#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 1.95 -0.52 3.17 1.02 -1.26 -5.08 119.74 119.01 2duw s LYS 2 Ca 0.00 -1.55 0.07 0.00 0.02 0.00 0.00 55.97 54.51 2duw s LYS 2 Cb 0.00 -1.98 0.30 0.00 -0.52 0.00 0.00 37.83 35.63 2duw s LYS 2 CO 0.00 0.36 0.76 -0.85 -0.92 0.00 0.00 175.35 174.71 2duw n GLU 3 N -0.56 2.12 0.36 1.68 0.00 -1.26 -4.82 120.64 118.16 2duw n GLU 3 Ca -0.07 -4.22 -0.17 0.00 0.00 0.00 0.00 57.16 52.70 2duw n GLU 3 Cb 0.59 -1.95 -0.09 0.00 0.00 0.00 0.00 31.44 29.99 2duw n GLU 3 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.13 176.22 2duw h ASN 4 N 3.56 -1.13 -4.59 -1.84 4.21 -1.98 -3.47 115.58 110.34 2duw h ASN 4 Ca 0.14 0.07 -0.49 0.00 1.21 0.00 0.00 56.30 57.22 2duw h ASN 4 Cb 0.71 0.34 -0.11 0.00 -1.12 0.00 0.00 38.32 38.14 2duw h ASN 4 CO 0.70 -0.66 -0.41 -0.90 -1.29 0.00 0.00 177.43 174.87 2duw n ASP 5 N -5.19 1.26 0.02 5.81 5.68 -1.26 -5.01 116.55 117.85 2duw n ASP 5 Ca -0.13 -2.90 0.22 0.00 -0.50 0.00 0.00 54.79 51.48 2duw n ASP 5 Cb 0.44 0.88 0.73 0.00 -1.14 0.00 0.00 41.12 42.04 2duw n ASP 5 CO 0.00 0.00 0.00 0.16 -1.33 0.00 0.00 177.20 176.03 2duw h ILE 6 N 1.58 0.50 -0.85 2.12 3.07 -1.98 0.21 117.51 122.15 2duw h ILE 6 Ca -0.28 0.00 0.12 0.00 1.55 0.00 0.00 64.86 66.25 2duw h ILE 6 Cb 1.06 0.65 -0.06 0.00 -0.27 0.00 0.00 36.82 38.21 2duw h ILE 6 CO 0.45 0.00 0.55 0.00 -1.05 0.00 0.00 178.15 178.10 2duw h ALA 7 N 1.57 1.81 0.02 0.16 0.00 -1.98 0.28 119.26 121.13 2duw h ALA 7 Ca 0.25 0.01 -0.22 0.00 0.00 0.00 0.00 54.91 54.94 2duw h ALA 7 Cb 1.17 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 2duw h ALA 7 CO -0.00 -0.02 -0.97 0.78 0.00 0.00 0.00 179.25 179.04 2duw h GLY 8 N 0.70 0.34 2.00 0.00 0.00 -1.27 -1.22 103.07 103.62 2duw h GLY 8 Ca 0.41 -0.63 -0.16 0.00 0.00 0.00 0.00 47.33 46.95 2duw h GLY 8 CO -0.18 0.56 -0.78 -2.22 0.00 0.00 0.00 176.54 173.92 2duw h ILE 9 N 0.16 1.56 0.00 2.60 5.03 -1.25 -0.57 117.51 125.04 2duw h ILE 9 Ca -0.07 -2.68 -0.18 0.00 -0.12 0.00 0.00 64.86 61.80 2duw h ILE 9 Cb 1.62 2.45 -0.03 0.00 -3.03 0.00 0.00 36.82 37.83 2duw h ILE 9 CO 0.16 0.77 -1.13 0.17 -0.68 0.00 0.00 178.15 177.43 2duw h LEU 10 N 0.00 0.00 0.00 1.44 8.10 -0.52 -2.97 115.31 121.36 2duw h LEU 10 Ca -0.01 0.00 -0.03 0.00 0.11 0.00 0.00 57.88 57.95 2duw h LEU 10 Cb 1.39 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 41.60 2duw h LEU 10 CO 0.10 0.72 -0.89 0.00 -4.11 0.00 0.00 178.44 174.26 2duw h THR 11 N 0.00 0.11 0.00 0.15 1.03 -1.21 -3.40 112.91 109.58 2duw h THR 11 Ca -0.11 -1.19 0.00 0.00 -0.01 0.00 0.00 66.41 65.10 2duw h THR 11 Cb 1.64 1.69 0.00 0.00 -1.07 0.00 0.00 68.15 70.41 2duw h THR 11 CO 0.07 0.06 -0.07 -1.28 -0.01 0.00 0.00 175.52 174.29 2duw h SER 12 N 0.00 0.00 -4.29 0.00 0.87 -1.19 -3.49 113.55 105.45 2duw h SER 12 Ca -0.02 0.00 -0.51 0.00 -1.23 0.00 0.00 61.79 60.03 2duw h SER 12 Cb 1.10 0.00 -0.26 0.00 -0.44 0.00 0.00 62.40 62.80 2duw h SER 12 CO 0.01 0.19 -0.82 0.28 -0.53 0.00 0.00 176.83 175.97 2duw s THR 13 N -1.27 1.35 -0.34 2.23 -1.32 -1.12 -5.09 115.64 110.08 2duw s THR 13 Ca -0.02 -1.03 0.00 0.00 -1.21 0.00 0.00 61.69 59.43 2duw s THR 13 Cb 0.00 -1.19 0.08 0.00 -1.51 0.00 0.00 72.50 69.89 2duw s THR 13 CO 0.03 0.13 0.06 0.00 -2.21 0.00 0.00 174.62 172.64 2duw s ARG 14 N -1.04 1.99 -0.01 7.08 1.70 -1.26 -4.30 118.95 123.11 2duw s ARG 14 Ca 0.05 -1.63 0.00 0.00 -0.47 0.00 0.00 55.73 53.68 2duw s ARG 14 Cb -0.08 -3.28 0.01 0.00 -0.57 0.00 0.00 34.95 31.04 2duw s ARG 14 CO 0.01 -0.85 0.01 0.99 -1.08 0.00 0.00 175.30 174.38 2duw s THR 15 N 1.09 0.02 -0.07 4.99 2.01 -1.26 -4.67 115.64 117.75 2duw s THR 15 Ca 0.03 0.07 0.02 0.00 0.31 0.00 0.00 61.69 62.13 2duw s THR 15 Cb -0.20 -0.08 0.01 0.00 0.01 0.00 0.00 72.50 72.24 2duw s THR 15 CO -0.05 0.05 -0.13 -0.63 -0.69 0.00 0.00 174.62 173.18 2duw s ILE 16 N 0.48 1.21 -0.02 1.82 1.09 -0.23 -1.10 121.20 124.44 2duw s ILE 16 Ca -0.04 -0.51 0.07 0.00 -1.10 0.00 0.00 60.65 59.07 2duw s ILE 16 Cb -0.06 -1.10 -0.02 0.00 -1.06 0.00 0.00 42.46 40.22 2duw s ILE 16 CO -0.01 0.37 -0.24 0.00 -0.10 0.00 0.00 174.94 174.96 2duw s ALA 17 N 0.72 1.98 -0.12 9.38 0.00 -0.84 -0.13 121.76 132.75 2duw s ALA 17 Ca -0.13 -1.02 -0.03 0.00 0.00 0.00 0.00 51.96 50.77 2duw s ALA 17 Cb -0.16 -0.51 -0.03 0.00 0.00 0.00 0.00 23.12 22.42 2duw s ALA 17 CO 0.03 0.48 0.00 -1.17 0.00 0.00 0.00 175.76 175.10 2duw s LEU 18 N -0.53 3.53 -0.20 0.00 2.96 -0.67 -0.96 118.68 122.81 2duw s LEU 18 Ca 0.08 0.06 -0.08 0.00 -0.22 0.00 0.00 54.13 53.97 2duw s LEU 18 Cb -0.09 -1.83 -0.04 0.00 0.50 0.00 0.00 46.19 44.72 2duw s LEU 18 CO -0.01 0.28 0.08 -0.69 -1.32 0.00 0.00 176.35 174.69 2duw s VAL 19 N -0.32 4.79 -0.25 1.68 1.01 -1.24 -0.15 120.40 125.92 2duw s VAL 19 Ca 0.07 -0.03 -0.01 0.00 0.00 0.00 0.00 61.98 62.00 2duw s VAL 19 Cb -0.12 -3.18 -0.02 0.00 0.00 0.00 0.00 36.38 33.06 2duw s VAL 19 CO 0.02 0.42 0.22 0.61 0.00 0.00 0.00 175.10 176.38 2duw n GLY 20 N 3.86 0.32 3.60 4.51 0.00 0.16 -4.61 105.19 113.03 2duw n GLY 20 Ca -0.16 -0.06 -0.41 0.00 0.00 0.00 0.00 46.02 45.38 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 -3.09 3.53 0.27 4.61 0.00 -1.19 -4.98 121.76 120.91 2duw s ALA 21 Ca 0.10 -0.60 0.02 0.00 0.00 0.00 0.00 51.96 51.48 2duw s ALA 21 Cb -0.01 -3.14 -0.01 0.00 0.00 0.00 0.00 23.12 19.96 2duw s ALA 21 CO 0.18 -1.09 0.06 -1.13 0.00 0.00 0.00 175.76 173.77 2duw n SER 22 N 5.94 1.74 -2.22 0.00 3.41 -1.26 -4.58 113.62 116.65 2duw n SER 22 Ca -0.00 -2.32 -0.25 0.00 -0.26 0.00 0.00 58.87 56.04 2duw n SER 22 Cb 0.49 0.48 0.02 0.00 -0.26 0.00 0.00 64.21 64.94 2duw n SER 22 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2duw n ASP 23 N -1.54 6.83 -4.13 4.04 2.03 -1.26 -4.78 116.55 117.75 2duw n ASP 23 Ca -0.07 -3.32 -0.37 0.00 0.52 0.00 0.00 54.79 51.54 2duw n ASP 23 Cb 0.38 -1.09 -0.07 0.00 -0.72 0.00 0.00 41.12 39.62 2duw n ASP 23 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2duw s LYS 24 N -2.42 3.18 0.00 -0.67 -0.14 -1.26 -4.88 119.74 113.55 2duw s LYS 24 Ca 0.47 -3.03 0.15 0.00 -1.36 0.00 0.00 55.97 52.20 2duw s LYS 24 Cb 0.35 -3.97 0.73 0.00 -1.68 0.00 0.00 37.83 33.27 2duw s LYS 24 CO -0.10 -1.24 1.41 -0.35 -0.76 0.00 0.00 175.35 174.32 2duw n PRO 25 N 2.76 0.19 -0.96 -1.68 -0.04 -1.26 -2.54 135.00 131.45 2duw n PRO 25 Ca 0.18 0.16 -0.09 0.00 -0.04 0.00 0.00 63.50 63.70 2duw n PRO 25 Cb 0.38 -1.50 0.25 0.00 -0.04 0.00 0.00 33.50 32.59 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 -1.31 4.33 -4.27 3.54 5.75 -1.26 -4.69 116.55 118.64 2duw n ASP 26 Ca 0.07 -3.16 -0.15 0.00 -0.01 0.00 0.00 54.79 51.53 2duw n ASP 26 Cb 0.12 -0.74 -0.10 0.00 -1.03 0.00 0.00 41.12 39.37 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 -2.76 1.13 0.28 0.11 0.52 -1.05 -5.03 118.95 112.14 2duw s ARG 27 Ca 0.49 -1.49 0.24 0.00 -0.52 0.00 0.00 55.73 54.46 2duw s ARG 27 Cb 0.40 -0.73 1.02 0.00 0.52 0.00 0.00 34.95 36.16 2duw s ARG 27 CO 0.12 0.09 1.73 -1.00 0.02 0.00 0.00 175.30 176.26 2duw h PRO 28 N 2.72 0.00 0.00 3.54 0.13 -1.90 -2.65 132.00 133.84 2duw h PRO 28 Ca -0.37 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.62 2duw h PRO 28 Cb 1.20 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.31 2duw h PRO 28 CO 0.63 0.00 -0.66 1.03 -0.23 0.00 0.00 178.00 178.77 2duw h SER 29 N 0.00 0.00 0.07 1.44 0.87 -1.89 -3.15 113.55 110.90 2duw h SER 29 Ca 0.00 0.00 -0.26 0.00 -1.23 0.00 0.00 61.79 60.30 2duw h SER 29 Cb 0.37 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.31 2duw h SER 29 CO 0.00 0.66 -1.39 0.22 -0.53 0.00 0.00 176.83 175.80 2duw h TYR 30 N 0.00 0.28 -0.76 2.24 5.03 -1.68 -3.22 116.97 118.86 2duw h TYR 30 Ca -0.01 -0.21 0.18 0.00 2.58 0.00 0.00 58.73 61.28 2duw h TYR 30 Cb 1.37 -0.01 -0.04 0.00 1.55 0.00 0.00 36.73 39.60 2duw h TYR 30 CO 0.00 1.54 0.52 0.07 -1.32 0.00 0.00 178.16 178.98 2duw h ARG 31 N -0.50 0.23 0.06 1.82 0.11 -1.61 0.28 114.38 114.78 2duw h ARG 31 Ca -0.32 -0.01 -0.26 0.00 0.10 0.00 0.00 59.98 59.49 2duw h ARG 31 Cb 1.62 -0.05 0.01 0.00 1.11 0.00 0.00 29.97 32.66 2duw h ARG 31 CO -0.03 0.15 -1.09 0.28 0.10 0.00 0.00 179.97 179.39 2duw h VAL 32 N 0.24 1.38 0.71 0.08 2.07 -1.68 -2.44 116.25 116.61 2duw h VAL 32 Ca 0.38 -2.56 -0.03 0.00 0.82 0.00 0.00 66.70 65.31 2duw h VAL 32 Cb 1.12 2.59 -0.01 0.00 -1.52 0.00 0.00 31.29 33.48 2duw h VAL 32 CO -0.09 0.77 -0.47 -0.03 0.02 0.00 0.00 177.57 177.77 2duw h MET 33 N 0.22 -1.08 0.00 1.57 4.05 -0.96 0.22 114.93 118.94 2duw h MET 33 Ca -0.12 0.07 -0.03 0.00 -0.28 0.00 0.00 59.70 59.34 2duw h MET 33 Cb 1.75 0.25 -0.00 0.00 -0.80 0.00 0.00 31.60 32.80 2duw h MET 33 CO 0.19 -0.72 -0.13 -0.22 0.23 0.00 0.00 176.91 176.26 2duw h LYS 34 N -1.12 0.00 0.08 0.39 3.11 -1.57 -1.65 116.57 115.82 2duw h LYS 34 Ca -0.09 0.00 -0.00 0.00 -2.81 0.00 0.00 60.65 57.74 2duw h LYS 34 Cb 0.91 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.14 2duw h LYS 34 CO 0.07 0.13 -0.04 -0.92 -2.81 0.00 0.00 179.45 175.89 2duw h TYR 35 N 0.00 -0.11 -0.06 1.91 3.20 -0.91 -1.14 116.97 119.85 2duw h TYR 35 Ca -0.00 -0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.75 2duw h TYR 35 Cb 0.43 0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.73 2duw h TYR 35 CO 0.00 0.30 -0.49 -0.07 -1.64 0.00 0.00 178.16 176.27 2duw h LEU 36 N -0.54 0.17 -0.17 2.82 3.38 -0.84 -1.50 115.31 118.63 2duw h LEU 36 Ca -0.01 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 57.83 2duw h LEU 36 Cb 0.46 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 2duw h LEU 36 CO 0.02 0.64 -0.05 -0.07 0.09 0.00 0.00 178.44 179.06 2duw h LEU 37 N 0.13 0.34 -0.40 1.67 3.38 -1.29 -0.87 115.31 118.27 2duw h LEU 37 Ca 0.01 -0.38 -0.11 0.00 0.09 0.00 0.00 57.88 57.49 2duw h LEU 37 Cb 0.91 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 2duw h LEU 37 CO 0.07 0.65 -0.17 -0.78 0.09 0.00 0.00 178.44 178.30 2duw h ASP 38 N 0.04 0.83 -0.17 -0.43 3.58 -1.16 -2.77 116.42 116.34 2duw h ASP 38 Ca 0.04 -0.39 0.05 0.00 0.42 0.00 0.00 57.03 57.15 2duw h ASP 38 Cb 0.50 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 41.32 2duw h ASP 38 CO 0.02 1.04 0.19 1.56 -2.88 0.00 0.00 179.24 179.17 2duw h GLN 39 N 0.62 0.00 0.00 0.28 1.08 -1.27 -3.45 115.11 112.37 2duw h GLN 39 Ca 0.09 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.29 2duw h GLN 39 Cb 0.71 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.14 2duw h GLN 39 CO 0.05 0.00 0.00 0.41 -0.95 0.00 0.00 178.83 178.34 2duw n GLY 40 N -1.39 0.58 2.27 3.46 0.00 -1.04 -5.09 105.19 103.97 2duw n GLY 40 Ca 0.01 -0.08 -0.19 0.00 0.00 0.00 0.00 46.02 45.77 2duw n GLY 40 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2duw n TYR 41 N 0.00 0.45 -3.70 1.61 4.02 -0.35 -5.04 117.16 114.15 2duw n TYR 41 Ca 0.00 -1.65 -0.38 0.00 -0.01 0.00 0.00 57.90 55.85 2duw n TYR 41 Cb 0.00 -0.12 -0.12 0.00 -0.02 0.00 0.00 39.34 39.08 2duw n TYR 41 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 176.86 174.27 2duw s HIS 42 N -2.35 3.20 -0.16 -0.72 2.46 -1.26 -4.69 115.29 111.78 2duw s HIS 42 Ca 0.06 -1.00 -0.04 0.00 0.47 0.00 0.00 55.06 54.55 2duw s HIS 42 Cb 0.00 -2.33 -0.03 0.00 -0.13 0.00 0.00 32.58 30.10 2duw s HIS 42 CO 0.04 -0.61 -0.01 0.08 -2.47 0.00 0.00 174.74 171.77 2duw s VAL 43 N 1.51 4.12 -0.58 0.89 1.01 -1.24 -1.07 120.40 125.04 2duw s VAL 43 Ca 0.02 -0.28 0.05 0.00 0.00 0.00 0.00 61.98 61.77 2duw s VAL 43 Cb -0.18 -2.81 0.20 0.00 0.00 0.00 0.00 36.38 33.58 2duw s VAL 43 CO 0.04 0.49 0.52 -0.38 0.00 0.00 0.00 175.10 175.78 2duw n ILE 44 N 3.44 0.86 -2.25 2.22 5.41 0.82 -4.85 119.36 125.00 2duw n ILE 44 Ca -0.17 -4.51 -0.41 0.00 1.00 0.00 0.00 62.75 58.66 2duw n ILE 44 Cb 0.52 -2.02 -0.03 0.00 -0.71 0.00 0.00 39.64 37.41 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 -1.32 4.46 -0.09 0.38 0.04 -1.26 -1.67 135.00 135.55 2duw s PRO 45 Ca 0.31 2.06 -0.00 0.00 0.04 0.00 0.00 61.00 63.41 2duw s PRO 45 Cb 0.05 -3.12 0.02 0.00 0.04 0.00 0.00 34.50 31.49 2duw s PRO 45 CO -0.13 -0.05 -0.05 0.08 0.04 0.00 0.00 177.00 176.89 2duw s VAL 46 N -1.06 0.76 0.01 -0.36 1.01 0.78 -4.06 120.40 117.49 2duw s VAL 46 Ca 0.48 -0.15 -0.10 0.00 0.00 0.00 0.00 61.98 62.21 2duw s VAL 46 Cb -0.37 -0.82 0.01 0.00 0.00 0.00 0.00 36.38 35.20 2duw s VAL 46 CO 0.48 0.31 0.21 -0.55 0.00 0.00 0.00 175.10 175.55 2duw s SER 47 N 1.59 -0.03 0.00 3.32 0.15 0.96 -0.66 113.70 119.03 2duw s SER 47 Ca 0.01 -0.17 0.14 0.00 0.70 0.00 0.00 55.95 56.63 2duw s SER 47 Cb -0.13 0.26 0.64 0.00 -1.71 0.00 0.00 66.02 65.08 2duw s SER 47 CO -0.05 -0.45 1.44 -0.81 1.20 0.00 0.00 173.24 174.57 2duw n PRO 48 N 1.15 0.06 -0.08 5.44 -0.04 -1.25 -2.36 135.00 137.93 2duw n PRO 48 Ca -0.21 0.23 -0.09 0.00 -0.04 0.00 0.00 63.50 63.39 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 1.17 -0.04 0.00 0.00 175.50 176.63 2duw n LYS 49 N -1.44 1.24 0.01 0.54 4.81 -1.26 -4.42 118.16 117.64 2duw n LYS 49 Ca 0.04 0.04 0.12 0.00 -0.87 0.00 0.00 58.31 57.64 2duw n LYS 49 Cb 0.15 -1.36 0.51 0.00 0.02 0.00 0.00 35.03 34.36 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 -2.71 0.36 -1.52 3.15 3.14 -1.13 -4.78 118.33 114.85 2duw n VAL 50 Ca -0.26 0.07 -0.42 0.00 -2.96 0.00 0.00 64.34 60.76 2duw n VAL 50 Cb 0.91 -0.68 -0.06 0.00 -1.06 0.00 0.00 33.84 32.95 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 -1.53 0.98 -0.06 1.55 0.00 -0.99 -0.05 120.51 120.41 2duw n ALA 51 Ca 0.06 -0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.03 2duw n ALA 51 Cb 0.29 -2.83 0.00 0.00 0.00 0.00 0.00 19.45 16.91 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 3.27 0.00 0.00 -1.25 -4.86 105.19 109.52 2duw n GLY 52 Ca 0.41 -0.05 -0.15 0.00 0.00 0.00 0.00 46.02 46.23 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 -0.25 1.33 -0.26 1.61 1.02 0.92 -5.00 119.74 119.12 2duw s LYS 53 Ca 0.00 -1.71 -0.02 0.00 0.02 0.00 0.00 55.97 54.26 2duw s LYS 53 Cb 0.00 -0.07 0.03 0.00 -0.52 0.00 0.00 37.83 37.26 2duw s LYS 53 CO 0.00 -0.32 -0.05 0.95 -0.92 0.00 0.00 175.35 175.01 2duw s THR 54 N -3.90 2.96 -0.34 2.17 -4.23 -1.26 -0.86 115.64 110.17 2duw s THR 54 Ca 0.38 -1.03 -0.09 0.00 -1.18 0.00 0.00 61.69 59.77 2duw s THR 54 Cb 0.08 -2.52 0.02 0.00 1.34 0.00 0.00 72.50 71.41 2duw s THR 54 CO 0.13 0.16 0.15 -0.22 -0.54 0.00 0.00 174.62 174.30 2duw s LEU 55 N 1.33 4.35 -1.95 4.79 2.96 -0.35 -4.48 118.68 125.32 2duw s LEU 55 Ca -0.00 -0.89 0.00 0.00 -0.22 0.00 0.00 54.13 53.02 2duw s LEU 55 Cb -0.17 -1.95 0.00 0.00 0.50 0.00 0.00 46.19 44.57 2duw s LEU 55 CO -0.04 -0.30 0.00 0.18 -1.32 0.00 0.00 176.35 174.87 2duw n LEU 56 N 4.92 -1.52 0.00 -0.68 4.32 -1.26 -0.25 117.00 122.54 2duw n LEU 56 Ca -0.13 0.35 0.00 0.00 -0.02 0.00 0.00 56.01 56.22 2duw n LEU 56 Cb 0.47 -2.73 0.00 0.00 -1.62 0.00 0.00 43.42 39.54 2duw n LEU 56 CO 0.34 -0.79 0.00 0.61 -1.22 0.00 0.00 177.39 176.32 2duw n GLY 57 N -0.53 0.74 3.71 -0.72 0.00 -1.26 -5.05 105.19 102.08 2duw n GLY 57 Ca -0.20 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 -0.73 4.25 0.40 1.61 -1.52 0.66 -5.05 119.66 119.28 2duw s GLN 58 Ca 0.00 0.20 -0.27 0.00 -1.95 0.00 0.00 55.36 53.34 2duw s GLN 58 Cb 0.00 -3.46 -0.10 0.00 -0.22 0.00 0.00 33.01 29.23 2duw s GLN 58 CO 0.00 0.14 1.39 0.94 -0.25 0.00 0.00 175.29 177.51 2duw n GLN 59 N 3.85 2.31 -3.54 2.91 -0.06 -1.26 -1.21 117.38 120.39 2duw n GLN 59 Ca -0.10 0.82 -0.29 0.00 -2.00 0.00 0.00 57.00 55.43 2duw n GLN 59 Cb 0.52 -2.53 -0.04 0.00 -4.06 0.00 0.00 30.24 24.13 2duw n GLN 59 CO 0.00 0.00 0.00 0.20 -0.20 0.00 0.00 177.06 177.06 2duw s GLY 60 N -0.33 1.93 -0.07 1.69 0.00 -0.04 -4.55 107.32 105.95 2duw s GLY 60 Ca 0.57 -0.64 -0.04 0.00 0.00 0.00 0.00 44.72 44.61 2duw s GLY 60 CO 0.61 -0.56 0.17 -0.19 0.00 0.00 0.00 173.10 173.13 2duw s TYR 61 N -1.91 -0.20 0.31 1.90 2.02 -1.26 -3.83 117.35 114.38 2duw s TYR 61 Ca 0.42 0.52 0.05 0.00 -0.37 0.00 0.00 57.07 57.69 2duw s TYR 61 Cb -0.11 -0.00 0.50 0.00 -0.40 0.00 0.00 41.96 41.94 2duw s TYR 61 CO 0.28 -0.15 1.75 0.00 -1.57 0.00 0.00 175.55 175.86 2duw h ALA 62 N 6.70 1.18 -2.69 3.71 0.00 -1.88 0.27 119.26 126.55 2duw h ALA 62 Ca -0.36 -0.35 -0.13 0.00 0.00 0.00 0.00 54.91 54.08 2duw h ALA 62 Cb 1.17 -0.10 -0.22 0.00 0.00 0.00 0.00 17.79 18.64 2duw h ALA 62 CO 0.41 0.53 -0.31 0.95 0.00 0.00 0.00 179.25 180.84 2duw s THR 63 N -4.39 0.04 0.47 0.00 -4.23 -1.26 -3.80 115.64 102.47 2duw s THR 63 Ca -0.06 -0.30 0.14 0.00 -1.18 0.00 0.00 61.69 60.30 2duw s THR 63 Cb 0.14 -0.55 0.30 0.00 1.34 0.00 0.00 72.50 73.73 2duw s THR 63 CO 0.77 -0.16 2.06 -0.07 -0.54 0.00 0.00 174.62 176.68 2duw h LEU 64 N 4.57 0.22 0.00 4.79 3.38 -1.94 0.22 115.31 126.55 2duw h LEU 64 Ca -0.28 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.69 2duw h LEU 64 Cb 1.18 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.88 2duw h LEU 64 CO 0.36 0.15 0.00 0.00 0.09 0.00 0.00 178.44 179.04 2duw n ALA 65 N -2.53 2.20 1.12 1.53 0.00 -1.26 -2.33 120.51 119.23 2duw n ALA 65 Ca 0.04 -0.11 0.12 0.00 0.00 0.00 0.00 53.44 53.48 2duw n ALA 65 Cb 0.23 -1.37 0.19 0.00 0.00 0.00 0.00 19.45 18.51 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 -1.23 1.32 -4.74 0.00 2.03 0.76 -4.89 116.55 109.79 2duw n ASP 66 Ca 0.12 -1.05 -0.39 0.00 0.52 0.00 0.00 54.79 53.99 2duw n ASP 66 Cb 0.16 0.33 -0.05 0.00 -0.72 0.00 0.00 41.12 40.84 2duw n ASP 66 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2duw s VAL 67 N -2.58 5.02 0.10 5.18 1.01 -0.99 -4.99 120.40 123.16 2duw s VAL 67 Ca 0.20 1.21 -0.15 0.00 0.00 0.00 0.00 61.98 63.24 2duw s VAL 67 Cb 0.18 -3.92 -0.09 0.00 0.00 0.00 0.00 36.38 32.55 2duw s VAL 67 CO 0.58 0.35 1.42 1.55 0.00 0.00 0.00 175.10 179.01 2duw h PRO 68 N 6.21 0.70 -7.22 2.72 0.13 -1.90 -3.45 132.00 129.20 2duw h PRO 68 Ca -0.43 -0.37 -0.48 0.00 -0.87 0.00 0.00 66.00 63.85 2duw h PRO 68 Cb 1.19 0.01 0.04 0.00 0.13 0.00 0.00 31.00 32.38 2duw h PRO 68 CO 0.73 0.98 0.38 -2.00 -0.23 0.00 0.00 178.00 177.86 2duw s GLU 69 N -4.36 3.64 -0.20 0.86 2.12 -1.26 -5.05 118.70 114.45 2duw s GLU 69 Ca -0.12 1.03 -0.08 0.00 0.36 0.00 0.00 54.97 56.15 2duw s GLU 69 Cb 0.09 -2.09 -0.04 0.00 0.26 0.00 0.00 34.13 32.35 2duw s GLU 69 CO 0.83 -0.53 0.08 0.15 -0.54 0.00 0.00 175.26 175.24 2duw s LYS 70 N -4.23 3.98 0.22 4.30 1.02 -1.26 -5.08 119.74 118.70 2duw s LYS 70 Ca 0.60 -0.33 -0.30 0.00 0.02 0.00 0.00 55.97 55.96 2duw s LYS 70 Cb -0.12 -3.28 -0.09 0.00 -0.52 0.00 0.00 37.83 33.82 2duw s LYS 70 CO 0.37 0.22 1.12 0.54 -0.92 0.00 0.00 175.35 176.67 2duw s VAL 71 N 0.54 3.63 -0.10 3.17 0.11 -1.26 -4.95 120.40 121.54 2duw s VAL 71 Ca 0.04 1.50 0.12 0.00 -2.93 0.00 0.00 61.98 60.71 2duw s VAL 71 Cb -0.13 -3.95 -0.24 0.00 -1.53 0.00 0.00 36.38 30.53 2duw s VAL 71 CO 0.01 0.30 0.46 0.47 -3.33 0.00 0.00 175.10 173.00 2duw n ASP 72 N 1.89 0.77 -3.68 3.54 8.00 -1.26 -3.73 116.55 122.08 2duw n ASP 72 Ca 0.01 0.27 -0.26 0.00 0.71 0.00 0.00 54.79 55.53 2duw n ASP 72 Cb 0.45 0.15 -0.17 0.00 -0.02 0.00 0.00 41.12 41.53 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 -2.56 0.35 -0.08 -1.24 1.75 -0.26 -2.44 119.30 114.82 2duw s MET 73 Ca -0.08 -0.15 -0.22 0.00 -1.25 0.00 0.00 55.69 53.98 2duw s MET 73 Cb 0.07 -1.72 -0.04 0.00 2.84 0.00 0.00 34.83 35.99 2duw s MET 73 CO 0.82 -0.58 0.66 0.08 -0.65 0.00 0.00 175.02 175.34 2duw s VAL 74 N 2.01 5.07 -0.33 10.11 1.01 -0.57 -2.00 120.40 135.71 2duw s VAL 74 Ca 0.01 1.35 -0.08 0.00 0.00 0.00 0.00 61.98 63.26 2duw s VAL 74 Cb -0.16 -4.00 0.02 0.00 0.00 0.00 0.00 36.38 32.25 2duw s VAL 74 CO -0.08 0.26 0.12 -1.81 0.00 0.00 0.00 175.10 173.60 2duw s ASP 75 N 0.77 5.35 -0.39 3.32 1.11 -0.13 -0.48 116.67 126.22 2duw s ASP 75 Ca 0.35 -0.88 -0.07 0.00 0.18 0.00 0.00 52.55 52.13 2duw s ASP 75 Cb -0.17 -1.92 0.08 0.00 1.07 0.00 0.00 42.92 41.98 2duw s ASP 75 CO 0.16 -0.27 0.20 -0.69 1.18 0.00 0.00 175.17 175.75 2duw s VAL 76 N 1.49 3.84 0.00 -1.27 1.01 0.83 -3.60 120.40 122.70 2duw s VAL 76 Ca 0.01 -1.48 0.00 0.00 0.00 0.00 0.00 61.98 60.51 2duw s VAL 76 Cb -0.18 -3.36 0.00 0.00 0.00 0.00 0.00 36.38 32.84 2duw s VAL 76 CO 0.04 -0.45 0.32 0.49 0.00 0.00 0.00 175.10 175.51 2duw n PHE 77 N 4.81 0.00 0.05 5.22 3.72 -1.26 -3.04 117.46 126.95 2duw n PHE 77 Ca -0.09 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.25 2duw n PHE 77 Cb 0.43 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.94 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 0.00 -0.25 -3.60 -1.08 3.08 -1.89 -3.42 114.38 107.22 2duw h ARG 78 Ca 0.00 0.02 -0.14 0.00 0.07 0.00 0.00 59.98 59.93 2duw h ARG 78 Cb 0.13 0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.19 2duw h ARG 78 CO 0.00 -0.17 0.01 1.21 -1.07 0.00 0.00 179.97 179.95 2duw s ASN 79 N -3.09 0.42 -0.03 7.04 3.04 -1.26 -4.98 114.94 116.07 2duw s ASN 79 Ca -0.05 -1.26 -0.22 0.00 0.04 0.00 0.00 52.86 51.37 2duw s ASN 79 Cb 0.02 0.73 -0.15 0.00 -1.54 0.00 0.00 41.25 40.31 2duw s ASN 79 CO 0.19 -1.44 0.96 0.77 -3.04 0.00 0.00 177.10 174.54 2duw h SER 80 N 2.08 -0.25 0.66 -4.21 4.64 -1.97 -3.25 113.55 111.25 2duw h SER 80 Ca -0.29 -0.28 -0.07 0.00 -0.47 0.00 0.00 61.79 60.68 2duw h SER 80 Cb 1.25 0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 63.39 2duw h SER 80 CO 0.38 0.24 -0.33 -0.33 -0.87 0.00 0.00 176.83 175.92 2duw h GLU 81 N -0.85 0.00 -0.16 4.77 5.08 -1.98 -2.82 114.58 118.62 2duw h GLU 81 Ca -0.03 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.38 2duw h GLU 81 Cb 0.51 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 2duw h GLU 81 CO 0.05 0.33 0.20 0.00 -1.00 0.00 0.00 179.01 178.60 2duw h ALA 82 N 1.67 1.71 -0.99 3.43 0.00 -1.96 -1.67 119.26 121.46 2duw h ALA 82 Ca -0.00 -0.01 0.19 0.00 0.00 0.00 0.00 54.91 55.09 2duw h ALA 82 Cb 0.75 0.01 -0.10 0.00 0.00 0.00 0.00 17.79 18.46 2duw h ALA 82 CO 0.04 -0.28 0.61 0.00 0.00 0.00 0.00 179.25 179.62 2duw h ALA 83 N 1.74 1.78 0.18 0.00 0.00 -1.56 0.22 119.26 121.63 2duw h ALA 83 Ca 0.08 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 2duw h ALA 83 Cb 0.48 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2duw h ALA 83 CO -0.00 -0.13 -0.09 2.35 0.00 0.00 0.00 179.25 181.39 2duw h TRP 84 N 0.71 -0.22 -0.67 0.00 2.91 -1.54 0.27 115.95 117.41 2duw h TRP 84 Ca 0.55 -0.01 0.04 0.00 1.13 0.00 0.00 58.89 60.61 2duw h TRP 84 Cb 0.93 0.07 -0.04 0.00 -0.51 0.00 0.00 29.16 29.61 2duw h TRP 84 CO -0.00 0.18 0.44 0.78 -1.03 0.00 0.00 178.44 178.81 2duw h GLY 85 N -0.74 0.90 2.00 2.65 0.00 -1.48 -1.53 103.07 104.88 2duw h GLY 85 Ca -0.02 -0.30 -0.17 0.00 0.00 0.00 0.00 47.33 46.83 2duw h GLY 85 CO 0.04 0.25 -0.82 -2.08 0.00 0.00 0.00 176.54 173.93 2duw h VAL 86 N 0.77 1.47 0.11 4.60 2.07 -0.60 -3.17 116.25 121.49 2duw h VAL 86 Ca 0.28 -2.94 -0.01 0.00 0.82 0.00 0.00 66.70 64.85 2duw h VAL 86 Cb 0.13 2.64 0.00 0.00 -1.52 0.00 0.00 31.29 32.55 2duw h VAL 86 CO -0.08 0.81 -0.05 0.00 0.02 0.00 0.00 177.57 178.26 2duw h ALA 87 N 1.18 -0.14 -0.78 1.67 0.00 0.03 -1.49 119.26 119.73 2duw h ALA 87 Ca -0.01 -0.16 0.05 0.00 0.00 0.00 0.00 54.91 54.79 2duw h ALA 87 Cb 1.58 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 19.37 2duw h ALA 87 CO 0.11 -0.42 0.48 -0.56 0.00 0.00 0.00 179.25 178.85 2duw h GLN 88 N -0.46 0.86 -0.25 0.00 3.07 -1.47 0.23 115.11 117.09 2duw h GLN 88 Ca -0.01 -0.05 -0.01 0.00 0.09 0.00 0.00 58.65 58.66 2duw h GLN 88 Cb 0.38 -0.19 -0.01 0.00 0.08 0.00 0.00 27.48 27.73 2duw h GLN 88 CO 0.02 0.57 0.10 0.93 0.09 0.00 0.00 178.83 180.55 2duw h GLU 89 N 0.89 0.36 -0.50 0.06 4.39 -1.51 0.24 114.58 118.51 2duw h GLU 89 Ca 0.34 -0.06 -0.06 0.00 0.34 0.00 0.00 59.36 59.92 2duw h GLU 89 Cb 0.14 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.71 2duw h GLU 89 CO -0.16 0.39 0.08 0.00 -1.16 0.00 0.00 179.01 178.16 2duw h ALA 90 N 0.95 0.66 -0.02 3.43 0.00 -0.78 -2.15 119.26 121.36 2duw h ALA 90 Ca 0.08 -0.24 -0.10 0.00 0.00 0.00 0.00 54.91 54.66 2duw h ALA 90 Cb 0.16 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2duw h ALA 90 CO -0.01 0.39 -0.47 0.82 0.00 0.00 0.00 179.25 179.99 2duw h ILE 91 N 0.70 1.34 -0.37 0.00 2.04 -0.44 0.19 117.51 120.97 2duw h ILE 91 Ca 0.15 -1.61 -0.11 0.00 1.00 0.00 0.00 64.86 64.29 2duw h ILE 91 Cb 0.40 1.85 -0.01 0.00 -0.74 0.00 0.00 36.82 38.32 2duw h ILE 91 CO 0.01 0.46 -0.21 0.00 0.00 0.00 0.00 178.15 178.41 2duw h ALA 92 N 1.50 0.52 0.00 1.87 0.00 -0.25 -3.05 119.26 119.86 2duw h ALA 92 Ca -0.00 -0.37 -0.09 0.00 0.00 0.00 0.00 54.91 54.45 2duw h ALA 92 Cb 0.84 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 2duw h ALA 92 CO 0.06 0.49 -0.41 -0.84 0.00 0.00 0.00 179.25 178.55 2duw h ILE 93 N 0.59 0.76 0.00 0.00 3.07 -1.28 -3.48 117.51 117.17 2duw h ILE 93 Ca 0.08 -1.87 0.00 0.00 1.55 0.00 0.00 64.86 64.62 2duw h ILE 93 Cb 0.77 2.22 0.00 0.00 -0.27 0.00 0.00 36.82 39.54 2duw h ILE 93 CO 0.06 0.40 0.00 0.61 -1.05 0.00 0.00 178.15 178.17 2duw n GLY 94 N 0.90 0.68 3.92 0.16 0.00 -0.50 -5.06 105.19 105.28 2duw n GLY 94 Ca 0.01 -0.78 -0.30 0.00 0.00 0.00 0.00 46.02 44.96 2duw n GLY 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2duw s ALA 95 N -1.04 2.08 0.00 4.61 0.00 0.56 -4.74 121.76 123.23 2duw s ALA 95 Ca 0.00 -1.29 0.00 0.00 0.00 0.00 0.00 51.96 50.67 2duw s ALA 95 Cb 0.00 -2.75 0.00 0.00 0.00 0.00 0.00 23.12 20.37 2duw s ALA 95 CO 0.00 -2.63 0.00 1.63 0.00 0.00 0.00 175.76 174.76 2duw n LYS 96 N -3.90 0.16 -4.05 0.00 4.76 -1.24 -4.96 118.16 108.93 2duw n LYS 96 Ca 0.16 0.00 -0.08 0.00 -2.87 0.00 0.00 58.31 55.53 2duw n LYS 96 Cb 0.59 -0.78 -0.10 0.00 -1.84 0.00 0.00 35.03 32.90 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 -1.57 0.19 -0.03 -0.18 2.01 -1.02 -3.24 115.64 111.79 2duw s THR 97 Ca 0.00 -1.56 -0.01 0.00 0.31 0.00 0.00 61.69 60.43 2duw s THR 97 Cb 0.00 -1.24 0.03 0.00 0.01 0.00 0.00 72.50 71.30 2duw s THR 97 CO 0.00 -0.86 0.03 -0.22 -0.69 0.00 0.00 174.62 172.87 2duw s LEU 98 N -2.59 0.79 -0.05 4.42 2.96 0.65 -1.51 118.68 123.34 2duw s LEU 98 Ca 0.02 0.02 0.04 0.00 -0.22 0.00 0.00 54.13 53.99 2duw s LEU 98 Cb 0.04 -0.17 -0.00 0.00 0.50 0.00 0.00 46.19 46.55 2duw s LEU 98 CO -0.08 -0.16 -0.18 0.86 -1.32 0.00 0.00 176.35 175.47 2duw s TRP 99 N 1.46 1.82 0.26 5.38 -0.11 0.37 -0.37 118.94 127.75 2duw s TRP 99 Ca -0.04 -0.53 0.03 0.00 1.22 0.00 0.00 56.10 56.77 2duw s TRP 99 Cb -0.13 -1.22 0.03 0.00 -1.50 0.00 0.00 33.47 30.65 2duw s TRP 99 CO -0.03 -0.18 0.21 1.28 -4.62 0.00 0.00 176.95 173.61 2duw n LEU 100 N 3.14 0.00 -4.83 5.86 4.77 -0.86 -0.12 117.00 124.97 2duw n LEU 100 Ca -0.18 -1.34 -0.33 0.00 -0.03 0.00 0.00 56.01 54.13 2duw n LEU 100 Cb 0.53 -0.04 -0.07 0.00 -2.33 0.00 0.00 43.42 41.51 2duw n LEU 100 CO 0.25 -0.43 0.60 -1.58 -1.33 0.00 0.00 177.39 174.90 2duw s GLN 101 N -3.08 4.19 -0.05 3.23 2.00 -1.17 -4.47 119.66 120.30 2duw s GLN 101 Ca 0.16 1.03 -0.30 0.00 -2.00 0.00 0.00 55.36 54.25 2duw s GLN 101 Cb -0.01 -2.25 -0.05 0.00 0.80 0.00 0.00 33.01 31.50 2duw s GLN 101 CO 0.10 0.02 1.63 -1.17 -0.50 0.00 0.00 175.29 175.36 2duw s LEU 102 N -3.12 4.32 0.00 3.68 0.20 -1.22 -2.93 118.68 119.62 2duw s LEU 102 Ca 0.60 2.22 0.00 0.00 0.69 0.00 0.00 54.13 57.64 2duw s LEU 102 Cb -0.09 -3.54 0.00 0.00 -0.43 0.00 0.00 46.19 42.13 2duw s LEU 102 CO 0.14 -0.91 0.00 0.61 -0.29 0.00 0.00 176.35 175.90 2duw n GLY 103 N 4.08 1.81 3.34 7.98 0.00 -1.26 -4.91 105.19 116.23 2duw n GLY 103 Ca 0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.92 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 2.01 -0.28 1.61 0.11 -1.15 -4.99 120.40 115.71 2duw s VAL 104 Ca 0.00 -1.63 -0.03 0.00 -2.93 0.00 0.00 61.98 57.39 2duw s VAL 104 Cb 0.00 -1.79 0.11 0.00 -1.53 0.00 0.00 36.38 33.17 2duw s VAL 104 CO 0.00 0.05 0.19 -0.63 -3.33 0.00 0.00 175.10 171.38 2duw s ILE 105 N -1.08 -0.20 -0.54 7.04 1.09 -1.26 -2.97 121.20 123.28 2duw s ILE 105 Ca 0.10 -0.58 0.04 0.00 -1.10 0.00 0.00 60.65 59.11 2duw s ILE 105 Cb -0.10 -0.93 0.14 0.00 -1.06 0.00 0.00 42.46 40.50 2duw s ILE 105 CO 0.05 -0.58 0.29 0.21 -0.10 0.00 0.00 174.94 174.81 2duw s ASN 106 N 2.21 4.33 0.20 3.58 3.84 -1.26 -4.96 114.94 122.87 2duw s ASN 106 Ca 0.09 -3.11 -0.12 0.00 0.21 0.00 0.00 52.86 49.92 2duw s ASN 106 Cb -0.15 -1.60 0.23 0.00 -0.55 0.00 0.00 41.25 39.18 2duw s ASN 106 CO -0.32 -0.21 1.69 1.05 -2.79 0.00 0.00 177.10 176.51 2duw h GLU 107 N 6.35 0.16 -0.46 0.43 4.11 -1.98 -0.11 114.58 123.07 2duw h GLU 107 Ca -0.05 -0.01 0.05 0.00 0.07 0.00 0.00 59.36 59.43 2duw h GLU 107 Cb 0.87 -0.04 -0.05 0.00 0.50 0.00 0.00 28.75 30.04 2duw h GLU 107 CO 0.68 0.10 0.19 1.96 0.07 0.00 0.00 179.01 182.01 2duw h GLN 108 N 0.16 0.37 0.00 1.06 4.20 -2.00 -0.54 115.11 118.36 2duw h GLN 108 Ca 0.28 -0.02 -0.04 0.00 0.06 0.00 0.00 58.65 58.93 2duw h GLN 108 Cb 0.42 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.11 2duw h GLN 108 CO -0.42 0.24 -0.18 0.00 -0.67 0.00 0.00 178.83 177.80 2duw h ALA 109 N 1.29 1.51 -0.01 3.87 0.00 -1.60 -1.40 119.26 122.92 2duw h ALA 109 Ca 0.21 -0.16 -0.18 0.00 0.00 0.00 0.00 54.91 54.78 2duw h ALA 109 Cb 0.19 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2duw h ALA 109 CO -0.20 0.22 -0.81 0.00 0.00 0.00 0.00 179.25 178.46 2duw h ALA 110 N 1.82 0.61 0.07 0.00 0.00 0.42 -3.18 119.26 119.00 2duw h ALA 110 Ca -0.00 -0.68 -0.26 0.00 0.00 0.00 0.00 54.91 53.96 2duw h ALA 110 Cb 0.35 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 18.09 2duw h ALA 110 CO 0.02 0.88 -1.07 0.28 0.00 0.00 0.00 179.25 179.36 2duw h VAL 111 N 0.12 1.31 -0.48 0.00 2.07 -0.61 -2.73 116.25 115.92 2duw h VAL 111 Ca -0.03 -2.34 0.09 0.00 0.82 0.00 0.00 66.70 65.23 2duw h VAL 111 Cb 1.40 2.61 -0.07 0.00 -1.52 0.00 0.00 31.29 33.72 2duw h VAL 111 CO 0.12 0.71 0.07 0.25 0.02 0.00 0.00 177.57 178.74 2duw h LEU 112 N 0.22 -0.06 -0.83 2.57 5.85 -1.33 0.28 115.31 122.00 2duw h LEU 112 Ca -0.15 0.10 -0.12 0.00 0.84 0.00 0.00 57.88 58.54 2duw h LEU 112 Cb 1.75 0.15 -0.02 0.00 0.37 0.00 0.00 40.66 42.91 2duw h LEU 112 CO 0.21 -0.00 -0.56 0.00 -0.34 0.00 0.00 178.44 177.74 2duw h ALA 113 N 1.39 1.03 -0.00 1.25 0.00 -1.64 -2.96 119.26 118.33 2duw h ALA 113 Ca 0.24 -0.51 -0.12 0.00 0.00 0.00 0.00 54.91 54.52 2duw h ALA 113 Cb 0.34 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 2duw h ALA 113 CO -0.34 0.70 -0.58 -0.09 0.00 0.00 0.00 179.25 178.94 2duw h ARG 114 N 0.05 0.01 -0.24 0.00 2.43 -0.82 0.26 114.38 116.06 2duw h ARG 114 Ca -0.00 -0.01 -0.11 0.00 -0.81 0.00 0.00 59.98 59.05 2duw h ARG 114 Cb 1.01 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.55 2duw h ARG 114 CO 0.08 0.59 -0.32 0.93 -1.51 0.00 0.00 179.97 179.74 2duw h GLU 115 N 0.01 0.50 0.00 0.20 5.08 -0.35 -3.08 114.58 116.95 2duw h GLU 115 Ca -0.01 -0.22 -0.13 0.00 -1.00 0.00 0.00 59.36 58.01 2duw h GLU 115 Cb 1.03 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.24 2duw h GLU 115 CO 0.08 0.76 -1.44 0.00 -1.00 0.00 0.00 179.01 177.41 2duw n ALA 116 N -2.49 2.12 0.00 3.43 0.00 -1.15 -4.97 120.51 117.45 2duw n ALA 116 Ca -0.01 -0.52 0.00 0.00 0.00 0.00 0.00 53.44 52.91 2duw n ALA 116 Cb 0.45 -0.92 0.00 0.00 0.00 0.00 0.00 19.45 18.98 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 1.36 1.42 3.54 0.00 0.00 0.55 -5.08 105.19 106.97 2duw n GLY 117 Ca -0.08 0.00 -0.38 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 2.09 -4.42 0.99 7.94 0.59 -4.88 117.00 119.30 2duw n LEU 118 Ca 0.00 0.78 -0.44 0.00 -1.11 0.00 0.00 56.01 55.24 2duw n LEU 118 Cb 0.00 -1.27 -0.04 0.00 0.53 0.00 0.00 43.42 42.64 2duw n LEU 118 CO 0.00 -2.48 0.64 -0.44 -1.11 0.00 0.00 177.39 174.00 2duw s SER 119 N -1.19 6.18 -0.08 1.96 0.01 -1.20 -4.27 113.70 115.11 2duw s SER 119 Ca 0.72 -1.16 -0.17 0.00 1.31 0.00 0.00 55.95 56.65 2duw s SER 119 Cb -0.44 -2.38 -0.05 0.00 0.21 0.00 0.00 66.02 63.36 2duw s SER 119 CO 0.51 -1.33 0.44 0.54 0.41 0.00 0.00 173.24 173.82 2duw s VAL 120 N 3.57 5.14 -0.19 3.43 0.11 -1.26 -0.26 120.40 130.94 2duw s VAL 120 Ca 0.18 0.88 -0.02 0.00 -2.93 0.00 0.00 61.98 60.09 2duw s VAL 120 Cb -0.19 -3.77 0.06 0.00 -1.53 0.00 0.00 36.38 30.95 2duw s VAL 120 CO 0.09 0.41 0.03 -0.69 -3.33 0.00 0.00 175.10 171.60 2duw s VAL 121 N 0.08 0.59 0.52 2.04 1.01 0.50 -4.96 120.40 120.18 2duw s VAL 121 Ca 0.24 -0.57 0.05 0.00 0.00 0.00 0.00 61.98 61.70 2duw s VAL 121 Cb -0.15 -1.07 0.02 0.00 0.00 0.00 0.00 36.38 35.18 2duw s VAL 121 CO 0.11 -0.18 0.33 0.00 0.00 0.00 0.00 175.10 175.36 2duw s MET 122 N 1.83 2.26 -1.55 2.72 0.23 -1.26 -2.02 119.30 121.51 2duw s MET 122 Ca -0.01 -2.03 0.00 0.00 -1.03 0.00 0.00 55.69 52.62 2duw s MET 122 Cb -0.17 -2.03 0.00 0.00 -1.53 0.00 0.00 34.83 31.10 2duw s MET 122 CO -0.08 -0.52 0.00 -3.47 -2.03 0.00 0.00 175.02 168.92 2duw n ASP 123 N -1.65 -5.25 -3.70 -1.18 2.03 -1.16 -4.95 116.55 100.70 2duw n ASP 123 Ca -0.03 0.06 -0.13 0.00 0.52 0.00 0.00 54.79 55.21 2duw n ASP 123 Cb 0.64 -4.40 -0.07 0.00 -0.72 0.00 0.00 41.12 36.58 2duw n ASP 123 CO 0.00 0.00 0.00 -0.60 -1.92 0.00 0.00 177.20 174.68 2duw s ARG 124 N -5.03 0.86 -0.23 -0.67 3.52 -1.26 -4.53 118.95 111.61 2duw s ARG 124 Ca 0.00 -0.37 -0.12 0.00 -0.13 0.00 0.00 55.73 55.10 2duw s ARG 124 Cb 0.00 0.38 0.07 0.00 -1.56 0.00 0.00 34.95 33.85 2duw s ARG 124 CO 0.00 -0.28 0.54 0.00 -0.81 0.00 0.00 175.30 174.75 2duw n PRO 126 N 4.40 0.15 -0.09 0.00 -0.04 -1.26 -1.78 135.00 136.37 2duw n PRO 126 Ca -0.21 0.39 -0.10 0.00 -0.04 0.00 0.00 63.50 63.54 2duw n PRO 126 Cb 0.56 -1.78 -0.02 0.00 -0.04 0.00 0.00 33.50 32.22 2duw n PRO 126 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2duw h ALA 127 N 2.32 0.39 0.00 0.55 0.00 -1.99 -1.59 119.26 118.93 2duw h ALA 127 Ca 0.00 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 2duw h ALA 127 Cb 0.33 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 2duw h ALA 127 CO 0.00 -0.05 -1.86 -0.89 0.00 0.00 0.00 179.25 176.45 2duw n ILE 128 N -4.77 0.19 -0.03 0.00 5.41 -1.18 -4.32 119.36 114.65 2duw n ILE 128 Ca -0.02 -0.53 -0.13 0.00 1.00 0.00 0.00 62.75 63.07 2duw n ILE 128 Cb 0.11 -0.09 -0.09 0.00 -0.71 0.00 0.00 39.64 38.86 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 0.18 -0.06 0.38 4.57 -1.35 -2.45 114.58 115.85 2duw h GLU 129 Ca -0.03 -0.10 0.04 0.00 -1.18 0.00 0.00 59.36 58.09 2duw h GLU 129 Cb 1.08 0.00 -0.06 0.00 -0.16 0.00 0.00 28.75 29.61 2duw h GLU 129 CO 0.00 0.63 -0.40 1.25 -1.18 0.00 0.00 179.01 179.31 2duw h LEU 130 N -0.27 -1.23 0.00 1.64 5.85 -1.49 0.10 115.31 119.91 2duw h LEU 130 Ca 0.01 0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.89 2duw h LEU 130 Cb 0.60 0.49 0.00 0.00 0.37 0.00 0.00 40.66 42.12 2duw h LEU 130 CO 0.02 -0.43 0.00 -0.81 -0.34 0.00 0.00 178.44 176.88 2duw n PRO 131 N -5.44 0.27 0.10 5.25 -0.04 -1.24 -0.02 135.00 133.88 2duw n PRO 131 Ca -0.05 0.11 -0.17 0.00 -0.04 0.00 0.00 63.50 63.36 2duw n PRO 131 Cb 0.36 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.20 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 0.37 0.00 0.54 0.11 -0.29 -2.56 114.38 112.56 2duw h ARG 132 Ca 0.00 -0.56 -0.11 0.00 0.10 0.00 0.00 59.98 59.41 2duw h ARG 132 Cb 0.11 0.20 -0.02 0.00 1.11 0.00 0.00 29.97 31.37 2duw h ARG 132 CO 0.00 1.24 -1.42 1.28 0.10 0.00 0.00 179.97 181.17 2duw n LEU 133 N -3.63 0.25 0.00 0.08 4.77 -1.08 -4.68 117.00 112.71 2duw n LEU 133 Ca -0.10 -0.00 0.04 0.00 -0.03 0.00 0.00 56.01 55.92 2duw n LEU 133 Cb 0.99 0.11 -0.11 0.00 -2.33 0.00 0.00 43.42 42.08 2duw n LEU 133 CO 0.55 0.19 -0.57 0.61 -1.33 0.00 0.00 177.39 176.83 2duw n GLY 134 N 2.67 -1.14 2.37 -0.72 0.00 0.97 -4.97 105.19 104.37 2duw n GLY 134 Ca -0.10 -0.33 -0.16 0.00 0.00 0.00 0.00 46.02 45.43 2duw n GLY 134 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2duw n LEU 135 N -2.59 -1.45 -4.20 0.99 -0.00 -0.96 -4.92 117.00 103.87 2duw n LEU 135 Ca -0.10 0.18 -0.27 0.00 -0.00 0.00 0.00 56.01 55.82 2duw n LEU 135 Cb 0.75 -2.31 0.20 0.00 -0.00 0.00 0.00 43.42 42.05 2duw n LEU 135 CO 0.44 -0.48 -0.11 0.00 -0.00 0.00 0.00 177.39 177.24 2duw n ALA 136 N -0.31 -3.13 0.10 1.96 0.00 -1.26 -4.91 120.51 112.96 2duw n ALA 136 Ca -0.17 -1.32 0.01 0.00 0.00 0.00 0.00 53.44 51.95 2duw n ALA 136 Cb 0.58 -1.37 0.05 0.00 0.00 0.00 0.00 19.45 18.71 2duw n ALA 136 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13