#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 1.40 -0.83 0.03 0.00 -1.26 -5.08 119.74 114.00 2duw s LYS 2 Ca 0.00 -0.61 0.01 0.00 0.00 0.00 0.00 55.97 55.38 2duw s LYS 2 Cb 0.00 -1.34 0.26 0.00 0.00 0.00 0.00 37.83 36.75 2duw s LYS 2 CO 0.00 0.36 1.00 -1.91 0.00 0.00 0.00 175.35 174.79 2duw n GLU 3 N 2.69 3.19 -4.07 1.78 2.13 -1.26 -5.02 120.64 120.08 2duw n GLU 3 Ca -0.15 -4.60 -0.18 0.00 0.66 0.00 0.00 57.16 52.88 2duw n GLU 3 Cb 0.54 -2.37 -0.07 0.00 0.27 0.00 0.00 31.44 29.81 2duw n GLU 3 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2duw n ASN 4 N 1.24 -0.56 -0.01 4.31 3.02 -1.26 -5.07 115.26 116.94 2duw n ASN 4 Ca 0.27 -3.02 0.06 0.00 -0.03 0.00 0.00 54.58 51.86 2duw n ASN 4 Cb 0.38 1.52 -0.10 0.00 -0.61 0.00 0.00 39.78 40.96 2duw n ASN 4 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 2duw n ASP 5 N -1.78 2.12 -0.02 6.41 5.75 -1.26 -4.49 116.55 123.28 2duw n ASP 5 Ca 0.07 -0.01 0.23 0.00 -0.01 0.00 0.00 54.79 55.07 2duw n ASP 5 Cb 0.56 1.57 0.72 0.00 -1.03 0.00 0.00 41.12 42.94 2duw n ASP 5 CO 0.00 0.00 0.00 0.16 -0.11 0.00 0.00 177.20 177.25 2duw h ILE 6 N 0.00 0.46 -0.86 2.12 3.07 -1.97 0.70 117.51 121.03 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 0.57 0.60 -0.06 0.00 -0.27 0.00 0.00 36.82 37.66 2duw h ILE 6 CO 0.00 0.00 0.56 0.00 -1.05 0.00 0.00 178.15 177.66 2duw h ALA 7 N 1.51 1.81 0.02 0.16 0.00 -1.99 0.26 119.26 121.02 2duw h ALA 7 Ca 0.29 0.01 -0.20 0.00 0.00 0.00 0.00 54.91 55.01 2duw h ALA 7 Cb 1.36 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 2duw h ALA 7 CO -0.00 -0.02 -0.92 0.78 0.00 0.00 0.00 179.25 179.09 2duw h GLY 8 N 0.71 0.18 1.60 0.00 0.00 -1.18 -1.43 103.07 102.95 2duw h GLY 8 Ca 0.42 -0.35 -0.22 0.00 0.00 0.00 0.00 47.33 47.18 2duw h GLY 8 CO -0.18 0.31 -0.92 -2.22 0.00 0.00 0.00 176.54 173.52 2duw h ILE 9 N 0.08 1.42 0.00 2.60 5.03 -1.20 -0.87 117.51 124.58 2duw h ILE 9 Ca -0.05 -2.48 -0.21 0.00 -0.12 0.00 0.00 64.86 62.00 2duw h ILE 9 Cb 1.58 2.43 -0.03 0.00 -3.03 0.00 0.00 36.82 37.76 2duw h ILE 9 CO 0.14 0.74 -1.04 0.17 -0.68 0.00 0.00 178.15 177.48 2duw h LEU 10 N 0.20 0.00 0.00 1.44 8.10 -0.60 -2.62 115.31 121.83 2duw h LEU 10 Ca -0.07 -0.00 -0.11 0.00 0.11 0.00 0.00 57.88 57.81 2duw h LEU 10 Cb 1.56 -0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 41.76 2duw h LEU 10 CO 0.16 1.00 -0.74 0.00 -4.11 0.00 0.00 178.44 174.75 2duw h THR 11 N 0.00 0.64 0.00 0.15 1.03 -1.29 -3.39 112.91 110.05 2duw h THR 11 Ca -0.03 -1.98 0.00 0.00 -0.01 0.00 0.00 66.41 64.39 2duw h THR 11 Cb 1.78 2.22 0.00 0.00 -1.07 0.00 0.00 68.15 71.09 2duw h THR 11 CO 0.13 0.37 -0.05 -1.28 -0.01 0.00 0.00 175.52 174.68 2duw h SER 12 N 0.00 0.00 -4.27 0.00 0.87 -1.20 -3.48 113.55 105.47 2duw h SER 12 Ca -0.05 0.00 -0.50 0.00 -1.23 0.00 0.00 61.79 60.01 2duw h SER 12 Cb 1.38 0.00 -0.28 0.00 -0.44 0.00 0.00 62.40 63.07 2duw h SER 12 CO 0.05 0.25 -0.82 0.28 -0.53 0.00 0.00 176.83 176.06 2duw s THR 13 N -1.31 1.24 -0.34 2.23 -1.32 -0.99 -5.09 115.64 110.07 2duw s THR 13 Ca -0.01 -0.80 0.00 0.00 -1.21 0.00 0.00 61.69 59.67 2duw s THR 13 Cb 0.00 -1.06 0.08 0.00 -1.51 0.00 0.00 72.50 70.02 2duw s THR 13 CO 0.02 0.25 0.05 -0.13 -2.21 0.00 0.00 174.62 172.60 2duw s ARG 14 N -0.64 2.01 -0.03 7.08 3.00 -1.26 -4.25 118.95 124.86 2duw s ARG 14 Ca 0.05 -1.61 -0.00 0.00 0.00 0.00 0.00 55.73 54.17 2duw s ARG 14 Cb -0.07 -3.26 0.03 0.00 0.00 0.00 0.00 34.95 31.66 2duw s ARG 14 CO 0.00 -0.83 0.02 0.99 0.00 0.00 0.00 175.30 175.48 2duw s THR 15 N 1.10 0.02 -0.10 0.02 2.01 -1.26 -4.64 115.64 112.78 2duw s THR 15 Ca 0.03 0.19 0.03 0.00 0.31 0.00 0.00 61.69 62.24 2duw s THR 15 Cb -0.20 -0.16 -0.01 0.00 0.01 0.00 0.00 72.50 72.14 2duw s THR 15 CO -0.05 0.12 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.19 2duw s ILE 16 N 1.17 2.57 0.00 1.82 1.09 0.14 -1.06 121.20 126.94 2duw s ILE 16 Ca -0.08 -0.85 0.07 0.00 -1.10 0.00 0.00 60.65 58.69 2duw s ILE 16 Cb -0.13 -2.02 -0.02 0.00 -1.06 0.00 0.00 42.46 39.23 2duw s ILE 16 CO -0.03 0.55 -0.22 0.00 -0.10 0.00 0.00 174.94 175.14 2duw s ALA 17 N 0.16 1.83 -0.09 9.38 0.00 -0.39 -0.32 121.76 132.33 2duw s ALA 17 Ca -0.10 -0.99 0.02 0.00 0.00 0.00 0.00 51.96 50.88 2duw s ALA 17 Cb -0.16 -0.43 -0.02 0.00 0.00 0.00 0.00 23.12 22.51 2duw s ALA 17 CO 0.06 0.44 -0.14 -1.17 0.00 0.00 0.00 175.76 174.94 2duw s LEU 18 N -0.73 2.68 -0.16 0.00 2.96 -0.89 -1.59 118.68 120.95 2duw s LEU 18 Ca 0.08 -0.28 -0.07 0.00 -0.22 0.00 0.00 54.13 53.64 2duw s LEU 18 Cb -0.09 -1.57 -0.04 0.00 0.50 0.00 0.00 46.19 44.99 2duw s LEU 18 CO 0.00 0.25 0.06 -0.69 -1.32 0.00 0.00 176.35 174.65 2duw s VAL 19 N -0.15 4.83 -0.70 1.68 1.01 -1.25 -0.06 120.40 125.76 2duw s VAL 19 Ca -0.01 -0.03 -0.00 0.00 0.00 0.00 0.00 61.98 61.94 2duw s VAL 19 Cb -0.14 -3.15 0.00 0.00 0.00 0.00 0.00 36.38 33.09 2duw s VAL 19 CO 0.03 0.50 0.58 0.61 0.00 0.00 0.00 175.10 176.82 2duw n GLY 20 N 3.19 -0.01 3.80 4.51 0.00 -0.03 -4.58 105.19 112.06 2duw n GLY 20 Ca -0.17 -0.15 -0.37 0.00 0.00 0.00 0.00 46.02 45.33 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 -3.21 3.41 0.25 4.61 0.00 -1.23 -4.97 121.76 120.62 2duw s ALA 21 Ca 0.02 0.22 -0.02 0.00 0.00 0.00 0.00 51.96 52.18 2duw s ALA 21 Cb -0.01 -2.86 0.01 0.00 0.00 0.00 0.00 23.12 20.26 2duw s ALA 21 CO 0.42 0.31 0.37 -1.13 0.00 0.00 0.00 175.76 175.73 2duw n SER 22 N 0.94 -1.03 -2.18 0.00 3.41 -1.26 -4.55 113.62 108.95 2duw n SER 22 Ca -0.03 -2.27 -0.24 0.00 -0.26 0.00 0.00 58.87 56.07 2duw n SER 22 Cb 0.50 1.87 0.02 0.00 -0.26 0.00 0.00 64.21 66.35 2duw n SER 22 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2duw n ASP 23 N -1.72 6.74 -4.19 4.04 5.68 -1.26 -4.81 116.55 121.03 2duw n ASP 23 Ca -0.00 -3.27 -0.40 0.00 -0.50 0.00 0.00 54.79 50.61 2duw n ASP 23 Cb 0.40 -1.09 -0.07 0.00 -1.14 0.00 0.00 41.12 39.22 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 -2.25 2.89 0.00 0.11 -0.14 -1.26 -4.90 119.74 114.19 2duw s LYS 24 Ca 0.45 -2.40 0.14 0.00 -1.36 0.00 0.00 55.97 52.81 2duw s LYS 24 Cb 0.34 -3.98 0.69 0.00 -1.68 0.00 0.00 37.83 33.19 2duw s LYS 24 CO -0.09 -1.21 1.42 -0.35 -0.76 0.00 0.00 175.35 174.36 2duw n PRO 25 N 3.84 0.13 -1.01 -1.68 -0.04 -1.26 -2.37 135.00 132.60 2duw n PRO 25 Ca 0.08 0.19 -0.04 0.00 -0.04 0.00 0.00 63.50 63.69 2duw n PRO 25 Cb 0.41 -1.50 0.33 0.00 -0.04 0.00 0.00 33.50 32.70 2duw n PRO 25 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2duw n ASP 26 N -1.37 5.03 -4.43 3.54 8.00 -1.26 -4.73 116.55 121.32 2duw n ASP 26 Ca 0.06 -3.18 -0.25 0.00 0.71 0.00 0.00 54.79 52.12 2duw n ASP 26 Cb 0.14 -0.74 -0.11 0.00 -0.02 0.00 0.00 41.12 40.39 2duw n ASP 26 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2duw s ARG 27 N -2.97 1.55 0.47 -1.24 0.52 -1.00 -5.03 118.95 111.25 2duw s ARG 27 Ca 0.55 -1.62 0.25 0.00 -0.52 0.00 0.00 55.73 54.40 2duw s ARG 27 Cb 0.44 -1.74 1.08 0.00 0.52 0.00 0.00 34.95 35.25 2duw s ARG 27 CO 0.14 0.35 1.90 -1.00 0.02 0.00 0.00 175.30 176.71 2duw h PRO 28 N 2.80 0.00 0.00 3.54 0.13 -1.92 -2.60 132.00 133.95 2duw h PRO 28 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2duw h PRO 28 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2duw h PRO 28 CO 0.54 0.19 0.00 0.77 -0.23 0.00 0.00 178.00 179.27 2duw h SER 29 N 0.00 0.00 0.02 1.44 0.02 -1.91 -3.16 113.55 109.96 2duw h SER 29 Ca -0.00 0.00 -0.16 0.00 -0.84 0.00 0.00 61.79 60.79 2duw h SER 29 Cb 0.63 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.15 2duw h SER 29 CO 0.02 0.00 -0.87 0.22 -1.14 0.00 0.00 176.83 175.06 2duw h TYR 30 N 0.00 0.07 -0.91 3.45 5.03 -1.69 -3.04 116.97 119.89 2duw h TYR 30 Ca 0.00 -0.05 0.16 0.00 2.58 0.00 0.00 58.73 61.42 2duw h TYR 30 Cb 0.83 -0.00 -0.07 0.00 1.55 0.00 0.00 36.73 39.04 2duw h TYR 30 CO 0.00 1.34 0.58 0.07 -1.32 0.00 0.00 178.16 178.83 2duw h ARG 31 N -0.88 0.60 0.02 1.82 0.11 -1.60 0.26 114.38 114.71 2duw h ARG 31 Ca -0.23 -0.04 -0.21 0.00 0.10 0.00 0.00 59.98 59.61 2duw h ARG 31 Cb 1.28 -0.14 -0.01 0.00 1.11 0.00 0.00 29.97 32.22 2duw h ARG 31 CO -0.10 0.40 -0.93 0.28 0.10 0.00 0.00 179.97 179.72 2duw h VAL 32 N 0.62 1.49 0.51 0.08 2.07 -1.69 -2.79 116.25 116.55 2duw h VAL 32 Ca 0.47 -2.66 -0.02 0.00 0.82 0.00 0.00 66.70 65.30 2duw h VAL 32 Cb 0.86 2.52 0.00 0.00 -1.52 0.00 0.00 31.29 33.15 2duw h VAL 32 CO -0.22 0.78 -0.25 -0.03 0.02 0.00 0.00 177.57 177.87 2duw h MET 33 N 0.12 -0.67 -0.05 1.57 4.05 -0.84 -1.65 114.93 117.46 2duw h MET 33 Ca -0.06 0.05 0.01 0.00 -0.28 0.00 0.00 59.70 59.42 2duw h MET 33 Cb 1.58 0.15 -0.00 0.00 -0.80 0.00 0.00 31.60 32.53 2duw h MET 33 CO 0.15 -0.45 0.05 -0.22 0.23 0.00 0.00 176.91 176.67 2duw h LYS 34 N -0.70 0.00 -0.30 0.39 1.63 -1.54 -1.85 116.57 114.20 2duw h LYS 34 Ca -0.07 0.00 -0.03 0.00 -0.85 0.00 0.00 60.65 59.70 2duw h LYS 34 Cb 0.54 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.16 2duw h LYS 34 CO 0.11 0.00 0.07 -0.92 -3.45 0.00 0.00 179.45 175.26 2duw h TYR 35 N 0.00 0.51 -0.03 1.91 3.20 -1.21 0.20 116.97 121.56 2duw h TYR 35 Ca 0.02 -0.06 -0.14 0.00 3.14 0.00 0.00 58.73 61.69 2duw h TYR 35 Cb 0.12 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.23 2duw h TYR 35 CO 0.00 0.55 -0.64 -0.07 -1.64 0.00 0.00 178.16 176.36 2duw h LEU 36 N 0.33 0.13 -0.12 2.82 3.38 -0.53 -2.36 115.31 118.94 2duw h LEU 36 Ca 0.09 -0.08 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 2duw h LEU 36 Cb 0.30 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 2duw h LEU 36 CO 0.00 0.73 -0.14 -0.07 0.09 0.00 0.00 178.44 179.06 2duw h LEU 37 N 0.08 0.34 -1.15 1.67 3.38 -1.18 -1.62 115.31 116.83 2duw h LEU 37 Ca -0.01 -0.49 -0.07 0.00 0.09 0.00 0.00 57.88 57.40 2duw h LEU 37 Cb 1.14 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.78 2duw h LEU 37 CO 0.09 0.76 -0.13 -0.78 0.09 0.00 0.00 178.44 178.47 2duw h ASP 38 N -0.08 0.42 0.45 -0.43 3.58 -0.97 -2.22 116.42 117.16 2duw h ASP 38 Ca 0.02 -0.11 -0.03 0.00 0.42 0.00 0.00 57.03 57.33 2duw h ASP 38 Cb 0.68 -0.11 -0.00 0.00 1.72 0.00 0.00 39.33 41.61 2duw h ASP 38 CO 0.03 0.59 -0.16 1.56 -2.88 0.00 0.00 179.24 178.38 2duw h GLN 39 N 0.41 0.00 0.00 0.28 1.08 -1.38 -3.46 115.11 112.03 2duw h GLN 39 Ca 0.08 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.28 2duw h GLN 39 Cb 0.48 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.91 2duw h GLN 39 CO 0.03 0.16 0.00 0.41 -0.95 0.00 0.00 178.83 178.48 2duw n GLY 40 N -0.55 0.66 2.52 3.46 0.00 -0.84 -5.09 105.19 105.37 2duw n GLY 40 Ca -0.02 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.78 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 0.74 -3.72 1.61 4.02 -0.63 -5.04 117.16 114.14 2duw n TYR 41 Ca 0.00 -1.76 -0.38 0.00 -0.01 0.00 0.00 57.90 55.75 2duw n TYR 41 Cb 0.00 -0.21 -0.12 0.00 -0.02 0.00 0.00 39.34 38.99 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 -2.32 3.24 -0.16 -0.72 2.46 -1.26 -4.71 115.29 111.82 2duw s HIS 42 Ca 0.02 -1.29 -0.06 0.00 0.47 0.00 0.00 55.06 54.19 2duw s HIS 42 Cb 0.00 -2.31 -0.04 0.00 -0.13 0.00 0.00 32.58 30.10 2duw s HIS 42 CO 0.01 -0.70 0.05 0.08 -2.47 0.00 0.00 174.74 171.71 2duw s VAL 43 N 1.44 4.69 -0.57 0.89 1.01 -1.25 -0.68 120.40 125.93 2duw s VAL 43 Ca -0.01 -0.08 0.05 0.00 0.00 0.00 0.00 61.98 61.95 2duw s VAL 43 Cb -0.19 -3.09 0.19 0.00 0.00 0.00 0.00 36.38 33.29 2duw s VAL 43 CO 0.04 0.49 0.48 -0.38 0.00 0.00 0.00 175.10 175.73 2duw n ILE 44 N 3.26 0.57 -2.23 2.22 5.41 0.57 -4.87 119.36 124.29 2duw n ILE 44 Ca -0.17 -4.36 -0.41 0.00 1.00 0.00 0.00 62.75 58.81 2duw n ILE 44 Cb 0.53 -1.98 -0.03 0.00 -0.71 0.00 0.00 39.64 37.45 2duw n ILE 44 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 2duw s PRO 45 N -1.07 4.41 -0.09 0.38 0.04 -1.26 -2.09 135.00 135.31 2duw s PRO 45 Ca 0.30 2.05 -0.00 0.00 0.04 0.00 0.00 61.00 63.39 2duw s PRO 45 Cb 0.03 -3.17 0.02 0.00 0.04 0.00 0.00 34.50 31.42 2duw s PRO 45 CO -0.15 -0.19 -0.07 0.08 0.04 0.00 0.00 177.00 176.71 2duw s VAL 46 N -0.22 0.89 0.01 -0.36 1.01 0.91 -3.83 120.40 118.80 2duw s VAL 46 Ca 0.54 -0.23 -0.10 0.00 0.00 0.00 0.00 61.98 62.19 2duw s VAL 46 Cb -0.36 -0.92 0.01 0.00 0.00 0.00 0.00 36.38 35.11 2duw s VAL 46 CO 0.41 0.34 0.21 -0.55 0.00 0.00 0.00 175.10 175.50 2duw s SER 47 N 1.56 -0.03 0.00 3.32 0.15 0.11 -0.85 113.70 117.95 2duw s SER 47 Ca 0.01 -0.18 0.14 0.00 0.70 0.00 0.00 55.95 56.62 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 -0.06 -0.46 1.44 -0.81 1.20 0.00 0.00 173.24 174.56 2duw n PRO 48 N 1.12 0.05 -0.07 5.44 -0.04 -1.25 -2.52 135.00 137.72 2duw n PRO 48 Ca -0.21 0.23 -0.08 0.00 -0.04 0.00 0.00 63.50 63.40 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 1.38 0.00 0.54 5.02 -1.26 -4.40 118.16 118.00 2duw n LYS 49 Ca 0.04 0.02 0.14 0.00 -2.02 0.00 0.00 58.31 56.50 2duw n LYS 49 Cb 0.15 -1.35 0.77 0.00 -0.02 0.00 0.00 35.03 34.58 2duw n LYS 49 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 2duw n VAL 50 N -2.65 0.05 -1.55 -0.18 0.24 -1.12 -4.76 118.33 108.36 2duw n VAL 50 Ca -0.25 0.01 -0.29 0.00 -2.04 0.00 0.00 64.34 61.78 2duw n VAL 50 Cb 0.92 -0.54 -0.04 0.00 -1.47 0.00 0.00 33.84 32.70 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 -1.20 0.63 0.00 2.33 0.00 -1.05 -0.69 120.51 120.54 2duw n ALA 51 Ca 0.16 -1.09 0.00 0.00 0.00 0.00 0.00 53.44 52.51 2duw n ALA 51 Cb 0.19 -3.23 0.00 0.00 0.00 0.00 0.00 19.45 16.41 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 6.27 1.38 3.19 0.00 0.00 -1.24 -4.85 105.19 109.94 2duw n GLY 52 Ca 0.41 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.31 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 -0.14 0.98 -0.24 1.61 1.02 0.13 -5.00 119.74 118.10 2duw s LYS 53 Ca 0.00 -1.45 0.00 0.00 0.02 0.00 0.00 55.97 54.54 2duw s LYS 53 Cb 0.00 -0.07 0.06 0.00 -0.52 0.00 0.00 37.83 37.30 2duw s LYS 53 CO 0.00 -0.15 -0.02 0.99 -0.92 0.00 0.00 175.35 175.25 2duw s THR 54 N -3.79 1.32 -0.10 2.17 2.01 -1.26 -0.10 115.64 115.89 2duw s THR 54 Ca 0.21 -1.15 -0.01 0.00 0.31 0.00 0.00 61.69 61.05 2duw s THR 54 Cb 0.07 -1.68 -0.03 0.00 0.01 0.00 0.00 72.50 70.87 2duw s THR 54 CO 0.01 -0.18 -0.06 -1.48 -0.69 0.00 0.00 174.62 172.21 2duw s LEU 55 N 1.48 3.15 -2.13 4.42 0.05 -0.41 -4.48 118.68 120.76 2duw s LEU 55 Ca -0.03 -0.09 0.00 0.00 0.05 0.00 0.00 54.13 54.06 2duw s LEU 55 Cb -0.18 -1.71 0.00 0.00 -2.05 0.00 0.00 46.19 42.24 2duw s LEU 55 CO -0.08 0.28 0.00 0.18 -0.55 0.00 0.00 176.35 176.18 2duw n LEU 56 N 2.80 -1.49 0.00 1.48 4.77 -1.26 -0.35 117.00 122.95 2duw n LEU 56 Ca -0.18 0.48 0.00 0.00 -0.03 0.00 0.00 56.01 56.28 2duw n LEU 56 Cb 0.53 -2.79 0.00 0.00 -2.33 0.00 0.00 43.42 38.83 2duw n LEU 56 CO 0.29 -1.02 0.00 0.61 -1.33 0.00 0.00 177.39 175.94 2duw n GLY 57 N -0.40 0.77 3.69 -0.72 0.00 -1.26 -5.04 105.19 102.23 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 -0.31 3.49 0.30 1.61 -1.52 0.52 -5.09 119.66 118.67 2duw s GLN 58 Ca 0.00 -0.34 -0.29 0.00 -1.95 0.00 0.00 55.36 52.79 2duw s GLN 58 Cb 0.00 -3.03 -0.09 0.00 -0.22 0.00 0.00 33.01 29.66 2duw s GLN 58 CO 0.00 0.53 1.11 -1.14 -0.25 0.00 0.00 175.29 175.54 2duw s GLN 59 N -0.36 4.54 0.17 2.91 2.00 -1.26 -1.29 119.66 126.37 2duw s GLN 59 Ca 0.09 1.80 -0.01 0.00 -2.00 0.00 0.00 55.36 55.23 2duw s GLN 59 Cb -0.12 -3.09 -0.04 0.00 0.80 0.00 0.00 33.01 30.56 2duw s GLN 59 CO 0.02 0.13 0.36 0.20 -0.50 0.00 0.00 175.29 175.49 2duw s GLY 60 N -0.95 1.90 -0.00 2.59 0.00 0.86 -4.47 107.32 107.25 2duw s GLY 60 Ca 0.47 -0.81 0.00 0.00 0.00 0.00 0.00 44.72 44.38 2duw s GLY 60 CO 0.40 -0.76 0.00 -0.19 0.00 0.00 0.00 173.10 172.55 2duw s TYR 61 N -1.78 0.02 0.35 1.90 2.02 -1.25 -3.69 117.35 114.93 2duw s TYR 61 Ca 0.38 0.02 0.09 0.00 -0.37 0.00 0.00 57.07 57.19 2duw s TYR 61 Cb -0.11 -0.05 0.66 0.00 -0.40 0.00 0.00 41.96 42.06 2duw s TYR 61 CO 0.28 -0.02 1.83 0.00 -1.57 0.00 0.00 175.55 176.07 2duw h ALA 62 N 6.36 1.35 -2.59 3.71 0.00 -1.87 0.30 119.26 126.53 2duw h ALA 62 Ca -0.28 -0.30 -0.12 0.00 0.00 0.00 0.00 54.91 54.21 2duw h ALA 62 Cb 1.19 -0.08 -0.20 0.00 0.00 0.00 0.00 17.79 18.70 2duw h ALA 62 CO 0.50 0.45 -0.34 0.95 0.00 0.00 0.00 179.25 180.81 2duw s THR 63 N -4.43 0.07 -0.36 0.00 -4.23 -1.26 -3.94 115.64 101.49 2duw s THR 63 Ca -0.05 -0.58 0.24 0.00 -1.18 0.00 0.00 61.69 60.12 2duw s THR 63 Cb 0.15 -0.60 0.25 0.00 1.34 0.00 0.00 72.50 73.64 2duw s THR 63 CO 0.74 -0.32 1.73 0.17 -0.54 0.00 0.00 174.62 176.40 2duw h LEU 64 N 3.91 0.00 -2.02 4.79 8.10 -1.93 -1.60 115.31 126.57 2duw h LEU 64 Ca -0.30 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.69 2duw h LEU 64 Cb 1.18 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.40 2duw h LEU 64 CO 0.41 0.00 0.00 0.00 -4.11 0.00 0.00 178.44 174.74 2duw n ALA 65 N -1.80 2.59 -0.02 0.17 0.00 -1.26 -3.87 120.51 116.33 2duw n ALA 65 Ca 0.01 -0.96 0.03 0.00 0.00 0.00 0.00 53.44 52.52 2duw n ALA 65 Cb 0.19 -0.98 -0.08 0.00 0.00 0.00 0.00 19.45 18.58 2duw n ALA 65 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2duw n ASP 66 N 0.89 2.61 -4.73 0.00 8.00 -0.60 -4.99 116.55 117.74 2duw n ASP 66 Ca 0.17 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 55.26 2duw n ASP 66 Cb 0.51 1.28 -0.04 0.00 -0.02 0.00 0.00 41.12 42.85 2duw n ASP 66 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2duw s VAL 67 N -2.59 4.28 0.11 2.53 0.11 -1.24 -4.96 120.40 118.63 2duw s VAL 67 Ca -0.04 1.81 -0.14 0.00 -2.93 0.00 0.00 61.98 60.68 2duw s VAL 67 Cb 0.06 -4.16 -0.08 0.00 -1.53 0.00 0.00 36.38 30.67 2duw s VAL 67 CO 0.42 0.24 1.43 1.55 -3.33 0.00 0.00 175.10 175.41 2duw h PRO 68 N 5.89 0.75 -6.25 1.54 0.13 -1.94 -3.43 132.00 128.70 2duw h PRO 68 Ca -0.43 -0.39 -0.55 0.00 -0.87 0.00 0.00 66.00 63.75 2duw h PRO 68 Cb 1.21 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 2duw h PRO 68 CO 0.74 1.02 1.09 -2.00 -0.23 0.00 0.00 178.00 178.62 2duw s GLU 69 N -4.37 4.09 0.25 0.86 2.12 -1.26 -4.97 118.70 115.42 2duw s GLU 69 Ca -0.12 2.03 -0.30 0.00 0.36 0.00 0.00 54.97 56.95 2duw s GLU 69 Cb 0.09 -3.98 -0.09 0.00 0.26 0.00 0.00 34.13 30.41 2duw s GLU 69 CO 0.84 -0.95 1.20 -1.59 -0.54 0.00 0.00 175.26 174.22 2duw s LYS 70 N 4.16 4.50 0.18 4.30 0.00 -1.26 -5.02 119.74 126.60 2duw s LYS 70 Ca 0.72 1.94 -0.16 0.00 0.00 0.00 0.00 55.97 58.47 2duw s LYS 70 Cb -0.31 -3.18 -0.07 0.00 0.00 0.00 0.00 37.83 34.27 2duw s LYS 70 CO 0.28 -0.03 0.62 0.08 0.00 0.00 0.00 175.35 176.30 2duw s VAL 71 N -0.61 4.74 -0.04 1.79 1.01 -1.26 -4.98 120.40 121.04 2duw s VAL 71 Ca 0.50 1.00 0.08 0.00 0.00 0.00 0.00 61.98 63.56 2duw s VAL 71 Cb -0.34 -3.78 -0.12 0.00 0.00 0.00 0.00 36.38 32.14 2duw s VAL 71 CO 0.42 0.22 0.11 0.47 0.00 0.00 0.00 175.10 176.31 2duw n ASP 72 N 0.74 3.04 -3.59 3.32 8.00 -1.26 -4.37 116.55 122.44 2duw n ASP 72 Ca -0.04 0.00 -0.22 0.00 0.71 0.00 0.00 54.79 55.24 2duw n ASP 72 Cb 0.52 1.06 -0.16 0.00 -0.02 0.00 0.00 41.12 42.52 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 -2.40 0.08 -0.26 -1.24 1.75 -0.22 -1.66 119.30 115.35 2duw s MET 73 Ca -0.04 0.11 -0.13 0.00 -1.25 0.00 0.00 55.69 54.38 2duw s MET 73 Cb 0.04 -1.38 -0.04 0.00 2.84 0.00 0.00 34.83 36.29 2duw s MET 73 CO 0.34 -0.60 0.27 0.08 -0.65 0.00 0.00 175.02 174.46 2duw s VAL 74 N 2.21 5.27 -0.16 10.11 1.01 -0.87 -1.27 120.40 136.70 2duw s VAL 74 Ca 0.04 0.36 -0.05 0.00 0.00 0.00 0.00 61.98 62.33 2duw s VAL 74 Cb -0.15 -3.60 -0.03 0.00 0.00 0.00 0.00 36.38 32.60 2duw s VAL 74 CO -0.09 0.24 -0.00 -1.81 0.00 0.00 0.00 175.10 173.44 2duw s ASP 75 N 1.49 5.11 -0.27 3.32 1.01 -0.62 -0.24 116.67 126.47 2duw s ASP 75 Ca 0.11 -0.04 -0.06 0.00 0.71 0.00 0.00 52.55 53.27 2duw s ASP 75 Cb -0.15 -1.84 -0.00 0.00 1.01 0.00 0.00 42.92 41.94 2duw s ASP 75 CO 0.09 0.18 0.04 -0.69 0.21 0.00 0.00 175.17 175.00 2duw s VAL 76 N 0.31 3.80 -0.01 -1.27 1.01 0.85 -3.83 120.40 121.26 2duw s VAL 76 Ca -0.01 -0.58 0.05 0.00 0.00 0.00 0.00 61.98 61.44 2duw s VAL 76 Cb -0.13 -2.87 -0.08 0.00 0.00 0.00 0.00 36.38 33.30 2duw s VAL 76 CO 0.02 0.22 0.11 0.49 0.00 0.00 0.00 175.10 175.93 2duw n PHE 77 N 4.84 0.00 0.03 5.22 3.72 -1.26 -3.43 117.46 126.59 2duw n PHE 77 Ca -0.16 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.20 2duw n PHE 77 Cb 0.49 -0.12 -0.02 0.00 -0.94 0.00 0.00 39.48 38.89 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 -0.19 -2.48 -1.08 3.08 -1.91 -3.43 114.38 108.37 2duw h ARG 78 Ca -0.01 0.01 0.17 0.00 0.07 0.00 0.00 59.98 60.22 2duw h ARG 78 Cb 0.28 0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.33 2duw h ARG 78 CO 0.00 -0.12 0.57 1.21 -1.07 0.00 0.00 179.97 180.56 2duw s ASN 79 N -2.96 -0.03 -0.02 7.04 2.47 -1.26 -5.04 114.94 115.13 2duw s ASN 79 Ca -0.04 -0.63 -0.23 0.00 0.42 0.00 0.00 52.86 52.39 2duw s ASN 79 Cb 0.01 0.50 -0.22 0.00 -1.45 0.00 0.00 41.25 40.09 2duw s ASN 79 CO 0.15 -0.97 1.09 0.77 -3.72 0.00 0.00 177.10 174.42 2duw h SER 80 N 2.00 0.32 -0.63 -4.21 4.64 -1.94 -3.21 113.55 110.51 2duw h SER 80 Ca -0.27 -0.73 0.15 0.00 -0.47 0.00 0.00 61.79 60.47 2duw h SER 80 Cb 1.22 -0.10 -0.03 0.00 -0.31 0.00 0.00 62.40 63.18 2duw h SER 80 CO 0.34 1.00 0.44 -0.08 -0.87 0.00 0.00 176.83 177.66 2duw h GLU 81 N -0.34 0.17 0.00 4.77 4.81 -2.01 0.24 114.58 122.21 2duw h GLU 81 Ca -0.03 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.11 2duw h GLU 81 Cb 1.03 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.36 2duw h GLU 81 CO 0.06 0.11 -0.38 0.00 -0.73 0.00 0.00 179.01 178.07 2duw h ALA 82 N 1.69 1.16 -0.98 2.92 0.00 -1.96 -3.04 119.26 119.04 2duw h ALA 82 Ca 0.30 -0.35 0.18 0.00 0.00 0.00 0.00 54.91 55.05 2duw h ALA 82 Cb 0.96 -0.06 -0.10 0.00 0.00 0.00 0.00 17.79 18.59 2duw h ALA 82 CO -0.05 0.48 0.61 0.00 0.00 0.00 0.00 179.25 180.30 2duw h ALA 83 N 1.62 1.77 0.30 0.00 0.00 -0.54 0.13 119.26 122.53 2duw h ALA 83 Ca -0.00 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2duw h ALA 83 Cb 0.78 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2duw h ALA 83 CO 0.05 -0.11 -0.14 2.35 0.00 0.00 0.00 179.25 181.40 2duw h TRP 84 N 0.72 -0.37 -0.99 0.00 2.91 -1.63 0.24 115.95 116.83 2duw h TRP 84 Ca 0.55 -0.01 0.04 0.00 1.13 0.00 0.00 58.89 60.60 2duw h TRP 84 Cb 0.90 0.12 -0.06 0.00 -0.51 0.00 0.00 29.16 29.62 2duw h TRP 84 CO -0.00 -0.04 0.64 0.78 -1.03 0.00 0.00 178.44 178.79 2duw h GLY 85 N -0.74 1.46 1.39 2.65 0.00 -1.48 -1.96 103.07 104.38 2duw h GLY 85 Ca -0.04 -0.49 -0.21 0.00 0.00 0.00 0.00 47.33 46.60 2duw h GLY 85 CO 0.07 0.40 -0.77 -2.08 0.00 0.00 0.00 176.54 174.16 2duw h VAL 86 N 1.23 1.33 0.42 4.60 2.07 -0.76 -2.96 116.25 122.17 2duw h VAL 86 Ca 0.40 -2.08 -0.01 0.00 0.82 0.00 0.00 66.70 65.83 2duw h VAL 86 Cb 0.04 2.07 -0.01 0.00 -1.52 0.00 0.00 31.29 31.87 2duw h VAL 86 CO -0.14 0.64 -0.31 0.00 0.02 0.00 0.00 177.57 177.79 2duw h ALA 87 N 0.74 -0.72 -0.81 1.67 0.00 -0.00 0.24 119.26 120.39 2duw h ALA 87 Ca -0.05 -0.13 0.08 0.00 0.00 0.00 0.00 54.91 54.81 2duw h ALA 87 Cb 1.38 0.40 -0.07 0.00 0.00 0.00 0.00 17.79 19.50 2duw h ALA 87 CO 0.15 -0.93 0.47 -0.56 0.00 0.00 0.00 179.25 178.38 2duw h GLN 88 N -0.71 0.81 -0.30 0.00 3.07 -1.46 -0.11 115.11 116.41 2duw h GLN 88 Ca -0.04 -0.05 -0.03 0.00 0.09 0.00 0.00 58.65 58.62 2duw h GLN 88 Cb 0.61 -0.18 -0.01 0.00 0.08 0.00 0.00 27.48 27.97 2duw h GLN 88 CO 0.01 0.54 0.08 0.93 0.09 0.00 0.00 178.83 180.47 2duw h GLU 89 N 0.83 0.48 0.01 0.06 4.39 -1.31 -1.78 114.58 117.27 2duw h GLU 89 Ca 0.37 -0.11 -0.00 0.00 0.34 0.00 0.00 59.36 59.96 2duw h GLU 89 Cb 0.26 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 28.85 2duw h GLU 89 CO -0.21 0.55 -0.01 0.00 -1.16 0.00 0.00 179.01 178.18 2duw h ALA 90 N 0.91 -0.02 0.00 3.43 0.00 0.11 -1.92 119.26 121.77 2duw h ALA 90 Ca 0.09 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2duw h ALA 90 Cb 0.28 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 2duw h ALA 90 CO 0.00 -0.51 -0.04 0.82 0.00 0.00 0.00 179.25 179.52 2duw h ILE 91 N -0.02 0.64 -0.05 0.00 2.04 -0.99 0.31 117.51 119.43 2duw h ILE 91 Ca -0.00 -0.15 -0.03 0.00 1.00 0.00 0.00 64.86 65.68 2duw h ILE 91 Cb 0.01 1.09 -0.00 0.00 -0.74 0.00 0.00 36.82 37.19 2duw h ILE 91 CO 0.00 0.04 -0.07 0.00 0.00 0.00 0.00 178.15 178.12 2duw h ALA 92 N 1.96 0.08 0.00 1.87 0.00 -0.57 -3.20 119.26 119.40 2duw h ALA 92 Ca -0.00 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.53 2duw h ALA 92 Cb 0.09 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2duw h ALA 92 CO 0.00 -0.10 -0.40 -0.84 0.00 0.00 0.00 179.25 177.91 2duw h ILE 93 N -0.34 0.84 0.00 0.00 3.07 -0.97 -3.47 117.51 116.64 2duw h ILE 93 Ca 0.01 -1.70 0.00 0.00 1.55 0.00 0.00 64.86 64.72 2duw h ILE 93 Cb 0.60 2.06 0.00 0.00 -0.27 0.00 0.00 36.82 39.21 2duw h ILE 93 CO 0.02 0.39 0.00 0.61 -1.05 0.00 0.00 178.15 178.12 2duw n GLY 94 N 0.53 0.76 2.87 0.16 0.00 0.10 -5.12 105.19 104.49 2duw n GLY 94 Ca 0.00 -0.15 -0.27 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 -4.61 0.00 4.61 0.00 0.85 -4.95 120.51 116.41 2duw n ALA 95 Ca 0.00 -1.39 0.00 0.00 0.00 0.00 0.00 53.44 52.05 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 -5.38 0.00 -4.09 0.00 5.02 -1.26 -4.94 118.16 107.51 2duw n LYS 96 Ca 0.12 0.00 -0.08 0.00 -2.02 0.00 0.00 58.31 56.33 2duw n LYS 96 Cb 0.54 -0.53 -0.10 0.00 -0.02 0.00 0.00 35.03 34.91 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 -1.34 0.32 -0.03 -0.18 2.01 -0.66 -3.25 115.64 112.52 2duw s THR 97 Ca 0.00 -1.68 -0.00 0.00 0.31 0.00 0.00 61.69 60.32 2duw s THR 97 Cb 0.00 -1.34 0.03 0.00 0.01 0.00 0.00 72.50 71.20 2duw s THR 97 CO 0.00 -0.88 0.04 -0.22 -0.69 0.00 0.00 174.62 172.88 2duw s LEU 98 N -2.69 1.01 -0.07 4.42 2.96 0.09 -2.05 118.68 122.35 2duw s LEU 98 Ca 0.04 0.07 0.02 0.00 -0.22 0.00 0.00 54.13 54.04 2duw s LEU 98 Cb 0.04 -0.03 0.01 0.00 0.50 0.00 0.00 46.19 46.72 2duw s LEU 98 CO -0.07 -0.14 -0.13 0.86 -1.32 0.00 0.00 176.35 175.55 2duw s TRP 99 N 1.12 1.60 0.14 5.38 -0.11 0.66 -1.16 118.94 126.58 2duw s TRP 99 Ca -0.09 -0.62 0.02 0.00 1.22 0.00 0.00 56.10 56.63 2duw s TRP 99 Cb -0.13 -1.16 0.02 0.00 -1.50 0.00 0.00 33.47 30.70 2duw s TRP 99 CO -0.03 -0.31 0.15 1.28 -4.62 0.00 0.00 176.95 173.42 2duw n LEU 100 N 3.85 0.00 -4.87 5.86 4.77 -0.68 -0.11 117.00 125.83 2duw n LEU 100 Ca -0.22 -0.70 -0.32 0.00 -0.03 0.00 0.00 56.01 54.74 2duw n LEU 100 Cb 0.52 -0.05 -0.05 0.00 -2.33 0.00 0.00 43.42 41.50 2duw n LEU 100 CO 0.25 -0.43 0.24 -1.58 -1.33 0.00 0.00 177.39 174.54 2duw s GLN 101 N -2.62 3.84 0.40 3.23 2.00 -1.22 -4.42 119.66 120.87 2duw s GLN 101 Ca 0.11 0.33 -0.26 0.00 -2.00 0.00 0.00 55.36 53.54 2duw s GLN 101 Cb -0.01 -2.65 -0.10 0.00 0.80 0.00 0.00 33.01 31.05 2duw s GLN 101 CO 0.07 0.31 1.29 -0.11 -0.50 0.00 0.00 175.29 176.36 2duw n LEU 102 N -0.09 4.00 -0.71 3.68 7.94 -1.26 -2.32 117.00 128.25 2duw n LEU 102 Ca 0.00 1.14 -0.07 0.00 -1.11 0.00 0.00 56.01 55.97 2duw n LEU 102 Cb 0.52 -1.51 -0.01 0.00 0.53 0.00 0.00 43.42 42.95 2duw n LEU 102 CO 0.45 -0.55 -0.08 0.61 -1.11 0.00 0.00 177.39 176.70 2duw n GLY 103 N 0.77 0.40 3.17 -3.96 0.00 -1.26 -4.90 105.19 99.41 2duw n GLY 103 Ca 0.06 -0.64 -0.30 0.00 0.00 0.00 0.00 46.02 45.13 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 -2.32 1.81 -0.21 1.61 1.01 -0.98 -4.98 120.40 116.34 2duw s VAL 104 Ca 0.00 -0.88 -0.03 0.00 0.00 0.00 0.00 61.98 61.07 2duw s VAL 104 Cb 0.00 -1.57 0.07 0.00 0.00 0.00 0.00 36.38 34.88 2duw s VAL 104 CO 0.00 0.50 0.07 -0.63 0.00 0.00 0.00 175.10 175.04 2duw s ILE 105 N 0.38 0.32 -0.57 2.22 1.01 -1.26 -2.30 121.20 120.99 2duw s ILE 105 Ca -0.17 -0.57 0.01 0.00 0.00 0.00 0.00 60.65 59.92 2duw s ILE 105 Cb -0.17 -0.97 0.14 0.00 0.01 0.00 0.00 42.46 41.47 2duw s ILE 105 CO 0.07 -0.35 0.34 0.20 0.00 0.00 0.00 174.94 175.20 2duw s ASN 106 N 1.94 4.69 0.55 3.58 -0.87 -1.26 -4.93 114.94 118.63 2duw s ASN 106 Ca 0.02 -3.00 0.28 0.00 -1.57 0.00 0.00 52.86 48.59 2duw s ASN 106 Cb -0.17 -1.72 1.46 0.00 -0.02 0.00 0.00 41.25 40.80 2duw s ASN 106 CO -0.14 -0.27 1.95 -0.08 -2.57 0.00 0.00 177.10 175.98 2duw h GLU 107 N 6.64 0.00 -0.00 -0.60 4.81 -1.98 0.27 114.58 123.71 2duw h GLU 107 Ca -0.05 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.17 2duw h GLU 107 Cb 0.91 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.29 2duw h GLU 107 CO 0.70 0.00 -0.05 1.96 -0.73 0.00 0.00 179.01 180.89 2duw h GLN 108 N 0.00 0.04 0.00 1.92 7.50 -1.99 -2.54 115.11 120.03 2duw h GLN 108 Ca 0.28 -0.04 -0.05 0.00 0.50 0.00 0.00 58.65 59.34 2duw h GLN 108 Cb 1.21 0.01 -0.01 0.00 0.05 0.00 0.00 27.48 28.75 2duw h GLN 108 CO -0.00 0.76 -0.23 0.00 -1.50 0.00 0.00 178.83 177.86 2duw h ALA 109 N 0.28 1.16 0.08 3.87 0.00 -1.61 -0.73 119.26 122.30 2duw h ALA 109 Ca -0.00 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 2duw h ALA 109 Cb 0.78 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2duw h ALA 109 CO 0.01 0.29 -0.04 0.00 0.00 0.00 0.00 179.25 179.51 2duw h ALA 110 N 1.77 -0.11 -0.12 0.00 0.00 -0.56 -3.25 119.26 116.99 2duw h ALA 110 Ca -0.00 -0.27 -0.12 0.00 0.00 0.00 0.00 54.91 54.52 2duw h ALA 110 Cb 0.61 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 2duw h ALA 110 CO 0.03 -0.25 -0.44 -0.24 0.00 0.00 0.00 179.25 178.35 2duw h VAL 111 N -0.73 1.32 -0.44 0.00 3.04 -1.42 -2.82 116.25 115.20 2duw h VAL 111 Ca -0.01 -1.60 0.13 0.00 -1.01 0.00 0.00 66.70 64.20 2duw h VAL 111 Cb 0.58 1.71 -0.02 0.00 -2.01 0.00 0.00 31.29 31.55 2duw h VAL 111 CO 0.02 0.48 0.37 0.25 -1.01 0.00 0.00 177.57 177.68 2duw h LEU 112 N 0.24 0.00 0.16 3.16 5.85 -1.20 -1.15 115.31 122.38 2duw h LEU 112 Ca 0.02 0.00 -0.36 0.00 0.84 0.00 0.00 57.88 58.38 2duw h LEU 112 Cb 0.88 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.91 2duw h LEU 112 CO 0.07 0.00 -1.85 0.00 -0.34 0.00 0.00 178.44 176.32 2duw h ALA 113 N 1.68 0.27 -0.97 1.25 0.00 -1.54 -3.36 119.26 116.59 2duw h ALA 113 Ca 0.21 -1.24 0.14 0.00 0.00 0.00 0.00 54.91 54.01 2duw h ALA 113 Cb 0.94 0.56 -0.08 0.00 0.00 0.00 0.00 17.79 19.20 2duw h ALA 113 CO -0.00 1.14 0.61 0.00 0.00 0.00 0.00 179.25 181.01 2duw h ARG 114 N 0.09 0.85 -0.59 0.00 3.08 -1.07 0.32 114.38 117.05 2duw h ARG 114 Ca -0.38 -0.05 0.17 0.00 0.07 0.00 0.00 59.98 59.79 2duw h ARG 114 Cb 2.08 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 31.91 2duw h ARG 114 CO 0.14 0.56 0.45 0.93 -1.07 0.00 0.00 179.97 180.99 2duw h GLU 115 N 0.88 0.00 0.00 0.04 4.39 -1.54 -0.82 114.58 117.53 2duw h GLU 115 Ca 0.50 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 60.06 2duw h GLU 115 Cb 0.62 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.24 2duw h GLU 115 CO -0.26 0.00 -2.04 0.00 -1.16 0.00 0.00 179.01 175.54 2duw n ALA 116 N -2.61 2.24 0.00 3.43 0.00 0.34 -5.00 120.51 118.91 2duw n ALA 116 Ca 0.11 -0.77 0.00 0.00 0.00 0.00 0.00 53.44 52.78 2duw n ALA 116 Cb 0.69 -0.45 0.00 0.00 0.00 0.00 0.00 19.45 19.69 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 1.59 0.61 3.52 0.00 0.00 0.84 -5.08 105.19 106.67 2duw n GLY 117 Ca -0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.50 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 1.82 -4.43 0.99 7.94 -0.91 -4.88 117.00 117.54 2duw n LEU 118 Ca 0.00 0.71 -0.44 0.00 -1.11 0.00 0.00 56.01 55.18 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 -2.67 0.64 -0.44 -1.11 0.00 0.00 177.39 173.81 2duw s SER 119 N -1.30 6.18 -0.09 1.96 0.01 -1.20 -4.35 113.70 114.91 2duw s SER 119 Ca 0.71 -1.13 -0.18 0.00 1.31 0.00 0.00 55.95 56.66 2duw s SER 119 Cb -0.41 -2.38 -0.05 0.00 0.21 0.00 0.00 66.02 63.40 2duw s SER 119 CO 0.53 -1.34 0.48 0.54 0.41 0.00 0.00 173.24 173.86 2duw s VAL 120 N 3.62 5.13 -0.19 3.43 0.11 -1.26 -0.73 120.40 130.50 2duw s VAL 120 Ca 0.19 0.97 -0.04 0.00 -2.93 0.00 0.00 61.98 60.16 2duw s VAL 120 Cb -0.19 -3.81 0.07 0.00 -1.53 0.00 0.00 36.38 30.91 2duw s VAL 120 CO 0.09 0.38 0.09 -0.69 -3.33 0.00 0.00 175.10 171.63 2duw s VAL 121 N 0.27 0.03 0.46 2.04 1.01 -0.31 -4.96 120.40 118.93 2duw s VAL 121 Ca 0.26 -0.33 0.07 0.00 0.00 0.00 0.00 61.98 61.98 2duw s VAL 121 Cb -0.16 -0.72 -0.02 0.00 0.00 0.00 0.00 36.38 35.49 2duw s VAL 121 CO 0.12 -0.34 0.28 0.00 0.00 0.00 0.00 175.10 175.15 2duw s MET 122 N 2.08 2.30 -1.46 2.72 0.23 -1.26 -1.68 119.30 122.22 2duw s MET 122 Ca 0.03 -1.86 -0.07 0.00 -1.03 0.00 0.00 55.69 52.76 2duw s MET 122 Cb -0.16 -2.08 0.03 0.00 -1.53 0.00 0.00 34.83 31.09 2duw s MET 122 CO -0.13 -0.29 0.65 -3.47 -2.03 0.00 0.00 175.02 169.75 2duw n ASP 123 N -1.46 -5.37 -3.76 -1.18 2.03 -0.97 -4.92 116.55 100.92 2duw n ASP 123 Ca -0.01 -0.37 -0.13 0.00 0.52 0.00 0.00 54.79 54.80 2duw n ASP 123 Cb 0.64 -4.34 -0.12 0.00 -0.72 0.00 0.00 41.12 36.58 2duw n ASP 123 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2duw s ARG 124 N -5.91 0.31 -0.04 -0.67 1.81 -1.26 -4.58 118.95 108.62 2duw s ARG 124 Ca 0.38 0.45 0.05 0.00 -1.72 0.00 0.00 55.73 54.88 2duw s ARG 124 Cb -0.18 0.10 -0.01 0.00 -0.45 0.00 0.00 34.95 34.41 2duw s ARG 124 CO 0.47 -0.07 -0.17 0.00 -0.68 0.00 0.00 175.30 174.85 2duw h PRO 126 N 6.15 0.00 -0.95 0.00 0.13 -1.96 -1.43 132.00 133.94 2duw h PRO 126 Ca -0.33 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.81 2duw h PRO 126 Cb 1.17 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.25 2duw h PRO 126 CO 0.48 0.13 0.63 0.00 -0.23 0.00 0.00 178.00 179.01 2duw h ALA 127 N 1.87 1.22 0.00 -0.56 0.00 -1.98 -1.09 119.26 118.72 2duw h ALA 127 Ca -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2duw h ALA 127 Cb 0.58 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2duw h ALA 127 CO 0.02 0.59 -1.79 -0.89 0.00 0.00 0.00 179.25 177.17 2duw n ILE 128 N -4.43 0.07 0.14 0.00 5.41 -1.16 -4.23 119.36 115.16 2duw n ILE 128 Ca 0.11 -0.46 -0.00 0.00 1.00 0.00 0.00 62.75 63.40 2duw n ILE 128 Cb 0.02 0.04 0.17 0.00 -0.71 0.00 0.00 39.64 39.16 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 0.00 0.44 0.38 4.22 -1.04 -2.45 114.58 116.13 2duw h GLU 129 Ca 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.42 2duw h GLU 129 Cb 0.95 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.21 2duw h GLU 129 CO 0.00 0.61 -0.21 1.25 -2.18 0.00 0.00 179.01 178.48 2duw h LEU 130 N 0.00 -0.50 0.00 1.64 5.85 -1.38 -3.14 115.31 117.79 2duw h LEU 130 Ca -0.01 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.63 2duw h LEU 130 Cb 1.14 0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.30 2duw h LEU 130 CO 0.08 -0.09 0.00 -0.81 -0.34 0.00 0.00 178.44 177.28 2duw n PRO 131 N -5.19 0.15 -0.14 5.25 -0.04 -1.24 -3.29 135.00 130.49 2duw n PRO 131 Ca -0.09 0.18 0.27 0.00 -0.04 0.00 0.00 63.50 63.82 2duw n PRO 131 Cb 0.29 -1.50 0.72 0.00 -0.04 0.00 0.00 33.50 32.96 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 -1.38 -0.08 114.38 113.58 2duw h ARG 132 Ca 0.00 0.00 -0.34 0.00 0.10 0.00 0.00 59.98 59.74 2duw h ARG 132 Cb 0.17 0.00 -0.06 0.00 1.11 0.00 0.00 29.97 31.19 2duw h ARG 132 CO 0.00 0.00 -2.13 1.28 0.10 0.00 0.00 179.97 179.22 2duw n LEU 133 N -4.26 0.45 0.00 0.08 4.32 -1.21 -5.02 117.00 111.36 2duw n LEU 133 Ca 0.17 0.15 0.00 0.00 -0.02 0.00 0.00 56.01 56.31 2duw n LEU 133 Cb 0.90 0.31 0.00 0.00 -1.62 0.00 0.00 43.42 43.01 2duw n LEU 133 CO 0.38 0.48 0.00 0.61 -1.22 0.00 0.00 177.39 177.64 2duw n GLY 134 N 1.70 0.75 0.01 -0.72 0.00 -0.04 -5.03 105.19 101.85 2duw n GLY 134 Ca -0.27 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.75 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 0.00 -4.63 0.99 4.32 -1.26 -5.04 117.00 111.38 2duw n LEU 135 Ca 0.00 0.00 -0.45 0.00 -0.02 0.00 0.00 56.01 55.54 2duw n LEU 135 Cb 0.00 0.05 -0.02 0.00 -1.62 0.00 0.00 43.42 41.83 2duw n LEU 135 CO 0.00 0.05 0.74 0.00 -1.22 0.00 0.00 177.39 176.97 2duw n ALA 136 N -1.91 0.28 0.00 -1.18 0.00 -1.26 -5.06 120.51 111.38 2duw n ALA 136 Ca -0.04 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.80 2duw n ALA 136 Cb 0.39 -2.12 0.00 0.00 0.00 0.00 0.00 19.45 17.72 2duw n ALA 136 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13