#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 2.68 -1.12 0.03 3.01 -1.26 -5.01 119.74 118.07 2duw s LYS 2 Ca 0.00 -1.97 -0.22 0.00 -1.01 0.00 0.00 55.97 52.76 2duw s LYS 2 Cb 0.00 -3.99 -0.05 0.00 -1.01 0.00 0.00 37.83 32.78 2duw s LYS 2 CO 0.00 -1.22 1.88 -2.00 0.51 0.00 0.00 175.35 174.52 2duw s GLU 3 N 1.00 2.79 0.57 1.68 2.56 -1.26 -4.94 118.70 121.11 2duw s GLU 3 Ca 0.09 -1.07 0.01 0.00 0.00 0.00 0.00 54.97 54.00 2duw s GLU 3 Cb -0.23 -5.25 0.04 0.00 2.00 0.00 0.00 34.13 30.69 2duw s GLU 3 CO -0.02 -3.48 0.80 0.54 -0.56 0.00 0.00 175.26 172.54 2duw s ASN 4 N 6.45 5.19 0.48 -1.70 2.20 -1.26 -5.12 114.94 121.18 2duw s ASN 4 Ca 0.65 -0.02 0.00 0.00 -0.94 0.00 0.00 52.86 52.55 2duw s ASN 4 Cb -0.01 -0.81 0.00 0.00 -2.00 0.00 0.00 41.25 38.42 2duw s ASN 4 CO 0.08 -1.22 0.00 0.47 -2.94 0.00 0.00 177.10 173.49 2duw n ASP 5 N -2.40 0.00 0.04 3.54 8.00 -1.26 -4.87 116.55 119.59 2duw n ASP 5 Ca 0.09 -0.99 0.21 0.00 0.71 0.00 0.00 54.79 54.80 2duw n ASP 5 Cb 0.60 0.00 0.73 0.00 -0.02 0.00 0.00 41.12 42.43 2duw n ASP 5 CO 0.00 0.00 0.00 0.16 -0.39 0.00 0.00 177.20 176.97 2duw h ILE 6 N -0.48 0.48 -0.83 0.53 3.07 -1.99 0.22 117.51 118.52 2duw h ILE 6 Ca 0.00 0.00 0.13 0.00 1.55 0.00 0.00 64.86 66.54 2duw h ILE 6 Cb 0.00 0.66 -0.06 0.00 -0.27 0.00 0.00 36.82 37.15 2duw h ILE 6 CO 0.00 0.00 0.54 0.00 -1.05 0.00 0.00 178.15 177.64 2duw h ALA 7 N 1.57 1.88 0.01 0.16 0.00 -1.98 0.26 119.26 121.17 2duw h ALA 7 Ca 0.24 0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.93 2duw h ALA 7 Cb 1.13 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.80 2duw h ALA 7 CO -0.00 -0.09 -0.95 0.78 0.00 0.00 0.00 179.25 178.99 2duw h GLY 8 N 0.63 0.36 2.00 0.00 0.00 -1.28 -1.13 103.07 103.66 2duw h GLY 8 Ca 0.40 -0.66 -0.17 0.00 0.00 0.00 0.00 47.33 46.90 2duw h GLY 8 CO -0.16 0.59 -0.79 -2.22 0.00 0.00 0.00 176.54 173.95 2duw h ILE 9 N 0.17 1.57 0.00 2.60 5.03 -1.25 -0.51 117.51 125.13 2duw h ILE 9 Ca -0.07 -2.72 -0.16 0.00 -0.12 0.00 0.00 64.86 61.79 2duw h ILE 9 Cb 1.59 2.47 -0.03 0.00 -3.03 0.00 0.00 36.82 37.82 2duw h ILE 9 CO 0.16 0.78 -1.05 0.17 -0.68 0.00 0.00 178.15 177.52 2duw h LEU 10 N 0.00 0.00 0.00 1.44 8.10 -0.56 -3.00 115.31 121.28 2duw h LEU 10 Ca -0.01 0.00 -0.03 0.00 0.11 0.00 0.00 57.88 57.96 2duw h LEU 10 Cb 1.40 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 41.62 2duw h LEU 10 CO 0.10 0.62 -0.99 0.00 -4.11 0.00 0.00 178.44 174.06 2duw h THR 11 N 0.00 0.08 0.00 0.15 1.03 -1.19 -3.41 112.91 109.57 2duw h THR 11 Ca -0.10 -1.16 0.00 0.00 -0.01 0.00 0.00 66.41 65.15 2duw h THR 11 Cb 1.56 1.62 0.00 0.00 -1.07 0.00 0.00 68.15 70.26 2duw h THR 11 CO 0.06 0.05 -0.05 -1.28 -0.01 0.00 0.00 175.52 174.29 2duw h SER 12 N 0.00 0.00 -4.30 0.00 0.87 -1.18 -3.49 113.55 105.46 2duw h SER 12 Ca -0.02 0.00 -0.49 0.00 -1.23 0.00 0.00 61.79 60.05 2duw h SER 12 Cb 1.09 0.00 -0.26 0.00 -0.44 0.00 0.00 62.40 62.79 2duw h SER 12 CO 0.01 0.14 -0.81 -0.89 -0.53 0.00 0.00 176.83 174.75 2duw s THR 13 N -1.20 1.26 -0.37 2.23 2.01 -1.13 -5.09 115.64 113.35 2duw s THR 13 Ca -0.02 -1.00 -0.02 0.00 0.31 0.00 0.00 61.69 60.97 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 0.02 0.10 0.12 -0.13 -0.69 0.00 0.00 174.62 174.05 2duw s ARG 14 N -1.03 2.12 0.01 4.92 0.52 -1.26 -4.32 118.95 119.90 2duw s ARG 14 Ca 0.04 -1.62 0.00 0.00 -0.52 0.00 0.00 55.73 53.62 2duw s ARG 14 Cb -0.08 -3.42 -0.01 0.00 0.52 0.00 0.00 34.95 31.97 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 1.17 0.05 -0.05 0.02 2.01 -1.26 -4.64 115.64 112.93 2duw s THR 15 Ca 0.04 -0.33 0.03 0.00 0.31 0.00 0.00 61.69 61.74 2duw s THR 15 Cb -0.21 -0.11 0.01 0.00 0.01 0.00 0.00 72.50 72.19 2duw s THR 15 CO -0.03 -0.17 -0.13 -0.63 -0.69 0.00 0.00 174.62 172.96 2duw s ILE 16 N -0.52 1.17 -0.06 1.82 1.09 -0.32 -2.71 121.20 121.66 2duw s ILE 16 Ca -0.06 -0.54 0.04 0.00 -1.10 0.00 0.00 60.65 59.00 2duw s ILE 16 Cb -0.04 -1.04 -0.02 0.00 -1.06 0.00 0.00 42.46 40.31 2duw s ILE 16 CO -0.00 0.35 -0.19 0.00 -0.10 0.00 0.00 174.94 175.00 2duw s ALA 17 N 0.37 2.44 -0.08 9.38 0.00 -0.58 -0.57 121.76 132.71 2duw s ALA 17 Ca -0.09 -1.00 0.04 0.00 0.00 0.00 0.00 51.96 50.91 2duw s ALA 17 Cb -0.13 -0.87 -0.01 0.00 0.00 0.00 0.00 23.12 22.11 2duw s ALA 17 CO 0.03 0.45 -0.20 -1.17 0.00 0.00 0.00 175.76 174.87 2duw s LEU 18 N -0.34 2.33 -0.24 0.00 2.96 -0.89 -1.20 118.68 121.31 2duw s LEU 18 Ca 0.03 -0.42 -0.06 0.00 -0.22 0.00 0.00 54.13 53.45 2duw s LEU 18 Cb -0.12 -1.46 -0.02 0.00 0.50 0.00 0.00 46.19 45.08 2duw s LEU 18 CO 0.02 0.24 0.04 -0.69 -1.32 0.00 0.00 176.35 174.64 2duw s VAL 19 N -0.11 4.07 0.00 1.68 1.01 -1.26 -0.36 120.40 125.44 2duw s VAL 19 Ca -0.04 -0.25 0.00 0.00 0.00 0.00 0.00 61.98 61.69 2duw s VAL 19 Cb -0.14 -2.89 0.00 0.00 0.00 0.00 0.00 36.38 33.35 2duw s VAL 19 CO 0.04 0.37 0.00 0.61 0.00 0.00 0.00 175.10 176.12 2duw n GLY 20 N 4.81 0.33 3.25 4.51 0.00 -0.09 -4.53 105.19 113.46 2duw n GLY 20 Ca -0.17 -0.36 -0.43 0.00 0.00 0.00 0.00 46.02 45.06 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 -2.76 4.05 0.07 4.61 0.00 -1.26 -4.95 121.76 121.53 2duw s ALA 21 Ca 0.00 -3.42 0.00 0.00 0.00 0.00 0.00 51.96 48.54 2duw s ALA 21 Cb 0.00 -3.24 0.00 0.00 0.00 0.00 0.00 23.12 19.88 2duw s ALA 21 CO 0.00 -2.22 0.00 0.43 0.00 0.00 0.00 175.76 173.97 2duw n SER 22 N 3.53 0.00 -2.21 0.00 7.64 -1.26 -4.76 113.62 116.56 2duw n SER 22 Ca 0.14 -0.93 -0.25 0.00 1.01 0.00 0.00 58.87 58.85 2duw n SER 22 Cb 0.43 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.65 2duw n SER 22 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 2duw n ASP 23 N -2.78 6.81 -4.13 6.43 5.68 -1.26 -4.78 116.55 122.52 2duw n ASP 23 Ca 0.00 -3.31 -0.37 0.00 -0.50 0.00 0.00 54.79 50.61 2duw n ASP 23 Cb 0.00 -1.09 -0.07 0.00 -1.14 0.00 0.00 41.12 38.83 2duw n ASP 23 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 2duw s LYS 24 N -2.37 3.17 0.00 0.11 -0.14 -1.26 -4.88 119.74 114.37 2duw s LYS 24 Ca 0.47 -3.03 0.15 0.00 -1.36 0.00 0.00 55.97 52.19 2duw s LYS 24 Cb 0.35 -3.96 0.73 0.00 -1.68 0.00 0.00 37.83 33.26 2duw s LYS 24 CO -0.09 -1.24 1.41 -0.35 -0.76 0.00 0.00 175.35 174.32 2duw n PRO 25 N 2.75 0.18 -0.95 -1.68 -0.04 -1.26 -2.50 135.00 131.50 2duw n PRO 25 Ca 0.18 0.16 -0.07 0.00 -0.04 0.00 0.00 63.50 63.73 2duw n PRO 25 Cb 0.38 -1.50 0.27 0.00 -0.04 0.00 0.00 33.50 32.61 2duw n PRO 25 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2duw n ASP 26 N -1.31 4.51 -4.30 3.54 2.03 -1.26 -4.68 116.55 115.07 2duw n ASP 26 Ca 0.07 -3.13 -0.16 0.00 0.52 0.00 0.00 54.79 52.08 2duw n ASP 26 Cb 0.12 -0.73 -0.10 0.00 -0.72 0.00 0.00 41.12 39.69 2duw n ASP 26 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2duw s ARG 27 N -2.77 1.21 0.36 -0.67 1.81 -1.04 -5.03 118.95 112.82 2duw s ARG 27 Ca 0.50 -1.53 0.27 0.00 -1.72 0.00 0.00 55.73 53.25 2duw s ARG 27 Cb 0.40 -0.89 1.14 0.00 -0.45 0.00 0.00 34.95 35.15 2duw s ARG 27 CO 0.12 0.13 1.81 -1.00 -0.68 0.00 0.00 175.30 175.69 2duw h PRO 28 N 2.66 0.00 0.00 3.54 0.13 -1.91 -2.65 132.00 133.77 2duw h PRO 28 Ca -0.37 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.64 2duw h PRO 28 Cb 1.21 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.32 2duw h PRO 28 CO 0.63 0.00 -0.56 0.66 -0.23 0.00 0.00 178.00 178.49 2duw h SER 29 N 0.00 0.00 0.03 1.44 4.64 -1.89 -3.05 113.55 114.72 2duw h SER 29 Ca 0.00 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.10 2duw h SER 29 Cb 0.40 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.47 2duw h SER 29 CO 0.00 0.56 -1.16 0.22 -0.87 0.00 0.00 176.83 175.59 2duw h TYR 30 N 0.00 0.13 -0.77 4.77 5.03 -1.68 -3.19 116.97 121.25 2duw h TYR 30 Ca -0.01 -0.09 0.17 0.00 2.58 0.00 0.00 58.73 61.38 2duw h TYR 30 Cb 1.27 -0.01 -0.05 0.00 1.55 0.00 0.00 36.73 39.49 2duw h TYR 30 CO 0.00 1.45 0.52 0.07 -1.32 0.00 0.00 178.16 178.88 2duw h ARG 31 N -0.78 0.34 0.02 1.82 0.11 -1.61 0.95 114.38 115.24 2duw h ARG 31 Ca -0.29 -0.02 -0.21 0.00 0.10 0.00 0.00 59.98 59.56 2duw h ARG 31 Cb 1.41 -0.08 -0.01 0.00 1.11 0.00 0.00 29.97 32.40 2duw h ARG 31 CO -0.10 0.23 -0.94 -0.24 0.10 0.00 0.00 179.97 179.02 2duw h VAL 32 N 0.35 1.54 0.65 0.08 3.04 -1.68 -2.61 116.25 117.63 2duw h VAL 32 Ca 0.38 -2.83 -0.03 0.00 -1.01 0.00 0.00 66.70 63.21 2duw h VAL 32 Cb 0.98 2.60 0.01 0.00 -2.01 0.00 0.00 31.29 32.86 2duw h VAL 32 CO -0.11 0.82 -0.31 -0.03 -1.01 0.00 0.00 177.57 176.92 2duw h MET 33 N 0.07 -0.84 0.00 4.17 1.85 -0.81 -2.31 114.93 117.06 2duw h MET 33 Ca -0.05 0.06 -0.01 0.00 -0.61 0.00 0.00 59.70 59.09 2duw h MET 33 Cb 1.60 0.19 -0.00 0.00 0.43 0.00 0.00 31.60 33.82 2duw h MET 33 CO 0.14 -0.56 -0.06 -0.22 -0.40 0.00 0.00 176.91 175.81 2duw h LYS 34 N -0.97 0.00 0.08 0.39 3.64 -1.55 -2.34 116.57 115.81 2duw h LYS 34 Ca -0.09 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.29 2duw h LYS 34 Cb 0.67 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.49 2duw h LYS 34 CO 0.15 0.06 -0.04 -0.92 -2.27 0.00 0.00 179.45 176.43 2duw h TYR 35 N 0.00 -0.09 -0.49 1.91 3.20 -1.31 0.24 116.97 120.44 2duw h TYR 35 Ca -0.00 -0.00 -0.10 0.00 3.14 0.00 0.00 58.73 61.77 2duw h TYR 35 Cb 0.14 0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.43 2duw h TYR 35 CO 0.00 0.05 -0.09 -0.07 -1.64 0.00 0.00 178.16 176.41 2duw h LEU 36 N -0.22 0.92 -0.25 2.82 3.38 -1.07 -1.57 115.31 119.31 2duw h LEU 36 Ca -0.01 -0.35 -0.02 0.00 0.09 0.00 0.00 57.88 57.59 2duw h LEU 36 Cb 0.19 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 2duw h LEU 36 CO 0.02 1.06 0.09 -0.07 0.09 0.00 0.00 178.44 179.63 2duw h LEU 37 N 0.77 0.36 0.49 1.67 3.38 -1.34 0.28 115.31 120.92 2duw h LEU 37 Ca 0.13 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 2duw h LEU 37 Cb 0.64 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.30 2duw h LEU 37 CO 0.04 0.45 -0.23 -0.78 0.09 0.00 0.00 178.44 178.01 2duw h ASP 38 N 0.25 -0.55 -0.17 -0.43 3.58 -0.47 -2.36 116.42 116.26 2duw h ASP 38 Ca 0.08 -0.01 0.05 0.00 0.42 0.00 0.00 57.03 57.57 2duw h ASP 38 Cb 0.21 0.14 -0.01 0.00 1.72 0.00 0.00 39.33 41.39 2duw h ASP 38 CO -0.00 -0.35 0.21 1.56 -2.88 0.00 0.00 179.24 177.77 2duw h GLN 39 N -0.71 0.00 0.00 0.28 1.08 -1.28 -3.45 115.11 111.02 2duw h GLN 39 Ca -0.07 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.13 2duw h GLN 39 Cb 0.53 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.96 2duw h GLN 39 CO 0.11 0.00 0.00 0.41 -0.95 0.00 0.00 178.83 178.40 2duw n GLY 40 N -1.38 0.77 3.17 3.46 0.00 -0.56 -5.09 105.19 105.56 2duw n GLY 40 Ca 0.01 -0.74 -0.10 0.00 0.00 0.00 0.00 46.02 45.20 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 -1.52 0.79 -0.34 1.61 1.51 0.89 -4.98 117.35 115.30 2duw s TYR 41 Ca 0.00 -1.17 -0.20 0.00 -1.01 0.00 0.00 57.07 54.70 2duw s TYR 41 Cb 0.00 -0.42 -0.00 0.00 -0.11 0.00 0.00 41.96 41.42 2duw s TYR 41 CO 0.00 -0.54 0.60 -1.01 -1.11 0.00 0.00 175.55 173.49 2duw s HIS 42 N -4.03 3.17 -0.07 2.71 3.76 -1.26 -4.37 115.29 115.19 2duw s HIS 42 Ca 0.22 0.36 0.02 0.00 -0.15 0.00 0.00 55.06 55.51 2duw s HIS 42 Cb 0.07 -3.04 -0.03 0.00 1.11 0.00 0.00 32.58 30.70 2duw s HIS 42 CO 0.01 -0.56 -0.10 0.08 -0.85 0.00 0.00 174.74 173.31 2duw s VAL 43 N 2.59 3.37 -0.53 -0.90 1.01 -1.26 -1.18 120.40 123.51 2duw s VAL 43 Ca 0.23 -0.59 0.06 0.00 0.00 0.00 0.00 61.98 61.67 2duw s VAL 43 Cb -0.15 -2.37 0.20 0.00 0.00 0.00 0.00 36.38 34.07 2duw s VAL 43 CO 0.14 0.58 0.50 -0.38 0.00 0.00 0.00 175.10 175.94 2duw n ILE 44 N 2.51 0.37 -2.24 2.22 5.41 0.26 -4.90 119.36 122.99 2duw n ILE 44 Ca -0.18 -4.30 -0.41 0.00 1.00 0.00 0.00 62.75 58.87 2duw n ILE 44 Cb 0.53 -1.95 -0.03 0.00 -0.71 0.00 0.00 39.64 37.47 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 -1.14 4.44 -0.08 0.38 0.04 -1.26 -2.09 135.00 135.30 2duw s PRO 45 Ca 0.33 2.06 -0.00 0.00 0.04 0.00 0.00 61.00 63.42 2duw s PRO 45 Cb 0.07 -3.15 0.03 0.00 0.04 0.00 0.00 34.50 31.49 2duw s PRO 45 CO -0.13 -0.12 -0.03 0.08 0.04 0.00 0.00 177.00 176.84 2duw s VAL 46 N -0.68 0.61 0.02 -0.36 1.01 0.51 -4.06 120.40 117.45 2duw s VAL 46 Ca 0.51 -0.06 -0.10 0.00 0.00 0.00 0.00 61.98 62.33 2duw s VAL 46 Cb -0.37 -0.69 0.01 0.00 0.00 0.00 0.00 36.38 35.32 2duw s VAL 46 CO 0.45 0.29 0.19 -0.55 0.00 0.00 0.00 175.10 175.47 2duw s SER 47 N 1.63 -0.00 0.00 3.32 0.15 0.97 -0.91 113.70 118.85 2duw s SER 47 Ca 0.01 -0.24 0.14 0.00 0.70 0.00 0.00 55.95 56.56 2duw s SER 47 Cb -0.13 0.26 0.65 0.00 -1.71 0.00 0.00 66.02 65.09 2duw s SER 47 CO -0.05 -0.47 1.44 -0.81 1.20 0.00 0.00 173.24 174.55 2duw n PRO 48 N 1.05 0.07 -0.08 5.44 -0.04 -1.25 -2.32 135.00 137.86 2duw n PRO 48 Ca -0.21 0.22 -0.09 0.00 -0.04 0.00 0.00 63.50 63.38 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 -1.43 1.28 0.00 0.54 3.00 -1.26 -4.40 118.16 115.89 2duw n LYS 49 Ca 0.05 0.03 0.15 0.00 -0.00 0.00 0.00 58.31 58.53 2duw n LYS 49 Cb 0.15 -1.37 0.77 0.00 0.00 0.00 0.00 35.03 34.59 2duw n LYS 49 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.40 178.73 2duw n VAL 50 N -2.69 0.00 -1.54 3.15 0.24 -1.12 -4.80 118.33 111.57 2duw n VAL 50 Ca -0.26 0.00 -0.38 0.00 -2.04 0.00 0.00 64.34 61.66 2duw n VAL 50 Cb 0.92 -0.50 -0.06 0.00 -1.47 0.00 0.00 33.84 32.73 2duw n VAL 50 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2duw n ALA 51 N -1.27 0.73 0.00 2.33 0.00 -0.98 -0.09 120.51 121.23 2duw n ALA 51 Ca 0.15 -0.75 0.00 0.00 0.00 0.00 0.00 53.44 52.84 2duw n ALA 51 Cb 0.23 -2.98 0.00 0.00 0.00 0.00 0.00 19.45 16.70 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 6.13 1.04 3.49 0.00 0.00 -1.26 -4.84 105.19 109.76 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 -0.03 1.90 -0.12 1.61 1.02 0.88 -4.98 119.74 120.01 2duw s LYS 53 Ca 0.00 -2.15 0.01 0.00 0.02 0.00 0.00 55.97 53.85 2duw s LYS 53 Cb 0.00 -0.54 0.02 0.00 -0.52 0.00 0.00 37.83 36.78 2duw s LYS 53 CO 0.00 -0.48 -0.15 0.95 -0.92 0.00 0.00 175.35 174.75 2duw s THR 54 N -3.24 1.56 -0.31 2.17 -4.23 -1.26 -0.10 115.64 110.23 2duw s THR 54 Ca 0.25 -0.67 -0.02 0.00 -1.18 0.00 0.00 61.69 60.08 2duw s THR 54 Cb 0.03 -1.44 0.06 0.00 1.34 0.00 0.00 72.50 72.49 2duw s THR 54 CO 0.15 0.46 0.02 -0.76 -0.54 0.00 0.00 174.62 173.95 2duw s LEU 55 N 1.13 4.05 -2.04 4.79 1.43 0.13 -4.61 118.68 123.56 2duw s LEU 55 Ca -0.03 -1.35 0.00 0.00 -1.03 0.00 0.00 54.13 51.72 2duw s LEU 55 Cb -0.14 -1.73 0.00 0.00 0.03 0.00 0.00 46.19 44.35 2duw s LEU 55 CO -0.04 -0.29 0.00 0.18 0.23 0.00 0.00 176.35 176.42 2duw n LEU 56 N 4.62 -1.53 0.00 1.79 4.32 -1.26 -0.48 117.00 124.46 2duw n LEU 56 Ca -0.12 0.40 0.00 0.00 -0.02 0.00 0.00 56.01 56.28 2duw n LEU 56 Cb 0.43 -2.78 0.00 0.00 -1.62 0.00 0.00 43.42 39.45 2duw n LEU 56 CO 0.27 -0.89 0.00 0.61 -1.22 0.00 0.00 177.39 176.16 2duw n GLY 57 N -0.49 0.58 3.80 -0.72 0.00 -1.26 -5.07 105.19 102.03 2duw n GLY 57 Ca -0.21 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.45 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 -0.97 3.91 -0.16 1.61 1.11 0.37 -5.05 119.66 120.48 2duw s GLN 58 Ca 0.00 0.07 -0.29 0.00 0.01 0.00 0.00 55.36 55.15 2duw s GLN 58 Cb 0.00 -3.30 -0.02 0.00 -1.01 0.00 0.00 33.01 28.68 2duw s GLN 58 CO 0.00 0.53 1.37 -1.14 0.01 0.00 0.00 175.29 176.06 2duw s GLN 59 N -0.40 4.16 0.84 2.91 2.00 -1.26 -0.69 119.66 127.22 2duw s GLN 59 Ca 0.17 1.72 -0.11 0.00 -2.00 0.00 0.00 55.36 55.14 2duw s GLN 59 Cb -0.13 -3.84 0.10 0.00 0.80 0.00 0.00 33.01 29.93 2duw s GLN 59 CO 0.06 -0.82 1.09 0.20 -0.50 0.00 0.00 175.29 175.31 2duw s GLY 60 N 2.50 1.64 -0.20 2.59 0.00 0.86 -4.73 107.32 109.97 2duw s GLY 60 Ca 0.60 0.03 -0.16 0.00 0.00 0.00 0.00 44.72 45.18 2duw s GLY 60 CO 0.19 0.46 0.52 -0.19 0.00 0.00 0.00 173.10 174.09 2duw s TYR 61 N -2.95 -0.65 0.34 1.90 2.02 -1.25 -4.00 117.35 112.77 2duw s TYR 61 Ca 0.62 1.48 0.22 0.00 -0.37 0.00 0.00 57.07 59.03 2duw s TYR 61 Cb -0.17 0.27 1.11 0.00 -0.40 0.00 0.00 41.96 42.76 2duw s TYR 61 CO 0.56 -0.33 1.94 0.00 -1.57 0.00 0.00 175.55 176.16 2duw h ALA 62 N 5.92 1.25 -2.18 3.71 0.00 -1.87 0.28 119.26 126.37 2duw h ALA 62 Ca -0.30 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.40 2duw h ALA 62 Cb 1.18 -0.04 -0.18 0.00 0.00 0.00 0.00 17.79 18.76 2duw h ALA 62 CO 0.20 0.28 0.29 -0.08 0.00 0.00 0.00 179.25 179.94 2duw s THR 63 N -4.07 0.00 -0.24 0.00 -1.32 -1.26 -3.94 115.64 104.81 2duw s THR 63 Ca -0.02 0.00 0.25 0.00 -1.21 0.00 0.00 61.69 60.71 2duw s THR 63 Cb 0.13 -1.00 0.26 0.00 -1.51 0.00 0.00 72.50 70.37 2duw s THR 63 CO 0.64 0.00 1.75 0.17 -2.21 0.00 0.00 174.62 174.97 2duw h LEU 64 N 2.58 0.00 -1.76 9.08 -0.00 -1.94 -0.88 115.31 122.39 2duw h LEU 64 Ca -0.26 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.62 2duw h LEU 64 Cb 1.19 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.85 2duw h LEU 64 CO 0.36 0.00 0.00 0.00 -0.00 0.00 0.00 178.44 178.80 2duw n ALA 65 N -1.82 2.64 -0.00 0.17 0.00 -1.26 -3.72 120.51 116.52 2duw n ALA 65 Ca 0.00 -0.82 0.03 0.00 0.00 0.00 0.00 53.44 52.66 2duw n ALA 65 Cb 0.13 -0.99 -0.05 0.00 0.00 0.00 0.00 19.45 18.54 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 0.64 3.38 -4.74 0.00 2.03 -0.34 -5.00 116.55 112.53 2duw n ASP 66 Ca 0.14 -0.01 -0.40 0.00 0.52 0.00 0.00 54.79 55.05 2duw n ASP 66 Cb 0.46 1.32 -0.05 0.00 -0.72 0.00 0.00 41.12 42.13 2duw n ASP 66 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2duw s VAL 67 N -2.48 4.80 0.11 5.18 0.11 -1.24 -4.98 120.40 121.90 2duw s VAL 67 Ca -0.03 1.64 -0.14 0.00 -2.93 0.00 0.00 61.98 60.53 2duw s VAL 67 Cb 0.04 -4.12 -0.08 0.00 -1.53 0.00 0.00 36.38 30.69 2duw s VAL 67 CO 0.29 0.32 1.43 1.55 -3.33 0.00 0.00 175.10 175.36 2duw h PRO 68 N 5.98 0.75 -6.97 1.54 0.13 -1.94 -3.45 132.00 128.05 2duw h PRO 68 Ca -0.43 -0.40 -0.53 0.00 -0.87 0.00 0.00 66.00 63.77 2duw h PRO 68 Cb 1.20 0.01 0.09 0.00 0.13 0.00 0.00 31.00 32.44 2duw h PRO 68 CO 0.72 1.02 0.60 -2.00 -0.23 0.00 0.00 178.00 178.11 2duw s GLU 69 N -4.37 3.78 -0.21 0.86 2.12 -1.26 -5.00 118.70 114.61 2duw s GLU 69 Ca -0.12 2.14 -0.09 0.00 0.36 0.00 0.00 54.97 57.25 2duw s GLU 69 Cb 0.09 -2.62 -0.05 0.00 0.26 0.00 0.00 34.13 31.82 2duw s GLU 69 CO 0.84 -0.64 0.12 0.15 -0.54 0.00 0.00 175.26 175.19 2duw s LYS 70 N -2.43 4.03 0.32 4.30 1.02 -1.26 -5.08 119.74 120.63 2duw s LYS 70 Ca 0.60 -0.30 -0.26 0.00 0.02 0.00 0.00 55.97 56.04 2duw s LYS 70 Cb -0.37 -3.39 -0.10 0.00 -0.52 0.00 0.00 37.83 33.44 2duw s LYS 70 CO 0.47 0.15 0.94 0.54 -0.92 0.00 0.00 175.35 176.54 2duw s VAL 71 N 0.75 4.22 -0.13 3.17 0.11 -1.26 -4.98 120.40 122.28 2duw s VAL 71 Ca 0.06 1.81 0.15 0.00 -2.93 0.00 0.00 61.98 61.07 2duw s VAL 71 Cb -0.13 -4.00 -0.24 0.00 -1.53 0.00 0.00 36.38 30.48 2duw s VAL 71 CO 0.02 0.14 0.32 0.47 -3.33 0.00 0.00 175.10 172.72 2duw n ASP 72 N 0.55 0.42 -3.67 3.54 9.92 -1.26 -4.51 116.55 121.54 2duw n ASP 72 Ca 0.02 0.18 -0.21 0.00 -0.53 0.00 0.00 54.79 54.25 2duw n ASP 72 Cb 0.50 0.51 -0.18 0.00 -0.64 0.00 0.00 41.12 41.31 2duw n ASP 72 CO 0.00 0.00 0.00 -0.32 0.13 0.00 0.00 177.20 177.01 2duw s MET 73 N -2.54 -0.02 -0.25 -1.24 1.75 -1.10 -2.91 119.30 112.99 2duw s MET 73 Ca -0.08 0.31 -0.10 0.00 -1.25 0.00 0.00 55.69 54.56 2duw s MET 73 Cb 0.07 -0.70 -0.05 0.00 2.84 0.00 0.00 34.83 36.99 2duw s MET 73 CO 0.82 -0.37 0.16 0.08 -0.65 0.00 0.00 175.02 175.07 2duw s VAL 74 N 2.15 5.28 -0.07 10.11 1.01 -0.89 -1.53 120.40 136.46 2duw s VAL 74 Ca 0.05 0.15 -0.02 0.00 0.00 0.00 0.00 61.98 62.16 2duw s VAL 74 Cb -0.13 -3.48 -0.03 0.00 0.00 0.00 0.00 36.38 32.74 2duw s VAL 74 CO -0.04 0.32 0.02 -1.81 0.00 0.00 0.00 175.10 173.60 2duw s ASP 75 N 1.27 5.39 -0.19 3.32 1.01 -0.34 -0.18 116.67 126.96 2duw s ASP 75 Ca 0.07 0.16 0.01 0.00 0.71 0.00 0.00 52.55 53.51 2duw s ASP 75 Cb -0.14 -1.54 0.03 0.00 1.01 0.00 0.00 42.92 42.28 2duw s ASP 75 CO 0.06 0.36 -0.14 -0.69 0.21 0.00 0.00 175.17 174.97 2duw s VAL 76 N -0.95 1.87 -0.02 -1.27 1.01 0.88 -4.01 120.40 117.91 2duw s VAL 76 Ca 0.15 -1.03 0.00 0.00 0.00 0.00 0.00 61.98 61.10 2duw s VAL 76 Cb -0.11 -1.83 -0.00 0.00 0.00 0.00 0.00 36.38 34.44 2duw s VAL 76 CO 0.04 0.31 0.02 0.49 0.00 0.00 0.00 175.10 175.97 2duw n PHE 77 N 4.63 0.00 0.08 5.22 3.01 -1.26 -3.59 117.46 125.55 2duw n PHE 77 Ca -0.17 0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.19 2duw n PHE 77 Cb 0.48 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.89 2duw n PHE 77 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2duw h ARG 78 N 0.00 -0.43 -1.94 -1.08 3.08 -1.92 -3.43 114.38 108.67 2duw h ARG 78 Ca 0.00 0.03 0.33 0.00 0.07 0.00 0.00 59.98 60.41 2duw h ARG 78 Cb 0.01 0.10 -0.08 0.00 0.08 0.00 0.00 29.97 30.07 2duw h ARG 78 CO 0.00 -0.29 0.88 1.21 -1.07 0.00 0.00 179.97 180.70 2duw s ASN 79 N -3.65 -0.01 0.01 7.04 3.84 -1.26 -5.00 114.94 115.91 2duw s ASN 79 Ca -0.09 -0.20 -0.25 0.00 0.21 0.00 0.00 52.86 52.53 2duw s ASN 79 Cb 0.03 0.16 -0.16 0.00 -0.55 0.00 0.00 41.25 40.73 2duw s ASN 79 CO 0.34 -0.31 1.19 0.77 -2.79 0.00 0.00 177.10 176.30 2duw h SER 80 N 2.00 -0.44 -0.23 -4.21 4.64 -1.96 -2.65 113.55 110.70 2duw h SER 80 Ca -0.25 -0.13 0.07 0.00 -0.47 0.00 0.00 61.79 61.01 2duw h SER 80 Cb 1.19 0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 63.38 2duw h SER 80 CO 0.31 -0.07 0.20 -0.33 -0.87 0.00 0.00 176.83 176.07 2duw h GLU 81 N -0.86 0.00 -0.15 4.77 5.08 -2.01 -0.14 114.58 121.26 2duw h GLU 81 Ca -0.05 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.17 2duw h GLU 81 Cb 0.54 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 2duw h GLU 81 CO 0.09 0.00 -0.50 0.00 -1.00 0.00 0.00 179.01 177.60 2duw h ALA 82 N 1.82 0.85 -0.94 3.43 0.00 -1.91 -3.06 119.26 119.45 2duw h ALA 82 Ca 0.11 -0.48 0.20 0.00 0.00 0.00 0.00 54.91 54.73 2duw h ALA 82 Cb 0.50 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 18.12 2duw h ALA 82 CO -0.00 0.67 0.61 0.00 0.00 0.00 0.00 179.25 180.52 2duw h ALA 83 N 1.13 2.05 0.20 0.00 0.00 -0.65 0.20 119.26 122.19 2duw h ALA 83 Ca 0.01 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2duw h ALA 83 Cb 1.00 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2duw h ALA 83 CO 0.09 -0.36 -0.10 2.35 0.00 0.00 0.00 179.25 181.23 2duw h TRP 84 N 0.52 -0.25 -0.27 0.00 2.91 -1.61 0.22 115.95 117.46 2duw h TRP 84 Ca 0.50 -0.01 -0.02 0.00 1.13 0.00 0.00 58.89 60.49 2duw h TRP 84 Cb 1.09 0.08 -0.01 0.00 -0.51 0.00 0.00 29.16 29.81 2duw h TRP 84 CO -0.00 0.12 0.07 0.78 -1.03 0.00 0.00 178.44 178.38 2duw h GLY 85 N -0.70 0.40 1.50 2.65 0.00 -1.39 -1.97 103.07 103.57 2duw h GLY 85 Ca -0.03 -0.19 -0.29 0.00 0.00 0.00 0.00 47.33 46.82 2duw h GLY 85 CO 0.05 0.18 -1.27 -2.08 0.00 0.00 0.00 176.54 173.42 2duw h VAL 86 N 0.38 1.42 -0.07 4.60 2.07 -0.63 -3.15 116.25 120.85 2duw h VAL 86 Ca 0.09 -2.86 -0.00 0.00 0.82 0.00 0.00 66.70 64.75 2duw h VAL 86 Cb 0.14 2.89 -0.00 0.00 -1.52 0.00 0.00 31.29 32.80 2duw h VAL 86 CO -0.00 0.84 0.04 0.00 0.02 0.00 0.00 177.57 178.47 2duw h ALA 87 N 0.47 0.09 -0.71 1.67 0.00 -0.20 -1.01 119.26 119.59 2duw h ALA 87 Ca -0.16 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.73 2duw h ALA 87 Cb 1.97 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 19.69 2duw h ALA 87 CO 0.22 -0.36 0.43 -0.56 0.00 0.00 0.00 179.25 178.98 2duw h GLN 88 N 0.01 0.79 -0.22 0.00 3.07 -1.48 -0.49 115.11 116.79 2duw h GLN 88 Ca 0.03 -0.05 -0.01 0.00 0.09 0.00 0.00 58.65 58.71 2duw h GLN 88 Cb 0.10 -0.18 -0.01 0.00 0.08 0.00 0.00 27.48 27.47 2duw h GLN 88 CO -0.00 0.52 0.10 0.93 0.09 0.00 0.00 178.83 180.47 2duw h GLU 89 N 0.81 0.32 -0.02 0.06 4.39 -1.47 -1.06 114.58 117.62 2duw h GLU 89 Ca 0.30 -0.05 0.01 0.00 0.34 0.00 0.00 59.36 59.95 2duw h GLU 89 Cb 0.09 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.67 2duw h GLU 89 CO -0.14 0.36 -0.02 0.00 -1.16 0.00 0.00 179.01 178.05 2duw h ALA 90 N 0.95 -0.01 0.00 3.43 0.00 -0.78 -1.91 119.26 120.95 2duw h ALA 90 Ca 0.08 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2duw h ALA 90 Cb 0.14 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 2duw h ALA 90 CO -0.01 -0.51 -0.07 0.82 0.00 0.00 0.00 179.25 179.48 2duw h ILE 91 N -0.03 0.85 0.05 0.00 2.04 -1.02 0.29 117.51 119.69 2duw h ILE 91 Ca 0.02 -0.25 -0.00 0.00 1.00 0.00 0.00 64.86 65.62 2duw h ILE 91 Cb 0.05 1.14 0.00 0.00 -0.74 0.00 0.00 36.82 37.28 2duw h ILE 91 CO -0.04 0.07 -0.03 0.00 0.00 0.00 0.00 178.15 178.16 2duw h ALA 92 N 1.93 -0.07 0.00 1.87 0.00 -0.43 -3.10 119.26 119.47 2duw h ALA 92 Ca -0.00 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 2duw h ALA 92 Cb 0.14 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2duw h ALA 92 CO 0.01 -0.37 -0.35 -0.84 0.00 0.00 0.00 179.25 177.70 2duw h ILE 93 N -0.41 0.80 0.00 0.00 3.07 -1.10 -3.47 117.51 116.40 2duw h ILE 93 Ca -0.01 -1.46 0.00 0.00 1.55 0.00 0.00 64.86 64.94 2duw h ILE 93 Cb 0.37 1.92 0.00 0.00 -0.27 0.00 0.00 36.82 38.83 2duw h ILE 93 CO 0.01 0.34 0.00 0.61 -1.05 0.00 0.00 178.15 178.06 2duw n GLY 94 N 0.27 0.74 2.05 0.16 0.00 -0.17 -5.12 105.19 103.12 2duw n GLY 94 Ca -0.00 -0.22 -0.20 0.00 0.00 0.00 0.00 46.02 45.60 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 -3.37 0.00 4.61 0.00 0.85 -4.98 120.51 117.62 2duw n ALA 95 Ca 0.00 -0.99 0.00 0.00 0.00 0.00 0.00 53.44 52.45 2duw n ALA 95 Cb 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 19.45 19.36 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 -4.45 0.00 -4.05 0.00 5.02 -1.26 -4.95 118.16 108.46 2duw n LYS 96 Ca 0.09 0.00 -0.08 0.00 -2.02 0.00 0.00 58.31 56.30 2duw n LYS 96 Cb 0.39 -0.57 -0.10 0.00 -0.02 0.00 0.00 35.03 34.73 2duw n LYS 96 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2duw s THR 97 N -1.37 0.19 -0.01 -0.18 2.01 -1.14 -3.40 115.64 111.74 2duw s THR 97 Ca 0.00 -1.61 0.00 0.00 0.31 0.00 0.00 61.69 60.40 2duw s THR 97 Cb 0.00 -1.29 0.02 0.00 0.01 0.00 0.00 72.50 71.24 2duw s THR 97 CO 0.00 -0.89 0.02 -0.22 -0.69 0.00 0.00 174.62 172.84 2duw s LEU 98 N -2.66 1.45 -0.02 4.42 2.96 0.02 -2.09 118.68 122.76 2duw s LEU 98 Ca 0.03 0.02 0.03 0.00 -0.22 0.00 0.00 54.13 53.99 2duw s LEU 98 Cb 0.05 -0.05 -0.00 0.00 0.50 0.00 0.00 46.19 46.69 2duw s LEU 98 CO -0.08 -0.08 -0.11 0.86 -1.32 0.00 0.00 176.35 175.62 2duw s TRP 99 N 0.64 1.08 0.00 5.38 -0.11 0.75 -1.13 118.94 125.55 2duw s TRP 99 Ca -0.05 -0.24 0.00 0.00 1.22 0.00 0.00 56.10 57.03 2duw s TRP 99 Cb -0.08 -0.72 0.00 0.00 -1.50 0.00 0.00 33.47 31.17 2duw s TRP 99 CO -0.02 -0.06 0.00 1.28 -4.62 0.00 0.00 176.95 173.53 2duw n LEU 100 N 3.00 0.00 -4.81 5.86 4.77 -0.71 -0.09 117.00 125.03 2duw n LEU 100 Ca -0.16 0.00 -0.36 0.00 -0.03 0.00 0.00 56.01 55.46 2duw n LEU 100 Cb 0.55 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.58 2duw n LEU 100 CO 0.25 -0.11 0.49 -1.10 -1.33 0.00 0.00 177.39 175.59 2duw s GLN 101 N -1.85 4.32 0.15 3.23 -1.52 -1.24 -4.36 119.66 118.40 2duw s GLN 101 Ca 0.00 0.99 -0.30 0.00 -1.95 0.00 0.00 55.36 54.09 2duw s GLN 101 Cb 0.00 -2.79 -0.08 0.00 -0.22 0.00 0.00 33.01 29.92 2duw s GLN 101 CO 0.00 0.33 1.30 -1.17 -0.25 0.00 0.00 175.29 175.49 2duw s LEU 102 N -2.13 4.40 0.00 2.90 2.96 -1.24 -2.78 118.68 122.79 2duw s LEU 102 Ca 0.47 2.30 0.00 0.00 -0.22 0.00 0.00 54.13 56.67 2duw s LEU 102 Cb -0.16 -3.60 0.00 0.00 0.50 0.00 0.00 46.19 42.93 2duw s LEU 102 CO 0.21 -0.53 0.00 0.61 -1.32 0.00 0.00 176.35 175.32 2duw n GLY 103 N 2.80 3.47 3.88 7.98 0.00 -1.26 -4.83 105.19 117.24 2duw n GLY 103 Ca 0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.94 5.21 -0.12 1.61 1.01 -1.12 -4.94 120.40 119.11 2duw s VAL 104 Ca 0.00 0.18 -0.01 0.00 0.00 0.00 0.00 61.98 62.15 2duw s VAL 104 Cb 0.00 -3.61 0.03 0.00 0.00 0.00 0.00 36.38 32.80 2duw s VAL 104 CO 0.00 0.24 -0.04 -0.63 0.00 0.00 0.00 175.10 174.67 2duw s ILE 105 N -1.44 0.78 -0.44 2.22 1.01 -1.26 -1.76 121.20 120.31 2duw s ILE 105 Ca 0.33 -0.25 0.03 0.00 0.00 0.00 0.00 60.65 60.76 2duw s ILE 105 Cb -0.13 -0.92 0.12 0.00 0.01 0.00 0.00 42.46 41.53 2duw s ILE 105 CO 0.20 0.23 0.17 0.20 0.00 0.00 0.00 174.94 175.74 2duw s ASN 106 N 1.79 4.70 0.31 3.58 -0.87 -1.26 -4.95 114.94 118.25 2duw s ASN 106 Ca 0.04 -2.51 0.03 0.00 -1.57 0.00 0.00 52.86 48.85 2duw s ASN 106 Cb -0.13 -1.67 0.52 0.00 -0.02 0.00 0.00 41.25 39.94 2duw s ASN 106 CO -0.07 -0.34 1.82 -0.08 -2.57 0.00 0.00 177.10 175.85 2duw h GLU 107 N 7.21 0.53 -0.05 -0.60 4.57 -1.98 0.59 114.58 124.86 2duw h GLU 107 Ca -0.06 -0.14 -0.01 0.00 -1.18 0.00 0.00 59.36 57.97 2duw h GLU 107 Cb 0.97 -0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 29.50 2duw h GLU 107 CO 0.62 0.62 -0.02 1.96 -1.18 0.00 0.00 179.01 181.01 2duw h GLN 108 N 0.50 0.10 0.00 1.92 4.20 -2.00 -1.99 115.11 117.84 2duw h GLN 108 Ca 0.10 -0.04 -0.06 0.00 0.06 0.00 0.00 58.65 58.71 2duw h GLN 108 Cb 0.44 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.21 2duw h GLN 108 CO 0.02 0.46 -0.27 0.00 -0.67 0.00 0.00 178.83 178.37 2duw h ALA 109 N 0.63 1.08 0.10 3.87 0.00 -1.89 -1.51 119.26 121.54 2duw h ALA 109 Ca 0.01 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 2duw h ALA 109 Cb 0.43 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2duw h ALA 109 CO 0.01 0.34 -0.05 0.00 0.00 0.00 0.00 179.25 179.55 2duw h ALA 110 N 1.73 -0.14 -0.12 0.00 0.00 -0.77 -3.22 119.26 116.74 2duw h ALA 110 Ca -0.00 -0.24 -0.11 0.00 0.00 0.00 0.00 54.91 54.56 2duw h ALA 110 Cb 0.73 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 2duw h ALA 110 CO 0.04 -0.32 -0.43 -0.24 0.00 0.00 0.00 179.25 178.30 2duw h VAL 111 N -0.66 1.32 -0.42 0.00 3.04 -1.35 -2.82 116.25 115.35 2duw h VAL 111 Ca -0.01 -1.59 0.12 0.00 -1.01 0.00 0.00 66.70 64.21 2duw h VAL 111 Cb 0.52 1.71 -0.02 0.00 -2.01 0.00 0.00 31.29 31.49 2duw h VAL 111 CO 0.02 0.48 0.36 0.25 -1.01 0.00 0.00 177.57 177.67 2duw h LEU 112 N 0.23 0.00 0.08 3.16 5.85 -1.31 -0.23 115.31 123.09 2duw h LEU 112 Ca 0.02 0.00 -0.31 0.00 0.84 0.00 0.00 57.88 58.42 2duw h LEU 112 Cb 0.86 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.87 2duw h LEU 112 CO 0.07 0.00 -1.69 0.00 -0.34 0.00 0.00 178.44 176.48 2duw h ALA 113 N 1.67 0.46 -0.50 1.25 0.00 -1.51 -3.35 119.26 117.28 2duw h ALA 113 Ca 0.20 -1.28 -0.03 0.00 0.00 0.00 0.00 54.91 53.80 2duw h ALA 113 Cb 0.91 0.44 -0.02 0.00 0.00 0.00 0.00 17.79 19.12 2duw h ALA 113 CO -0.00 1.32 0.19 0.00 0.00 0.00 0.00 179.25 180.76 2duw h ARG 114 N 0.05 0.72 -0.28 0.00 2.47 -0.97 0.14 114.38 116.50 2duw h ARG 114 Ca -0.30 -0.10 0.08 0.00 -1.26 0.00 0.00 59.98 58.40 2duw h ARG 114 Cb 2.01 -0.13 -0.01 0.00 -1.65 0.00 0.00 29.97 30.19 2duw h ARG 114 CO 0.12 0.60 0.28 0.93 0.56 0.00 0.00 179.97 182.45 2duw h GLU 115 N 0.71 0.00 0.00 0.04 4.39 -1.43 -1.51 114.58 116.78 2duw h GLU 115 Ca 0.17 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.76 2duw h GLU 115 Cb 0.15 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.78 2duw h GLU 115 CO -0.02 0.00 -1.88 0.00 -1.16 0.00 0.00 179.01 175.96 2duw n ALA 116 N -2.40 2.20 0.00 3.43 0.00 -0.68 -5.00 120.51 118.06 2duw n ALA 116 Ca 0.04 -0.65 0.00 0.00 0.00 0.00 0.00 53.44 52.83 2duw n ALA 116 Cb 0.43 -0.36 0.00 0.00 0.00 0.00 0.00 19.45 19.51 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 1.77 1.10 3.52 0.00 0.00 0.41 -5.08 105.19 106.90 2duw n GLY 117 Ca -0.12 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.52 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 1.91 -4.45 0.99 7.94 -0.63 -4.88 117.00 117.87 2duw n LEU 118 Ca 0.00 0.74 -0.43 0.00 -1.11 0.00 0.00 56.01 55.21 2duw n LEU 118 Cb 0.00 -1.26 -0.04 0.00 0.53 0.00 0.00 43.42 42.65 2duw n LEU 118 CO 0.00 -2.62 0.75 -0.55 -1.11 0.00 0.00 177.39 173.86 2duw s SER 119 N -1.25 6.18 -0.08 1.96 0.15 -1.22 -4.31 113.70 115.13 2duw s SER 119 Ca 0.71 -1.01 -0.17 0.00 0.70 0.00 0.00 55.95 56.19 2duw s SER 119 Cb -0.42 -2.42 -0.05 0.00 -1.71 0.00 0.00 66.02 61.42 2duw s SER 119 CO 0.52 -1.43 0.44 0.54 1.20 0.00 0.00 173.24 174.50 2duw s VAL 120 N 4.03 5.13 -0.22 4.45 0.11 -1.26 -0.80 120.40 131.83 2duw s VAL 120 Ca 0.22 0.88 -0.04 0.00 -2.93 0.00 0.00 61.98 60.11 2duw s VAL 120 Cb -0.17 -3.77 0.08 0.00 -1.53 0.00 0.00 36.38 30.99 2duw s VAL 120 CO 0.10 0.42 0.10 -0.69 -3.33 0.00 0.00 175.10 171.70 2duw s VAL 121 N 0.00 0.02 0.47 2.04 1.01 -0.28 -4.96 120.40 118.70 2duw s VAL 121 Ca 0.24 -0.48 0.05 0.00 0.00 0.00 0.00 61.98 61.79 2duw s VAL 121 Cb -0.16 -0.82 0.05 0.00 0.00 0.00 0.00 36.38 35.46 2duw s VAL 121 CO 0.11 -0.46 0.39 1.15 0.00 0.00 0.00 175.10 176.29 2duw n MET 122 N 5.23 0.78 -3.26 2.72 0.00 -1.26 -1.73 117.12 119.60 2duw n MET 122 Ca -0.07 -2.87 -0.23 0.00 0.00 0.00 0.00 57.70 54.54 2duw n MET 122 Cb 0.46 0.24 0.01 0.00 0.00 0.00 0.00 33.22 33.93 2duw n MET 122 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 175.97 172.50 2duw n ASP 123 N -1.94 -4.32 -3.72 3.17 2.03 -0.72 -4.89 116.55 106.16 2duw n ASP 123 Ca 0.00 -0.35 -0.12 0.00 0.52 0.00 0.00 54.79 54.84 2duw n ASP 123 Cb 0.53 -3.54 -0.10 0.00 -0.72 0.00 0.00 41.12 37.28 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 -5.92 0.45 -0.05 -0.67 6.06 -1.24 -4.18 118.95 113.40 2duw s ARG 124 Ca 0.37 0.67 0.01 0.00 -2.50 0.00 0.00 55.73 54.28 2duw s ARG 124 Cb -0.19 0.13 0.02 0.00 0.06 0.00 0.00 34.95 34.97 2duw s ARG 124 CO 0.46 -0.10 -0.06 0.00 -2.50 0.00 0.00 175.30 173.09 2duw n PRO 126 N 4.06 0.19 -0.11 0.00 -0.04 -1.26 -1.74 135.00 136.09 2duw n PRO 126 Ca -0.23 0.43 -0.09 0.00 -0.04 0.00 0.00 63.50 63.56 2duw n PRO 126 Cb 0.51 -1.87 -0.01 0.00 -0.04 0.00 0.00 33.50 32.09 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 2.26 0.46 0.00 0.55 0.00 -1.99 -1.11 119.26 119.43 2duw h ALA 127 Ca 0.00 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 2duw h ALA 127 Cb 0.35 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 2duw h ALA 127 CO 0.00 0.01 -1.84 -0.89 0.00 0.00 0.00 179.25 176.53 2duw n ILE 128 N -4.74 0.17 -0.04 0.00 5.41 -1.18 -4.34 119.36 114.63 2duw n ILE 128 Ca -0.01 -0.52 -0.14 0.00 1.00 0.00 0.00 62.75 63.08 2duw n ILE 128 Cb 0.10 -0.08 -0.08 0.00 -0.71 0.00 0.00 39.64 38.87 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 0.40 0.00 0.38 4.81 -1.33 -2.70 114.58 116.14 2duw h GLU 129 Ca -0.02 -0.26 0.03 0.00 -0.13 0.00 0.00 59.36 58.97 2duw h GLU 129 Cb 1.05 0.04 -0.05 0.00 0.63 0.00 0.00 28.75 30.42 2duw h GLU 129 CO 0.00 0.87 -0.41 1.25 -0.73 0.00 0.00 179.01 179.99 2duw h LEU 130 N -0.02 -1.25 0.00 1.64 5.85 -1.40 0.61 115.31 120.74 2duw h LEU 130 Ca 0.00 0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.87 2duw h LEU 130 Cb 0.87 0.49 0.00 0.00 0.37 0.00 0.00 40.66 42.39 2duw h LEU 130 CO 0.06 -0.45 0.00 -0.81 -0.34 0.00 0.00 178.44 176.90 2duw n PRO 131 N -5.45 0.27 0.11 5.25 -0.04 -1.25 0.09 135.00 133.99 2duw n PRO 131 Ca -0.06 0.12 -0.17 0.00 -0.04 0.00 0.00 63.50 63.34 2duw n PRO 131 Cb 0.37 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.19 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 0.33 0.00 0.54 0.11 -0.52 -2.59 114.38 112.24 2duw h ARG 132 Ca 0.00 -0.55 -0.12 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 1.26 -1.43 1.28 0.10 0.00 0.00 179.97 181.18 2duw n LEU 133 N -3.57 0.22 0.00 0.08 4.32 -1.08 -4.68 117.00 112.30 2duw n LEU 133 Ca -0.10 -0.00 0.05 0.00 -0.02 0.00 0.00 56.01 55.94 2duw n LEU 133 Cb 1.03 0.12 -0.12 0.00 -1.62 0.00 0.00 43.42 42.84 2duw n LEU 133 CO 0.55 0.19 -0.59 0.61 -1.22 0.00 0.00 177.39 176.94 2duw n GLY 134 N 2.65 -1.13 2.38 -0.72 0.00 0.11 -4.97 105.19 103.51 2duw n GLY 134 Ca -0.11 -0.35 -0.16 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.56 -1.48 -4.26 0.99 -0.00 -0.98 -4.92 117.00 103.79 2duw n LEU 135 Ca -0.10 0.17 -0.33 0.00 -0.00 0.00 0.00 56.01 55.75 2duw n LEU 135 Cb 0.73 -2.35 0.15 0.00 -0.00 0.00 0.00 43.42 41.96 2duw n LEU 135 CO 0.44 -0.47 -0.67 0.00 -0.00 0.00 0.00 177.39 176.69 2duw n ALA 136 N -0.40 -4.20 0.12 1.96 0.00 -1.26 -4.91 120.51 111.82 2duw n ALA 136 Ca -0.18 -1.22 0.01 0.00 0.00 0.00 0.00 53.44 52.05 2duw n ALA 136 Cb 0.59 -1.47 0.06 0.00 0.00 0.00 0.00 19.45 18.63 2duw n ALA 136 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13