#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 0.27 -0.48 0.03 2.47 -1.26 -5.06 119.74 115.70 2duw s LYS 2 Ca 0.00 0.48 0.04 0.00 -1.56 0.00 0.00 55.97 54.94 2duw s LYS 2 Cb 0.00 0.00 0.41 0.00 -1.46 0.00 0.00 37.83 36.79 2duw s LYS 2 CO 0.00 -0.11 1.21 0.39 0.16 0.00 0.00 175.35 177.00 2duw n GLU 3 N 3.69 3.36 0.06 4.03 -0.58 -1.26 -4.31 120.64 125.63 2duw n GLU 3 Ca -0.20 -4.40 -0.04 0.00 -0.42 0.00 0.00 57.16 52.10 2duw n GLU 3 Cb 0.55 -2.25 0.19 0.00 -0.57 0.00 0.00 31.44 29.36 2duw n GLU 3 CO 0.00 0.00 0.00 -0.97 -0.48 0.00 0.00 177.13 175.68 2duw h ASN 4 N 2.62 0.36 -5.59 1.62 -1.24 -1.97 -3.47 115.58 107.91 2duw h ASN 4 Ca 0.33 -0.15 -0.31 0.00 0.71 0.00 0.00 56.30 56.88 2duw h ASN 4 Cb 0.83 -0.10 -0.09 0.00 0.73 0.00 0.00 38.32 39.69 2duw h ASN 4 CO 0.91 0.73 -0.25 -1.81 -1.29 0.00 0.00 177.43 175.71 2duw s ASP 5 N -6.87 1.02 0.57 1.15 1.11 -1.26 -5.02 116.67 107.38 2duw s ASP 5 Ca -0.05 -1.53 0.29 0.00 0.18 0.00 0.00 52.55 51.44 2duw s ASP 5 Cb 0.13 0.64 1.47 0.00 1.07 0.00 0.00 42.92 46.23 2duw s ASP 5 CO 0.79 -1.24 1.92 0.16 1.18 0.00 0.00 175.17 177.97 2duw h ILE 6 N 2.13 0.46 -0.80 0.77 3.07 -1.98 0.49 117.51 121.65 2duw h ILE 6 Ca -0.28 0.00 0.14 0.00 1.55 0.00 0.00 64.86 66.27 2duw h ILE 6 Cb 1.24 0.63 -0.06 0.00 -0.27 0.00 0.00 36.82 38.36 2duw h ILE 6 CO 0.39 0.00 0.53 0.00 -1.05 0.00 0.00 178.15 178.01 2duw h ALA 7 N 1.53 1.95 0.01 0.16 0.00 -1.95 0.18 119.26 121.14 2duw h ALA 7 Ca 0.26 0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.98 2duw h ALA 7 Cb 1.24 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 2duw h ALA 7 CO -0.00 -0.16 -0.91 0.78 0.00 0.00 0.00 179.25 178.96 2duw h GLY 8 N 0.56 0.13 1.49 0.00 0.00 -1.08 -1.49 103.07 102.67 2duw h GLY 8 Ca 0.39 -0.24 -0.24 0.00 0.00 0.00 0.00 47.33 47.24 2duw h GLY 8 CO -0.15 0.22 -0.98 -2.22 0.00 0.00 0.00 176.54 173.40 2duw h ILE 9 N 0.06 1.38 0.03 2.60 5.03 -1.16 -1.05 117.51 124.40 2duw h ILE 9 Ca -0.04 -2.45 -0.21 0.00 -0.12 0.00 0.00 64.86 62.04 2duw h ILE 9 Cb 1.57 2.45 -0.02 0.00 -3.03 0.00 0.00 36.82 37.79 2duw h ILE 9 CO 0.13 0.73 -1.00 0.17 -0.68 0.00 0.00 178.15 177.50 2duw h LEU 10 N 0.25 0.12 0.00 1.44 8.10 -0.79 -2.41 115.31 122.02 2duw h LEU 10 Ca -0.09 -0.12 -0.13 0.00 0.11 0.00 0.00 57.88 57.65 2duw h LEU 10 Cb 1.63 -0.04 -0.02 0.00 -0.44 0.00 0.00 40.66 41.79 2duw h LEU 10 CO 0.17 1.04 -0.70 0.00 -4.11 0.00 0.00 178.44 174.85 2duw h THR 11 N 0.03 0.91 0.00 0.15 1.03 -1.31 -3.39 112.91 110.33 2duw h THR 11 Ca -0.04 -2.33 0.00 0.00 -0.01 0.00 0.00 66.41 64.03 2duw h THR 11 Cb 1.72 2.42 0.00 0.00 -1.07 0.00 0.00 68.15 71.22 2duw h THR 11 CO 0.14 0.52 -0.04 -1.28 -0.01 0.00 0.00 175.52 174.86 2duw h SER 12 N 0.00 0.00 -3.86 0.00 0.87 -1.22 -3.48 113.55 105.86 2duw h SER 12 Ca -0.03 0.00 -0.51 0.00 -1.23 0.00 0.00 61.79 60.02 2duw h SER 12 Cb 1.46 0.00 -0.31 0.00 -0.44 0.00 0.00 62.40 63.11 2duw h SER 12 CO 0.07 0.25 -0.82 -0.89 -0.53 0.00 0.00 176.83 174.92 2duw s THR 13 N -1.31 1.17 -0.40 2.23 2.01 -0.91 -5.09 115.64 113.35 2duw s THR 13 Ca -0.01 -0.57 -0.05 0.00 0.31 0.00 0.00 61.69 61.36 2duw s THR 13 Cb 0.00 -1.02 0.09 0.00 0.01 0.00 0.00 72.50 71.58 2duw s THR 13 CO 0.02 0.35 0.20 0.00 -0.69 0.00 0.00 174.62 174.49 2duw s ARG 14 N 0.11 2.33 0.01 4.92 1.70 -1.26 -4.27 118.95 122.49 2duw s ARG 14 Ca -0.04 -1.59 0.00 0.00 -0.47 0.00 0.00 55.73 53.64 2duw s ARG 14 Cb -0.10 -3.61 -0.01 0.00 -0.57 0.00 0.00 34.95 30.65 2duw s ARG 14 CO 0.01 -0.96 -0.01 0.99 -1.08 0.00 0.00 175.30 174.25 2duw s THR 15 N 1.28 0.06 -0.03 4.99 2.01 -1.26 -4.63 115.64 118.06 2duw s THR 15 Ca 0.04 -0.33 0.04 0.00 0.31 0.00 0.00 61.69 61.75 2duw s THR 15 Cb -0.23 -0.11 -0.00 0.00 0.01 0.00 0.00 72.50 72.17 2duw s THR 15 CO -0.01 -0.17 -0.14 -0.63 -0.69 0.00 0.00 174.62 172.97 2duw s ILE 16 N -0.52 1.18 -0.04 1.82 1.09 -0.29 -2.46 121.20 121.97 2duw s ILE 16 Ca -0.06 -0.60 0.05 0.00 -1.10 0.00 0.00 60.65 58.94 2duw s ILE 16 Cb -0.04 -1.01 -0.01 0.00 -1.06 0.00 0.00 42.46 40.35 2duw s ILE 16 CO -0.00 0.34 -0.19 0.00 -0.10 0.00 0.00 174.94 174.99 2duw s ALA 17 N -0.05 1.67 -0.11 9.38 0.00 -0.28 -0.09 121.76 132.28 2duw s ALA 17 Ca -0.00 -0.78 -0.02 0.00 0.00 0.00 0.00 51.96 51.16 2duw s ALA 17 Cb -0.09 -0.54 -0.03 0.00 0.00 0.00 0.00 23.12 22.47 2duw s ALA 17 CO 0.01 0.31 -0.03 -1.17 0.00 0.00 0.00 175.76 174.88 2duw s LEU 18 N -0.03 3.32 -0.14 0.00 0.20 -0.81 -0.33 118.68 120.88 2duw s LEU 18 Ca -0.03 -0.02 -0.09 0.00 0.69 0.00 0.00 54.13 54.68 2duw s LEU 18 Cb -0.12 -1.77 -0.04 0.00 -0.43 0.00 0.00 46.19 43.83 2duw s LEU 18 CO 0.02 0.28 0.16 0.54 -0.29 0.00 0.00 176.35 177.06 2duw s VAL 19 N -0.29 5.43 -0.72 1.68 0.11 -1.21 -1.02 120.40 124.37 2duw s VAL 19 Ca 0.05 0.26 -0.04 0.00 -2.93 0.00 0.00 61.98 59.33 2duw s VAL 19 Cb -0.12 -3.46 -0.05 0.00 -1.53 0.00 0.00 36.38 31.22 2duw s VAL 19 CO 0.02 0.54 0.64 0.61 -3.33 0.00 0.00 175.10 173.58 2duw n GLY 20 N 2.61 -0.59 3.40 6.54 0.00 -0.24 -4.25 105.19 112.66 2duw n GLY 20 Ca -0.18 0.33 -0.45 0.00 0.00 0.00 0.00 46.02 45.72 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 -3.25 3.65 0.00 4.61 0.00 -1.13 -4.94 121.76 120.70 2duw s ALA 21 Ca 0.30 -2.98 0.00 0.00 0.00 0.00 0.00 51.96 49.28 2duw s ALA 21 Cb -0.04 -3.84 0.00 0.00 0.00 0.00 0.00 23.12 19.25 2duw s ALA 21 CO 0.52 -2.70 0.00 0.43 0.00 0.00 0.00 175.76 174.01 2duw n SER 22 N 5.53 0.69 -2.21 0.00 7.64 -1.26 -4.47 113.62 119.55 2duw n SER 22 Ca 0.20 -0.87 -0.25 0.00 1.01 0.00 0.00 58.87 58.96 2duw n SER 22 Cb 0.48 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.70 2duw n SER 22 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2duw n ASP 23 N -2.00 6.80 -4.13 6.43 8.00 -1.26 -4.78 116.55 125.60 2duw n ASP 23 Ca 0.00 -3.30 -0.38 0.00 0.71 0.00 0.00 54.79 51.82 2duw n ASP 23 Cb 0.00 -1.09 -0.07 0.00 -0.02 0.00 0.00 41.12 39.95 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 -2.36 3.16 0.00 -1.24 -0.14 -1.26 -4.88 119.74 113.02 2duw s LYS 24 Ca 0.46 -3.00 0.15 0.00 -1.36 0.00 0.00 55.97 52.22 2duw s LYS 24 Cb 0.35 -3.97 0.73 0.00 -1.68 0.00 0.00 37.83 33.26 2duw s LYS 24 CO -0.09 -1.24 1.42 -0.35 -0.76 0.00 0.00 175.35 174.33 2duw n PRO 25 N 2.80 0.17 -0.94 -1.68 -0.04 -1.26 -2.45 135.00 131.60 2duw n PRO 25 Ca 0.17 0.16 -0.05 0.00 -0.04 0.00 0.00 63.50 63.75 2duw n PRO 25 Cb 0.38 -1.50 0.29 0.00 -0.04 0.00 0.00 33.50 32.63 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 -1.32 4.70 -4.31 3.54 2.03 -1.26 -4.70 116.55 115.23 2duw n ASP 26 Ca 0.06 -3.09 -0.17 0.00 0.52 0.00 0.00 54.79 52.12 2duw n ASP 26 Cb 0.13 -0.73 -0.10 0.00 -0.72 0.00 0.00 41.12 39.70 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 -2.76 1.24 0.25 -0.67 0.52 -1.03 -5.03 118.95 111.47 2duw s ARG 27 Ca 0.51 -1.55 0.23 0.00 -0.52 0.00 0.00 55.73 54.40 2duw s ARG 27 Cb 0.40 -0.91 0.97 0.00 0.52 0.00 0.00 34.95 35.93 2duw s ARG 27 CO 0.13 0.12 1.70 -0.35 0.02 0.00 0.00 175.30 176.92 2duw n PRO 28 N -0.32 0.18 0.12 3.54 -0.04 -1.26 -2.44 135.00 134.78 2duw n PRO 28 Ca -0.09 0.42 -0.01 0.00 -0.04 0.00 0.00 63.50 63.79 2duw n PRO 28 Cb 0.61 -1.86 0.05 0.00 -0.04 0.00 0.00 33.50 32.27 2duw n PRO 28 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2duw h SER 29 N 0.00 0.00 0.07 3.54 4.64 -1.88 -3.14 113.55 116.78 2duw h SER 29 Ca 0.00 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.06 2duw h SER 29 Cb 0.35 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.43 2duw h SER 29 CO 0.00 0.67 -1.37 0.22 -0.87 0.00 0.00 176.83 175.48 2duw h TYR 30 N 0.00 0.28 -0.77 4.77 5.03 -1.67 -3.21 116.97 121.39 2duw h TYR 30 Ca -0.01 -0.20 0.18 0.00 2.58 0.00 0.00 58.73 61.28 2duw h TYR 30 Cb 1.39 -0.01 -0.05 0.00 1.55 0.00 0.00 36.73 39.61 2duw h TYR 30 CO 0.00 1.54 0.53 0.07 -1.32 0.00 0.00 178.16 178.97 2duw h ARG 31 N -0.51 0.25 0.07 1.82 0.11 -1.62 -0.18 114.38 114.31 2duw h ARG 31 Ca -0.32 -0.01 -0.28 0.00 0.10 0.00 0.00 59.98 59.47 2duw h ARG 31 Cb 1.61 -0.06 0.02 0.00 1.11 0.00 0.00 29.97 32.65 2duw h ARG 31 CO -0.03 0.16 -1.14 0.28 0.10 0.00 0.00 179.97 179.35 2duw h VAL 32 N 0.26 1.32 0.28 0.08 2.07 -1.68 -2.74 116.25 115.83 2duw h VAL 32 Ca 0.38 -2.44 0.01 0.00 0.82 0.00 0.00 66.70 65.46 2duw h VAL 32 Cb 1.11 2.57 -0.03 0.00 -1.52 0.00 0.00 31.29 33.42 2duw h VAL 32 CO -0.09 0.74 -0.39 -0.03 0.02 0.00 0.00 177.57 177.82 2duw h MET 33 N 0.29 -0.70 0.00 1.57 4.05 -1.04 0.18 114.93 119.28 2duw h MET 33 Ca -0.15 0.05 -0.01 0.00 -0.28 0.00 0.00 59.70 59.30 2duw h MET 33 Cb 1.80 0.16 -0.00 0.00 -0.80 0.00 0.00 31.60 32.76 2duw h MET 33 CO 0.21 -0.47 -0.07 -0.22 0.23 0.00 0.00 176.91 176.60 2duw h LYS 34 N -0.73 0.00 0.05 0.39 3.64 -1.57 -0.59 116.57 117.76 2duw h LYS 34 Ca -0.01 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2duw h LYS 34 Cb 0.69 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.51 2duw h LYS 34 CO -0.13 0.07 -0.02 -0.92 -2.27 0.00 0.00 179.45 176.17 2duw h TYR 35 N 0.00 -0.06 0.00 1.91 3.20 -0.93 -0.87 116.97 120.22 2duw h TYR 35 Ca -0.00 -0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.79 2duw h TYR 35 Cb 0.39 0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.67 2duw h TYR 35 CO 0.00 0.53 -0.36 -0.07 -1.64 0.00 0.00 178.16 176.62 2duw h LEU 36 N -0.72 0.00 0.03 2.82 3.38 -0.57 -1.97 115.31 118.28 2duw h LEU 36 Ca -0.01 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.80 2duw h LEU 36 Cb 0.61 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.38 2duw h LEU 36 CO 0.01 0.36 -0.66 -0.07 0.09 0.00 0.00 178.44 178.17 2duw h LEU 37 N 0.00 0.53 -0.43 1.67 3.38 -1.15 -1.42 115.31 117.89 2duw h LEU 37 Ca -0.00 -0.80 -0.14 0.00 0.09 0.00 0.00 57.88 57.03 2duw h LEU 37 Cb 0.94 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 2duw h LEU 37 CO 0.05 1.27 -0.27 -0.78 0.09 0.00 0.00 178.44 178.79 2duw h ASP 38 N -0.14 0.98 -0.17 -0.43 1.82 -1.15 -2.80 116.42 114.53 2duw h ASP 38 Ca -0.09 -0.42 0.05 0.00 -0.39 0.00 0.00 57.03 56.18 2duw h ASP 38 Cb 1.39 -0.27 -0.01 0.00 0.68 0.00 0.00 39.33 41.12 2duw h ASP 38 CO 0.13 1.19 0.20 1.56 -1.61 0.00 0.00 179.24 180.71 2duw h GLN 39 N 0.78 0.00 0.00 0.28 1.08 -1.45 -3.45 115.11 112.35 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 0.85 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.28 2duw h GLN 39 CO 0.08 0.00 0.00 0.41 -0.95 0.00 0.00 178.83 178.37 2duw n GLY 40 N -1.39 1.17 3.62 3.46 0.00 -1.06 -5.10 105.19 105.90 2duw n GLY 40 Ca 0.01 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.00 2.54 -0.30 1.61 2.02 -0.54 -5.06 117.35 115.62 2duw s TYR 41 Ca 0.00 -0.44 -0.27 0.00 -0.37 0.00 0.00 57.07 55.99 2duw s TYR 41 Cb 0.00 -1.48 0.01 0.00 -0.40 0.00 0.00 41.96 40.09 2duw s TYR 41 CO 0.00 0.49 0.95 -1.58 -1.57 0.00 0.00 175.55 173.83 2duw s HIS 42 N -2.52 3.20 -0.05 2.71 2.46 -1.26 -4.52 115.29 115.30 2duw s HIS 42 Ca 0.35 1.08 0.03 0.00 0.47 0.00 0.00 55.06 56.98 2duw s HIS 42 Cb 0.00 -3.43 -0.03 0.00 -0.13 0.00 0.00 32.58 29.00 2duw s HIS 42 CO 0.19 -0.64 -0.13 0.08 -2.47 0.00 0.00 174.74 171.77 2duw s VAL 43 N 3.29 3.15 -0.53 0.89 1.01 -1.26 -1.14 120.40 125.80 2duw s VAL 43 Ca 0.40 -0.70 0.05 0.00 0.00 0.00 0.00 61.98 61.73 2duw s VAL 43 Cb -0.13 -2.24 0.20 0.00 0.00 0.00 0.00 36.38 34.20 2duw s VAL 43 CO 0.13 0.59 0.48 -0.38 0.00 0.00 0.00 175.10 175.92 2duw n ILE 44 N 2.28 0.29 -2.19 2.22 5.41 0.87 -4.89 119.36 123.36 2duw n ILE 44 Ca -0.17 -4.24 -0.42 0.00 1.00 0.00 0.00 62.75 58.92 2duw n ILE 44 Cb 0.52 -1.94 -0.03 0.00 -0.71 0.00 0.00 39.64 37.49 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 -1.01 4.29 -0.12 0.38 0.04 -1.26 -1.93 135.00 135.39 2duw s PRO 45 Ca 0.32 2.03 0.01 0.00 0.04 0.00 0.00 61.00 63.39 2duw s PRO 45 Cb 0.05 -3.46 0.02 0.00 0.04 0.00 0.00 34.50 31.16 2duw s PRO 45 CO -0.15 -0.53 -0.13 0.08 0.04 0.00 0.00 177.00 176.31 2duw s VAL 46 N 1.93 1.41 0.02 -0.36 1.01 -0.19 -3.98 120.40 120.23 2duw s VAL 46 Ca 0.65 -0.56 -0.09 0.00 0.00 0.00 0.00 61.98 61.98 2duw s VAL 46 Cb -0.34 -1.33 0.01 0.00 0.00 0.00 0.00 36.38 34.72 2duw s VAL 46 CO 0.28 0.43 0.19 -0.55 0.00 0.00 0.00 175.10 175.45 2duw s SER 47 N 1.30 0.00 0.00 3.32 0.15 0.98 -1.07 113.70 118.38 2duw s SER 47 Ca -0.00 -0.25 0.14 0.00 0.70 0.00 0.00 55.95 56.54 2duw s SER 47 Cb -0.14 0.26 0.64 0.00 -1.71 0.00 0.00 66.02 65.07 2duw s SER 47 CO -0.06 -0.48 1.44 -0.81 1.20 0.00 0.00 173.24 174.54 2duw n PRO 48 N 1.03 0.05 -0.08 5.44 -0.04 -1.25 -2.23 135.00 137.93 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 1.63 -0.04 0.00 0.00 175.50 177.09 2duw n LYS 49 N -1.45 1.26 0.00 0.54 5.02 -1.26 -4.41 118.16 117.86 2duw n LYS 49 Ca 0.04 0.03 0.14 0.00 -2.02 0.00 0.00 58.31 56.51 2duw n LYS 49 Cb 0.15 -1.36 0.70 0.00 -0.02 0.00 0.00 35.03 34.51 2duw n LYS 49 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 2duw n VAL 50 N -2.70 0.04 -1.53 -0.18 3.14 -1.13 -4.80 118.33 111.17 2duw n VAL 50 Ca -0.26 0.01 -0.41 0.00 -2.96 0.00 0.00 64.34 60.72 2duw n VAL 50 Cb 0.91 -0.52 -0.06 0.00 -1.06 0.00 0.00 33.84 33.11 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 -1.34 0.91 -0.08 1.55 0.00 -0.95 -0.09 120.51 120.51 2duw n ALA 51 Ca 0.12 -0.55 0.00 0.00 0.00 0.00 0.00 53.44 53.01 2duw n ALA 51 Cb 0.26 -2.88 0.00 0.00 0.00 0.00 0.00 19.45 16.83 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 6.17 0.95 3.40 0.00 0.00 -1.24 -4.83 105.19 109.65 2duw n GLY 52 Ca 0.42 -0.08 -0.22 0.00 0.00 0.00 0.00 46.02 46.14 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 -0.17 1.80 -0.18 1.61 -0.14 0.87 -4.98 119.74 118.54 2duw s LYS 53 Ca 0.00 -2.07 -0.00 0.00 -1.36 0.00 0.00 55.97 52.54 2duw s LYS 53 Cb 0.00 -0.21 0.04 0.00 -1.68 0.00 0.00 37.83 35.98 2duw s LYS 53 CO 0.00 -0.52 -0.07 0.95 -0.76 0.00 0.00 175.35 174.95 2duw s THR 54 N -3.38 1.30 -0.25 2.17 -4.23 -1.26 -0.19 115.64 109.80 2duw s THR 54 Ca 0.31 -0.80 -0.05 0.00 -1.18 0.00 0.00 61.69 59.98 2duw s THR 54 Cb 0.03 -1.46 -0.00 0.00 1.34 0.00 0.00 72.50 72.41 2duw s THR 54 CO 0.19 0.11 0.01 -0.76 -0.54 0.00 0.00 174.62 173.63 2duw s LEU 55 N 1.54 3.31 -1.71 4.79 1.43 -0.32 -4.51 118.68 123.21 2duw s LEU 55 Ca -0.01 -0.54 0.00 0.00 -1.03 0.00 0.00 54.13 52.55 2duw s LEU 55 Cb -0.16 -1.80 0.00 0.00 0.03 0.00 0.00 46.19 44.27 2duw s LEU 55 CO -0.08 -0.09 0.00 0.18 0.23 0.00 0.00 176.35 176.59 2duw n LEU 56 N 4.81 -1.60 0.00 1.79 4.77 -1.26 -1.13 117.00 124.38 2duw n LEU 56 Ca -0.16 0.19 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 2duw n LEU 56 Cb 0.49 -2.59 0.00 0.00 -2.33 0.00 0.00 43.42 39.00 2duw n LEU 56 CO 0.30 -0.52 0.00 0.61 -1.33 0.00 0.00 177.39 176.45 2duw n GLY 57 N -0.90 1.08 3.86 -0.72 0.00 -1.26 -5.04 105.19 102.22 2duw n GLY 57 Ca -0.20 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.47 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 -0.38 3.74 0.29 1.61 -1.52 -0.28 -5.06 119.66 118.06 2duw s GLN 58 Ca 0.00 0.16 -0.29 0.00 -1.95 0.00 0.00 55.36 53.28 2duw s GLN 58 Cb 0.00 -3.06 -0.10 0.00 -0.22 0.00 0.00 33.01 29.63 2duw s GLN 58 CO 0.00 0.61 1.17 -1.14 -0.25 0.00 0.00 175.29 175.68 2duw s GLN 59 N -1.69 4.54 0.21 2.91 2.00 -1.26 -1.17 119.66 125.20 2duw s GLN 59 Ca 0.30 1.93 -0.03 0.00 -2.00 0.00 0.00 55.36 55.56 2duw s GLN 59 Cb -0.14 -3.16 -0.05 0.00 0.80 0.00 0.00 33.01 30.46 2duw s GLN 59 CO 0.16 0.07 0.44 0.20 -0.50 0.00 0.00 175.29 175.66 2duw s GLY 60 N -0.67 1.92 -0.10 2.59 0.00 0.73 -4.52 107.32 107.28 2duw s GLY 60 Ca 0.47 -0.67 -0.08 0.00 0.00 0.00 0.00 44.72 44.43 2duw s GLY 60 CO 0.44 -0.60 0.25 -0.19 0.00 0.00 0.00 173.10 173.00 2duw s TYR 61 N -1.88 -0.29 0.37 1.90 2.02 -1.25 -3.63 117.35 114.58 2duw s TYR 61 Ca 0.41 0.71 0.25 0.00 -0.37 0.00 0.00 57.07 58.06 2duw s TYR 61 Cb -0.11 0.09 1.27 0.00 -0.40 0.00 0.00 41.96 42.81 2duw s TYR 61 CO 0.28 -0.16 2.00 0.00 -1.57 0.00 0.00 175.55 176.11 2duw h ALA 62 N 6.04 1.27 -2.04 3.71 0.00 -1.87 0.28 119.26 126.64 2duw h ALA 62 Ca -0.29 -0.15 0.17 0.00 0.00 0.00 0.00 54.91 54.64 2duw h ALA 62 Cb 1.19 -0.03 -0.15 0.00 0.00 0.00 0.00 17.79 18.80 2duw h ALA 62 CO 0.35 0.21 0.59 -0.08 0.00 0.00 0.00 179.25 180.32 2duw s THR 63 N -4.13 0.00 -0.18 0.00 -1.32 -1.26 -3.85 115.64 104.90 2duw s THR 63 Ca -0.02 -0.10 0.26 0.00 -1.21 0.00 0.00 61.69 60.62 2duw s THR 63 Cb 0.13 -1.19 0.26 0.00 -1.51 0.00 0.00 72.50 70.20 2duw s THR 63 CO 0.61 0.00 1.78 0.17 -2.21 0.00 0.00 174.62 174.97 2duw h LEU 64 N 2.00 0.00 -1.68 9.08 -0.00 -1.94 -0.70 115.31 122.06 2duw h LEU 64 Ca -0.20 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.68 2duw h LEU 64 Cb 1.22 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.88 2duw h LEU 64 CO 0.28 0.00 0.00 0.00 -0.00 0.00 0.00 178.44 178.72 2duw n ALA 65 N -1.83 2.60 -0.01 0.17 0.00 -1.26 -3.72 120.51 116.46 2duw n ALA 65 Ca -0.00 -0.78 0.03 0.00 0.00 0.00 0.00 53.44 52.69 2duw n ALA 65 Cb 0.13 -0.99 -0.06 0.00 0.00 0.00 0.00 19.45 18.53 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 0.63 3.29 -4.74 0.00 -0.08 -0.27 -4.99 116.55 110.37 2duw n ASP 66 Ca 0.14 0.00 -0.39 0.00 -1.51 0.00 0.00 54.79 53.03 2duw n ASP 66 Cb 0.43 1.27 -0.05 0.00 2.34 0.00 0.00 41.12 45.11 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 -2.48 4.96 0.11 5.18 0.11 -1.24 -4.99 120.40 122.05 2duw s VAL 67 Ca -0.03 1.30 -0.14 0.00 -2.93 0.00 0.00 61.98 60.17 2duw s VAL 67 Cb 0.05 -3.96 -0.08 0.00 -1.53 0.00 0.00 36.38 30.86 2duw s VAL 67 CO 0.31 0.36 1.43 1.55 -3.33 0.00 0.00 175.10 175.42 2duw h PRO 68 N 6.05 0.73 -6.85 1.54 0.13 -1.94 -3.44 132.00 128.22 2duw h PRO 68 Ca -0.44 -0.38 -0.52 0.00 -0.87 0.00 0.00 66.00 63.80 2duw h PRO 68 Cb 1.20 0.01 0.05 0.00 0.13 0.00 0.00 31.00 32.39 2duw h PRO 68 CO 0.72 1.00 0.57 -2.00 -0.23 0.00 0.00 178.00 178.06 2duw s GLU 69 N -4.38 4.46 -0.20 0.86 2.12 -1.26 -5.01 118.70 115.29 2duw s GLU 69 Ca -0.12 2.05 -0.15 0.00 0.36 0.00 0.00 54.97 57.11 2duw s GLU 69 Cb 0.09 -3.11 -0.04 0.00 0.26 0.00 0.00 34.13 31.33 2duw s GLU 69 CO 0.84 -0.03 0.34 0.15 -0.54 0.00 0.00 175.26 176.01 2duw s LYS 70 N -1.66 4.17 0.38 4.30 1.02 -1.26 -5.07 119.74 121.61 2duw s LYS 70 Ca 0.47 0.10 -0.25 0.00 0.02 0.00 0.00 55.97 56.31 2duw s LYS 70 Cb -0.37 -3.52 -0.09 0.00 -0.52 0.00 0.00 37.83 33.34 2duw s LYS 70 CO 0.48 0.03 1.07 0.54 -0.92 0.00 0.00 175.35 176.55 2duw s VAL 71 N 1.11 3.61 -0.14 3.17 0.11 -1.26 -4.96 120.40 122.05 2duw s VAL 71 Ca 0.16 1.32 0.21 0.00 -2.93 0.00 0.00 61.98 60.75 2duw s VAL 71 Cb -0.14 -3.72 -0.17 0.00 -1.53 0.00 0.00 36.38 30.82 2duw s VAL 71 CO 0.07 0.09 0.73 -0.67 -3.33 0.00 0.00 175.10 171.98 2duw n ASP 72 N 0.19 0.46 -3.57 3.54 2.03 -1.26 -3.96 116.55 113.98 2duw n ASP 72 Ca 0.04 0.18 -0.16 0.00 0.52 0.00 0.00 54.79 55.37 2duw n ASP 72 Cb 0.48 1.07 -0.13 0.00 -0.72 0.00 0.00 41.12 41.82 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 -3.31 0.15 -0.38 -0.67 1.75 -1.03 -2.52 119.30 113.30 2duw s MET 73 Ca -0.04 0.44 -0.16 0.00 -1.25 0.00 0.00 55.69 54.67 2duw s MET 73 Cb 0.11 -0.68 0.00 0.00 2.84 0.00 0.00 34.83 37.10 2duw s MET 73 CO 0.84 -0.49 0.37 0.08 -0.65 0.00 0.00 175.02 175.18 2duw s VAL 74 N 2.35 5.16 -0.34 10.11 1.01 -0.86 -1.13 120.40 136.70 2duw s VAL 74 Ca 0.05 -0.18 -0.14 0.00 0.00 0.00 0.00 61.98 61.71 2duw s VAL 74 Cb -0.14 -3.90 -0.02 0.00 0.00 0.00 0.00 36.38 32.32 2duw s VAL 74 CO -0.10 -0.23 0.28 -1.81 0.00 0.00 0.00 175.10 173.24 2duw s ASP 75 N 1.75 6.10 -0.31 3.32 1.11 0.55 -0.29 116.67 128.90 2duw s ASP 75 Ca 0.11 -0.36 -0.14 0.00 0.18 0.00 0.00 52.55 52.34 2duw s ASP 75 Cb -0.17 -2.16 -0.03 0.00 1.07 0.00 0.00 42.92 41.64 2duw s ASP 75 CO 0.12 -0.26 0.31 -0.69 1.18 0.00 0.00 175.17 175.83 2duw s VAL 76 N 1.82 5.22 -0.03 -1.27 1.01 0.66 -3.35 120.40 124.45 2duw s VAL 76 Ca 0.08 0.15 0.01 0.00 0.00 0.00 0.00 61.98 62.22 2duw s VAL 76 Cb -0.17 -3.72 -0.01 0.00 0.00 0.00 0.00 36.38 32.48 2duw s VAL 76 CO 0.11 0.04 0.03 0.49 0.00 0.00 0.00 175.10 175.78 2duw n PHE 77 N 5.27 0.00 0.06 5.22 3.72 -1.26 -3.73 117.46 126.73 2duw n PHE 77 Ca -0.10 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.21 2duw n PHE 77 Cb 0.50 -0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.99 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 -0.39 -1.98 -1.08 3.08 -1.90 -3.42 114.38 108.69 2duw h ARG 78 Ca 0.00 0.03 0.34 0.00 0.07 0.00 0.00 59.98 60.41 2duw h ARG 78 Cb 0.02 0.09 -0.08 0.00 0.08 0.00 0.00 29.97 30.08 2duw h ARG 78 CO 0.00 -0.26 0.88 1.21 -1.07 0.00 0.00 179.97 180.73 2duw s ASN 79 N -3.57 -0.01 -0.03 7.04 3.84 -1.26 -5.01 114.94 115.94 2duw s ASN 79 Ca -0.09 -0.20 -0.23 0.00 0.21 0.00 0.00 52.86 52.55 2duw s ASN 79 Cb 0.03 0.16 -0.17 0.00 -0.55 0.00 0.00 41.25 40.72 2duw s ASN 79 CO 0.31 -0.31 1.04 0.77 -2.79 0.00 0.00 177.10 176.12 2duw h SER 80 N 2.00 -0.20 -0.47 -4.21 4.64 -1.96 -2.85 113.55 110.51 2duw h SER 80 Ca -0.24 -0.33 0.14 0.00 -0.47 0.00 0.00 61.79 60.88 2duw h SER 80 Cb 1.19 0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 63.31 2duw h SER 80 CO 0.31 0.30 0.34 -0.33 -0.87 0.00 0.00 176.83 176.58 2duw h GLU 81 N -0.77 0.00 0.00 4.77 4.39 -2.02 0.24 114.58 121.19 2duw h GLU 81 Ca -0.02 0.00 -0.09 0.00 0.34 0.00 0.00 59.36 59.58 2duw h GLU 81 Cb 0.52 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.15 2duw h GLU 81 CO 0.04 0.00 -0.45 0.00 -1.16 0.00 0.00 179.01 177.44 2duw h ALA 82 N 1.75 0.89 -0.74 3.43 0.00 -1.94 -3.23 119.26 119.43 2duw h ALA 82 Ca 0.22 -0.41 0.14 0.00 0.00 0.00 0.00 54.91 54.86 2duw h ALA 82 Cb 0.91 -0.07 -0.09 0.00 0.00 0.00 0.00 17.79 18.53 2duw h ALA 82 CO -0.00 0.57 0.30 0.00 0.00 0.00 0.00 179.25 180.11 2duw h ALA 83 N 1.55 1.04 0.21 0.00 0.00 -0.28 0.57 119.26 122.34 2duw h ALA 83 Ca -0.00 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2duw h ALA 83 Cb 1.06 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2duw h ALA 83 CO 0.06 -0.20 -0.10 2.35 0.00 0.00 0.00 179.25 181.36 2duw h TRP 84 N 0.45 -0.26 -0.76 0.00 2.91 -1.65 0.12 115.95 116.76 2duw h TRP 84 Ca 0.40 -0.01 0.12 0.00 1.13 0.00 0.00 58.89 60.54 2duw h TRP 84 Cb 0.60 0.09 -0.05 0.00 -0.51 0.00 0.00 29.16 29.28 2duw h TRP 84 CO -0.16 0.03 0.50 0.78 -1.03 0.00 0.00 178.44 178.56 2duw h GLY 85 N -0.55 0.89 1.27 2.65 0.00 -1.51 -1.79 103.07 104.02 2duw h GLY 85 Ca -0.03 -0.24 -0.31 0.00 0.00 0.00 0.00 47.33 46.75 2duw h GLY 85 CO 0.05 0.12 -1.29 -2.08 0.00 0.00 0.00 176.54 173.33 2duw h VAL 86 N 0.58 1.29 -0.00 4.60 2.07 -0.79 -3.21 116.25 120.78 2duw h VAL 86 Ca 0.36 -2.53 0.03 0.00 0.82 0.00 0.00 66.70 65.39 2duw h VAL 86 Cb 0.62 2.76 -0.05 0.00 -1.52 0.00 0.00 31.29 33.11 2duw h VAL 86 CO -0.13 0.77 -0.27 0.00 0.02 0.00 0.00 177.57 177.96 2duw h ALA 87 N 0.28 -0.36 -0.93 1.67 0.00 0.08 0.20 119.26 120.21 2duw h ALA 87 Ca -0.20 -0.01 0.11 0.00 0.00 0.00 0.00 54.91 54.81 2duw h ALA 87 Cb 1.97 0.47 -0.08 0.00 0.00 0.00 0.00 17.79 20.15 2duw h ALA 87 CO 0.24 -0.77 0.56 -0.56 0.00 0.00 0.00 179.25 178.73 2duw h GLN 88 N -0.41 0.89 -0.26 0.00 3.07 -1.54 0.28 115.11 117.15 2duw h GLN 88 Ca 0.06 -0.05 -0.04 0.00 0.09 0.00 0.00 58.65 58.71 2duw h GLN 88 Cb 0.49 -0.20 -0.01 0.00 0.08 0.00 0.00 27.48 27.84 2duw h GLN 88 CO -0.23 0.59 -0.00 0.93 0.09 0.00 0.00 178.83 180.20 2duw h GLU 89 N 0.92 0.46 -0.14 0.06 5.08 -1.35 -1.47 114.58 118.14 2duw h GLU 89 Ca 0.45 -0.15 0.00 0.00 -1.00 0.00 0.00 59.36 58.66 2duw h GLU 89 Cb 0.41 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 2duw h GLU 89 CO -0.25 0.63 0.09 0.00 -1.00 0.00 0.00 179.01 178.48 2duw h ALA 90 N 0.81 0.18 -0.08 3.43 0.00 0.16 -2.23 119.26 121.53 2duw h ALA 90 Ca 0.07 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 2duw h ALA 90 Cb 0.43 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2duw h ALA 90 CO 0.01 -0.33 -0.10 0.82 0.00 0.00 0.00 179.25 179.66 2duw h ILE 91 N 0.17 1.12 -0.01 0.00 2.04 -0.95 0.27 117.51 120.15 2duw h ILE 91 Ca 0.05 -0.53 -0.00 0.00 1.00 0.00 0.00 64.86 65.38 2duw h ILE 91 Cb 0.00 1.17 -0.00 0.00 -0.74 0.00 0.00 36.82 37.25 2duw h ILE 91 CO -0.01 0.16 0.00 0.00 0.00 0.00 0.00 178.15 178.31 2duw h ALA 92 N 1.79 0.02 0.00 1.87 0.00 -0.72 -2.99 119.26 119.23 2duw h ALA 92 Ca 0.03 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 2duw h ALA 92 Cb 0.25 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2duw h ALA 92 CO 0.01 -0.37 -0.38 -0.84 0.00 0.00 0.00 179.25 177.68 2duw h ILE 93 N -0.21 0.80 0.00 0.00 3.07 -1.17 -3.47 117.51 116.53 2duw h ILE 93 Ca 0.00 -1.62 0.00 0.00 1.55 0.00 0.00 64.86 64.80 2duw h ILE 93 Cb 0.23 2.02 0.00 0.00 -0.27 0.00 0.00 36.82 38.81 2duw h ILE 93 CO 0.00 0.37 0.00 0.61 -1.05 0.00 0.00 178.15 178.08 2duw n GLY 94 N 0.48 0.64 3.09 0.16 0.00 0.01 -5.11 105.19 104.46 2duw n GLY 94 Ca 0.00 -0.18 -0.27 0.00 0.00 0.00 0.00 46.02 45.58 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 -4.67 0.00 4.61 0.00 0.74 -4.99 120.51 116.20 2duw n ALA 95 Ca 0.00 -1.36 0.00 0.00 0.00 0.00 0.00 53.44 52.08 2duw n ALA 95 Cb 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 19.45 19.33 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 -4.88 0.90 -3.81 0.00 4.76 -1.25 -4.97 118.16 108.90 2duw n LYS 96 Ca 0.12 0.00 -0.10 0.00 -2.87 0.00 0.00 58.31 55.47 2duw n LYS 96 Cb 0.53 -0.92 -0.07 0.00 -1.84 0.00 0.00 35.03 32.73 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 -1.84 0.12 -0.03 -0.18 2.01 -1.05 -3.93 115.64 110.74 2duw s THR 97 Ca 0.00 -1.00 0.01 0.00 0.31 0.00 0.00 61.69 61.01 2duw s THR 97 Cb 0.00 -1.20 0.02 0.00 0.01 0.00 0.00 72.50 71.33 2duw s THR 97 CO 0.00 -0.55 -0.03 -0.22 -0.69 0.00 0.00 174.62 173.13 2duw s LEU 98 N -2.64 1.43 -0.06 4.42 2.96 0.05 -2.04 118.68 122.81 2duw s LEU 98 Ca 0.02 -0.08 0.01 0.00 -0.22 0.00 0.00 54.13 53.87 2duw s LEU 98 Cb 0.03 -0.31 0.02 0.00 0.50 0.00 0.00 46.19 46.43 2duw s LEU 98 CO -0.09 -0.04 -0.08 0.86 -1.32 0.00 0.00 176.35 175.67 2duw s TRP 99 N 0.70 1.14 0.03 5.38 -0.11 0.60 -1.17 118.94 125.51 2duw s TRP 99 Ca -0.08 -0.40 0.00 0.00 1.22 0.00 0.00 56.10 56.84 2duw s TRP 99 Cb -0.11 -0.91 0.00 0.00 -1.50 0.00 0.00 33.47 30.96 2duw s TRP 99 CO -0.01 -0.26 0.03 1.28 -4.62 0.00 0.00 176.95 173.37 2duw n LEU 100 N 4.05 0.00 -4.80 5.86 4.77 -0.65 -0.25 117.00 125.99 2duw n LEU 100 Ca -0.22 -0.16 -0.36 0.00 -0.03 0.00 0.00 56.01 55.24 2duw n LEU 100 Cb 0.51 -0.01 -0.06 0.00 -2.33 0.00 0.00 43.42 41.53 2duw n LEU 100 CO 0.23 -0.33 0.58 -1.10 -1.33 0.00 0.00 177.39 175.44 2duw s GLN 101 N -2.13 4.42 0.02 3.23 -1.52 -1.24 -4.25 119.66 118.18 2duw s GLN 101 Ca 0.02 1.15 -0.30 0.00 -1.95 0.00 0.00 55.36 54.28 2duw s GLN 101 Cb -0.00 -2.73 -0.05 0.00 -0.22 0.00 0.00 33.01 30.01 2duw s GLN 101 CO 0.01 0.27 1.17 -1.17 -0.25 0.00 0.00 175.29 175.32 2duw s LEU 102 N -2.21 4.34 0.00 2.90 2.96 -1.25 -2.64 118.68 122.78 2duw s LEU 102 Ca 0.50 1.91 0.00 0.00 -0.22 0.00 0.00 54.13 56.32 2duw s LEU 102 Cb -0.17 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 42.95 2duw s LEU 102 CO 0.21 -0.48 0.00 0.61 -1.32 0.00 0.00 176.35 175.38 2duw n GLY 103 N 3.22 2.05 3.80 7.98 0.00 -1.26 -4.84 105.19 116.13 2duw n GLY 103 Ca 0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.35 4.62 -0.13 1.61 1.01 -1.19 -4.99 120.40 118.99 2duw s VAL 104 Ca 0.00 -0.78 -0.02 0.00 0.00 0.00 0.00 61.98 61.18 2duw s VAL 104 Cb 0.00 -3.25 0.04 0.00 0.00 0.00 0.00 36.38 33.17 2duw s VAL 104 CO 0.00 0.09 0.01 -0.63 0.00 0.00 0.00 175.10 174.57 2duw s ILE 105 N -1.46 0.49 -0.69 2.22 1.01 -1.26 -2.30 121.20 119.21 2duw s ILE 105 Ca 0.30 -0.20 -0.02 0.00 0.00 0.00 0.00 60.65 60.73 2duw s ILE 105 Cb -0.12 -0.79 0.17 0.00 0.01 0.00 0.00 42.46 41.74 2duw s ILE 105 CO 0.23 0.07 0.52 0.20 0.00 0.00 0.00 174.94 175.96 2duw s ASN 106 N 1.90 5.34 0.35 3.58 -0.87 -1.26 -4.93 114.94 119.06 2duw s ASN 106 Ca 0.03 -3.13 0.09 0.00 -1.57 0.00 0.00 52.86 48.27 2duw s ASN 106 Cb -0.14 -1.85 0.83 0.00 -0.02 0.00 0.00 41.25 40.07 2duw s ASN 106 CO -0.07 -0.30 1.85 -0.08 -2.57 0.00 0.00 177.10 175.93 2duw h GLU 107 N 6.66 0.66 -0.33 -0.60 4.81 -1.99 -0.73 114.58 123.07 2duw h GLU 107 Ca 0.03 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.16 2duw h GLU 107 Cb 0.91 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.12 2duw h GLU 107 CO 0.74 0.44 -0.04 1.96 -0.73 0.00 0.00 179.01 181.38 2duw h GLN 108 N 0.68 0.61 0.00 1.92 7.50 -2.00 -2.58 115.11 121.25 2duw h GLN 108 Ca 0.48 -0.22 -0.03 0.00 0.50 0.00 0.00 58.65 59.38 2duw h GLN 108 Cb 0.81 -0.04 -0.00 0.00 0.05 0.00 0.00 27.48 28.29 2duw h GLN 108 CO -0.23 0.76 -0.15 0.00 -1.50 0.00 0.00 178.83 177.71 2duw h ALA 109 N 0.83 1.42 -0.01 3.87 0.00 -1.58 -1.88 119.26 121.91 2duw h ALA 109 Ca 0.09 -0.14 -0.18 0.00 0.00 0.00 0.00 54.91 54.68 2duw h ALA 109 Cb 0.51 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2duw h ALA 109 CO 0.02 0.19 -0.79 0.00 0.00 0.00 0.00 179.25 178.68 2duw h ALA 110 N 1.85 0.65 0.04 0.00 0.00 -0.94 -3.16 119.26 117.70 2duw h ALA 110 Ca -0.00 -0.67 -0.25 0.00 0.00 0.00 0.00 54.91 53.99 2duw h ALA 110 Cb 0.35 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.07 2duw h ALA 110 CO 0.02 0.87 -1.00 0.28 0.00 0.00 0.00 179.25 179.42 2duw h VAL 111 N 0.10 1.32 0.36 0.00 2.07 -1.02 -2.62 116.25 116.47 2duw h VAL 111 Ca -0.03 -2.29 -0.01 0.00 0.82 0.00 0.00 66.70 65.20 2duw h VAL 111 Cb 1.37 2.56 -0.03 0.00 -1.52 0.00 0.00 31.29 33.68 2duw h VAL 111 CO 0.12 0.69 -0.50 0.25 0.02 0.00 0.00 177.57 178.15 2duw h LEU 112 N 0.22 -1.43 -1.63 2.57 5.85 -1.42 -0.39 115.31 119.07 2duw h LEU 112 Ca -0.14 0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.69 2duw h LEU 112 Cb 1.68 0.49 -0.01 0.00 0.37 0.00 0.00 40.66 43.19 2duw h LEU 112 CO 0.19 -0.62 0.00 0.00 -0.34 0.00 0.00 178.44 177.68 2duw h ALA 113 N -0.80 1.71 -0.36 1.25 0.00 -1.68 -1.99 119.26 117.39 2duw h ALA 113 Ca -0.04 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 2duw h ALA 113 Cb 0.82 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 2duw h ALA 113 CO -0.14 0.23 0.05 0.00 0.00 0.00 0.00 179.25 179.39 2duw h ARG 114 N 0.23 0.54 -0.82 0.00 3.08 -0.97 0.26 114.38 116.70 2duw h ARG 114 Ca 0.06 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 60.01 2duw h ARG 114 Cb 0.16 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 30.08 2duw h ARG 114 CO 0.00 0.52 0.52 0.93 -1.07 0.00 0.00 179.97 180.88 2duw h GLU 115 N 0.52 1.10 0.00 0.04 5.08 -0.30 -2.59 114.58 118.44 2duw h GLU 115 Ca 0.12 -0.08 -0.11 0.00 -1.00 0.00 0.00 59.36 58.29 2duw h GLU 115 Cb 0.25 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 29.25 2duw h GLU 115 CO 0.00 0.75 -0.95 0.00 -1.00 0.00 0.00 179.01 177.81 2duw h ALA 116 N 1.29 0.66 0.00 3.43 0.00 -1.50 -3.48 119.26 119.66 2duw h ALA 116 Ca 0.30 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2duw h ALA 116 Cb -0.09 0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2duw h ALA 116 CO -0.06 0.61 0.00 0.41 0.00 0.00 0.00 179.25 180.21 2duw n GLY 117 N 1.28 0.36 3.44 0.00 0.00 0.81 -5.07 105.19 106.01 2duw n GLY 117 Ca -0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.64 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 0.27 -4.48 0.99 7.94 -0.50 -4.87 117.00 116.34 2duw n LEU 118 Ca 0.00 0.46 -0.43 0.00 -1.11 0.00 0.00 56.01 54.94 2duw n LEU 118 Cb 0.00 -1.21 -0.03 0.00 0.53 0.00 0.00 43.42 42.71 2duw n LEU 118 CO 0.00 -3.39 0.99 -0.55 -1.11 0.00 0.00 177.39 173.33 2duw s SER 119 N -1.71 6.34 -0.20 1.96 0.15 -1.25 -4.51 113.70 114.47 2duw s SER 119 Ca 0.61 -1.26 -0.19 0.00 0.70 0.00 0.00 55.95 55.82 2duw s SER 119 Cb -0.28 -2.46 -0.03 0.00 -1.71 0.00 0.00 66.02 61.54 2duw s SER 119 CO 0.63 -1.41 0.52 0.54 1.20 0.00 0.00 173.24 174.72 2duw s VAL 120 N 4.10 5.10 -0.24 4.45 0.11 -1.26 -0.77 120.40 131.89 2duw s VAL 120 Ca 0.31 0.96 -0.02 0.00 -2.93 0.00 0.00 61.98 60.30 2duw s VAL 120 Cb -0.10 -3.85 0.08 0.00 -1.53 0.00 0.00 36.38 30.98 2duw s VAL 120 CO 0.03 0.17 0.06 -0.69 -3.33 0.00 0.00 175.10 171.33 2duw s VAL 121 N 1.68 0.66 0.57 2.04 1.01 -0.32 -4.98 120.40 121.06 2duw s VAL 121 Ca 0.24 -0.91 0.05 0.00 0.00 0.00 0.00 61.98 61.37 2duw s VAL 121 Cb -0.15 -1.30 0.05 0.00 0.00 0.00 0.00 36.38 34.98 2duw s VAL 121 CO 0.10 -0.41 0.44 0.00 0.00 0.00 0.00 175.10 175.22 2duw s MET 122 N 1.77 2.23 -1.40 2.72 0.23 -1.26 -1.63 119.30 121.95 2duw s MET 122 Ca 0.03 -2.07 -0.10 0.00 -1.03 0.00 0.00 55.69 52.53 2duw s MET 122 Cb -0.17 -2.10 0.07 0.00 -1.53 0.00 0.00 34.83 31.10 2duw s MET 122 CO -0.16 -0.70 0.62 -3.47 -2.03 0.00 0.00 175.02 169.28 2duw n ASP 123 N -1.84 -4.35 -3.72 -1.18 2.03 -0.97 -4.88 116.55 101.64 2duw n ASP 123 Ca -0.02 -0.48 -0.12 0.00 0.52 0.00 0.00 54.79 54.70 2duw n ASP 123 Cb 0.64 -3.55 -0.10 0.00 -0.72 0.00 0.00 41.12 37.39 2duw n ASP 123 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2duw s ARG 124 N -6.12 0.43 -0.04 -0.67 1.81 -1.23 -4.22 118.95 108.91 2duw s ARG 124 Ca 0.45 0.63 0.01 0.00 -1.72 0.00 0.00 55.73 55.10 2duw s ARG 124 Cb -0.23 0.13 0.02 0.00 -0.45 0.00 0.00 34.95 34.42 2duw s ARG 124 CO 0.56 -0.09 -0.04 0.00 -0.68 0.00 0.00 175.30 175.05 2duw h PRO 126 N 7.08 0.00 -0.55 0.00 0.13 -1.97 -1.64 132.00 135.05 2duw h PRO 126 Ca -0.39 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.71 2duw h PRO 126 Cb 1.15 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.25 2duw h PRO 126 CO 0.48 0.13 0.23 0.00 -0.23 0.00 0.00 178.00 178.60 2duw h ALA 127 N 1.87 1.37 0.00 -0.56 0.00 -2.00 -0.89 119.26 119.04 2duw h ALA 127 Ca -0.00 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 2duw h ALA 127 Cb 0.59 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2duw h ALA 127 CO 0.02 0.48 -1.93 -0.89 0.00 0.00 0.00 179.25 176.93 2duw n ILE 128 N -4.34 0.19 0.13 0.00 2.08 -1.13 -4.25 119.36 112.04 2duw n ILE 128 Ca 0.05 -0.54 -0.01 0.00 0.56 0.00 0.00 62.75 62.81 2duw n ILE 128 Cb 0.15 -0.08 0.12 0.00 -0.75 0.00 0.00 39.64 39.08 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 0.50 0.38 4.81 -1.10 -2.73 114.58 116.44 2duw h GLU 129 Ca -0.05 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.16 2duw h GLU 129 Cb 1.11 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.50 2duw h GLU 129 CO 0.00 0.65 -0.24 1.25 -0.73 0.00 0.00 179.01 179.94 2duw h LEU 130 N 0.00 -0.57 0.00 1.64 5.85 -1.34 -3.06 115.31 117.83 2duw h LEU 130 Ca -0.01 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.65 2duw h LEU 130 Cb 1.25 0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.43 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 0.15 -0.13 5.25 -0.04 -1.25 -3.29 135.00 130.44 2duw n PRO 131 Ca -0.10 0.18 0.27 0.00 -0.04 0.00 0.00 63.50 63.80 2duw n PRO 131 Cb 0.31 -1.50 0.72 0.00 -0.04 0.00 0.00 33.50 32.99 2duw n PRO 131 CO 0.00 0.00 0.00 0.07 -0.04 0.00 0.00 175.50 175.53 2duw h ARG 132 N 0.00 0.00 0.00 0.54 0.11 -1.37 -1.82 114.38 111.84 2duw h ARG 132 Ca 0.00 0.00 -0.27 0.00 0.10 0.00 0.00 59.98 59.81 2duw h ARG 132 Cb 0.17 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 31.20 2duw h ARG 132 CO 0.00 0.00 -2.00 1.28 0.10 0.00 0.00 179.97 179.35 2duw n LEU 133 N -4.26 0.15 0.00 0.08 4.77 -1.21 -5.03 117.00 111.50 2duw n LEU 133 Ca 0.16 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 2duw n LEU 133 Cb 0.88 0.31 0.00 0.00 -2.33 0.00 0.00 43.42 42.28 2duw n LEU 133 CO 0.38 0.38 0.00 0.61 -1.33 0.00 0.00 177.39 177.43 2duw n GLY 134 N 2.13 1.14 0.07 -0.72 0.00 -0.69 -5.03 105.19 102.10 2duw n GLY 134 Ca -0.24 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.77 2duw n GLY 134 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2duw n LEU 135 N 0.00 0.20 -4.61 0.99 4.77 -1.26 -4.97 117.00 112.11 2duw n LEU 135 Ca 0.00 0.09 -0.43 0.00 -0.03 0.00 0.00 56.01 55.63 2duw n LEU 135 Cb 0.00 0.24 -0.01 0.00 -2.33 0.00 0.00 43.42 41.33 2duw n LEU 135 CO 0.00 0.26 0.63 0.00 -1.33 0.00 0.00 177.39 176.95 2duw n ALA 136 N -2.51 0.17 0.00 -1.18 0.00 -1.26 -5.06 120.51 110.67 2duw n ALA 136 Ca -0.18 0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.59 2duw n ALA 136 Cb 0.90 -2.08 0.00 0.00 0.00 0.00 0.00 19.45 18.27 2duw n ALA 136 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13