#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 2.60 -0.66 0.03 2.47 -1.26 -5.02 119.74 117.90 2duw s LYS 2 Ca 0.00 -1.17 0.06 0.00 -1.56 0.00 0.00 55.97 53.30 2duw s LYS 2 Cb 0.00 -3.30 0.23 0.00 -1.46 0.00 0.00 37.83 33.31 2duw s LYS 2 CO 0.00 -0.60 0.69 -0.85 0.16 0.00 0.00 175.35 174.74 2duw n GLU 3 N 4.73 2.36 -3.72 4.03 0.28 -1.26 -5.05 120.64 122.02 2duw n GLU 3 Ca -0.13 -4.63 -0.12 0.00 -0.16 0.00 0.00 57.16 52.12 2duw n GLU 3 Cb 0.45 -2.26 -0.01 0.00 1.43 0.00 0.00 31.44 31.04 2duw n GLU 3 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2duw n ASN 4 N 1.11 -1.51 0.00 -1.84 3.02 -1.26 -5.11 115.26 109.67 2duw n ASN 4 Ca 0.28 -2.66 0.00 0.00 -0.03 0.00 0.00 54.58 52.16 2duw n ASN 4 Cb 0.40 2.69 0.00 0.00 -0.61 0.00 0.00 39.78 42.26 2duw n ASN 4 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2duw n ASP 5 N -1.61 0.00 -0.02 6.41 -0.08 -1.26 -4.66 116.55 115.33 2duw n ASP 5 Ca -0.02 0.00 0.24 0.00 -1.51 0.00 0.00 54.79 53.50 2duw n ASP 5 Cb 0.54 -0.12 0.72 0.00 2.34 0.00 0.00 41.12 44.61 2duw n ASP 5 CO 0.00 0.00 0.00 0.16 0.12 0.00 0.00 177.20 177.48 2duw h ILE 6 N 0.00 0.44 -0.85 5.18 3.07 -1.99 0.81 117.51 124.17 2duw h ILE 6 Ca 0.00 0.00 0.14 0.00 1.55 0.00 0.00 64.86 66.55 2duw h ILE 6 Cb 0.00 0.58 -0.06 0.00 -0.27 0.00 0.00 36.82 37.07 2duw h ILE 6 CO 0.00 0.00 0.55 0.00 -1.05 0.00 0.00 178.15 177.65 2duw h ALA 7 N 1.48 1.87 0.01 0.16 0.00 -1.99 0.24 119.26 121.04 2duw h ALA 7 Ca 0.29 0.01 -0.20 0.00 0.00 0.00 0.00 54.91 55.01 2duw h ALA 7 Cb 1.40 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 2duw h ALA 7 CO -0.00 -0.09 -0.92 0.78 0.00 0.00 0.00 179.25 179.02 2duw h GLY 8 N 0.65 0.16 1.48 0.00 0.00 -1.10 -1.47 103.07 102.78 2duw h GLY 8 Ca 0.42 -0.30 -0.24 0.00 0.00 0.00 0.00 47.33 47.21 2duw h GLY 8 CO -0.18 0.27 -0.97 -2.22 0.00 0.00 0.00 176.54 173.44 2duw h ILE 9 N 0.07 1.38 0.03 2.60 5.03 -1.18 -1.06 117.51 124.38 2duw h ILE 9 Ca -0.04 -2.42 -0.22 0.00 -0.12 0.00 0.00 64.86 62.06 2duw h ILE 9 Cb 1.57 2.43 -0.02 0.00 -3.03 0.00 0.00 36.82 37.77 2duw h ILE 9 CO 0.13 0.73 -1.01 0.17 -0.68 0.00 0.00 178.15 177.49 2duw h LEU 10 N 0.26 0.14 0.00 1.44 8.10 -0.65 -2.36 115.31 122.24 2duw h LEU 10 Ca -0.09 -0.14 -0.13 0.00 0.11 0.00 0.00 57.88 57.63 2duw h LEU 10 Cb 1.61 -0.05 -0.02 0.00 -0.44 0.00 0.00 40.66 41.77 2duw h LEU 10 CO 0.17 1.06 -0.68 0.00 -4.11 0.00 0.00 178.44 174.88 2duw h THR 11 N 0.04 0.95 0.00 0.15 1.03 -1.31 -3.39 112.91 110.38 2duw h THR 11 Ca -0.04 -2.38 0.00 0.00 -0.01 0.00 0.00 66.41 63.98 2duw h THR 11 Cb 1.73 2.45 0.00 0.00 -1.07 0.00 0.00 68.15 71.25 2duw h THR 11 CO 0.14 0.54 -0.04 -1.28 -0.01 0.00 0.00 175.52 174.87 2duw h SER 12 N 0.00 0.00 -3.76 0.00 0.87 -1.22 -3.48 113.55 105.96 2duw h SER 12 Ca -0.02 0.00 -0.51 0.00 -1.23 0.00 0.00 61.79 60.02 2duw h SER 12 Cb 1.47 0.00 -0.32 0.00 -0.44 0.00 0.00 62.40 63.11 2duw h SER 12 CO 0.07 0.26 -0.82 -0.89 -0.53 0.00 0.00 176.83 174.93 2duw s THR 13 N -1.32 1.17 -0.42 2.23 2.01 -0.89 -5.09 115.64 113.34 2duw s THR 13 Ca -0.01 -0.56 -0.07 0.00 0.31 0.00 0.00 61.69 61.36 2duw s THR 13 Cb 0.00 -1.03 0.09 0.00 0.01 0.00 0.00 72.50 71.57 2duw s THR 13 CO 0.02 0.35 0.24 -0.13 -0.69 0.00 0.00 174.62 174.41 2duw s ARG 14 N 0.23 2.43 0.00 4.92 0.52 -1.26 -4.26 118.95 121.53 2duw s ARG 14 Ca -0.06 -1.58 0.00 0.00 -0.52 0.00 0.00 55.73 53.57 2duw s ARG 14 Cb -0.12 -3.71 -0.00 0.00 0.52 0.00 0.00 34.95 31.64 2duw s ARG 14 CO 0.02 -0.99 -0.01 0.99 0.02 0.00 0.00 175.30 175.33 2duw s THR 15 N 1.34 0.05 -0.03 0.02 2.01 -1.26 -4.64 115.64 113.12 2duw s THR 15 Ca 0.04 -0.20 0.04 0.00 0.31 0.00 0.00 61.69 61.88 2duw s THR 15 Cb -0.23 -0.08 -0.00 0.00 0.01 0.00 0.00 72.50 72.19 2duw s THR 15 CO -0.00 -0.10 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.06 2duw s ILE 16 N -0.31 1.22 0.02 1.82 1.09 0.16 -2.29 121.20 122.91 2duw s ILE 16 Ca -0.03 -0.61 0.06 0.00 -1.10 0.00 0.00 60.65 58.97 2duw s ILE 16 Cb -0.02 -1.05 -0.02 0.00 -1.06 0.00 0.00 42.46 40.31 2duw s ILE 16 CO -0.00 0.36 -0.18 0.00 -0.10 0.00 0.00 174.94 175.01 2duw s ALA 17 N 0.03 1.55 -0.08 9.38 0.00 -0.52 -0.43 121.76 131.69 2duw s ALA 17 Ca -0.02 -0.91 0.03 0.00 0.00 0.00 0.00 51.96 51.06 2duw s ALA 17 Cb -0.10 -0.32 -0.02 0.00 0.00 0.00 0.00 23.12 22.68 2duw s ALA 17 CO 0.01 0.35 -0.17 -1.17 0.00 0.00 0.00 175.76 174.78 2duw s LEU 18 N -0.90 2.55 -0.25 0.00 0.20 -0.84 -0.78 118.68 118.65 2duw s LEU 18 Ca 0.06 -0.33 -0.07 0.00 0.69 0.00 0.00 54.13 54.48 2duw s LEU 18 Cb -0.08 -1.52 -0.03 0.00 -0.43 0.00 0.00 46.19 44.13 2duw s LEU 18 CO 0.01 0.26 0.07 -0.69 -0.29 0.00 0.00 176.35 175.70 2duw s VAL 19 N -0.22 4.26 0.00 1.68 1.01 -1.23 -0.07 120.40 125.83 2duw s VAL 19 Ca -0.00 -0.20 0.00 0.00 0.00 0.00 0.00 61.98 61.77 2duw s VAL 19 Cb -0.13 -3.00 0.00 0.00 0.00 0.00 0.00 36.38 33.25 2duw s VAL 19 CO 0.03 0.33 0.00 0.61 0.00 0.00 0.00 175.10 176.07 2duw n GLY 20 N 4.92 0.80 3.57 4.51 0.00 0.60 -4.50 105.19 115.09 2duw n GLY 20 Ca -0.16 -0.51 -0.41 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 -2.56 3.49 0.25 4.61 0.00 -1.23 -4.97 121.76 121.35 2duw s ALA 21 Ca 0.00 -0.86 0.03 0.00 0.00 0.00 0.00 51.96 51.12 2duw s ALA 21 Cb 0.00 -3.07 -0.01 0.00 0.00 0.00 0.00 23.12 20.04 2duw s ALA 21 CO 0.00 -1.18 0.10 -1.13 0.00 0.00 0.00 175.76 173.54 2duw n SER 22 N 5.84 1.02 -2.24 0.00 3.41 -1.26 -4.48 113.62 115.91 2duw n SER 22 Ca -0.03 -2.37 -0.26 0.00 -0.26 0.00 0.00 58.87 55.95 2duw n SER 22 Cb 0.49 0.68 0.03 0.00 -0.26 0.00 0.00 64.21 65.14 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 -1.75 6.88 -4.13 4.04 8.00 -1.26 -4.78 116.55 123.55 2duw n ASP 23 Ca -0.03 -3.35 -0.37 0.00 0.71 0.00 0.00 54.79 51.74 2duw n ASP 23 Cb 0.39 -1.08 -0.07 0.00 -0.02 0.00 0.00 41.12 40.34 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 -2.51 3.16 0.00 -1.24 -0.14 -1.26 -4.88 119.74 112.87 2duw s LYS 24 Ca 0.48 -3.03 0.15 0.00 -1.36 0.00 0.00 55.97 52.21 2duw s LYS 24 Cb 0.36 -3.96 0.73 0.00 -1.68 0.00 0.00 37.83 33.28 2duw s LYS 24 CO -0.10 -1.24 1.41 -0.35 -0.76 0.00 0.00 175.35 174.31 2duw n PRO 25 N 2.76 0.18 -0.89 -1.68 -0.04 -1.26 -2.52 135.00 131.56 2duw n PRO 25 Ca 0.17 0.16 -0.06 0.00 -0.04 0.00 0.00 63.50 63.74 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 -0.25 -0.04 0.00 0.00 175.50 175.21 2duw n ASP 26 N -1.31 4.41 -4.28 3.54 8.00 -1.26 -4.70 116.55 120.95 2duw n ASP 26 Ca 0.06 -3.05 -0.15 0.00 0.71 0.00 0.00 54.79 52.37 2duw n ASP 26 Cb 0.12 -0.72 -0.10 0.00 -0.02 0.00 0.00 41.12 40.41 2duw n ASP 26 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2duw s ARG 27 N -2.63 1.13 0.55 -1.24 0.52 -1.05 -5.04 118.95 111.20 2duw s ARG 27 Ca 0.47 -1.49 0.33 0.00 -0.52 0.00 0.00 55.73 54.52 2duw s ARG 27 Cb 0.38 -0.76 1.38 0.00 0.52 0.00 0.00 34.95 36.47 2duw s ARG 27 CO 0.12 0.10 1.99 -1.00 0.02 0.00 0.00 175.30 176.53 2duw h PRO 28 N 2.72 0.00 0.00 3.54 0.13 -1.88 -2.66 132.00 133.85 2duw h PRO 28 Ca -0.37 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.69 2duw h PRO 28 Cb 1.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 2duw h PRO 28 CO 0.63 0.02 -0.33 1.03 -0.23 0.00 0.00 178.00 179.12 2duw h SER 29 N 0.00 0.00 0.02 1.44 0.87 -1.90 -2.81 113.55 111.17 2duw h SER 29 Ca -0.00 0.00 -0.21 0.00 -1.23 0.00 0.00 61.79 60.35 2duw h SER 29 Cb 0.50 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.44 2duw h SER 29 CO 0.00 0.33 -1.13 0.22 -0.53 0.00 0.00 176.83 175.72 2duw h TYR 30 N 0.00 0.06 -0.77 2.24 5.03 -1.68 -3.13 116.97 118.72 2duw h TYR 30 Ca -0.00 -0.05 0.13 0.00 2.58 0.00 0.00 58.73 61.39 2duw h TYR 30 Cb 0.94 -0.00 -0.05 0.00 1.55 0.00 0.00 36.73 39.16 2duw h TYR 30 CO 0.00 1.44 0.51 0.07 -1.32 0.00 0.00 178.16 178.86 2duw h ARG 31 N -0.88 0.50 0.02 1.82 0.11 -1.58 0.07 114.38 114.44 2duw h ARG 31 Ca -0.30 -0.03 -0.20 0.00 0.10 0.00 0.00 59.98 59.55 2duw h ARG 31 Cb 1.34 -0.11 -0.02 0.00 1.11 0.00 0.00 29.97 32.29 2duw h ARG 31 CO -0.14 0.33 -0.93 -0.24 0.10 0.00 0.00 179.97 179.09 2duw h VAL 32 N 0.51 1.55 0.43 0.08 3.04 -1.65 -2.74 116.25 117.48 2duw h VAL 32 Ca 0.37 -2.84 -0.02 0.00 -1.01 0.00 0.00 66.70 63.20 2duw h VAL 32 Cb 0.73 2.59 0.00 0.00 -2.01 0.00 0.00 31.29 32.61 2duw h VAL 32 CO -0.13 0.82 -0.21 -0.03 -1.01 0.00 0.00 177.57 177.01 2duw h MET 33 N 0.06 -0.56 0.00 4.17 4.05 -0.94 -1.58 114.93 120.14 2duw h MET 33 Ca -0.04 0.04 -0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2duw h MET 33 Cb 1.59 0.13 -0.00 0.00 -0.80 0.00 0.00 31.60 32.52 2duw h MET 33 CO 0.13 -0.37 -0.00 -0.22 0.23 0.00 0.00 176.91 176.68 2duw h LYS 34 N -0.65 0.00 -0.09 0.39 3.64 -1.55 -1.92 116.57 116.39 2duw h LYS 34 Ca -0.06 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.27 2duw h LYS 34 Cb 0.45 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.26 2duw h LYS 34 CO 0.10 0.00 -0.12 -0.92 -2.27 0.00 0.00 179.45 176.24 2duw h TYR 35 N 0.00 0.30 0.00 1.91 3.20 -1.30 -1.44 116.97 119.64 2duw h TYR 35 Ca -0.00 -0.10 -0.10 0.00 3.14 0.00 0.00 58.73 61.67 2duw h TYR 35 Cb 0.03 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.23 2duw h TYR 35 CO 0.00 0.70 -0.47 -0.07 -1.64 0.00 0.00 178.16 176.68 2duw h LEU 36 N -0.19 0.00 -0.08 2.82 3.38 -0.67 -2.04 115.31 118.53 2duw h LEU 36 Ca 0.01 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.90 2duw h LEU 36 Cb 0.67 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.42 2duw h LEU 36 CO 0.03 0.47 -0.25 -0.07 0.09 0.00 0.00 178.44 178.71 2duw h LEU 37 N 0.00 0.37 -0.54 1.67 3.38 -1.34 -1.20 115.31 117.65 2duw h LEU 37 Ca -0.00 -0.60 -0.09 0.00 0.09 0.00 0.00 57.88 57.27 2duw h LEU 37 Cb 0.94 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.56 2duw h LEU 37 CO 0.06 0.91 -0.03 -0.78 0.09 0.00 0.00 178.44 178.69 2duw h ASP 38 N -0.15 0.95 -0.15 -0.43 1.82 -1.24 -2.58 116.42 114.64 2duw h ASP 38 Ca -0.01 -0.32 0.04 0.00 -0.39 0.00 0.00 57.03 56.36 2duw h ASP 38 Cb 0.87 -0.26 -0.01 0.00 0.68 0.00 0.00 39.33 40.62 2duw h ASP 38 CO 0.05 1.04 0.18 1.56 -1.61 0.00 0.00 179.24 180.46 2duw h GLN 39 N 0.84 0.00 0.00 0.28 1.08 -1.42 -3.45 115.11 112.44 2duw h GLN 39 Ca 0.15 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.35 2duw h GLN 39 Cb 0.57 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.00 2duw h GLN 39 CO 0.03 0.00 0.00 0.41 -0.95 0.00 0.00 178.83 178.32 2duw n GLY 40 N -1.38 0.89 3.45 3.46 0.00 -0.97 -5.08 105.19 105.56 2duw n GLY 40 Ca 0.01 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.74 2.28 -0.35 1.61 2.02 -0.46 -5.05 117.35 115.66 2duw s TYR 41 Ca 0.00 -0.34 -0.29 0.00 -0.37 0.00 0.00 57.07 56.07 2duw s TYR 41 Cb 0.00 -1.04 0.02 0.00 -0.40 0.00 0.00 41.96 40.54 2duw s TYR 41 CO 0.00 0.63 1.13 -1.01 -1.57 0.00 0.00 175.55 174.74 2duw s HIS 42 N -2.21 2.98 -0.12 2.71 3.76 -1.26 -4.47 115.29 116.68 2duw s HIS 42 Ca 0.26 1.02 -0.01 0.00 -0.15 0.00 0.00 55.06 56.18 2duw s HIS 42 Cb -0.06 -3.91 -0.03 0.00 1.11 0.00 0.00 32.58 29.69 2duw s HIS 42 CO 0.13 -1.06 -0.07 0.08 -0.85 0.00 0.00 174.74 172.97 2duw s VAL 43 N 3.99 3.66 -0.57 -0.90 1.01 -1.24 -0.67 120.40 125.68 2duw s VAL 43 Ca 0.48 -0.46 0.05 0.00 0.00 0.00 0.00 61.98 62.05 2duw s VAL 43 Cb -0.12 -2.55 0.19 0.00 0.00 0.00 0.00 36.38 33.90 2duw s VAL 43 CO 0.21 0.54 0.50 -0.38 0.00 0.00 0.00 175.10 175.96 2duw n ILE 44 N 3.05 0.60 -2.24 2.22 5.41 0.43 -4.87 119.36 123.95 2duw n ILE 44 Ca -0.18 -4.38 -0.41 0.00 1.00 0.00 0.00 62.75 58.78 2duw n ILE 44 Cb 0.53 -1.98 -0.03 0.00 -0.71 0.00 0.00 39.64 37.45 2duw n ILE 44 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 2duw s PRO 45 N -1.15 4.44 -0.07 0.38 0.04 -1.26 -1.99 135.00 135.40 2duw s PRO 45 Ca 0.31 2.05 -0.01 0.00 0.04 0.00 0.00 61.00 63.40 2duw s PRO 45 Cb 0.04 -3.14 0.03 0.00 0.04 0.00 0.00 34.50 31.46 2duw s PRO 45 CO -0.14 -0.11 -0.02 0.08 0.04 0.00 0.00 177.00 176.85 2duw s VAL 46 N -0.70 0.52 0.01 -0.36 1.01 0.90 -4.02 120.40 117.76 2duw s VAL 46 Ca 0.50 -0.00 -0.10 0.00 0.00 0.00 0.00 61.98 62.38 2duw s VAL 46 Cb -0.37 -0.62 0.01 0.00 0.00 0.00 0.00 36.38 35.40 2duw s VAL 46 CO 0.45 0.27 0.19 -0.55 0.00 0.00 0.00 175.10 175.46 2duw s SER 47 N 1.67 -0.01 0.00 3.32 0.15 0.11 -0.29 113.70 118.64 2duw s SER 47 Ca 0.01 -0.21 0.14 0.00 0.70 0.00 0.00 55.95 56.59 2duw s SER 47 Cb -0.13 0.26 0.61 0.00 -1.71 0.00 0.00 66.02 65.05 2duw s SER 47 CO -0.04 -0.46 1.45 -0.81 1.20 0.00 0.00 173.24 174.58 2duw n PRO 48 N 1.11 0.01 -0.07 5.44 -0.04 -1.25 -2.19 135.00 138.01 2duw n PRO 48 Ca -0.21 0.25 -0.08 0.00 -0.04 0.00 0.00 63.50 63.42 2duw n PRO 48 Cb 0.57 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.43 2duw n PRO 48 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2duw n LYS 49 N -1.49 1.39 0.00 0.54 5.02 -1.26 -4.41 118.16 117.95 2duw n LYS 49 Ca 0.04 0.02 0.13 0.00 -2.02 0.00 0.00 58.31 56.48 2duw n LYS 49 Cb 0.16 -1.35 0.61 0.00 -0.02 0.00 0.00 35.03 34.43 2duw n LYS 49 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 2duw n VAL 50 N -2.65 0.09 -1.52 -0.18 3.14 -1.13 -4.80 118.33 111.28 2duw n VAL 50 Ca -0.25 0.02 -0.42 0.00 -2.96 0.00 0.00 64.34 60.74 2duw n VAL 50 Cb 0.92 -0.55 -0.06 0.00 -1.06 0.00 0.00 33.84 33.09 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 -1.46 0.94 -0.05 1.55 0.00 -0.93 -0.04 120.51 120.52 2duw n ALA 51 Ca 0.08 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 53.03 2duw n ALA 51 Cb 0.31 -2.84 0.00 0.00 0.00 0.00 0.00 19.45 16.92 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 6.20 0.97 3.44 0.00 0.00 -1.24 -4.84 105.19 109.71 2duw n GLY 52 Ca 0.42 -0.05 -0.23 0.00 0.00 0.00 0.00 46.02 46.15 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 -0.21 1.84 -0.11 1.61 -0.14 0.94 -4.99 119.74 118.68 2duw s LYS 53 Ca 0.00 -2.10 -0.00 0.00 -1.36 0.00 0.00 55.97 52.51 2duw s LYS 53 Cb 0.00 -0.33 0.03 0.00 -1.68 0.00 0.00 37.83 35.84 2duw s LYS 53 CO 0.00 -0.51 -0.07 0.95 -0.76 0.00 0.00 175.35 174.96 2duw s THR 54 N -3.33 0.98 -0.26 2.17 -4.23 -1.26 -0.74 115.64 108.97 2duw s THR 54 Ca 0.29 -0.27 -0.01 0.00 -1.18 0.00 0.00 61.69 60.53 2duw s THR 54 Cb 0.03 -1.01 0.04 0.00 1.34 0.00 0.00 72.50 72.89 2duw s THR 54 CO 0.18 0.35 -0.06 -0.76 -0.54 0.00 0.00 174.62 173.80 2duw s LEU 55 N 1.73 3.36 -1.63 4.79 1.43 -0.34 -4.61 118.68 123.41 2duw s LEU 55 Ca 0.05 -1.02 0.00 0.00 -1.03 0.00 0.00 54.13 52.13 2duw s LEU 55 Cb -0.13 -1.66 0.00 0.00 0.03 0.00 0.00 46.19 44.44 2duw s LEU 55 CO -0.08 -0.16 0.00 0.18 0.23 0.00 0.00 176.35 176.52 2duw n LEU 56 N 4.63 -1.71 0.00 1.79 4.77 -1.26 -1.21 117.00 124.01 2duw n LEU 56 Ca -0.16 0.08 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 2duw n LEU 56 Cb 0.46 -2.60 0.00 0.00 -2.33 0.00 0.00 43.42 38.95 2duw n LEU 56 CO 0.26 -0.36 0.00 0.61 -1.33 0.00 0.00 177.39 176.57 2duw n GLY 57 N -0.96 0.83 3.83 -0.72 0.00 -1.26 -5.04 105.19 101.87 2duw n GLY 57 Ca -0.21 0.00 -0.38 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 -0.35 3.86 0.32 1.61 -1.52 -0.35 -5.07 119.66 118.17 2duw s GLN 58 Ca 0.00 0.25 -0.28 0.00 -1.95 0.00 0.00 55.36 53.38 2duw s GLN 58 Cb 0.00 -3.25 -0.10 0.00 -0.22 0.00 0.00 33.01 29.45 2duw s GLN 58 CO 0.00 0.64 1.16 -1.14 -0.25 0.00 0.00 175.29 175.70 2duw s GLN 59 N -0.82 4.44 0.20 2.91 2.00 -1.26 -1.20 119.66 125.94 2duw s GLN 59 Ca 0.21 1.89 -0.02 0.00 -2.00 0.00 0.00 55.36 55.44 2duw s GLN 59 Cb -0.15 -3.03 -0.05 0.00 0.80 0.00 0.00 33.01 30.58 2duw s GLN 59 CO 0.10 0.00 0.41 0.20 -0.50 0.00 0.00 175.29 175.51 2duw s GLY 60 N -0.87 1.91 -0.09 2.59 0.00 0.08 -4.51 107.32 106.43 2duw s GLY 60 Ca 0.48 -0.72 -0.06 0.00 0.00 0.00 0.00 44.72 44.42 2duw s GLY 60 CO 0.43 -0.66 0.22 -0.19 0.00 0.00 0.00 173.10 172.90 2duw s TYR 61 N -1.85 -0.27 0.36 1.90 2.02 -1.26 -3.71 117.35 114.55 2duw s TYR 61 Ca 0.40 0.65 0.25 0.00 -0.37 0.00 0.00 57.07 57.99 2duw s TYR 61 Cb -0.11 0.06 1.27 0.00 -0.40 0.00 0.00 41.96 42.78 2duw s TYR 61 CO 0.28 -0.16 2.00 0.00 -1.57 0.00 0.00 175.55 176.10 2duw h ALA 62 N 6.36 1.26 -1.96 3.71 0.00 -1.88 0.30 119.26 127.06 2duw h ALA 62 Ca -0.32 -0.15 0.10 0.00 0.00 0.00 0.00 54.91 54.54 2duw h ALA 62 Cb 1.18 -0.03 -0.18 0.00 0.00 0.00 0.00 17.79 18.76 2duw h ALA 62 CO 0.38 0.21 0.52 -0.08 0.00 0.00 0.00 179.25 180.28 2duw s THR 63 N -4.12 0.00 0.58 0.00 -1.32 -1.26 -3.87 115.64 105.65 2duw s THR 63 Ca -0.02 0.00 0.28 0.00 -1.21 0.00 0.00 61.69 60.74 2duw s THR 63 Cb 0.13 -1.00 0.35 0.00 -1.51 0.00 0.00 72.50 70.47 2duw s THR 63 CO 0.61 0.00 2.20 -0.07 -2.21 0.00 0.00 174.62 175.15 2duw h LEU 64 N 2.23 0.00 -0.17 9.08 3.38 -1.93 0.25 115.31 128.15 2duw h LEU 64 Ca -0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.77 2duw h LEU 64 Cb 1.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.95 2duw h LEU 64 CO 0.31 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.84 2duw n ALA 65 N -2.35 2.66 0.03 1.53 0.00 -1.26 -3.13 120.51 117.99 2duw n ALA 65 Ca -0.02 -0.24 0.11 0.00 0.00 0.00 0.00 53.44 53.30 2duw n ALA 65 Cb 0.16 -1.43 -0.11 0.00 0.00 0.00 0.00 19.45 18.06 2duw n ALA 65 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2duw n ASP 66 N -0.77 0.28 -4.71 0.00 -0.08 0.87 -4.90 116.55 107.25 2duw n ASP 66 Ca 0.22 0.11 -0.35 0.00 -1.51 0.00 0.00 54.79 53.26 2duw n ASP 66 Cb 0.15 1.48 -0.09 0.00 2.34 0.00 0.00 41.12 45.00 2duw n ASP 66 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2duw s VAL 67 N -3.46 5.01 0.11 5.18 0.11 -1.19 -5.01 120.40 121.14 2duw s VAL 67 Ca -0.06 0.04 -0.14 0.00 -2.93 0.00 0.00 61.98 58.89 2duw s VAL 67 Cb 0.12 -3.23 -0.08 0.00 -1.53 0.00 0.00 36.38 31.67 2duw s VAL 67 CO 0.87 0.50 1.43 1.55 -3.33 0.00 0.00 175.10 176.12 2duw h PRO 68 N 6.18 0.73 -6.62 1.54 0.13 -1.90 -3.45 132.00 128.61 2duw h PRO 68 Ca -0.43 -0.39 -0.58 0.00 -0.87 0.00 0.00 66.00 63.73 2duw h PRO 68 Cb 1.18 0.01 0.11 0.00 0.13 0.00 0.00 31.00 32.43 2duw h PRO 68 CO 0.68 1.01 0.35 -1.91 -0.23 0.00 0.00 178.00 177.89 2duw n GLU 69 N -4.24 1.79 -3.65 0.86 4.07 -1.26 -4.96 120.64 113.25 2duw n GLU 69 Ca -0.04 0.63 -0.38 0.00 -0.06 0.00 0.00 57.16 57.31 2duw n GLU 69 Cb 0.48 -2.12 -0.12 0.00 -0.06 0.00 0.00 31.44 29.62 2duw n GLU 69 CO 0.00 0.00 0.00 0.15 -0.06 0.00 0.00 177.13 177.22 2duw s LYS 70 N -1.68 3.70 0.34 5.31 -0.14 -1.26 -5.08 119.74 120.93 2duw s LYS 70 Ca 0.57 -0.47 -0.27 0.00 -1.36 0.00 0.00 55.97 54.44 2duw s LYS 70 Cb -0.63 -3.54 -0.09 0.00 -1.68 0.00 0.00 37.83 31.89 2duw s LYS 70 CO 0.61 -0.25 1.09 0.54 -0.76 0.00 0.00 175.35 176.58 2duw s VAL 71 N 1.68 3.52 -0.13 3.17 0.11 -1.26 -4.96 120.40 122.53 2duw s VAL 71 Ca 0.06 1.36 0.19 0.00 -2.93 0.00 0.00 61.98 60.66 2duw s VAL 71 Cb -0.16 -3.80 -0.17 0.00 -1.53 0.00 0.00 36.38 30.72 2duw s VAL 71 CO 0.08 0.20 0.67 -0.67 -3.33 0.00 0.00 175.10 172.04 2duw n ASP 72 N 0.58 0.54 -3.59 3.54 2.03 -1.26 -3.94 116.55 114.45 2duw n ASP 72 Ca 0.02 0.23 -0.20 0.00 0.52 0.00 0.00 54.79 55.36 2duw n ASP 72 Cb 0.47 0.73 -0.15 0.00 -0.72 0.00 0.00 41.12 41.45 2duw n ASP 72 CO 0.00 0.00 0.00 -0.32 -1.92 0.00 0.00 177.20 174.96 2duw s MET 73 N -3.06 0.08 -0.41 -0.67 1.75 -0.97 -2.59 119.30 113.43 2duw s MET 73 Ca -0.05 0.25 -0.18 0.00 -1.25 0.00 0.00 55.69 54.47 2duw s MET 73 Cb 0.10 -1.04 0.02 0.00 2.84 0.00 0.00 34.83 36.74 2duw s MET 73 CO 0.83 -0.53 0.46 0.08 -0.65 0.00 0.00 175.02 175.22 2duw s VAL 74 N 2.25 5.06 -0.16 10.11 1.01 -0.18 -1.44 120.40 137.06 2duw s VAL 74 Ca 0.04 -0.18 -0.11 0.00 0.00 0.00 0.00 61.98 61.73 2duw s VAL 74 Cb -0.14 -4.03 -0.05 0.00 0.00 0.00 0.00 36.38 32.16 2duw s VAL 74 CO -0.09 -0.39 0.22 -1.81 0.00 0.00 0.00 175.10 173.03 2duw s ASP 75 N 1.82 6.37 -0.14 3.32 1.11 0.04 -0.13 116.67 129.06 2duw s ASP 75 Ca 0.14 0.44 0.02 0.00 0.18 0.00 0.00 52.55 53.32 2duw s ASP 75 Cb -0.16 -2.13 0.00 0.00 1.07 0.00 0.00 42.92 41.70 2duw s ASP 75 CO 0.14 0.20 -0.20 -0.69 1.18 0.00 0.00 175.17 175.80 2duw s VAL 76 N 0.05 2.30 0.00 -1.27 1.01 0.73 -3.57 120.40 119.65 2duw s VAL 76 Ca 0.14 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 61.22 2duw s VAL 76 Cb -0.12 -1.94 0.00 0.00 0.00 0.00 0.00 36.38 34.32 2duw s VAL 76 CO 0.02 0.54 0.67 0.49 0.00 0.00 0.00 175.10 176.83 2duw n PHE 77 N 4.02 0.00 0.00 5.22 3.72 -1.26 -3.52 117.46 125.63 2duw n PHE 77 Ca -0.20 -0.20 0.00 0.00 -0.05 0.00 0.00 57.45 57.00 2duw n PHE 77 Cb 0.52 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 39.04 2duw n PHE 77 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2duw n ARG 78 N -0.20 0.00 -3.82 -1.08 1.74 -1.26 -4.17 116.66 107.86 2duw n ARG 78 Ca 0.00 0.30 -0.07 0.00 -0.77 0.00 0.00 57.85 57.31 2duw n ARG 78 Cb 0.36 -1.19 0.02 0.00 -1.02 0.00 0.00 32.46 30.64 2duw n ARG 78 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 2duw s ASN 79 N -2.05 0.01 -0.05 0.55 -0.87 -1.26 -4.96 114.94 106.31 2duw s ASN 79 Ca 0.00 -1.06 -0.10 0.00 -1.57 0.00 0.00 52.86 50.13 2duw s ASN 79 Cb 0.00 0.77 -0.06 0.00 -0.02 0.00 0.00 41.25 41.95 2duw s ASN 79 CO 0.00 -1.54 0.44 0.28 -2.57 0.00 0.00 177.10 173.71 2duw h SER 80 N 2.00 -0.32 -0.19 -1.22 0.02 -1.99 -2.85 113.55 109.00 2duw h SER 80 Ca -0.32 0.01 0.05 0.00 -0.84 0.00 0.00 61.79 60.70 2duw h SER 80 Cb 1.24 0.08 -0.01 0.00 0.14 0.00 0.00 62.40 63.86 2duw h SER 80 CO 0.40 0.12 0.21 -0.33 -1.14 0.00 0.00 176.83 176.09 2duw h GLU 81 N -1.07 0.00 0.00 3.45 4.39 -2.00 0.23 114.58 119.57 2duw h GLU 81 Ca -0.04 0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.60 2duw h GLU 81 Cb 0.29 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.93 2duw h GLU 81 CO 0.06 0.00 -0.30 0.00 -1.16 0.00 0.00 179.01 177.61 2duw h ALA 82 N 1.76 0.86 -0.98 3.43 0.00 -1.96 -3.25 119.26 119.11 2duw h ALA 82 Ca 0.09 -0.28 0.19 0.00 0.00 0.00 0.00 54.91 54.92 2duw h ALA 82 Cb 0.51 -0.05 -0.10 0.00 0.00 0.00 0.00 17.79 18.15 2duw h ALA 82 CO -0.00 0.38 0.61 0.00 0.00 0.00 0.00 179.25 180.24 2duw h ALA 83 N 1.70 1.83 0.27 0.00 0.00 -0.29 0.09 119.26 122.85 2duw h ALA 83 Ca -0.00 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2duw h ALA 83 Cb 1.08 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.80 2duw h ALA 83 CO 0.04 -0.17 -0.13 2.35 0.00 0.00 0.00 179.25 181.33 2duw h TRP 84 N 0.67 -0.34 -0.96 0.00 2.91 -1.69 -0.03 115.95 116.51 2duw h TRP 84 Ca 0.55 -0.01 0.12 0.00 1.13 0.00 0.00 58.89 60.68 2duw h TRP 84 Cb 0.98 0.11 -0.08 0.00 -0.51 0.00 0.00 29.16 29.66 2duw h TRP 84 CO -0.00 0.01 0.61 0.78 -1.03 0.00 0.00 178.44 178.81 2duw h GLY 85 N -0.77 1.49 1.74 2.65 0.00 -1.52 -1.13 103.07 105.53 2duw h GLY 85 Ca -0.04 -0.40 -0.19 0.00 0.00 0.00 0.00 47.33 46.71 2duw h GLY 85 CO 0.06 0.17 -0.81 -2.08 0.00 0.00 0.00 176.54 173.88 2duw h VAL 86 N 0.93 1.46 0.68 4.60 2.07 -1.00 -3.19 116.25 121.79 2duw h VAL 86 Ca 0.47 -2.44 -0.03 0.00 0.82 0.00 0.00 66.70 65.52 2duw h VAL 86 Cb 0.49 2.34 -0.00 0.00 -1.52 0.00 0.00 31.29 32.60 2duw h VAL 86 CO -0.23 0.71 -0.40 0.00 0.02 0.00 0.00 177.57 177.67 2duw h ALA 87 N 1.00 -1.04 -0.85 1.67 0.00 0.26 -1.10 119.26 119.20 2duw h ALA 87 Ca -0.04 -0.21 0.16 0.00 0.00 0.00 0.00 54.91 54.82 2duw h ALA 87 Cb 1.41 0.49 -0.10 0.00 0.00 0.00 0.00 17.79 19.59 2duw h ALA 87 CO 0.13 -1.10 0.43 -0.56 0.00 0.00 0.00 179.25 178.15 2duw h GLN 88 N -1.02 0.58 -0.80 0.00 3.07 -1.53 0.22 115.11 115.63 2duw h GLN 88 Ca -0.09 -0.03 -0.02 0.00 0.09 0.00 0.00 58.65 58.60 2duw h GLN 88 Cb 0.81 -0.13 -0.04 0.00 0.08 0.00 0.00 27.48 28.21 2duw h GLN 88 CO 0.10 0.38 0.41 0.93 0.09 0.00 0.00 178.83 180.74 2duw h GLU 89 N 0.59 1.12 -0.08 0.06 5.08 -1.48 0.10 114.58 119.98 2duw h GLU 89 Ca 0.47 -0.14 -0.18 0.00 -1.00 0.00 0.00 59.36 58.51 2duw h GLU 89 Cb 0.70 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.73 2duw h GLU 89 CO -0.38 0.84 -0.73 0.00 -1.00 0.00 0.00 179.01 177.74 2duw h ALA 90 N 1.33 0.60 0.00 3.43 0.00 0.40 -2.27 119.26 122.75 2duw h ALA 90 Ca 0.28 -0.61 -0.14 0.00 0.00 0.00 0.00 54.91 54.44 2duw h ALA 90 Cb 0.06 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2duw h ALA 90 CO -0.04 0.76 -0.69 0.82 0.00 0.00 0.00 179.25 180.10 2duw h ILE 91 N 0.28 1.49 -0.01 0.00 2.04 -0.25 0.27 117.51 121.33 2duw h ILE 91 Ca -0.03 -2.36 -0.23 0.00 1.00 0.00 0.00 64.86 63.23 2duw h ILE 91 Cb 1.30 2.28 0.02 0.00 -0.74 0.00 0.00 36.82 39.68 2duw h ILE 91 CO 0.12 0.67 -0.90 0.00 0.00 0.00 0.00 178.15 178.05 2duw h ALA 92 N 1.31 0.12 0.00 1.87 0.00 -0.76 -3.21 119.26 118.58 2duw h ALA 92 Ca -0.01 -0.66 -0.05 0.00 0.00 0.00 0.00 54.91 54.20 2duw h ALA 92 Cb 1.22 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 2duw h ALA 92 CO 0.09 0.58 -0.25 -0.84 0.00 0.00 0.00 179.25 178.84 2duw h ILE 93 N 0.25 0.64 0.00 0.00 3.07 -1.42 -3.47 117.51 116.58 2duw h ILE 93 Ca -0.11 -1.13 0.00 0.00 1.55 0.00 0.00 64.86 65.17 2duw h ILE 93 Cb 1.57 1.74 0.00 0.00 -0.27 0.00 0.00 36.82 39.86 2duw h ILE 93 CO 0.18 0.24 0.00 0.61 -1.05 0.00 0.00 178.15 178.13 2duw n GLY 94 N 0.04 0.55 2.38 0.16 0.00 -0.92 -5.07 105.19 102.33 2duw n GLY 94 Ca -0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.35 0.00 4.61 0.00 0.89 -4.87 120.51 118.78 2duw n ALA 95 Ca 0.00 -1.11 0.00 0.00 0.00 0.00 0.00 53.44 52.33 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 -3.79 0.50 -4.12 0.00 4.76 -1.25 -4.98 118.16 109.28 2duw n LYS 96 Ca 0.10 0.00 -0.09 0.00 -2.87 0.00 0.00 58.31 55.45 2duw n LYS 96 Cb 0.40 -0.80 -0.10 0.00 -1.84 0.00 0.00 35.03 32.69 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 -1.61 0.47 -0.25 -0.18 2.01 -1.07 -2.95 115.64 112.07 2duw s THR 97 Ca 0.00 -1.75 -0.04 0.00 0.31 0.00 0.00 61.69 60.21 2duw s THR 97 Cb 0.00 -1.44 0.09 0.00 0.01 0.00 0.00 72.50 71.16 2duw s THR 97 CO 0.00 -0.85 0.13 -0.22 -0.69 0.00 0.00 174.62 172.99 2duw s LEU 98 N -2.77 0.41 -0.14 4.42 2.96 -0.23 -1.01 118.68 122.32 2duw s LEU 98 Ca 0.06 -0.99 -0.08 0.00 -0.22 0.00 0.00 54.13 52.90 2duw s LEU 98 Cb 0.04 -0.24 -0.04 0.00 0.50 0.00 0.00 46.19 46.44 2duw s LEU 98 CO -0.06 -0.40 0.14 0.86 -1.32 0.00 0.00 176.35 175.57 2duw s TRP 99 N 2.13 3.54 0.22 5.38 -0.11 0.82 -0.11 118.94 130.82 2duw s TRP 99 Ca 0.07 0.48 0.01 0.00 1.22 0.00 0.00 56.10 57.88 2duw s TRP 99 Cb -0.16 -2.01 0.01 0.00 -1.50 0.00 0.00 33.47 29.82 2duw s TRP 99 CO -0.26 0.60 0.12 1.28 -4.62 0.00 0.00 176.95 174.07 2duw n LEU 100 N 2.44 0.00 -4.86 5.86 4.77 -0.76 -0.20 117.00 124.25 2duw n LEU 100 Ca -0.19 -1.22 -0.31 0.00 -0.03 0.00 0.00 56.01 54.26 2duw n LEU 100 Cb 0.54 0.03 -0.05 0.00 -2.33 0.00 0.00 43.42 41.61 2duw n LEU 100 CO 0.33 -0.33 0.40 -1.10 -1.33 0.00 0.00 177.39 175.36 2duw s GLN 101 N -2.88 3.89 0.44 3.23 -1.52 -1.23 -4.39 119.66 117.21 2duw s GLN 101 Ca 0.09 0.54 -0.25 0.00 -1.95 0.00 0.00 55.36 53.79 2duw s GLN 101 Cb -0.01 -2.44 -0.08 0.00 -0.22 0.00 0.00 33.01 30.26 2duw s GLN 101 CO 0.06 0.10 1.41 -0.51 -0.25 0.00 0.00 175.29 176.10 2duw s LEU 102 N -3.30 4.13 -1.22 2.90 1.43 -1.04 -2.39 118.68 119.18 2duw s LEU 102 Ca 0.52 2.88 0.00 0.00 -1.03 0.00 0.00 54.13 56.50 2duw s LEU 102 Cb -0.10 -3.93 0.00 0.00 0.03 0.00 0.00 46.19 42.19 2duw s LEU 102 CO 0.23 -1.13 0.00 0.61 0.23 0.00 0.00 176.35 176.30 2duw n GLY 103 N 0.59 0.58 2.97 -3.19 0.00 -1.26 -4.90 105.19 99.98 2duw n GLY 103 Ca 0.05 -0.39 -0.31 0.00 0.00 0.00 0.00 46.02 45.37 2duw n GLY 103 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2duw s VAL 104 N -2.56 2.02 -0.42 1.61 1.01 -1.00 -4.99 120.40 116.06 2duw s VAL 104 Ca 0.00 -2.12 -0.16 0.00 0.00 0.00 0.00 61.98 59.70 2duw s VAL 104 Cb 0.00 -2.47 0.03 0.00 0.00 0.00 0.00 36.38 33.94 2duw s VAL 104 CO 0.00 -0.57 0.34 -0.63 0.00 0.00 0.00 175.10 174.24 2duw s ILE 105 N 1.05 5.22 -0.67 2.22 1.01 -1.26 -3.16 121.20 125.60 2duw s ILE 105 Ca 0.09 -0.65 -0.01 0.00 0.00 0.00 0.00 60.65 60.09 2duw s ILE 105 Cb -0.19 -3.98 0.17 0.00 0.01 0.00 0.00 42.46 38.47 2duw s ILE 105 CO -0.11 -0.37 0.49 0.20 0.00 0.00 0.00 174.94 175.15 2duw s ASN 106 N 1.82 5.22 0.40 3.58 -0.87 -1.26 -4.93 114.94 118.90 2duw s ASN 106 Ca 0.06 -3.15 0.15 0.00 -1.57 0.00 0.00 52.86 48.35 2duw s ASN 106 Cb -0.19 -1.82 1.00 0.00 -0.02 0.00 0.00 41.25 40.22 2duw s ASN 106 CO 0.10 -0.29 1.86 -0.08 -2.57 0.00 0.00 177.10 176.13 2duw h GLU 107 N 6.60 0.48 0.12 -0.60 4.57 -1.99 -1.05 114.58 122.70 2duw h GLU 107 Ca 0.03 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.17 2duw h GLU 107 Cb 0.90 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 29.38 2duw h GLU 107 CO 0.74 0.32 -0.06 0.37 -1.18 0.00 0.00 179.01 179.20 2duw h GLN 108 N 0.50 -0.15 -0.29 1.92 5.75 -2.00 -2.82 115.11 118.01 2duw h GLN 108 Ca 0.46 0.01 0.08 0.00 -0.15 0.00 0.00 58.65 59.05 2duw h GLN 108 Cb 1.01 0.03 -0.01 0.00 1.07 0.00 0.00 27.48 29.59 2duw h GLN 108 CO -0.19 0.31 0.31 0.00 -2.65 0.00 0.00 178.83 176.61 2duw h ALA 109 N 0.01 1.96 0.04 3.38 0.00 -1.71 0.98 119.26 123.92 2duw h ALA 109 Ca -0.02 -0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.66 2duw h ALA 109 Cb 0.54 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 2duw h ALA 109 CO 0.03 -0.46 -1.00 0.00 0.00 0.00 0.00 179.25 177.82 2duw h ALA 110 N 1.65 0.34 -0.25 0.00 0.00 -1.15 -3.25 119.26 116.59 2duw h ALA 110 Ca 0.14 -0.77 -0.09 0.00 0.00 0.00 0.00 54.91 54.19 2duw h ALA 110 Cb 0.75 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 2duw h ALA 110 CO -0.00 0.91 -0.19 0.28 0.00 0.00 0.00 179.25 180.25 2duw h VAL 111 N 0.14 1.31 -0.30 0.00 2.07 -0.57 -2.28 116.25 116.62 2duw h VAL 111 Ca -0.08 -1.32 0.07 0.00 0.82 0.00 0.00 66.70 66.19 2duw h VAL 111 Cb 1.66 1.61 -0.07 0.00 -1.52 0.00 0.00 31.29 32.97 2duw h VAL 111 CO 0.16 0.41 -0.20 0.25 0.02 0.00 0.00 177.57 178.22 2duw h LEU 112 N 0.29 -0.65 -1.42 2.57 6.46 -1.49 0.31 115.31 121.38 2duw h LEU 112 Ca 0.05 0.14 -0.06 0.00 -0.12 0.00 0.00 57.88 57.88 2duw h LEU 112 Cb 0.72 0.33 -0.01 0.00 -0.73 0.00 0.00 40.66 40.98 2duw h LEU 112 CO 0.05 -0.23 -0.29 0.00 -0.62 0.00 0.00 178.44 177.34 2duw h ALA 113 N 0.99 1.48 0.00 1.25 0.00 -1.59 -2.25 119.26 119.14 2duw h ALA 113 Ca 0.16 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 2duw h ALA 113 Cb 0.41 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2duw h ALA 113 CO -0.40 0.37 -0.37 -0.09 0.00 0.00 0.00 179.25 178.76 2duw h ARG 114 N 0.00 0.00 -0.08 0.00 1.12 -0.40 0.36 114.38 115.38 2duw h ARG 114 Ca -0.00 0.00 -0.15 0.00 -1.11 0.00 0.00 59.98 58.71 2duw h ARG 114 Cb 0.53 0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 30.48 2duw h ARG 114 CO 0.04 0.37 -0.62 0.93 -3.11 0.00 0.00 179.97 177.58 2duw h GLU 115 N 0.00 0.29 0.00 0.20 4.39 0.14 -3.24 114.58 116.36 2duw h GLU 115 Ca -0.00 -0.20 -0.15 0.00 0.34 0.00 0.00 59.36 59.34 2duw h GLU 115 Cb 1.03 0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.68 2duw h GLU 115 CO 0.05 0.82 -1.97 0.00 -1.16 0.00 0.00 179.01 176.75 2duw n ALA 116 N -2.48 2.20 0.00 3.43 0.00 -1.17 -4.99 120.51 117.50 2duw n ALA 116 Ca -0.03 -0.78 0.00 0.00 0.00 0.00 0.00 53.44 52.63 2duw n ALA 116 Cb 0.63 -0.62 0.00 0.00 0.00 0.00 0.00 19.45 19.46 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 1.44 0.67 3.35 0.00 0.00 0.89 -5.09 105.19 106.45 2duw n GLY 117 Ca -0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.55 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 -1.25 -4.27 0.99 7.94 0.90 -4.90 117.00 116.42 2duw n LEU 118 Ca 0.00 0.14 -0.44 0.00 -1.11 0.00 0.00 56.01 54.60 2duw n LEU 118 Cb 0.00 -1.09 -0.05 0.00 0.53 0.00 0.00 43.42 42.81 2duw n LEU 118 CO 0.00 -3.46 0.18 -0.44 -1.11 0.00 0.00 177.39 172.56 2duw s SER 119 N -1.91 6.16 0.04 1.96 0.01 -1.15 -4.48 113.70 114.32 2duw s SER 119 Ca 0.56 -2.24 -0.16 0.00 1.31 0.00 0.00 55.95 55.42 2duw s SER 119 Cb -0.17 -2.12 -0.06 0.00 0.21 0.00 0.00 66.02 63.88 2duw s SER 119 CO 0.67 -0.67 0.48 0.54 0.41 0.00 0.00 173.24 174.67 2duw s VAL 120 N 0.88 4.90 -0.19 3.43 0.11 -1.26 -1.06 120.40 127.21 2duw s VAL 120 Ca 0.10 0.98 -0.05 0.00 -2.93 0.00 0.00 61.98 60.08 2duw s VAL 120 Cb -0.21 -3.79 0.07 0.00 -1.53 0.00 0.00 36.38 30.92 2duw s VAL 120 CO -0.03 0.54 0.11 -0.69 -3.33 0.00 0.00 175.10 171.71 2duw s VAL 121 N -1.12 -0.12 0.49 2.04 1.01 0.84 -4.93 120.40 118.62 2duw s VAL 121 Ca 0.27 -0.22 0.07 0.00 0.00 0.00 0.00 61.98 62.10 2duw s VAL 121 Cb -0.18 -0.63 0.02 0.00 0.00 0.00 0.00 36.38 35.59 2duw s VAL 121 CO 0.16 -0.32 0.42 0.00 0.00 0.00 0.00 175.10 175.36 2duw s MET 122 N 2.16 2.35 -1.70 2.72 0.23 -1.26 -1.84 119.30 121.96 2duw s MET 122 Ca 0.03 -1.81 -0.01 0.00 -1.03 0.00 0.00 55.69 52.87 2duw s MET 122 Cb -0.16 -2.24 0.00 0.00 -1.53 0.00 0.00 34.83 30.90 2duw s MET 122 CO -0.12 -0.46 0.16 -3.47 -2.03 0.00 0.00 175.02 169.09 2duw n ASP 123 N -1.70 -5.91 -4.10 -1.18 2.03 -1.19 -4.94 116.55 99.55 2duw n ASP 123 Ca 0.02 -0.09 -0.11 0.00 0.52 0.00 0.00 54.79 55.14 2duw n ASP 123 Cb 0.63 -4.87 -0.08 0.00 -0.72 0.00 0.00 41.12 36.07 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 -5.20 1.21 -0.28 -0.67 1.81 -1.26 -4.51 118.95 110.06 2duw s ARG 124 Ca 0.08 -1.43 -0.24 0.00 -1.72 0.00 0.00 55.73 52.42 2duw s ARG 124 Cb -0.03 0.33 0.10 0.00 -0.45 0.00 0.00 34.95 34.90 2duw s ARG 124 CO 0.10 -0.42 0.91 0.00 -0.68 0.00 0.00 175.30 175.20 2duw h PRO 126 N 4.80 0.00 -0.58 0.00 0.13 -1.96 -1.41 132.00 132.98 2duw h PRO 126 Ca -0.29 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.84 2duw h PRO 126 Cb 1.18 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.28 2duw h PRO 126 CO 0.10 0.26 0.33 0.00 -0.23 0.00 0.00 178.00 178.46 2duw h ALA 127 N 1.74 1.50 0.00 -0.56 0.00 -1.98 -0.11 119.26 119.84 2duw h ALA 127 Ca -0.00 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 2duw h ALA 127 Cb 0.69 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2duw h ALA 127 CO 0.03 0.43 -1.91 -0.89 0.00 0.00 0.00 179.25 176.92 2duw n ILE 128 N -4.40 0.25 0.14 0.00 2.08 -1.14 -4.23 119.36 112.05 2duw n ILE 128 Ca 0.05 -0.55 0.01 0.00 0.56 0.00 0.00 62.75 62.82 2duw n ILE 128 Cb 0.09 -0.11 0.12 0.00 -0.75 0.00 0.00 39.64 38.98 2duw n ILE 128 CO 0.00 0.00 0.00 -0.08 0.56 0.00 0.00 176.55 177.03 2duw h GLU 129 N 0.00 0.00 0.49 0.38 4.22 -0.97 -2.84 114.58 115.87 2duw h GLU 129 Ca -0.06 0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.35 2duw h GLU 129 Cb 1.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.40 2duw h GLU 129 CO 0.00 0.60 -0.24 1.25 -2.18 0.00 0.00 179.01 178.44 2duw h LEU 130 N 0.00 -0.56 0.00 1.64 5.85 -1.19 -3.08 115.31 117.97 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 1.27 0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.44 2duw h LEU 130 CO 0.08 -0.18 0.00 -0.81 -0.34 0.00 0.00 178.44 177.19 2duw n PRO 131 N -5.25 0.13 -0.14 5.25 -0.04 -1.25 -3.27 135.00 130.42 2duw n PRO 131 Ca -0.10 0.19 0.26 0.00 -0.04 0.00 0.00 63.50 63.81 2duw n PRO 131 Cb 0.31 -1.50 0.71 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 0.01 0.00 0.54 0.11 -1.40 -2.49 114.38 111.15 2duw h ARG 132 Ca 0.00 -0.00 -0.16 0.00 0.10 0.00 0.00 59.98 59.92 2duw h ARG 132 Cb 0.18 -0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.23 2duw h ARG 132 CO 0.00 0.01 -1.59 1.28 0.10 0.00 0.00 179.97 179.77 2duw n LEU 133 N -4.30 0.14 0.00 0.08 4.77 -1.20 -5.03 117.00 111.45 2duw n LEU 133 Ca 0.17 -0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 2duw n LEU 133 Cb 0.88 0.18 0.00 0.00 -2.33 0.00 0.00 43.42 42.15 2duw n LEU 133 CO 0.38 0.23 0.00 0.61 -1.33 0.00 0.00 177.39 177.29 2duw n GLY 134 N 2.49 1.96 0.11 -0.72 0.00 -0.94 -5.02 105.19 103.07 2duw n GLY 134 Ca -0.14 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.90 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 -9.65 0.99 3.38 -1.85 -3.47 115.31 104.71 2duw h LEU 135 Ca 0.00 0.00 -0.41 0.00 0.09 0.00 0.00 57.88 57.56 2duw h LEU 135 Cb 0.00 0.00 0.22 0.00 0.09 0.00 0.00 40.66 40.97 2duw h LEU 135 CO 0.00 0.49 -0.77 0.00 0.09 0.00 0.00 178.44 178.25 2duw n ALA 136 N -2.31 -3.60 1.80 1.53 0.00 -1.26 -5.06 120.51 111.61 2duw n ALA 136 Ca -0.04 -1.31 0.15 0.00 0.00 0.00 0.00 53.44 52.24 2duw n ALA 136 Cb 0.77 -1.48 0.78 0.00 0.00 0.00 0.00 19.45 19.52 2duw n ALA 136 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86