61 1.01 -0.16 -4.77 121.20 118.54 2da4 s ILE 72 Ca 0.00 0.15 -0.10 0.00 0.00 0.00 0.00 60.65 60.70 2da4 s ILE 72 Cb 0.00 -3.69 0.23 0.00 0.01 0.00 0.00 42.46 39.01 2da4 s ILE 72 CO 0.00 -0.67 1.41 -1.84 0.00 0.00 0.00 174.94 173.85 2da4 n GLU 73 N 9.14 3.68 -1.65 2.79 0.28 -1.26 -0.91 120.64 132.70 2da4 n GLU 73 Ca 0.25 -4.13 -0.44 0.00 -0.16 0.00 0.00 57.16 52.68 2da4 n GLU 73 Cb 0.53 -2.76 -0.02 0.00 1.43 0.00 0.00 31.44 30.62 2da4 n GLU 73 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 177.13 178.30 2da4 n VAL 74 N 3.14 1.71 -3.26 3.84 0.24 -1.26 -4.98 118.33 117.76 2da4 n VAL 74 Ca 0.31 -0.43 0.03 0.00 -2.04 0.00 0.00 64.34 62.22 2da4 n VAL 74 Cb 0.39 -1.31 -0.03 0.00 -1.47 0.00 0.00 33.84 31.42 2da4 n VAL 74 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2da4 s SER 75 N -0.25 -0.50 0.45 -1.34 0.15 -1.26 -5.10 113.70 105.85 2da4 s SER 75 Ca 0.60 0.51 -0.25 0.00 0.70 0.00 0.00 55.95 57.51 2da4 s SER 75 Cb -0.65 1.50 -0.08 0.00 -1.71 0.00 0.00 66.02 65.08 2da4 s SER 75 CO 0.58 -0.10 1.42 0.61 1.20 0.00 0.00 173.24 176.96 2da4 n GLY 76 N 5.15 0.98 3.55 9.45 0.00 -1.26 -4.87 105.19 118.19 2da4 n GLY 76 Ca -0.07 0.18 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 2da4 n GLY 76 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2da4 s PRO 77 N -2.45 2.59 0.07 1.61 0.04 -1.26 -4.83 135.00 130.76 2da4 s PRO 77 Ca 0.62 0.21 -0.19 0.00 0.04 0.00 0.00 61.00 61.68 2da4 s PRO 77 Cb -0.45 -4.69 -0.10 0.00 0.04 0.00 0.00 34.50 29.30 2da4 s PRO 77 CO 0.57 -3.03 1.50 0.66 0.04 0.00 0.00 177.00 176.74 2da4 h SER 78 N 13.36 0.37 -3.87 6.66 4.64 -2.07 -3.36 113.55 129.28 2da4 h SER 78 Ca -0.10 -0.32 -0.70 0.00 -0.47 0.00 0.00 61.79 60.20 2da4 h SER 78 Cb 1.09 -0.10 -0.36 0.00 -0.31 0.00 0.00 62.40 62.73 2da4 h SER 78 CO 1.21 0.60 -0.28 -0.94 -0.87 0.00 0.00 176.83 176.55 2da4 s SER 79 N -5.90 5.46 0.00 4.97 1.04 -1.26 -5.35 113.70 112.67 2da4 s SER 79 Ca -0.14 -3.18 0.19 0.00 0.48 0.00 0.00 55.95 53.30 2da4 s SER 79 Cb 0.07 -1.87 1.11 0.00 0.10 0.00 0.00 66.02 65.43 2da4 s SER 79 CO 0.74 -0.30 1.50 0.61 0.98 0.00 0.00 173.24 176.77