#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2duw s LYS 2 N 0.00 2.71 -0.07 0.03 -2.85 -1.26 -5.05 119.74 113.25 2duw s LYS 2 Ca 0.00 -1.35 0.17 0.00 -1.00 0.00 0.00 55.97 53.79 2duw s LYS 2 Cb 0.00 -2.52 0.34 0.00 -2.06 0.00 0.00 37.83 33.59 2duw s LYS 2 CO 0.00 -0.09 1.15 -0.85 0.10 0.00 0.00 175.35 175.66 2duw n GLU 3 N -1.55 0.54 -0.06 1.78 -0.00 -1.26 -4.04 120.64 116.06 2duw n GLU 3 Ca 0.02 -2.22 -0.02 0.00 -0.00 0.00 0.00 57.16 54.94 2duw n GLU 3 Cb 0.60 -0.66 -0.14 0.00 -0.00 0.00 0.00 31.44 31.24 2duw n GLU 3 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.13 175.42 2duw n ASN 4 N -0.21 0.68 -4.99 -1.84 5.15 -1.26 -4.81 115.26 107.99 2duw n ASN 4 Ca 0.09 0.00 -0.19 0.00 -0.60 0.00 0.00 54.58 53.89 2duw n ASN 4 Cb 0.90 1.28 -0.00 0.00 -0.53 0.00 0.00 39.78 41.43 2duw n ASN 4 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2duw s ASP 5 N -4.78 5.86 0.57 1.20 2.15 -1.26 -4.98 116.67 115.42 2duw s ASP 5 Ca -0.08 -0.27 0.29 0.00 0.43 0.00 0.00 52.55 52.92 2duw s ASP 5 Cb 0.08 -1.07 1.47 0.00 -0.30 0.00 0.00 42.92 43.10 2duw s ASP 5 CO 0.74 -0.51 1.92 0.16 -0.17 0.00 0.00 175.17 177.31 2duw h ILE 6 N 0.84 0.48 -0.95 4.11 3.07 -1.97 0.18 117.51 123.27 2duw h ILE 6 Ca -0.44 0.00 0.12 0.00 1.55 0.00 0.00 64.86 66.08 2duw h ILE 6 Cb 1.26 0.63 -0.08 0.00 -0.27 0.00 0.00 36.82 38.37 2duw h ILE 6 CO 0.51 0.00 0.61 0.00 -1.05 0.00 0.00 178.15 178.22 2duw h ALA 7 N 1.54 1.61 0.02 0.16 0.00 -1.93 0.30 119.26 120.96 2duw h ALA 7 Ca 0.26 0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.97 2duw h ALA 7 Cb 1.24 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 2duw h ALA 7 CO -0.00 0.17 -0.94 0.78 0.00 0.00 0.00 179.25 179.25 2duw h GLY 8 N 0.92 0.22 1.92 0.00 0.00 -1.09 -1.22 103.07 103.81 2duw h GLY 8 Ca 0.46 -0.42 -0.17 0.00 0.00 0.00 0.00 47.33 47.20 2duw h GLY 8 CO -0.23 0.37 -0.78 -2.22 0.00 0.00 0.00 176.54 173.68 2duw h ILE 9 N 0.10 1.52 0.00 2.60 5.03 -1.23 -0.69 117.51 124.83 2duw h ILE 9 Ca -0.05 -2.57 -0.21 0.00 -0.12 0.00 0.00 64.86 61.91 2duw h ILE 9 Cb 1.60 2.39 -0.03 0.00 -3.03 0.00 0.00 36.82 37.75 2duw h ILE 9 CO 0.14 0.74 -1.24 0.17 -0.68 0.00 0.00 178.15 177.29 2duw h LEU 10 N 0.04 0.00 0.00 1.44 8.10 -0.48 -2.95 115.31 121.46 2duw h LEU 10 Ca -0.02 0.00 -0.05 0.00 0.11 0.00 0.00 57.88 57.92 2duw h LEU 10 Cb 1.38 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 41.59 2duw h LEU 10 CO 0.11 0.84 -0.72 0.00 -4.11 0.00 0.00 178.44 174.56 2duw h THR 11 N 0.00 0.25 0.00 0.15 1.03 -1.22 -3.40 112.91 109.72 2duw h THR 11 Ca -0.13 -1.40 0.00 0.00 -0.01 0.00 0.00 66.41 64.87 2duw h THR 11 Cb 1.75 1.90 0.00 0.00 -1.07 0.00 0.00 68.15 70.73 2duw h THR 11 CO 0.09 0.14 -0.09 -1.28 -0.01 0.00 0.00 175.52 174.37 2duw h SER 12 N 0.00 0.00 -4.30 0.00 0.87 -1.22 -3.49 113.55 105.42 2duw h SER 12 Ca -0.03 0.00 -0.49 0.00 -1.23 0.00 0.00 61.79 60.04 2duw h SER 12 Cb 1.18 0.00 -0.26 0.00 -0.44 0.00 0.00 62.40 62.88 2duw h SER 12 CO 0.02 0.24 -0.81 -0.89 -0.53 0.00 0.00 176.83 174.86 2duw s THR 13 N -1.34 1.26 -0.36 2.23 2.01 -1.11 -5.09 115.64 113.24 2duw s THR 13 Ca -0.03 -1.00 -0.02 0.00 0.31 0.00 0.00 61.69 60.96 2duw s THR 13 Cb 0.00 -1.12 0.09 0.00 0.01 0.00 0.00 72.50 71.48 2duw s THR 13 CO 0.04 0.10 0.11 -0.13 -0.69 0.00 0.00 174.62 174.05 2duw s ARG 14 N -1.04 2.08 0.01 4.92 0.52 -1.26 -4.27 118.95 119.91 2duw s ARG 14 Ca 0.04 -1.64 0.00 0.00 -0.52 0.00 0.00 55.73 53.61 2duw s ARG 14 Cb -0.08 -3.40 -0.01 0.00 0.52 0.00 0.00 34.95 31.99 2duw s ARG 14 CO 0.01 -0.90 -0.01 0.99 0.02 0.00 0.00 175.30 175.41 2duw s THR 15 N 1.15 0.04 -0.04 0.02 2.01 -1.26 -4.73 115.64 112.83 2duw s THR 15 Ca 0.04 -0.33 0.02 0.00 0.31 0.00 0.00 61.69 61.73 2duw s THR 15 Cb -0.21 -0.11 0.01 0.00 0.01 0.00 0.00 72.50 72.20 2duw s THR 15 CO -0.04 -0.18 -0.10 -0.63 -0.69 0.00 0.00 174.62 172.98 2duw s ILE 16 N -0.53 0.94 -0.13 1.82 1.09 -0.48 -2.66 121.20 121.24 2duw s ILE 16 Ca -0.06 -0.41 0.02 0.00 -1.10 0.00 0.00 60.65 59.10 2duw s ILE 16 Cb -0.04 -0.85 0.02 0.00 -1.06 0.00 0.00 42.46 40.53 2duw s ILE 16 CO -0.00 0.30 -0.18 0.00 -0.10 0.00 0.00 174.94 174.96 2duw s ALA 17 N 0.41 1.97 -0.20 9.38 0.00 -0.48 -0.06 121.76 132.78 2duw s ALA 17 Ca -0.08 -0.93 -0.14 0.00 0.00 0.00 0.00 51.96 50.81 2duw s ALA 17 Cb -0.12 -0.97 -0.04 0.00 0.00 0.00 0.00 23.12 21.99 2duw s ALA 17 CO 0.02 -0.16 0.32 -1.17 0.00 0.00 0.00 175.76 174.77 2duw s LEU 18 N 1.07 4.18 -0.34 0.00 2.96 -0.51 -0.25 118.68 125.78 2duw s LEU 18 Ca -0.03 0.43 -0.12 0.00 -0.22 0.00 0.00 54.13 54.19 2duw s LEU 18 Cb -0.14 -2.39 -0.01 0.00 0.50 0.00 0.00 46.19 44.14 2duw s LEU 18 CO -0.05 0.01 0.23 -0.69 -1.32 0.00 0.00 176.35 174.53 2duw s VAL 19 N 0.99 5.15 0.00 1.68 1.01 -1.22 -0.09 120.40 127.93 2duw s VAL 19 Ca 0.16 -0.29 0.00 0.00 0.00 0.00 0.00 61.98 61.85 2duw s VAL 19 Cb -0.14 -3.66 0.00 0.00 0.00 0.00 0.00 36.38 32.58 2duw s VAL 19 CO 0.06 -0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.75 2duw n GLY 20 N 5.09 0.78 3.65 4.51 0.00 -0.08 -4.48 105.19 114.66 2duw n GLY 20 Ca -0.13 -0.55 -0.40 0.00 0.00 0.00 0.00 46.02 44.94 2duw n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2duw s ALA 21 N -2.47 3.56 0.27 4.61 0.00 -1.25 -4.93 121.76 121.55 2duw s ALA 21 Ca 0.00 -0.36 0.04 0.00 0.00 0.00 0.00 51.96 51.64 2duw s ALA 21 Cb 0.00 -2.93 -0.01 0.00 0.00 0.00 0.00 23.12 20.18 2duw s ALA 21 CO 0.00 -0.57 0.14 -1.13 0.00 0.00 0.00 175.76 174.21 2duw n SER 22 N 5.09 0.48 -2.39 0.00 3.41 -1.26 -4.70 113.62 114.25 2duw n SER 22 Ca -0.02 -2.56 -0.30 0.00 -0.26 0.00 0.00 58.87 55.73 2duw n SER 22 Cb 0.50 0.92 0.03 0.00 -0.26 0.00 0.00 64.21 65.40 2duw n SER 22 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2duw n ASP 23 N -1.83 7.07 -4.13 4.04 8.00 -1.26 -4.80 116.55 123.65 2duw n ASP 23 Ca -0.00 -3.48 -0.37 0.00 0.71 0.00 0.00 54.79 51.64 2duw n ASP 23 Cb 0.43 -1.08 -0.07 0.00 -0.02 0.00 0.00 41.12 40.39 2duw n ASP 23 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2duw s LYS 24 N -2.89 3.16 0.00 -1.24 -0.14 -1.26 -4.88 119.74 112.49 2duw s LYS 24 Ca 0.52 -3.04 0.15 0.00 -1.36 0.00 0.00 55.97 52.24 2duw s LYS 24 Cb 0.40 -3.96 0.74 0.00 -1.68 0.00 0.00 37.83 33.33 2duw s LYS 24 CO -0.15 -1.24 1.41 -0.35 -0.76 0.00 0.00 175.35 174.26 2duw n PRO 25 N 2.73 0.19 -1.11 -1.68 -0.04 -1.26 -2.50 135.00 131.33 2duw n PRO 25 Ca 0.18 0.15 -0.13 0.00 -0.04 0.00 0.00 63.50 63.66 2duw n PRO 25 Cb 0.38 -1.50 0.26 0.00 -0.04 0.00 0.00 33.50 32.60 2duw n PRO 25 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2duw n ASP 26 N -1.30 4.45 -4.26 3.54 5.75 -1.26 -4.69 116.55 118.78 2duw n ASP 26 Ca 0.07 -3.37 -0.15 0.00 -0.01 0.00 0.00 54.79 51.32 2duw n ASP 26 Cb 0.12 -0.78 -0.10 0.00 -1.03 0.00 0.00 41.12 39.33 2duw n ASP 26 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 2duw s ARG 27 N -3.11 1.07 0.40 0.11 0.52 -1.04 -5.03 118.95 111.87 2duw s ARG 27 Ca 0.56 -1.43 0.29 0.00 -0.52 0.00 0.00 55.73 54.63 2duw s ARG 27 Cb 0.46 -0.70 1.19 0.00 0.52 0.00 0.00 34.95 36.42 2duw s ARG 27 CO 0.13 0.10 1.85 -1.00 0.02 0.00 0.00 175.30 176.39 2duw h PRO 28 N 2.86 0.00 0.00 3.54 0.13 -1.90 -2.48 132.00 134.16 2duw h PRO 28 Ca -0.37 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.61 2duw h PRO 28 Cb 1.19 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.30 2duw h PRO 28 CO 0.62 0.00 -0.73 0.77 -0.23 0.00 0.00 178.00 178.42 2duw h SER 29 N 0.00 0.00 0.10 1.44 0.02 -1.89 -3.18 113.55 110.04 2duw h SER 29 Ca 0.00 0.00 -0.29 0.00 -0.84 0.00 0.00 61.79 60.66 2duw h SER 29 Cb 0.42 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.95 2duw h SER 29 CO 0.00 0.73 -1.51 0.22 -1.14 0.00 0.00 176.83 175.14 2duw h TYR 30 N 0.00 0.37 -0.72 3.45 5.03 -1.67 -3.24 116.97 120.18 2duw h TYR 30 Ca -0.01 -0.27 0.19 0.00 2.58 0.00 0.00 58.73 61.22 2duw h TYR 30 Cb 1.44 -0.01 -0.04 0.00 1.55 0.00 0.00 36.73 39.67 2duw h TYR 30 CO 0.00 1.59 0.50 0.07 -1.32 0.00 0.00 178.16 179.01 2duw h ARG 31 N -0.35 0.15 0.08 1.82 -0.00 -1.56 -0.39 114.38 114.14 2duw h ARG 31 Ca -0.34 -0.01 -0.28 0.00 -0.00 0.00 0.00 59.98 59.36 2duw h ARG 31 Cb 1.74 -0.03 0.03 0.00 -0.00 0.00 0.00 29.97 31.70 2duw h ARG 31 CO 0.02 0.10 -1.13 0.28 -0.00 0.00 0.00 179.97 179.24 2duw h VAL 32 N 0.16 1.30 0.44 0.08 2.07 -1.68 -2.65 116.25 115.96 2duw h VAL 32 Ca 0.35 -2.37 -0.01 0.00 0.82 0.00 0.00 66.70 65.49 2duw h VAL 32 Cb 1.16 2.62 -0.02 0.00 -1.52 0.00 0.00 31.29 33.54 2duw h VAL 32 CO -0.06 0.72 -0.45 -0.03 0.02 0.00 0.00 177.57 177.78 2duw h MET 33 N 0.25 -0.86 0.00 1.57 1.85 -1.10 0.20 114.93 116.84 2duw h MET 33 Ca -0.16 0.06 -0.01 0.00 -0.61 0.00 0.00 59.70 58.98 2duw h MET 33 Cb 1.81 0.19 -0.00 0.00 0.43 0.00 0.00 31.60 34.03 2duw h MET 33 CO 0.22 -0.57 -0.03 -0.22 -0.40 0.00 0.00 176.91 175.91 2duw h LYS 34 N -0.89 0.00 -0.05 0.39 1.63 -1.58 -2.41 116.57 113.67 2duw h LYS 34 Ca -0.05 0.00 -0.07 0.00 -0.85 0.00 0.00 60.65 59.67 2duw h LYS 34 Cb 0.77 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.41 2duw h LYS 34 CO -0.06 0.03 -0.26 -0.92 -3.45 0.00 0.00 179.45 174.78 2duw h TYR 35 N 0.00 0.35 -0.46 1.91 3.20 -0.93 -2.23 116.97 118.83 2duw h TYR 35 Ca -0.00 -0.16 -0.04 0.00 3.14 0.00 0.00 58.73 61.67 2duw h TYR 35 Cb 0.22 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.42 2duw h TYR 35 CO 0.00 0.89 0.12 -0.07 -1.64 0.00 0.00 178.16 177.46 2duw h LEU 36 N -0.29 0.69 -0.29 2.82 3.38 -0.29 -2.58 115.31 118.75 2duw h LEU 36 Ca -0.02 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.72 2duw h LEU 36 Cb 0.93 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 2duw h LEU 36 CO 0.05 0.73 0.16 -0.07 0.09 0.00 0.00 178.44 179.40 2duw h LEU 37 N 0.61 0.36 -0.05 1.67 3.38 -1.52 -0.10 115.31 119.66 2duw h LEU 37 Ca 0.14 -0.09 0.04 0.00 0.09 0.00 0.00 57.88 58.06 2duw h LEU 37 Cb 0.31 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 40.91 2duw h LEU 37 CO -0.00 0.35 -0.28 -0.78 0.09 0.00 0.00 178.44 177.83 2duw h ASP 38 N 0.35 -0.84 -0.17 -0.43 3.58 -1.29 0.35 116.42 117.96 2duw h ASP 38 Ca 0.10 0.12 0.05 0.00 0.42 0.00 0.00 57.03 57.72 2duw h ASP 38 Cb 0.07 0.35 -0.01 0.00 1.72 0.00 0.00 39.33 41.46 2duw h ASP 38 CO -0.02 -0.34 0.21 1.56 -2.88 0.00 0.00 179.24 177.77 2duw h GLN 39 N -0.39 0.00 0.00 0.28 1.08 -1.36 -3.45 115.11 111.26 2duw h GLN 39 Ca 0.08 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.28 2duw h GLN 39 Cb 0.50 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.93 2duw h GLN 39 CO -0.27 0.00 0.00 0.41 -0.95 0.00 0.00 178.83 178.02 2duw n GLY 40 N -1.39 0.84 3.69 3.46 0.00 0.11 -4.98 105.19 106.93 2duw n GLY 40 Ca 0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.80 2duw n GLY 40 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2duw s TYR 41 N -1.50 2.65 -0.34 1.61 1.51 -0.09 -5.01 117.35 116.18 2duw s TYR 41 Ca 0.00 -0.40 -0.15 0.00 -1.01 0.00 0.00 57.07 55.52 2duw s TYR 41 Cb 0.00 -1.57 -0.01 0.00 -0.11 0.00 0.00 41.96 40.27 2duw s TYR 41 CO 0.00 0.40 0.35 -1.58 -1.11 0.00 0.00 175.55 173.61 2duw s HIS 42 N -2.45 3.21 0.01 2.71 2.46 -1.26 -4.36 115.29 115.61 2duw s HIS 42 Ca 0.36 -0.05 0.03 0.00 0.47 0.00 0.00 55.06 55.87 2duw s HIS 42 Cb -0.02 -2.65 -0.03 0.00 -0.13 0.00 0.00 32.58 29.75 2duw s HIS 42 CO 0.21 -0.43 -0.04 0.14 -2.47 0.00 0.00 174.74 172.16 2duw s VAL 43 N 1.98 3.83 -0.55 0.89 -7.23 -1.25 -1.38 120.40 116.70 2duw s VAL 43 Ca 0.11 -0.73 0.04 0.00 -1.81 0.00 0.00 61.98 59.59 2duw s VAL 43 Cb -0.17 -2.69 0.16 0.00 0.56 0.00 0.00 36.38 34.25 2duw s VAL 43 CO 0.12 0.37 0.40 -0.63 -0.31 0.00 0.00 175.10 175.04 2duw s ILE 44 N -1.05 1.62 0.05 -0.62 1.01 0.91 -4.89 121.20 118.23 2duw s ILE 44 Ca 0.18 -3.36 -0.31 0.00 0.00 0.00 0.00 60.65 57.16 2duw s ILE 44 Cb -0.11 -2.09 -0.07 0.00 0.01 0.00 0.00 42.46 40.21 2duw s ILE 44 CO 0.09 -1.09 1.42 -2.16 0.00 0.00 0.00 174.94 173.20 2duw s PRO 45 N -0.58 4.29 -0.13 2.79 0.04 -1.26 -1.43 135.00 138.73 2duw s PRO 45 Ca 0.27 2.03 0.01 0.00 0.04 0.00 0.00 61.00 63.35 2duw s PRO 45 Cb -0.04 -3.46 0.02 0.00 0.04 0.00 0.00 34.50 31.06 2duw s PRO 45 CO -0.16 -0.54 -0.14 0.08 0.04 0.00 0.00 177.00 176.29 2duw s VAL 46 N 1.96 1.51 0.01 -0.36 1.01 0.87 -3.87 120.40 121.54 2duw s VAL 46 Ca 0.65 -0.61 -0.10 0.00 0.00 0.00 0.00 61.98 61.91 2duw s VAL 46 Cb -0.34 -1.41 0.01 0.00 0.00 0.00 0.00 36.38 34.64 2duw s VAL 46 CO 0.28 0.45 0.20 -0.55 0.00 0.00 0.00 175.10 175.48 2duw s SER 47 N 1.33 -0.02 0.16 3.32 0.15 0.97 -0.90 113.70 118.71 2duw s SER 47 Ca 0.01 -0.20 0.20 0.00 0.70 0.00 0.00 55.95 56.66 2duw s SER 47 Cb -0.13 0.26 0.84 0.00 -1.71 0.00 0.00 66.02 65.28 2duw s SER 47 CO -0.08 -0.47 1.61 -0.81 1.20 0.00 0.00 173.24 174.70 2duw n PRO 48 N 1.09 0.12 -0.07 5.44 -0.04 -1.25 -2.29 135.00 138.00 2duw n PRO 48 Ca -0.21 0.36 -0.07 0.00 -0.04 0.00 0.00 63.50 63.54 2duw n PRO 48 Cb 0.57 -1.73 -0.10 0.00 -0.04 0.00 0.00 33.50 32.19 2duw n PRO 48 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2duw n LYS 49 N -1.96 1.59 0.00 0.54 4.81 -1.26 -4.40 118.16 117.47 2duw n LYS 49 Ca 0.03 0.01 0.13 0.00 -0.87 0.00 0.00 58.31 57.60 2duw n LYS 49 Cb 0.20 -1.35 0.61 0.00 0.02 0.00 0.00 35.03 34.51 2duw n LYS 49 CO 0.00 0.00 0.00 1.55 1.17 0.00 0.00 177.40 180.12 2duw n VAL 50 N -2.57 0.17 -1.53 3.15 3.14 -1.15 -4.79 118.33 114.75 2duw n VAL 50 Ca -0.23 0.04 -0.39 0.00 -2.96 0.00 0.00 64.34 60.79 2duw n VAL 50 Cb 0.93 -0.60 -0.06 0.00 -1.06 0.00 0.00 33.84 33.05 2duw n VAL 50 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2duw n ALA 51 N -1.41 0.81 0.00 1.55 0.00 -0.97 -0.07 120.51 120.42 2duw n ALA 51 Ca 0.09 -0.64 0.00 0.00 0.00 0.00 0.00 53.44 52.89 2duw n ALA 51 Cb 0.27 -2.92 0.00 0.00 0.00 0.00 0.00 19.45 16.80 2duw n ALA 51 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2duw n GLY 52 N 6.15 1.10 3.52 0.00 0.00 -1.25 -4.84 105.19 109.87 2duw n GLY 52 Ca 0.43 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.20 2duw n GLY 52 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2duw s LYS 53 N -0.18 1.81 -0.18 1.61 -0.14 0.90 -4.96 119.74 118.59 2duw s LYS 53 Ca 0.00 -2.05 -0.00 0.00 -1.36 0.00 0.00 55.97 52.56 2duw s LYS 53 Cb 0.00 -1.02 0.05 0.00 -1.68 0.00 0.00 37.83 35.18 2duw s LYS 53 CO 0.00 -0.23 -0.05 0.95 -0.76 0.00 0.00 175.35 175.26 2duw s THR 54 N -3.14 1.14 -0.22 2.17 -4.23 -1.26 -0.84 115.64 109.26 2duw s THR 54 Ca 0.31 -0.73 -0.02 0.00 -1.18 0.00 0.00 61.69 60.08 2duw s THR 54 Cb 0.07 -1.35 0.01 0.00 1.34 0.00 0.00 72.50 72.57 2duw s THR 54 CO 0.15 0.06 -0.09 -0.76 -0.54 0.00 0.00 174.62 173.44 2duw s LEU 55 N 1.61 2.83 -1.81 4.79 1.43 -0.22 -4.59 118.68 122.72 2duw s LEU 55 Ca -0.01 -0.68 0.00 0.00 -1.03 0.00 0.00 54.13 52.41 2duw s LEU 55 Cb -0.16 -1.64 0.00 0.00 0.03 0.00 0.00 46.19 44.42 2duw s LEU 55 CO -0.07 -0.06 0.00 0.18 0.23 0.00 0.00 176.35 176.62 2duw n LEU 56 N 4.69 -1.64 0.00 1.79 4.77 -1.26 -0.97 117.00 124.39 2duw n LEU 56 Ca -0.18 0.21 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 2duw n LEU 56 Cb 0.49 -2.68 0.00 0.00 -2.33 0.00 0.00 43.42 38.89 2duw n LEU 56 CO 0.27 -0.57 0.00 0.61 -1.33 0.00 0.00 177.39 176.37 2duw n GLY 57 N -0.84 0.88 3.84 -0.72 0.00 -1.26 -5.04 105.19 102.05 2duw n GLY 57 Ca -0.21 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.44 2duw n GLY 57 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2duw s GLN 58 N -0.41 3.76 0.32 1.61 -1.52 -0.14 -5.08 119.66 118.20 2duw s GLN 58 Ca 0.00 0.16 -0.27 0.00 -1.95 0.00 0.00 55.36 53.30 2duw s GLN 58 Cb 0.00 -3.23 -0.09 0.00 -0.22 0.00 0.00 33.01 29.46 2duw s GLN 58 CO 0.00 0.68 1.00 -1.14 -0.25 0.00 0.00 175.29 175.57 2duw s GLN 59 N -0.89 4.55 0.47 2.91 2.00 -1.26 -1.06 119.66 126.39 2duw s GLN 59 Ca 0.19 1.49 -0.01 0.00 -2.00 0.00 0.00 55.36 55.03 2duw s GLN 59 Cb -0.14 -2.90 -0.00 0.00 0.80 0.00 0.00 33.01 30.76 2duw s GLN 59 CO 0.09 0.22 0.71 0.20 -0.50 0.00 0.00 175.29 176.00 2duw s GLY 60 N -1.39 1.57 -0.18 2.59 0.00 -0.02 -4.47 107.32 105.42 2duw s GLY 60 Ca 0.49 -0.98 -0.11 0.00 0.00 0.00 0.00 44.72 44.12 2duw s GLY 60 CO 0.29 -0.79 0.45 -0.19 0.00 0.00 0.00 173.10 172.85 2duw s TYR 61 N -2.63 -0.63 0.38 1.90 2.02 -1.25 -3.96 117.35 113.19 2duw s TYR 61 Ca 0.49 1.36 0.13 0.00 -0.37 0.00 0.00 57.07 58.68 2duw s TYR 61 Cb -0.10 0.29 0.75 0.00 -0.40 0.00 0.00 41.96 42.50 2duw s TYR 61 CO 0.39 -0.34 1.84 0.00 -1.57 0.00 0.00 175.55 175.87 2duw h ALA 62 N 6.80 1.42 -2.62 3.71 0.00 -1.87 0.27 119.26 126.97 2duw h ALA 62 Ca -0.34 -0.32 -0.13 0.00 0.00 0.00 0.00 54.91 54.12 2duw h ALA 62 Cb 1.19 -0.06 -0.21 0.00 0.00 0.00 0.00 17.79 18.71 2duw h ALA 62 CO 0.27 0.44 -0.32 0.95 0.00 0.00 0.00 179.25 180.58 2duw s THR 63 N -4.24 0.05 0.44 0.00 -4.23 -1.26 -3.96 115.64 102.45 2duw s THR 63 Ca -0.03 -0.45 0.13 0.00 -1.18 0.00 0.00 61.69 60.16 2duw s THR 63 Cb 0.15 -0.56 0.19 0.00 1.34 0.00 0.00 72.50 73.61 2duw s THR 63 CO 0.72 -0.25 1.99 -0.07 -0.54 0.00 0.00 174.62 176.47 2duw h LEU 64 N 4.17 0.05 0.00 4.79 3.38 -1.94 -0.71 115.31 125.05 2duw h LEU 64 Ca -0.29 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.67 2duw h LEU 64 Cb 1.18 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.92 2duw h LEU 64 CO 0.39 0.21 0.00 0.00 0.09 0.00 0.00 178.44 179.13 2duw n ALA 65 N -2.50 2.41 1.07 1.53 0.00 -1.26 -2.57 120.51 119.18 2duw n ALA 65 Ca -0.02 -0.15 0.11 0.00 0.00 0.00 0.00 53.44 53.39 2duw n ALA 65 Cb 0.24 -1.43 0.11 0.00 0.00 0.00 0.00 19.45 18.37 2duw n ALA 65 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2duw n ASP 66 N -1.14 1.31 -4.73 0.00 9.92 -0.27 -4.90 116.55 116.74 2duw n ASP 66 Ca 0.16 -1.05 -0.39 0.00 -0.53 0.00 0.00 54.79 52.98 2duw n ASP 66 Cb 0.15 0.47 -0.05 0.00 -0.64 0.00 0.00 41.12 41.04 2duw n ASP 66 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 2duw s VAL 67 N -2.68 4.98 0.09 2.53 1.01 -1.06 -4.98 120.40 120.30 2duw s VAL 67 Ca 0.17 1.37 -0.16 0.00 0.00 0.00 0.00 61.98 63.36 2duw s VAL 67 Cb 0.18 -4.00 -0.09 0.00 0.00 0.00 0.00 36.38 32.47 2duw s VAL 67 CO 0.64 0.32 1.41 1.55 0.00 0.00 0.00 175.10 179.02 2duw h PRO 68 N 6.32 0.65 -7.01 2.72 0.13 -1.90 -3.44 132.00 129.47 2duw h PRO 68 Ca -0.42 -0.34 -0.48 0.00 -0.87 0.00 0.00 66.00 63.89 2duw h PRO 68 Cb 1.20 0.01 0.02 0.00 0.13 0.00 0.00 31.00 32.36 2duw h PRO 68 CO 0.73 0.95 0.40 -2.00 -0.23 0.00 0.00 178.00 177.85 2duw s GLU 69 N -4.36 4.03 -0.26 0.86 -6.30 -1.26 -5.03 118.70 106.38 2duw s GLU 69 Ca -0.13 1.44 -0.12 0.00 -2.50 0.00 0.00 54.97 53.66 2duw s GLU 69 Cb 0.08 -2.36 -0.05 0.00 0.00 0.00 0.00 34.13 31.81 2duw s GLU 69 CO 0.82 -0.25 0.25 -1.59 0.02 0.00 0.00 175.26 174.51 2duw s LYS 70 N -2.80 4.03 0.27 4.30 -2.85 -1.26 -5.07 119.74 116.35 2duw s LYS 70 Ca 0.62 -0.15 -0.29 0.00 -1.00 0.00 0.00 55.97 55.14 2duw s LYS 70 Cb -0.19 -3.61 -0.09 0.00 -2.06 0.00 0.00 37.83 31.87 2duw s LYS 70 CO 0.24 -0.12 1.02 0.54 0.10 0.00 0.00 175.35 177.13 2duw s VAL 71 N 1.58 3.79 -0.12 1.79 0.11 -1.26 -4.96 120.40 121.33 2duw s VAL 71 Ca 0.11 1.76 0.20 0.00 -2.93 0.00 0.00 61.98 61.12 2duw s VAL 71 Cb -0.15 -4.11 -0.23 0.00 -1.53 0.00 0.00 36.38 30.37 2duw s VAL 71 CO 0.08 0.39 0.53 0.47 -3.33 0.00 0.00 175.10 173.25 2duw n ASP 72 N 1.22 0.31 -3.66 3.54 8.00 -1.26 -4.22 116.55 120.48 2duw n ASP 72 Ca -0.01 0.13 -0.14 0.00 0.71 0.00 0.00 54.79 55.48 2duw n ASP 72 Cb 0.46 1.12 -0.13 0.00 -0.02 0.00 0.00 41.12 42.54 2duw n ASP 72 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 2duw s MET 73 N -3.10 0.13 -0.12 -1.24 1.75 -1.09 -2.88 119.30 112.76 2duw s MET 73 Ca -0.06 0.71 -0.05 0.00 -1.25 0.00 0.00 55.69 55.04 2duw s MET 73 Cb 0.10 -0.09 -0.04 0.00 2.84 0.00 0.00 34.83 37.64 2duw s MET 73 CO 0.85 -0.30 0.07 0.08 -0.65 0.00 0.00 175.02 175.07 2duw s VAL 74 N 2.40 4.88 0.04 10.11 1.01 -0.86 -1.38 120.40 136.60 2duw s VAL 74 Ca 0.02 -0.03 0.03 0.00 0.00 0.00 0.00 61.98 62.00 2duw s VAL 74 Cb -0.12 -3.11 -0.04 0.00 0.00 0.00 0.00 36.38 33.11 2duw s VAL 74 CO -0.08 0.59 0.02 1.51 0.00 0.00 0.00 175.10 177.13 2duw s ASP 75 N -0.72 5.21 -0.30 3.32 1.47 0.65 -0.74 116.67 125.56 2duw s ASP 75 Ca 0.12 -0.05 -0.01 0.00 1.18 0.00 0.00 52.55 53.79 2duw s ASP 75 Cb -0.12 -1.34 0.09 0.00 -0.34 0.00 0.00 42.92 41.21 2duw s ASP 75 CO 0.03 0.23 0.08 -0.69 0.68 0.00 0.00 175.17 175.50 2duw s VAL 76 N -1.22 0.88 -0.50 2.11 1.01 0.88 -3.40 120.40 120.15 2duw s VAL 76 Ca 0.24 -1.31 0.06 0.00 0.00 0.00 0.00 61.98 60.96 2duw s VAL 76 Cb -0.12 -1.62 -0.01 0.00 0.00 0.00 0.00 36.38 34.64 2duw s VAL 76 CO 0.15 -0.61 0.45 0.49 0.00 0.00 0.00 175.10 175.59 2duw n PHE 77 N 4.86 0.00 0.03 5.22 3.72 -1.26 -3.40 117.46 126.63 2duw n PHE 77 Ca -0.03 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.34 2duw n PHE 77 Cb 0.43 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.95 2duw n PHE 77 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2duw h ARG 78 N 0.58 -0.16 -2.62 -1.08 3.08 -1.92 -3.41 114.38 108.86 2duw h ARG 78 Ca 0.00 0.01 0.12 0.00 0.07 0.00 0.00 59.98 60.18 2duw h ARG 78 Cb 0.19 0.04 -0.08 0.00 0.08 0.00 0.00 29.97 30.19 2duw h ARG 78 CO 0.00 -0.10 0.37 -0.80 -1.07 0.00 0.00 179.97 178.37 2duw s ASN 79 N -2.84 -0.26 0.04 7.04 0.01 -1.26 -5.01 114.94 112.66 2duw s ASN 79 Ca -0.03 -0.39 -0.32 0.00 -0.71 0.00 0.00 52.86 51.41 2duw s ASN 79 Cb 0.01 0.57 -0.18 0.00 0.41 0.00 0.00 41.25 42.06 2duw s ASN 79 CO 0.12 -1.03 1.43 0.77 -1.51 0.00 0.00 177.10 176.88 2duw h SER 80 N 2.00 -0.84 0.19 -1.22 4.64 -1.94 -2.78 113.55 113.60 2duw h SER 80 Ca -0.23 0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.08 2duw h SER 80 Cb 1.25 0.22 -0.00 0.00 -0.31 0.00 0.00 62.40 63.55 2duw h SER 80 CO 0.26 -0.53 -0.07 -0.08 -0.87 0.00 0.00 176.83 175.55 2duw h GLU 81 N -1.11 0.00 0.00 4.77 4.57 -1.99 -1.40 114.58 119.43 2duw h GLU 81 Ca -0.10 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.06 2duw h GLU 81 Cb 0.78 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.37 2duw h GLU 81 CO 0.17 0.07 -0.10 0.00 -1.18 0.00 0.00 179.01 177.96 2duw h ALA 82 N 1.93 1.30 -0.89 2.92 0.00 -1.89 -2.79 119.26 119.84 2duw h ALA 82 Ca -0.00 -0.09 0.15 0.00 0.00 0.00 0.00 54.91 54.97 2duw h ALA 82 Cb 0.18 -0.02 -0.10 0.00 0.00 0.00 0.00 17.79 17.86 2duw h ALA 82 CO 0.01 0.13 0.49 0.00 0.00 0.00 0.00 179.25 179.88 2duw h ALA 83 N 1.90 1.37 0.30 0.00 0.00 -1.10 0.25 119.26 121.99 2duw h ALA 83 Ca -0.00 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2duw h ALA 83 Cb 0.30 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2duw h ALA 83 CO 0.01 -0.06 -0.15 2.35 0.00 0.00 0.00 179.25 181.41 2duw h TRP 84 N 0.68 -0.38 -0.51 0.00 2.91 -1.69 0.23 115.95 117.20 2duw h TRP 84 Ca 0.49 -0.01 0.04 0.00 1.13 0.00 0.00 58.89 60.54 2duw h TRP 84 Cb 0.69 0.13 -0.03 0.00 -0.51 0.00 0.00 29.16 29.43 2duw h TRP 84 CO -0.07 -0.05 0.34 0.78 -1.03 0.00 0.00 178.44 178.41 2duw h GLY 85 N -0.74 0.63 1.69 2.65 0.00 -1.52 -0.89 103.07 104.89 2duw h GLY 85 Ca -0.04 -0.21 -0.04 0.00 0.00 0.00 0.00 47.33 47.03 2duw h GLY 85 CO 0.07 0.18 -0.48 -2.08 0.00 0.00 0.00 176.54 174.23 2duw h VAL 86 N 0.54 0.27 -0.06 4.60 2.07 -0.46 -3.26 116.25 119.95 2duw h VAL 86 Ca 0.21 -1.41 -0.13 0.00 0.82 0.00 0.00 66.70 66.19 2duw h VAL 86 Cb 0.17 2.01 0.01 0.00 -1.52 0.00 0.00 31.29 31.96 2duw h VAL 86 CO -0.06 0.15 -0.45 0.00 0.02 0.00 0.00 177.57 177.24 2duw h ALA 87 N 1.81 0.14 -0.62 1.67 0.00 0.81 -2.09 119.26 120.98 2duw h ALA 87 Ca -0.02 -0.50 -0.00 0.00 0.00 0.00 0.00 54.91 54.39 2duw h ALA 87 Cb 1.16 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.92 2duw h ALA 87 CO 0.02 0.30 0.37 -0.56 0.00 0.00 0.00 179.25 179.38 2duw h GLN 88 N -0.06 0.85 -0.49 0.00 3.07 -1.42 0.15 115.11 117.21 2duw h GLN 88 Ca -0.04 -0.08 -0.11 0.00 0.09 0.00 0.00 58.65 58.51 2duw h GLN 88 Cb 1.12 -0.18 -0.01 0.00 0.08 0.00 0.00 27.48 28.49 2duw h GLN 88 CO 0.09 0.61 -0.12 1.05 0.09 0.00 0.00 178.83 180.55 2duw h GLU 89 N 0.85 0.94 -0.42 0.06 4.11 -1.62 -0.02 114.58 118.48 2duw h GLU 89 Ca 0.22 -0.36 -0.08 0.00 0.07 0.00 0.00 59.36 59.21 2duw h GLU 89 Cb -0.02 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 2duw h GLU 89 CO -0.04 1.03 -0.05 0.00 0.07 0.00 0.00 179.01 180.02 2duw h ALA 90 N 0.89 0.57 -0.22 1.06 0.00 -1.06 -2.35 119.26 118.14 2duw h ALA 90 Ca 0.12 -0.29 -0.14 0.00 0.00 0.00 0.00 54.91 54.61 2duw h ALA 90 Cb 0.68 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2duw h ALA 90 CO 0.05 0.40 -0.43 0.82 0.00 0.00 0.00 179.25 180.08 2duw h ILE 91 N 0.59 1.31 -0.25 0.00 2.04 -0.65 0.26 117.51 120.81 2duw h ILE 91 Ca 0.11 -1.61 -0.01 0.00 1.00 0.00 0.00 64.86 64.35 2duw h ILE 91 Cb 0.55 1.60 -0.01 0.00 -0.74 0.00 0.00 36.82 38.22 2duw h ILE 91 CO 0.03 0.50 0.12 0.00 0.00 0.00 0.00 178.15 178.81 2duw h ALA 92 N 1.09 0.33 0.00 1.87 0.00 -0.88 -2.55 119.26 119.12 2duw h ALA 92 Ca 0.03 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 2duw h ALA 92 Cb 0.93 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 2duw h ALA 92 CO 0.08 -0.11 -0.25 -0.84 0.00 0.00 0.00 179.25 178.13 2duw h ILE 93 N 0.28 0.65 0.00 0.00 3.07 -1.40 -3.47 117.51 116.64 2duw h ILE 93 Ca 0.09 -1.14 0.00 0.00 1.55 0.00 0.00 64.86 65.36 2duw h ILE 93 Cb 0.12 1.74 0.00 0.00 -0.27 0.00 0.00 36.82 38.41 2duw h ILE 93 CO -0.01 0.24 0.00 0.61 -1.05 0.00 0.00 178.15 177.94 2duw n GLY 94 N 0.04 0.69 2.96 0.16 0.00 -0.80 -5.03 105.19 103.22 2duw n GLY 94 Ca -0.00 -0.78 -0.24 0.00 0.00 0.00 0.00 46.02 45.00 2duw n GLY 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2duw n ALA 95 N 0.00 -1.92 0.00 4.61 0.00 0.86 -4.88 120.51 119.18 2duw n ALA 95 Ca 0.00 -1.35 0.00 0.00 0.00 0.00 0.00 53.44 52.09 2duw n ALA 95 Cb 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 19.45 19.37 2duw n ALA 95 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2duw n LYS 96 N -3.68 0.00 -4.13 0.00 4.76 -1.26 -4.96 118.16 108.90 2duw n LYS 96 Ca 0.13 0.00 -0.10 0.00 -2.87 0.00 0.00 58.31 55.47 2duw n LYS 96 Cb 0.47 -0.67 -0.10 0.00 -1.84 0.00 0.00 35.03 32.89 2duw n LYS 96 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 2duw s THR 97 N -1.52 0.54 -0.19 -0.18 2.01 -1.14 -2.93 115.64 112.24 2duw s THR 97 Ca 0.00 -1.75 -0.05 0.00 0.31 0.00 0.00 61.69 60.21 2duw s THR 97 Cb 0.00 -1.44 0.07 0.00 0.01 0.00 0.00 72.50 71.14 2duw s THR 97 CO 0.00 -0.82 0.12 -0.22 -0.69 0.00 0.00 174.62 173.02 2duw s LEU 98 N -2.75 0.25 -0.09 4.42 2.96 -0.06 -2.03 118.68 121.38 2duw s LEU 98 Ca 0.07 -0.57 -0.03 0.00 -0.22 0.00 0.00 54.13 53.38 2duw s LEU 98 Cb 0.03 -0.11 -0.03 0.00 0.50 0.00 0.00 46.19 46.58 2duw s LEU 98 CO -0.05 -0.35 0.03 0.86 -1.32 0.00 0.00 176.35 175.52 2duw s TRP 99 N 2.18 3.24 0.21 5.38 -0.11 0.08 -0.12 118.94 129.81 2duw s TRP 99 Ca 0.04 0.26 0.01 0.00 1.22 0.00 0.00 56.10 57.62 2duw s TRP 99 Cb -0.16 -1.82 0.01 0.00 -1.50 0.00 0.00 33.47 30.00 2duw s TRP 99 CO -0.12 0.52 0.06 1.28 -4.62 0.00 0.00 176.95 174.07 2duw n LEU 100 N 2.13 0.00 -4.90 5.86 4.77 -0.67 -0.08 117.00 124.11 2duw n LEU 100 Ca -0.19 -1.21 -0.29 0.00 -0.03 0.00 0.00 56.01 54.30 2duw n LEU 100 Cb 0.54 0.08 0.03 0.00 -2.33 0.00 0.00 43.42 41.75 2duw n LEU 100 CO 0.29 -0.25 0.64 -1.10 -1.33 0.00 0.00 177.39 175.64 2duw s GLN 101 N -2.78 2.99 -0.08 3.23 -1.52 -1.22 -4.42 119.66 115.86 2duw s GLN 101 Ca 0.04 0.28 -0.27 0.00 -1.95 0.00 0.00 55.36 53.47 2duw s GLN 101 Cb -0.00 -2.15 -0.02 0.00 -0.22 0.00 0.00 33.01 30.61 2duw s GLN 101 CO 0.03 -0.81 0.87 -0.51 -0.25 0.00 0.00 175.29 174.62 2duw s LEU 102 N -5.16 4.28 0.00 2.90 1.43 -1.26 -3.10 118.68 117.78 2duw s LEU 102 Ca 0.55 1.39 0.00 0.00 -1.03 0.00 0.00 54.13 55.04 2duw s LEU 102 Cb -0.11 -3.35 0.00 0.00 0.03 0.00 0.00 46.19 42.76 2duw s LEU 102 CO 0.49 -0.29 0.00 0.61 0.23 0.00 0.00 176.35 177.39 2duw n GLY 103 N 3.13 0.90 3.31 -3.19 0.00 -1.26 -4.94 105.19 103.14 2duw n GLY 103 Ca 0.04 -0.17 -0.27 0.00 0.00 0.00 0.00 46.02 45.63 2duw n GLY 103 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2duw s VAL 104 N -2.00 1.90 -0.21 1.61 0.11 -1.24 -5.01 120.40 115.56 2duw s VAL 104 Ca 0.00 -1.49 -0.04 0.00 -2.93 0.00 0.00 61.98 57.52 2duw s VAL 104 Cb 0.00 -1.68 0.09 0.00 -1.53 0.00 0.00 36.38 33.25 2duw s VAL 104 CO 0.00 0.10 0.17 -0.63 -3.33 0.00 0.00 175.10 171.42 2duw s ILE 105 N -1.00 -0.22 -0.57 7.04 1.01 -1.26 -2.96 121.20 123.25 2duw s ILE 105 Ca 0.09 -0.24 0.01 0.00 0.00 0.00 0.00 60.65 60.52 2duw s ILE 105 Cb -0.10 -0.70 0.14 0.00 0.01 0.00 0.00 42.46 41.81 2duw s ILE 105 CO 0.04 -0.32 0.34 0.20 0.00 0.00 0.00 174.94 175.20 2duw s ASN 106 N 2.24 4.68 0.30 3.58 -0.87 -1.26 -4.95 114.94 118.66 2duw s ASN 106 Ca 0.06 -3.00 0.04 0.00 -1.57 0.00 0.00 52.86 48.38 2duw s ASN 106 Cb -0.16 -1.72 0.65 0.00 -0.02 0.00 0.00 41.25 40.00 2duw s ASN 106 CO -0.16 -0.27 1.82 -0.08 -2.57 0.00 0.00 177.10 175.83 2duw h GLU 107 N 6.64 0.86 -0.45 -0.60 4.81 -1.99 -0.73 114.58 123.12 2duw h GLU 107 Ca -0.05 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.10 2duw h GLU 107 Cb 0.91 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 30.07 2duw h GLU 107 CO 0.70 0.57 0.16 1.96 -0.73 0.00 0.00 179.01 181.67 2duw h GLN 108 N 0.88 0.68 -0.34 1.92 7.50 -2.00 -2.28 115.11 121.48 2duw h GLN 108 Ca 0.53 -0.13 -0.05 0.00 0.50 0.00 0.00 58.65 59.50 2duw h GLN 108 Cb 0.67 -0.11 -0.02 0.00 0.05 0.00 0.00 27.48 28.08 2duw h GLN 108 CO -0.31 0.64 0.00 0.00 -1.50 0.00 0.00 178.83 177.67 2duw h ALA 109 N 1.01 1.38 -0.17 3.87 0.00 -1.56 -1.10 119.26 122.69 2duw h ALA 109 Ca 0.15 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 2duw h ALA 109 Cb 0.22 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2duw h ALA 109 CO -0.01 0.43 -0.32 0.00 0.00 0.00 0.00 179.25 179.35 2duw h ALA 110 N 1.51 1.13 0.09 0.00 0.00 -0.87 -2.82 119.26 118.31 2duw h ALA 110 Ca 0.11 -0.37 -0.27 0.00 0.00 0.00 0.00 54.91 54.38 2duw h ALA 110 Cb 0.32 -0.10 0.03 0.00 0.00 0.00 0.00 17.79 18.03 2duw h ALA 110 CO 0.01 0.56 -1.11 0.28 0.00 0.00 0.00 179.25 178.99 2duw h VAL 111 N 0.30 1.32 -0.89 0.00 2.07 -0.89 -2.46 116.25 115.69 2duw h VAL 111 Ca 0.04 -2.39 0.08 0.00 0.82 0.00 0.00 66.70 65.25 2duw h VAL 111 Cb 0.72 2.68 -0.07 0.00 -1.52 0.00 0.00 31.29 33.10 2duw h VAL 111 CO 0.06 0.72 0.55 0.25 0.02 0.00 0.00 177.57 179.16 2duw h LEU 112 N 0.20 0.83 -0.21 2.57 5.85 -1.15 0.26 115.31 123.66 2duw h LEU 112 Ca -0.16 0.03 -0.22 0.00 0.84 0.00 0.00 57.88 58.37 2duw h LEU 112 Cb 1.80 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 42.68 2duw h LEU 112 CO 0.21 0.50 -0.92 0.00 -0.34 0.00 0.00 178.44 177.90 2duw h ALA 113 N 1.45 0.41 -0.46 1.25 0.00 -1.57 -3.27 119.26 117.07 2duw h ALA 113 Ca 0.41 -0.71 -0.11 0.00 0.00 0.00 0.00 54.91 54.49 2duw h ALA 113 Cb 0.27 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2duw h ALA 113 CO -0.21 0.84 -0.15 -0.09 0.00 0.00 0.00 179.25 179.64 2duw h ARG 114 N 0.20 0.92 -0.49 0.00 9.65 -0.83 0.34 114.38 124.17 2duw h ARG 114 Ca -0.07 -0.37 0.14 0.00 -1.10 0.00 0.00 59.98 58.58 2duw h ARG 114 Cb 1.55 -0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 30.07 2duw h ARG 114 CO 0.15 1.03 0.40 0.93 2.80 0.00 0.00 179.97 185.28 2duw h GLU 115 N 0.76 0.00 0.00 0.20 4.39 -0.57 -0.78 114.58 118.59 2duw h GLU 115 Ca 0.11 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.67 2duw h GLU 115 Cb 0.71 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.34 2duw h GLU 115 CO 0.05 0.00 -2.07 0.00 -1.16 0.00 0.00 179.01 175.84 2duw n ALA 116 N -2.53 2.23 0.00 3.43 0.00 -1.05 -5.00 120.51 117.60 2duw n ALA 116 Ca 0.09 -0.79 0.00 0.00 0.00 0.00 0.00 53.44 52.73 2duw n ALA 116 Cb 0.61 -0.46 0.00 0.00 0.00 0.00 0.00 19.45 19.60 2duw n ALA 116 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2duw n GLY 117 N 1.57 1.32 3.57 0.00 0.00 0.83 -5.08 105.19 107.40 2duw n GLY 117 Ca -0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.47 2duw n GLY 117 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2duw n LEU 118 N 0.00 2.11 -4.46 0.99 7.94 0.83 -4.86 117.00 119.55 2duw n LEU 118 Ca 0.00 0.95 -0.43 0.00 -1.11 0.00 0.00 56.01 55.42 2duw n LEU 118 Cb 0.00 -1.30 -0.04 0.00 0.53 0.00 0.00 43.42 42.62 2duw n LEU 118 CO 0.00 -1.96 0.81 -0.44 -1.11 0.00 0.00 177.39 174.69 2duw s SER 119 N -0.90 6.19 -0.07 1.96 0.01 -1.15 -4.18 113.70 115.55 2duw s SER 119 Ca 0.66 -0.98 -0.18 0.00 1.31 0.00 0.00 55.95 56.76 2duw s SER 119 Cb -0.53 -2.43 -0.05 0.00 0.21 0.00 0.00 66.02 63.22 2duw s SER 119 CO 0.55 -1.47 0.48 0.54 0.41 0.00 0.00 173.24 173.75 2duw s VAL 120 N 4.19 5.10 -0.18 3.43 0.11 -1.26 -0.88 120.40 130.91 2duw s VAL 120 Ca 0.24 0.98 -0.03 0.00 -2.93 0.00 0.00 61.98 60.24 2duw s VAL 120 Cb -0.15 -3.81 0.06 0.00 -1.53 0.00 0.00 36.38 30.94 2duw s VAL 120 CO 0.10 0.40 0.03 -0.69 -3.33 0.00 0.00 175.10 171.60 2duw s VAL 121 N 0.12 0.53 0.51 2.04 1.01 0.84 -4.96 120.40 120.50 2duw s VAL 121 Ca 0.26 -0.49 0.06 0.00 0.00 0.00 0.00 61.98 61.81 2duw s VAL 121 Cb -0.16 -0.99 0.02 0.00 0.00 0.00 0.00 36.38 35.25 2duw s VAL 121 CO 0.12 -0.15 0.37 0.00 0.00 0.00 0.00 175.10 175.44 2duw s MET 122 N 1.86 2.28 -1.46 2.72 0.23 -1.26 -1.66 119.30 122.00 2duw s MET 122 Ca -0.00 -1.95 -0.12 0.00 -1.03 0.00 0.00 55.69 52.59 2duw s MET 122 Cb -0.16 -2.11 0.08 0.00 -1.53 0.00 0.00 34.83 31.11 2duw s MET 122 CO -0.08 -0.51 0.74 -3.47 -2.03 0.00 0.00 175.02 169.68 2duw n ASP 123 N -1.67 -4.41 -3.79 -1.18 2.03 -1.15 -4.93 116.55 101.44 2duw n ASP 123 Ca -0.01 -0.61 -0.13 0.00 0.52 0.00 0.00 54.79 54.57 2duw n ASP 123 Cb 0.64 -3.57 -0.12 0.00 -0.72 0.00 0.00 41.12 37.35 2duw n ASP 123 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2duw s ARG 124 N -6.33 0.25 -0.06 -0.67 1.81 -1.24 -4.65 118.95 108.05 2duw s ARG 124 Ca 0.54 0.31 0.01 0.00 -1.72 0.00 0.00 55.73 54.88 2duw s ARG 124 Cb -0.28 0.11 0.02 0.00 -0.45 0.00 0.00 34.95 34.35 2duw s ARG 124 CO 0.67 -0.04 -0.08 0.00 -0.68 0.00 0.00 175.30 175.17 2duw h PRO 126 N 7.16 0.00 -0.88 0.00 0.13 -1.96 -1.43 132.00 135.01 2duw h PRO 126 Ca -0.34 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.79 2duw h PRO 126 Cb 1.17 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.25 2duw h PRO 126 CO 0.46 0.09 0.55 0.00 -0.23 0.00 0.00 178.00 178.87 2duw h ALA 127 N 1.91 1.12 0.00 -0.56 0.00 -1.99 -1.37 119.26 118.38 2duw h ALA 127 Ca -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2duw h ALA 127 Cb 0.56 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2duw h ALA 127 CO 0.01 0.57 -1.73 -0.89 0.00 0.00 0.00 179.25 177.20 2duw n ILE 128 N -4.43 0.07 0.12 0.00 5.41 -1.16 -4.24 119.36 115.14 2duw n ILE 128 Ca 0.09 -0.43 -0.03 0.00 1.00 0.00 0.00 62.75 63.39 2duw n ILE 128 Cb 0.04 0.09 0.13 0.00 -0.71 0.00 0.00 39.64 39.20 2duw n ILE 128 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 176.55 176.47 2duw h GLU 129 N 0.00 0.05 0.48 0.38 4.81 -1.07 -2.39 114.58 116.84 2duw h GLU 129 Ca 0.00 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.17 2duw h GLU 129 Cb 0.93 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.32 2duw h GLU 129 CO 0.00 0.69 -0.23 1.25 -0.73 0.00 0.00 179.01 179.99 2duw h LEU 130 N 0.03 -0.55 0.00 1.64 5.85 -1.43 -3.09 115.31 117.77 2duw h LEU 130 Ca -0.01 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.64 2duw h LEU 130 Cb 1.17 0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.34 2duw h LEU 130 CO 0.09 -0.16 0.00 -0.81 -0.34 0.00 0.00 178.44 177.22 2duw n PRO 131 N -5.24 0.14 -0.13 5.25 -0.04 -1.24 -3.28 135.00 130.47 2duw n PRO 131 Ca -0.10 0.18 0.26 0.00 -0.04 0.00 0.00 63.50 63.80 2duw n PRO 131 Cb 0.30 -1.50 0.72 0.00 -0.04 0.00 0.00 33.50 32.98 2duw n PRO 131 CO 0.00 0.00 0.00 0.07 -0.04 0.00 0.00 175.50 175.53 2duw h ARG 132 N 0.00 0.00 0.00 0.54 0.11 -1.34 -1.92 114.38 111.77 2duw h ARG 132 Ca 0.00 0.00 -0.26 0.00 0.10 0.00 0.00 59.98 59.82 2duw h ARG 132 Cb 0.17 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 31.20 2duw h ARG 132 CO 0.00 0.00 -1.97 1.28 0.10 0.00 0.00 179.97 179.38 2duw n LEU 133 N -4.26 0.21 0.00 0.08 4.77 -1.20 -5.02 117.00 111.57 2duw n LEU 133 Ca 0.16 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 2duw n LEU 133 Cb 0.87 0.28 0.00 0.00 -2.33 0.00 0.00 43.42 42.24 2duw n LEU 133 CO 0.38 0.38 0.00 0.61 -1.33 0.00 0.00 177.39 177.43 2duw n GLY 134 N 2.17 1.68 0.11 -0.72 0.00 -0.72 -5.01 105.19 102.69 2duw n GLY 134 Ca -0.23 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.78 2duw n GLY 134 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2duw h LEU 135 N 0.00 0.00 -9.32 0.99 4.07 -1.83 -3.46 115.31 105.76 2duw h LEU 135 Ca 0.00 0.00 -0.65 0.00 0.08 0.00 0.00 57.88 57.31 2duw h LEU 135 Cb 0.00 0.00 0.04 0.00 1.08 0.00 0.00 40.66 41.78 2duw h LEU 135 CO 0.00 0.64 0.77 0.00 -1.08 0.00 0.00 178.44 178.77 2duw n ALA 136 N -2.29 0.25 0.00 1.53 0.00 -1.26 -5.04 120.51 113.71 2duw n ALA 136 Ca -0.01 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.86 2duw n ALA 136 Cb 0.81 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.98 2duw n ALA 136 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13