#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 2.94 0.25 3.17 1.02 -1.26 -5.13 119.74 120.74 2duw s LYS 2 Ca 0.00 -0.61 0.06 0.00 0.02 0.00 0.00 55.97 55.44 2duw s LYS 2 Cb 0.00 -2.77 -0.05 0.00 -0.52 0.00 0.00 37.83 34.48 2duw s LYS 2 CO 0.00 0.60 -0.07 -1.21 -0.92 0.00 0.00 175.35 173.75 2duw s GLU 3 N -2.08 1.45 -0.28 1.68 0.41 -1.26 -5.06 118.70 113.56 2duw s GLU 3 Ca 0.26 -1.72 0.10 0.00 -0.41 0.00 0.00 54.97 53.21 2duw s GLU 3 Cb -0.12 -1.03 0.47 0.00 -1.78 0.00 0.00 34.13 31.66 2duw s GLU 3 CO 0.18 0.04 1.18 0.27 -0.49 0.00 0.00 175.26 176.44 2duw n ASN 4 N -0.50 4.17 -2.36 -0.19 0.23 -1.26 -4.74 115.26 110.60 2duw n ASN 4 Ca -0.06 -3.46 -0.11 0.00 -0.53 0.00 0.00 54.58 50.42 2duw n ASN 4 Cb 0.63 -0.37 -0.04 0.00 -2.08 0.00 0.00 39.78 37.92 2duw n ASN 4 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 2duw n ASP 5 N -0.70 -0.61 -0.00 0.53 9.92 -1.26 -5.01 116.55 119.41 2duw n ASP 5 Ca 0.36 -2.32 0.23 0.00 -0.53 0.00 0.00 54.79 52.52 2duw n ASP 5 Cb 0.93 1.28 0.73 0.00 -0.64 0.00 0.00 41.12 43.42 2duw n ASP 5 CO 0.00 0.00 0.00 0.16 0.13 0.00 0.00 177.20 177.49 2duw h ILE 6 N 1.67 0.48 -1.00 0.53 3.07 -1.96 0.06 117.51 120.36 2duw h ILE 6 Ca -0.16 0.00 0.12 0.00 1.55 0.00 0.00 64.86 66.37 2duw h ILE 6 Cb 0.76 0.63 -0.08 0.00 -0.27 0.00 0.00 36.82 37.86 2duw h ILE 6 CO 0.22 0.00 0.63 0.00 -1.05 0.00 0.00 178.15 177.96 2duw h ALA 7 N 1.54 1.53 0.01 0.16 0.00 -1.97 0.25 119.26 120.77 2duw h ALA 7 Ca 0.27 0.02 -0.19 0.00 0.00 0.00 0.00 54.91 55.00 2duw h ALA 7 Cb 1.26 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 2duw h ALA 7 CO -0.00 0.23 -0.88 0.78 0.00 0.00 0.00 179.25 179.38 2duw h GLY 8 N 1.00 0.17 2.00 0.00 0.00 -1.27 -1.60 103.07 103.37 2duw h GLY 8 Ca 0.49 -0.31 -0.16 0.00 0.00 0.00 0.00 47.33 47.36 2duw h GLY 8 CO -0.25 0.27 -0.75 -2.22 0.00 0.00 0.00 176.54 173.59 2duw h ILE 9 N 0.08 1.52 0.00 2.60 5.03 -1.22 -0.56 117.51 124.96 2duw h ILE 9 Ca -0.04 -2.59 -0.20 0.00 -0.12 0.00 0.00 64.86 61.91 2duw h ILE 9 Cb 1.51 2.40 -0.03 0.00 -3.03 0.00 0.00 36.82 37.67 2duw h ILE 9 CO 0.13 0.74 -1.20 0.17 -0.68 0.00 0.00 178.15 177.31 2duw h LEU 10 N 0.00 0.00 0.00 1.44 8.10 -0.57 -2.88 115.31 121.39 2duw h LEU 10 Ca -0.01 0.00 -0.01 0.00 0.11 0.00 0.00 57.88 57.97 2duw h LEU 10 Cb 1.34 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 41.56 2duw h LEU 10 CO 0.10 0.81 -0.77 0.00 -4.11 0.00 0.00 178.44 174.46 2duw h THR 11 N 0.00 0.04 0.00 0.15 1.03 -1.28 -3.40 112.91 109.45 2duw h THR 11 Ca -0.12 -1.07 0.00 0.00 -0.01 0.00 0.00 66.41 65.21 2duw h THR 11 Cb 1.72 1.66 0.00 0.00 -1.07 0.00 0.00 68.15 70.46 2duw h THR 11 CO 0.08 0.02 -0.10 -1.28 -0.01 0.00 0.00 175.52 174.23 2duw h SER 12 N 0.00 0.00 -3.37 0.00 0.87 -1.19 -3.48 113.55 106.38 2duw h SER 12 Ca -0.01 0.00 -0.52 0.00 -1.23 0.00 0.00 61.79 60.03 2duw h SER 12 Cb 1.03 0.00 -0.34 0.00 -0.44 0.00 0.00 62.40 62.66 2duw h SER 12 CO 0.00 0.20 -0.82 -0.89 -0.53 0.00 0.00 176.83 174.80 2duw s THR 13 N -1.30 1.17 -0.45 2.23 2.01 -1.09 -5.09 115.64 113.12 2duw s THR 13 Ca -0.03 -0.48 -0.12 0.00 0.31 0.00 0.00 61.69 61.37 2duw s THR 13 Cb 0.00 -1.08 0.08 0.00 0.01 0.00 0.00 72.50 71.52 2duw s THR 13 CO 0.04 0.37 0.33 -0.13 -0.69 0.00 0.00 174.62 174.55 2duw s ARG 14 N 0.81 2.76 -0.02 4.92 0.52 -1.26 -4.38 118.95 122.30 2duw s ARG 14 Ca -0.12 -1.46 0.00 0.00 -0.52 0.00 0.00 55.73 53.64 2duw s ARG 14 Cb -0.15 -3.96 0.03 0.00 0.52 0.00 0.00 34.95 31.38 2duw s ARG 14 CO 0.02 -1.03 0.02 0.99 0.02 0.00 0.00 175.30 175.32 2duw s THR 15 N 1.51 0.03 -0.15 0.02 2.01 -1.26 -4.65 115.64 113.15 2duw s THR 15 Ca 0.04 0.17 -0.02 0.00 0.31 0.00 0.00 61.69 62.19 2duw s THR 15 Cb -0.24 -0.15 -0.02 0.00 0.01 0.00 0.00 72.50 72.10 2duw s THR 15 CO 0.04 0.11 -0.09 -0.63 -0.69 0.00 0.00 174.62 173.36 2duw s ILE 16 N 1.05 3.34 0.11 1.82 1.09 -0.55 -0.10 121.20 127.95 2duw s ILE 16 Ca -0.09 -0.55 0.04 0.00 -1.10 0.00 0.00 60.65 58.95 2duw s ILE 16 Cb -0.13 -2.44 -0.04 0.00 -1.06 0.00 0.00 42.46 38.79 2duw s ILE 16 CO -0.02 0.50 0.07 0.00 -0.10 0.00 0.00 174.94 175.38 2duw s ALA 17 N 0.54 3.48 -0.07 9.38 0.00 0.89 -0.85 121.76 135.13 2duw s ALA 17 Ca -0.06 -1.11 0.01 0.00 0.00 0.00 0.00 51.96 50.80 2duw s ALA 17 Cb -0.15 -1.33 0.02 0.00 0.00 0.00 0.00 23.12 21.66 2duw s ALA 17 CO 0.03 0.66 -0.07 -1.17 0.00 0.00 0.00 175.76 175.21 2duw s LEU 18 N -2.58 1.35 -0.20 0.00 2.96 -0.86 -1.50 118.68 117.84 2duw s LEU 18 Ca 0.29 -0.21 -0.07 0.00 -0.22 0.00 0.00 54.13 53.91 2duw s LEU 18 Cb -0.11 -0.64 -0.04 0.00 0.50 0.00 0.00 46.19 45.90 2duw s LEU 18 CO 0.21 -0.05 0.06 -0.69 -1.32 0.00 0.00 176.35 174.57 2duw s VAL 19 N 1.05 4.58 -0.17 1.68 1.01 -1.25 -0.12 120.40 127.17 2duw s VAL 19 Ca -0.08 -0.10 -0.01 0.00 0.00 0.00 0.00 61.98 61.79 2duw s VAL 19 Cb -0.14 -3.09 -0.01 0.00 0.00 0.00 0.00 36.38 33.14 2duw s VAL 19 CO -0.00 0.42 0.15 0.61 0.00 0.00 0.00 175.10 176.28 2duw n GLY 20 N 4.01 0.14 3.53 4.51 0.00 -0.46 -4.64 105.19 112.28 2duw n GLY 20 Ca -0.16 -0.10 -0.43 0.00 0.00 0.00 0.00 46.02 45.32 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 -3.04 3.20 0.26 4.61 0.00 -1.25 -4.99 121.76 120.55 2duw s ALA 21 Ca 0.05 -1.14 0.01 0.00 0.00 0.00 0.00 51.96 50.88 2duw s ALA 21 Cb -0.01 -3.66 -0.00 0.00 0.00 0.00 0.00 23.12 19.45 2duw s ALA 21 CO 0.14 -2.24 0.03 0.45 0.00 0.00 0.00 175.76 174.14 2duw n SER 22 N 7.24 2.23 -2.75 0.00 2.88 -1.26 -4.70 113.62 117.27 2duw n SER 22 Ca 0.02 -2.23 -0.38 0.00 -1.33 0.00 0.00 58.87 54.96 2duw n SER 22 Cb 0.48 0.32 0.05 0.00 -0.75 0.00 0.00 64.21 64.30 2duw n SER 22 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 2duw n ASP 23 N -1.36 7.53 -4.12 -3.46 5.75 -1.26 -4.84 116.55 114.79 2duw n ASP 23 Ca -0.09 -3.79 -0.37 0.00 -0.01 0.00 0.00 54.79 50.53 2duw n ASP 23 Cb 0.35 -1.05 -0.07 0.00 -1.03 0.00 0.00 41.12 39.31 2duw n ASP 23 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 2duw s LYS 24 N -3.90 3.05 0.00 0.11 -0.14 -1.26 -4.89 119.74 112.71 2duw s LYS 24 Ca 0.55 -2.97 0.15 0.00 -1.36 0.00 0.00 55.97 52.34 2duw s LYS 24 Cb 0.45 -3.91 0.72 0.00 -1.68 0.00 0.00 37.83 33.42 2duw s LYS 24 CO -0.31 -1.23 1.41 -0.35 -0.76 0.00 0.00 175.35 174.11 2duw n PRO 25 N 2.83 0.18 -0.98 -1.68 -0.04 -1.26 -2.48 135.00 131.57 2duw n PRO 25 Ca 0.16 0.16 -0.07 0.00 -0.04 0.00 0.00 63.50 63.71 2duw n PRO 25 Cb 0.38 -1.50 0.28 0.00 -0.04 0.00 0.00 33.50 32.62 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 -1.32 4.60 -4.22 3.54 8.00 -1.26 -4.69 116.55 121.20 2duw n ASP 26 Ca 0.06 -3.16 -0.13 0.00 0.71 0.00 0.00 54.79 52.26 2duw n ASP 26 Cb 0.13 -0.74 -0.10 0.00 -0.02 0.00 0.00 41.12 40.38 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 -2.84 0.98 0.36 -1.24 1.81 -1.03 -5.03 118.95 111.95 2duw s ARG 27 Ca 0.52 -1.38 0.27 0.00 -1.72 0.00 0.00 55.73 53.42 2duw s ARG 27 Cb 0.41 -0.52 1.13 0.00 -0.45 0.00 0.00 34.95 35.52 2duw s ARG 27 CO 0.13 0.06 1.81 -1.00 -0.68 0.00 0.00 175.30 175.61 2duw h PRO 28 N 2.95 0.00 0.00 3.54 0.13 -1.91 -2.54 132.00 134.17 2duw h PRO 28 Ca -0.36 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.60 2duw h PRO 28 Cb 1.18 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.29 2duw h PRO 28 CO 0.62 0.00 -0.77 0.66 -0.23 0.00 0.00 178.00 178.28 2duw h SER 29 N 0.00 0.00 0.09 1.44 4.64 -1.88 -3.13 113.55 114.71 2duw h SER 29 Ca 0.00 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.04 2duw h SER 29 Cb 0.40 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.48 2duw h SER 29 CO 0.00 0.77 -1.50 0.22 -0.87 0.00 0.00 176.83 175.45 2duw h TYR 30 N 0.00 0.35 -0.72 4.77 5.03 -1.66 -3.22 116.97 121.52 2duw h TYR 30 Ca -0.01 -0.25 0.17 0.00 2.58 0.00 0.00 58.73 61.22 2duw h TYR 30 Cb 1.44 -0.01 -0.04 0.00 1.55 0.00 0.00 36.73 39.67 2duw h TYR 30 CO 0.00 1.59 0.49 0.07 -1.32 0.00 0.00 178.16 178.99 2duw h ARG 31 N -0.38 0.23 0.08 1.82 0.11 -1.57 -0.59 114.38 114.08 2duw h ARG 31 Ca -0.34 -0.01 -0.29 0.00 0.10 0.00 0.00 59.98 59.44 2duw h ARG 31 Cb 1.71 -0.05 0.03 0.00 1.11 0.00 0.00 29.97 32.77 2duw h ARG 31 CO 0.00 0.15 -1.17 0.28 0.10 0.00 0.00 179.97 179.34 2duw h VAL 32 N 0.24 1.28 0.51 0.08 2.07 -1.68 -2.55 116.25 116.20 2duw h VAL 32 Ca 0.35 -2.38 -0.02 0.00 0.82 0.00 0.00 66.70 65.47 2duw h VAL 32 Cb 1.04 2.60 -0.02 0.00 -1.52 0.00 0.00 31.29 33.39 2duw h VAL 32 CO -0.08 0.73 -0.48 -0.03 0.02 0.00 0.00 177.57 177.74 2duw h MET 33 N 0.30 -0.94 0.00 1.57 4.05 -1.13 0.51 114.93 119.30 2duw h MET 33 Ca -0.17 0.06 -0.01 0.00 -0.28 0.00 0.00 59.70 59.30 2duw h MET 33 Cb 1.84 0.21 -0.00 0.00 -0.80 0.00 0.00 31.60 32.85 2duw h MET 33 CO 0.23 -0.62 -0.06 -0.22 0.23 0.00 0.00 176.91 176.46 2duw h LYS 34 N -0.97 0.00 0.08 0.39 1.63 -1.57 -1.42 116.57 114.71 2duw h LYS 34 Ca -0.06 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.73 2duw h LYS 34 Cb 0.83 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.46 2duw h LYS 34 CO -0.04 0.06 -0.04 -0.92 -3.45 0.00 0.00 179.45 175.06 2duw h TYR 35 N 0.00 -0.09 -0.03 1.91 3.20 -0.89 -1.46 116.97 119.60 2duw h TYR 35 Ca -0.00 -0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.75 2duw h TYR 35 Cb 0.29 0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.58 2duw h TYR 35 CO 0.00 0.36 -0.53 -0.07 -1.64 0.00 0.00 178.16 176.28 2duw h LEU 36 N -0.60 0.09 -0.64 2.82 3.38 -0.73 -1.59 115.31 118.05 2duw h LEU 36 Ca -0.01 -0.05 -0.14 0.00 0.09 0.00 0.00 57.88 57.77 2duw h LEU 36 Cb 0.50 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 2duw h LEU 36 CO 0.02 0.61 -0.45 -0.07 0.09 0.00 0.00 178.44 178.64 2duw h LEU 37 N 0.07 0.58 0.04 1.67 3.38 -1.28 -1.37 115.31 118.40 2duw h LEU 37 Ca -0.00 -0.28 -0.22 0.00 0.09 0.00 0.00 57.88 57.48 2duw h LEU 37 Cb 0.96 -0.16 0.02 0.00 0.09 0.00 0.00 40.66 41.57 2duw h LEU 37 CO 0.07 0.95 -0.87 -0.78 0.09 0.00 0.00 178.44 177.91 2duw h ASP 38 N 0.44 0.69 -0.16 -0.43 1.82 -1.12 -3.20 116.42 114.46 2duw h ASP 38 Ca 0.03 -0.79 0.05 0.00 -0.39 0.00 0.00 57.03 55.92 2duw h ASP 38 Cb 0.96 -0.21 -0.01 0.00 0.68 0.00 0.00 39.33 40.75 2duw h ASP 38 CO 0.09 1.40 0.20 1.56 -1.61 0.00 0.00 179.24 180.87 2duw h GLN 39 N 0.07 0.00 0.00 0.28 1.08 -1.29 -3.45 115.11 111.79 2duw h GLN 39 Ca -0.12 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.08 2duw h GLN 39 Cb 1.57 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 29.00 2duw h GLN 39 CO 0.17 0.00 0.00 0.41 -0.95 0.00 0.00 178.83 178.46 2duw n GLY 40 N -1.37 0.79 3.58 3.46 0.00 -1.13 -5.09 105.19 105.44 2duw n GLY 40 Ca 0.01 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.76 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 2.46 -0.30 1.61 2.02 -0.53 -5.06 117.35 116.05 2duw s TYR 41 Ca 0.00 -0.58 -0.23 0.00 -0.37 0.00 0.00 57.07 55.89 2duw s TYR 41 Cb 0.00 -1.58 -0.00 0.00 -0.40 0.00 0.00 41.96 39.98 2duw s TYR 41 CO 0.00 0.51 0.77 -1.01 -1.57 0.00 0.00 175.55 174.25 2duw s HIS 42 N -2.65 3.22 -0.13 2.71 3.76 -1.26 -4.57 115.29 116.37 2duw s HIS 42 Ca 0.34 0.82 -0.02 0.00 -0.15 0.00 0.00 55.06 56.05 2duw s HIS 42 Cb 0.06 -3.15 -0.02 0.00 1.11 0.00 0.00 32.58 30.57 2duw s HIS 42 CO 0.17 -0.52 -0.07 0.08 -0.85 0.00 0.00 174.74 173.55 2duw s VAL 43 N 2.88 3.63 -0.61 -0.90 1.01 -1.26 -1.48 120.40 123.67 2duw s VAL 43 Ca 0.31 -0.46 0.05 0.00 0.00 0.00 0.00 61.98 61.88 2duw s VAL 43 Cb -0.14 -2.55 0.17 0.00 0.00 0.00 0.00 36.38 33.86 2duw s VAL 43 CO 0.12 0.53 0.46 -0.38 0.00 0.00 0.00 175.10 175.82 2duw n ILE 44 N 3.19 0.78 -2.23 2.22 5.41 -0.03 -4.86 119.36 123.84 2duw n ILE 44 Ca -0.18 -4.44 -0.41 0.00 1.00 0.00 0.00 62.75 58.72 2duw n ILE 44 Cb 0.53 -2.02 -0.03 0.00 -0.71 0.00 0.00 39.64 37.40 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 -1.05 4.40 -0.08 0.38 0.04 -1.26 -2.04 135.00 135.39 2duw s PRO 45 Ca 0.28 2.05 -0.00 0.00 0.04 0.00 0.00 61.00 63.36 2duw s PRO 45 Cb -0.01 -3.19 0.02 0.00 0.04 0.00 0.00 34.50 31.37 2duw s PRO 45 CO -0.17 -0.23 -0.04 0.08 0.04 0.00 0.00 177.00 176.67 2duw s VAL 46 N 0.03 0.70 0.02 -0.36 1.01 0.83 -3.80 120.40 118.83 2duw s VAL 46 Ca 0.56 -0.11 -0.10 0.00 0.00 0.00 0.00 61.98 62.33 2duw s VAL 46 Cb -0.36 -0.77 0.01 0.00 0.00 0.00 0.00 36.38 35.25 2duw s VAL 46 CO 0.39 0.30 0.20 -0.55 0.00 0.00 0.00 175.10 175.45 2duw s SER 47 N 1.64 -0.02 0.25 3.32 0.15 0.11 -1.36 113.70 117.78 2duw s SER 47 Ca 0.02 -0.21 0.23 0.00 0.70 0.00 0.00 55.95 56.69 2duw s SER 47 Cb -0.13 0.27 0.97 0.00 -1.71 0.00 0.00 66.02 65.41 2duw s SER 47 CO -0.05 -0.47 1.70 -0.81 1.20 0.00 0.00 173.24 174.80 2duw n PRO 48 N 1.07 0.18 -0.07 5.44 -0.04 -1.26 -2.46 135.00 137.87 2duw n PRO 48 Ca -0.21 0.42 -0.07 0.00 -0.04 0.00 0.00 63.50 63.60 2duw n PRO 48 Cb 0.57 -1.86 -0.11 0.00 -0.04 0.00 0.00 33.50 32.07 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 -2.20 1.75 0.00 0.54 5.02 -1.26 -4.39 118.16 117.62 2duw n LYS 49 Ca 0.02 -0.01 0.13 0.00 -2.02 0.00 0.00 58.31 56.43 2duw n LYS 49 Cb 0.22 -1.35 0.64 0.00 -0.02 0.00 0.00 35.03 34.52 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 -2.50 0.17 -1.72 -0.18 3.14 -1.15 -4.75 118.33 111.34 2duw n VAL 50 Ca -0.22 0.04 -0.39 0.00 -2.96 0.00 0.00 64.34 60.81 2duw n VAL 50 Cb 0.94 -0.60 -0.03 0.00 -1.06 0.00 0.00 33.84 33.09 2duw n VAL 50 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2duw s ALA 51 N -2.68 2.11 0.00 1.55 0.00 -1.03 -1.26 121.76 120.45 2duw s ALA 51 Ca 0.22 0.08 0.00 0.00 0.00 0.00 0.00 51.96 52.25 2duw s ALA 51 Cb 0.17 -4.24 0.00 0.00 0.00 0.00 0.00 23.12 19.05 2duw s ALA 51 CO 0.42 -3.79 0.00 0.41 0.00 0.00 0.00 175.76 172.80 2duw n GLY 52 N 5.83 1.21 3.13 0.00 0.00 -1.26 -4.85 105.19 109.24 2duw n GLY 52 Ca 0.30 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.24 2duw n GLY 52 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2duw s LYS 53 N -0.36 0.82 -0.20 1.61 -2.85 -0.39 -5.01 119.74 113.36 2duw s LYS 53 Ca 0.00 -1.36 -0.04 0.00 -1.00 0.00 0.00 55.97 53.57 2duw s LYS 53 Cb 0.00 0.21 -0.01 0.00 -2.06 0.00 0.00 37.83 35.97 2duw s LYS 53 CO 0.00 -0.20 -0.05 0.99 0.10 0.00 0.00 175.35 176.20 2duw s THR 54 N -3.99 3.46 -0.21 3.79 2.01 -1.26 -0.24 115.64 119.21 2duw s THR 54 Ca 0.18 -0.47 -0.05 0.00 0.31 0.00 0.00 61.69 61.66 2duw s THR 54 Cb 0.08 -2.56 -0.02 0.00 0.01 0.00 0.00 72.50 70.01 2duw s THR 54 CO -0.02 0.44 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.57 2duw s LEU 55 N 1.20 3.13 -2.02 4.42 1.43 0.87 -4.49 118.68 123.22 2duw s LEU 55 Ca 0.02 -0.28 0.00 0.00 -1.03 0.00 0.00 54.13 52.85 2duw s LEU 55 Cb -0.14 -1.80 0.00 0.00 0.03 0.00 0.00 46.19 44.28 2duw s LEU 55 CO -0.01 0.02 0.00 0.18 0.23 0.00 0.00 176.35 176.77 2duw n LEU 56 N 4.52 -1.50 0.00 1.79 4.77 -1.26 -0.30 117.00 125.01 2duw n LEU 56 Ca -0.17 0.40 0.00 0.00 -0.03 0.00 0.00 56.01 56.21 2duw n LEU 56 Cb 0.51 -2.75 0.00 0.00 -2.33 0.00 0.00 43.42 38.86 2duw n LEU 56 CO 0.30 -0.88 0.00 0.61 -1.33 0.00 0.00 177.39 176.09 2duw n GLY 57 N -0.48 0.69 3.82 -0.72 0.00 -1.26 -5.05 105.19 102.19 2duw n GLY 57 Ca -0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.44 2duw n GLY 57 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2duw s GLN 58 N -0.76 3.93 0.13 1.61 -1.52 0.59 -5.05 119.66 118.60 2duw s GLN 58 Ca 0.00 0.28 -0.30 0.00 -1.95 0.00 0.00 55.36 53.38 2duw s GLN 58 Cb 0.00 -3.27 -0.07 0.00 -0.22 0.00 0.00 33.01 29.45 2duw s GLN 58 CO 0.00 0.59 1.25 -1.14 -0.25 0.00 0.00 175.29 175.73 2duw s GLN 59 N -0.67 4.43 0.54 2.91 2.00 -1.26 -0.09 119.66 127.51 2duw s GLN 59 Ca 0.21 1.90 -0.08 0.00 -2.00 0.00 0.00 55.36 55.39 2duw s GLN 59 Cb -0.15 -3.27 -0.04 0.00 0.80 0.00 0.00 33.01 30.35 2duw s GLN 59 CO 0.10 -0.23 0.89 0.20 -0.50 0.00 0.00 175.29 175.75 2duw s GLY 60 N 0.64 1.57 -0.13 2.59 0.00 0.67 -4.50 107.32 108.16 2duw s GLY 60 Ca 0.57 -0.33 -0.09 0.00 0.00 0.00 0.00 44.72 44.87 2duw s GLY 60 CO 0.33 -0.12 0.32 -0.19 0.00 0.00 0.00 173.10 173.44 2duw s TYR 61 N -2.92 -0.40 0.40 1.90 2.02 -1.25 -4.11 117.35 112.99 2duw s TYR 61 Ca 0.51 0.92 0.26 0.00 -0.37 0.00 0.00 57.07 58.39 2duw s TYR 61 Cb -0.11 0.13 1.39 0.00 -0.40 0.00 0.00 41.96 42.98 2duw s TYR 61 CO 0.49 -0.22 2.05 0.00 -1.57 0.00 0.00 175.55 176.30 2duw h ALA 62 N 6.35 1.29 -2.10 3.71 0.00 -1.88 0.31 119.26 126.95 2duw h ALA 62 Ca -0.32 -0.12 0.09 0.00 0.00 0.00 0.00 54.91 54.56 2duw h ALA 62 Cb 1.18 -0.02 -0.17 0.00 0.00 0.00 0.00 17.79 18.77 2duw h ALA 62 CO 0.32 0.16 0.48 -0.08 0.00 0.00 0.00 179.25 180.13 2duw s THR 63 N -4.19 0.00 0.52 0.00 -1.32 -1.26 -4.04 115.64 105.35 2duw s THR 63 Ca -0.03 0.00 0.31 0.00 -1.21 0.00 0.00 61.69 60.76 2duw s THR 63 Cb 0.13 -1.00 0.34 0.00 -1.51 0.00 0.00 72.50 70.46 2duw s THR 63 CO 0.59 0.00 2.19 -0.07 -2.21 0.00 0.00 174.62 175.13 2duw h LEU 64 N 2.22 0.00 -0.27 9.08 3.38 -1.94 0.30 115.31 128.08 2duw h LEU 64 Ca -0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.75 2duw h LEU 64 Cb 1.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.97 2duw h LEU 64 CO 0.32 0.05 0.00 0.00 0.09 0.00 0.00 178.44 178.89 2duw n ALA 65 N -2.27 2.61 -0.02 1.53 0.00 -1.26 -3.19 120.51 117.91 2duw n ALA 65 Ca -0.02 -0.23 0.08 0.00 0.00 0.00 0.00 53.44 53.26 2duw n ALA 65 Cb 0.15 -1.31 -0.16 0.00 0.00 0.00 0.00 19.45 18.13 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 -0.58 0.36 -4.77 0.00 2.03 0.09 -4.93 116.55 108.75 2duw n ASP 66 Ca 0.17 0.00 -0.36 0.00 0.52 0.00 0.00 54.79 55.13 2duw n ASP 66 Cb 0.15 1.82 -0.07 0.00 -0.72 0.00 0.00 41.12 42.30 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 -3.31 5.40 0.13 5.18 0.11 -1.19 -5.00 120.40 121.72 2duw s VAL 67 Ca -0.08 0.28 -0.12 0.00 -2.93 0.00 0.00 61.98 59.13 2duw s VAL 67 Cb 0.12 -3.49 -0.06 0.00 -1.53 0.00 0.00 36.38 31.42 2duw s VAL 67 CO 0.84 0.49 1.45 1.55 -3.33 0.00 0.00 175.10 176.09 2duw h PRO 68 N 6.13 0.85 -6.66 1.54 0.13 -1.92 -3.45 132.00 128.62 2duw h PRO 68 Ca -0.45 -0.45 -0.57 0.00 -0.87 0.00 0.00 66.00 63.65 2duw h PRO 68 Cb 1.18 0.02 0.17 0.00 0.13 0.00 0.00 31.00 32.50 2duw h PRO 68 CO 0.70 1.09 -0.23 -1.91 -0.23 0.00 0.00 178.00 177.42 2duw n GLU 69 N -4.13 0.54 -3.99 0.86 4.07 -1.26 -4.98 120.64 111.74 2duw n GLU 69 Ca -0.03 0.22 -0.34 0.00 -0.06 0.00 0.00 57.16 56.96 2duw n GLU 69 Cb 0.52 -1.89 -0.06 0.00 -0.06 0.00 0.00 31.44 29.96 2duw n GLU 69 CO 0.00 0.00 0.00 -1.59 -0.06 0.00 0.00 177.13 175.48 2duw s LYS 70 N -2.53 3.28 -0.03 5.31 -2.85 -1.26 -5.10 119.74 116.56 2duw s LYS 70 Ca 0.70 -0.37 -0.06 0.00 -1.00 0.00 0.00 55.97 55.25 2duw s LYS 70 Cb -0.40 -3.01 -0.04 0.00 -2.06 0.00 0.00 37.83 32.32 2duw s LYS 70 CO 0.53 0.68 0.21 0.08 0.10 0.00 0.00 175.35 176.95 2duw s VAL 71 N -1.23 5.39 -0.15 1.79 1.01 -1.26 -4.98 120.40 120.97 2duw s VAL 71 Ca 0.24 0.09 0.02 0.00 0.00 0.00 0.00 61.98 62.32 2duw s VAL 71 Cb -0.12 -3.52 -0.10 0.00 0.00 0.00 0.00 36.38 32.63 2duw s VAL 71 CO 0.15 0.42 -0.13 0.47 0.00 0.00 0.00 175.10 176.01 2duw n ASP 72 N 1.29 2.76 -3.80 3.32 8.00 -1.24 -3.54 116.55 123.34 2duw n ASP 72 Ca -0.13 -0.08 -0.28 0.00 0.71 0.00 0.00 54.79 55.01 2duw n ASP 72 Cb 0.53 -0.20 -0.16 0.00 -0.02 0.00 0.00 41.12 41.27 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 -2.31 0.97 -0.48 -1.24 1.75 0.85 -0.67 119.30 118.18 2duw s MET 73 Ca -0.20 -0.49 -0.23 0.00 -1.25 0.00 0.00 55.69 53.52 2duw s MET 73 Cb 0.05 -2.06 0.03 0.00 2.84 0.00 0.00 34.83 35.69 2duw s MET 73 CO 0.37 -0.56 0.78 0.08 -0.65 0.00 0.00 175.02 175.04 2duw s VAL 74 N 1.75 4.64 -0.65 10.11 1.01 -0.91 -0.08 120.40 136.27 2duw s VAL 74 Ca -0.01 0.26 -0.22 0.00 0.00 0.00 0.00 61.98 62.01 2duw s VAL 74 Cb -0.17 -4.35 0.08 0.00 0.00 0.00 0.00 36.38 31.94 2duw s VAL 74 CO -0.07 -0.80 0.91 -0.62 0.00 0.00 0.00 175.10 174.52 2duw s ASP 75 N 2.33 6.19 -0.41 3.32 -1.08 -0.56 -0.09 116.67 126.37 2duw s ASP 75 Ca 0.27 -1.13 -0.11 0.00 -0.52 0.00 0.00 52.55 51.06 2duw s ASP 75 Cb -0.13 -2.39 0.05 0.00 -1.46 0.00 0.00 42.92 38.99 2duw s ASP 75 CO 0.20 -1.36 0.26 -0.69 0.52 0.00 0.00 175.17 174.10 2duw s VAL 76 N 3.70 4.56 0.00 1.11 1.01 0.77 -3.90 120.40 127.65 2duw s VAL 76 Ca 0.20 -1.09 0.00 0.00 0.00 0.00 0.00 61.98 61.09 2duw s VAL 76 Cb -0.18 -3.66 0.00 0.00 0.00 0.00 0.00 36.38 32.54 2duw s VAL 76 CO 0.09 -0.39 0.28 2.22 0.00 0.00 0.00 175.10 177.30 2duw n PHE 77 N 5.00 0.00 0.00 5.22 1.16 -1.26 -2.33 117.46 125.25 2duw n PHE 77 Ca -0.11 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.47 2duw n PHE 77 Cb 0.44 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.31 2duw n PHE 77 CO 0.00 0.00 0.00 0.54 -1.87 0.00 0.00 176.76 175.43 2duw n ARG 78 N -0.17 0.00 -4.02 3.97 1.74 -1.26 -4.77 116.66 112.15 2duw n ARG 78 Ca 0.00 0.75 -0.12 0.00 -0.77 0.00 0.00 57.85 57.71 2duw n ARG 78 Cb 0.05 -1.46 -0.04 0.00 -1.02 0.00 0.00 32.46 30.00 2duw n ARG 78 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 2duw s ASN 79 N -2.59 0.40 -0.05 0.55 0.02 -1.26 -5.02 114.94 106.99 2duw s ASN 79 Ca 0.00 -1.23 -0.11 0.00 -1.02 0.00 0.00 52.86 50.49 2duw s ASN 79 Cb 0.00 0.66 -0.06 0.00 0.02 0.00 0.00 41.25 41.86 2duw s ASN 79 CO 0.00 -1.29 0.48 0.77 0.02 0.00 0.00 177.10 177.08 2duw h SER 80 N 2.16 -0.35 0.02 -1.22 4.64 -1.97 -3.21 113.55 113.62 2duw h SER 80 Ca -0.28 0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.05 2duw h SER 80 Cb 1.25 0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 63.43 2duw h SER 80 CO 0.38 0.10 -0.01 -0.08 -0.87 0.00 0.00 176.83 176.35 2duw h GLU 81 N -1.11 0.00 0.00 4.77 4.81 -1.98 -0.84 114.58 120.23 2duw h GLU 81 Ca -0.04 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.14 2duw h GLU 81 Cb 0.32 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.69 2duw h GLU 81 CO 0.07 0.01 -0.21 0.00 -0.73 0.00 0.00 179.01 178.14 2duw h ALA 82 N 1.99 1.46 -0.86 2.92 0.00 -1.97 -2.62 119.26 120.18 2duw h ALA 82 Ca -0.00 -0.20 0.25 0.00 0.00 0.00 0.00 54.91 54.96 2duw h ALA 82 Cb 0.02 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 2duw h ALA 82 CO 0.00 0.27 0.61 0.00 0.00 0.00 0.00 179.25 180.13 2duw h ALA 83 N 1.79 2.78 0.15 0.00 0.00 -1.15 -0.48 119.26 122.36 2duw h ALA 83 Ca -0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2duw h ALA 83 Cb 0.43 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2duw h ALA 83 CO 0.03 -1.03 -0.07 2.35 0.00 0.00 0.00 179.25 180.53 2duw h TRP 84 N 0.02 -0.18 0.00 0.00 2.91 -1.65 0.93 115.95 117.98 2duw h TRP 84 Ca 0.41 -0.00 -0.01 0.00 1.13 0.00 0.00 58.89 60.41 2duw h TRP 84 Cb 1.61 0.06 -0.00 0.00 -0.51 0.00 0.00 29.16 30.32 2duw h TRP 84 CO -0.00 0.26 -0.06 0.78 -1.03 0.00 0.00 178.44 178.40 2duw h GLY 85 N -0.76 0.00 1.25 2.65 0.00 -1.39 -2.36 103.07 102.46 2duw h GLY 85 Ca -0.02 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 46.99 2duw h GLY 85 CO 0.03 0.00 -1.51 -2.08 0.00 0.00 0.00 176.54 172.98 2duw h VAL 86 N 0.00 1.20 0.45 4.60 2.07 -1.15 -3.28 116.25 120.15 2duw h VAL 86 Ca -0.00 -2.77 -0.02 0.00 0.82 0.00 0.00 66.70 64.73 2duw h VAL 86 Cb 0.10 2.86 -0.01 0.00 -1.52 0.00 0.00 31.29 32.72 2duw h VAL 86 CO 0.01 0.84 -0.29 0.00 0.02 0.00 0.00 177.57 178.15 2duw h ALA 87 N 0.37 -0.71 -0.83 1.67 0.00 -0.37 0.38 119.26 119.76 2duw h ALA 87 Ca -0.25 -0.14 0.15 0.00 0.00 0.00 0.00 54.91 54.68 2duw h ALA 87 Cb 2.06 0.36 -0.10 0.00 0.00 0.00 0.00 17.79 20.11 2duw h ALA 87 CO 0.20 -0.91 0.41 -0.56 0.00 0.00 0.00 179.25 178.38 2duw h GLN 88 N -0.71 0.56 -0.37 0.00 3.07 -1.60 -0.82 115.11 115.25 2duw h GLN 88 Ca -0.05 -0.03 -0.05 0.00 0.09 0.00 0.00 58.65 58.61 2duw h GLN 88 Cb 0.59 -0.13 -0.01 0.00 0.08 0.00 0.00 27.48 28.01 2duw h GLN 88 CO 0.04 0.37 0.05 0.93 0.09 0.00 0.00 178.83 180.31 2duw h GLU 89 N 0.57 0.62 -0.84 0.06 4.39 -1.54 -1.96 114.58 115.89 2duw h GLU 89 Ca 0.46 -0.17 0.07 0.00 0.34 0.00 0.00 59.36 60.06 2duw h GLU 89 Cb 0.68 -0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 29.21 2duw h GLU 89 CO -0.38 0.69 0.55 0.00 -1.16 0.00 0.00 179.01 178.71 2duw h ALA 90 N 0.90 1.61 0.00 3.43 0.00 0.42 -0.42 119.26 125.20 2duw h ALA 90 Ca 0.11 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 2duw h ALA 90 Cb 0.38 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2duw h ALA 90 CO 0.01 0.26 -0.41 0.82 0.00 0.00 0.00 179.25 179.92 2duw h ILE 91 N 0.90 0.84 0.10 0.00 2.04 -1.03 0.28 117.51 120.64 2duw h ILE 91 Ca 0.37 -1.77 -0.00 0.00 1.00 0.00 0.00 64.86 64.45 2duw h ILE 91 Cb 0.26 2.12 0.00 0.00 -0.74 0.00 0.00 36.82 38.46 2duw h ILE 91 CO -0.14 0.41 -0.05 0.00 0.00 0.00 0.00 178.15 178.37 2duw h ALA 92 N 1.59 -0.13 -0.04 1.87 0.00 -0.30 -3.19 119.26 119.05 2duw h ALA 92 Ca -0.00 -0.19 -0.12 0.00 0.00 0.00 0.00 54.91 54.59 2duw h ALA 92 Cb 1.08 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 2duw h ALA 92 CO 0.05 -0.38 -0.53 -0.84 0.00 0.00 0.00 179.25 177.55 2duw h ILE 93 N -0.52 1.37 0.00 0.00 -0.00 -1.49 -3.47 117.51 113.40 2duw h ILE 93 Ca -0.01 -1.82 0.00 0.00 -0.00 0.00 0.00 64.86 63.02 2duw h ILE 93 Cb 0.43 1.94 0.00 0.00 -0.00 0.00 0.00 36.82 39.19 2duw h ILE 93 CO 0.02 0.53 0.00 0.61 -0.00 0.00 0.00 178.15 179.31 2duw n GLY 94 N 0.05 0.69 3.57 0.16 0.00 -0.88 -5.01 105.19 103.77 2duw n GLY 94 Ca -0.02 -0.24 -0.29 0.00 0.00 0.00 0.00 46.02 45.48 2duw n GLY 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2duw s ALA 95 N -0.81 0.23 -0.02 4.61 0.00 0.93 -4.78 121.76 121.91 2duw s ALA 95 Ca 0.00 -0.40 0.02 0.00 0.00 0.00 0.00 51.96 51.59 2duw s ALA 95 Cb 0.00 -3.12 -0.03 0.00 0.00 0.00 0.00 23.12 19.97 2duw s ALA 95 CO 0.00 -3.43 0.02 1.63 0.00 0.00 0.00 175.76 173.98 2duw n LYS 96 N -4.62 2.97 -3.95 0.00 4.76 -1.23 -4.96 118.16 111.13 2duw n LYS 96 Ca 0.05 -0.01 -0.08 0.00 -2.87 0.00 0.00 58.31 55.40 2duw n LYS 96 Cb 0.57 -1.07 -0.09 0.00 -1.84 0.00 0.00 35.03 32.61 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 -2.08 0.17 -0.27 -0.18 2.01 0.16 -3.91 115.64 111.53 2duw s THR 97 Ca -0.01 -1.37 -0.03 0.00 0.31 0.00 0.00 61.69 60.59 2duw s THR 97 Cb 0.01 -1.29 0.09 0.00 0.01 0.00 0.00 72.50 71.32 2duw s THR 97 CO 0.11 -0.75 0.11 -0.22 -0.69 0.00 0.00 174.62 173.17 2duw s LEU 98 N -2.71 0.95 -0.17 4.42 2.96 0.71 -2.14 118.68 122.71 2duw s LEU 98 Ca 0.03 -1.23 -0.09 0.00 -0.22 0.00 0.00 54.13 52.62 2duw s LEU 98 Cb 0.04 -0.47 -0.05 0.00 0.50 0.00 0.00 46.19 46.22 2duw s LEU 98 CO -0.09 -0.41 0.15 0.86 -1.32 0.00 0.00 176.35 175.54 2duw s TRP 99 N 1.98 3.49 0.24 5.38 -0.11 0.88 -0.54 118.94 130.25 2duw s TRP 99 Ca 0.07 0.43 0.02 0.00 1.22 0.00 0.00 56.10 57.85 2duw s TRP 99 Cb -0.16 -2.10 0.02 0.00 -1.50 0.00 0.00 33.47 29.74 2duw s TRP 99 CO -0.28 0.45 0.20 1.28 -4.62 0.00 0.00 176.95 173.99 2duw n LEU 100 N 2.94 0.00 -4.81 5.86 4.77 -0.52 -0.16 117.00 125.08 2duw n LEU 100 Ca -0.17 -1.20 -0.36 0.00 -0.03 0.00 0.00 56.01 54.25 2duw n LEU 100 Cb 0.53 -0.04 -0.06 0.00 -2.33 0.00 0.00 43.42 41.51 2duw n LEU 100 CO 0.35 -0.43 0.46 -1.58 -1.33 0.00 0.00 177.39 174.86 2duw s GLN 101 N -2.99 4.32 0.37 3.23 2.00 -0.98 -4.56 119.66 121.04 2duw s GLN 101 Ca 0.15 0.96 -0.27 0.00 -2.00 0.00 0.00 55.36 54.20 2duw s GLN 101 Cb -0.01 -2.88 -0.11 0.00 0.80 0.00 0.00 33.01 30.81 2duw s GLN 101 CO 0.10 0.38 1.24 -0.11 -0.50 0.00 0.00 175.29 176.40 2duw n LEU 102 N 0.72 3.53 -0.57 3.68 7.94 -1.26 -1.37 117.00 129.66 2duw n LEU 102 Ca -0.02 1.16 -0.07 0.00 -1.11 0.00 0.00 56.01 55.97 2duw n LEU 102 Cb 0.51 -1.47 -0.03 0.00 0.53 0.00 0.00 43.42 42.96 2duw n LEU 102 CO 0.43 -0.67 -0.07 0.61 -1.11 0.00 0.00 177.39 176.58 2duw n GLY 103 N 0.84 0.89 3.01 -3.96 0.00 -1.26 -4.89 105.19 99.82 2duw n GLY 103 Ca 0.06 -0.27 -0.29 0.00 0.00 0.00 0.00 46.02 45.52 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 -2.04 1.43 -0.06 1.61 1.01 -0.47 -4.95 120.40 116.92 2duw s VAL 104 Ca 0.00 -0.57 0.04 0.00 0.00 0.00 0.00 61.98 61.45 2duw s VAL 104 Cb 0.00 -1.34 0.00 0.00 0.00 0.00 0.00 36.38 35.04 2duw s VAL 104 CO 0.00 0.43 -0.18 -0.63 0.00 0.00 0.00 175.10 174.72 2duw s ILE 105 N 1.30 1.52 -0.29 2.22 1.01 -1.26 -2.45 121.20 123.25 2duw s ILE 105 Ca -0.00 -0.74 0.03 0.00 0.00 0.00 0.00 60.65 59.94 2duw s ILE 105 Cb -0.14 -1.33 0.08 0.00 0.01 0.00 0.00 42.46 41.08 2duw s ILE 105 CO -0.06 0.44 -0.04 0.20 0.00 0.00 0.00 174.94 175.48 2duw s ASN 106 N 0.25 4.49 0.17 3.58 -0.87 -1.26 -4.98 114.94 116.33 2duw s ASN 106 Ca -0.10 -1.66 -0.06 0.00 -1.57 0.00 0.00 52.86 49.47 2duw s ASN 106 Cb -0.14 -1.52 0.06 0.00 -0.02 0.00 0.00 41.25 39.63 2duw s ASN 106 CO 0.04 -0.27 1.49 -0.08 -2.57 0.00 0.00 177.10 175.71 2duw h GLU 107 N 7.74 0.69 -0.05 -0.60 4.81 -1.99 -0.39 114.58 124.79 2duw h GLU 107 Ca -0.13 -0.41 -0.01 0.00 -0.13 0.00 0.00 59.36 58.68 2duw h GLU 107 Cb 1.04 0.04 -0.00 0.00 0.63 0.00 0.00 28.75 30.45 2duw h GLU 107 CO 0.48 1.03 -0.00 1.96 -0.73 0.00 0.00 179.01 181.74 2duw h GLN 108 N 0.54 0.10 0.00 1.92 7.50 -2.00 -2.69 115.11 120.47 2duw h GLN 108 Ca 0.02 -0.03 -0.05 0.00 0.50 0.00 0.00 58.65 59.09 2duw h GLN 108 Cb 1.06 -0.01 -0.01 0.00 0.05 0.00 0.00 27.48 28.58 2duw h GLN 108 CO 0.10 0.40 -0.23 0.00 -1.50 0.00 0.00 178.83 177.60 2duw h ALA 109 N 0.70 1.04 0.10 3.87 0.00 -1.89 -1.98 119.26 121.09 2duw h ALA 109 Ca 0.01 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 2duw h ALA 109 Cb 0.36 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2duw h ALA 109 CO 0.00 0.29 -0.05 0.00 0.00 0.00 0.00 179.25 179.50 2duw h ALA 110 N 1.77 -0.13 -0.06 0.00 0.00 -0.90 -3.06 119.26 116.89 2duw h ALA 110 Ca -0.00 -0.14 -0.17 0.00 0.00 0.00 0.00 54.91 54.59 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 0.03 -0.44 -0.72 -0.24 0.00 0.00 0.00 179.25 177.88 2duw h VAL 111 N -0.39 1.40 -0.58 0.00 3.04 -1.47 -3.00 116.25 115.25 2duw h VAL 111 Ca -0.01 -2.19 0.17 0.00 -1.01 0.00 0.00 66.70 63.66 2duw h VAL 111 Cb 0.33 2.15 -0.02 0.00 -2.01 0.00 0.00 31.29 31.74 2duw h VAL 111 CO 0.02 0.65 0.45 0.25 -1.01 0.00 0.00 177.57 177.93 2duw h LEU 112 N 0.21 0.00 0.16 3.16 5.85 -1.34 -0.94 115.31 122.41 2duw h LEU 112 Ca -0.03 0.00 -0.36 0.00 0.84 0.00 0.00 57.88 58.34 2duw h LEU 112 Cb 1.28 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.31 2duw h LEU 112 CO 0.12 0.00 -1.85 0.00 -0.34 0.00 0.00 178.44 176.36 2duw h ALA 113 N 1.64 0.29 -0.99 1.25 0.00 -1.45 -3.36 119.26 116.64 2duw h ALA 113 Ca 0.27 -1.26 0.17 0.00 0.00 0.00 0.00 54.91 54.10 2duw h ALA 113 Cb 1.17 0.56 -0.10 0.00 0.00 0.00 0.00 17.79 19.43 2duw h ALA 113 CO -0.00 1.16 0.62 -0.09 0.00 0.00 0.00 179.25 180.93 2duw h ARG 114 N 0.09 0.75 -0.65 0.00 1.12 -1.05 0.35 114.38 115.00 2duw h ARG 114 Ca -0.38 -0.05 0.18 0.00 -1.11 0.00 0.00 59.98 58.63 2duw h ARG 114 Cb 2.07 -0.17 -0.03 0.00 -0.01 0.00 0.00 29.97 31.83 2duw h ARG 114 CO 0.14 0.50 0.46 0.93 -3.11 0.00 0.00 179.97 178.89 2duw h GLU 115 N 0.78 0.06 0.00 0.20 4.39 -1.56 -0.99 114.58 117.45 2duw h GLU 115 Ca 0.54 -0.00 -0.16 0.00 0.34 0.00 0.00 59.36 60.08 2duw h GLU 115 Cb 0.83 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 29.44 2duw h GLU 115 CO -0.32 0.04 -2.15 0.00 -1.16 0.00 0.00 179.01 175.41 2duw n ALA 116 N -2.64 2.23 0.00 3.43 0.00 0.67 -5.01 120.51 119.20 2duw n ALA 116 Ca 0.12 -0.86 0.00 0.00 0.00 0.00 0.00 53.44 52.70 2duw n ALA 116 Cb 0.68 -0.49 0.00 0.00 0.00 0.00 0.00 19.45 19.64 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 1.49 1.87 3.86 0.00 0.00 0.90 -5.10 105.19 108.22 2duw n GLY 117 Ca -0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.54 2duw n GLY 117 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2duw s LEU 118 N 0.00 4.04 -0.65 0.99 2.96 -0.77 -4.97 118.68 120.28 2duw s LEU 118 Ca 0.00 1.13 -0.23 0.00 -0.22 0.00 0.00 54.13 54.82 2duw s LEU 118 Cb 0.00 -3.94 0.07 0.00 0.50 0.00 0.00 46.19 42.81 2duw s LEU 118 CO 0.00 -0.21 0.96 -0.44 -1.32 0.00 0.00 176.35 175.34 2duw s SER 119 N -2.52 6.19 -0.04 3.68 0.01 -1.25 -4.43 113.70 115.33 2duw s SER 119 Ca 0.51 -0.93 -0.18 0.00 1.31 0.00 0.00 55.95 56.67 2duw s SER 119 Cb -0.10 -2.42 -0.05 0.00 0.21 0.00 0.00 66.02 63.66 2duw s SER 119 CO 0.22 -1.42 0.49 -0.69 0.41 0.00 0.00 173.24 172.25 2duw s VAL 120 N 4.05 5.04 -0.09 3.43 1.01 -1.26 -0.21 120.40 132.36 2duw s VAL 120 Ca 0.23 1.02 -0.03 0.00 0.00 0.00 0.00 61.98 63.19 2duw s VAL 120 Cb -0.16 -3.82 0.04 0.00 0.00 0.00 0.00 36.38 32.44 2duw s VAL 120 CO 0.11 0.44 0.09 -0.69 0.00 0.00 0.00 175.10 175.05 2duw s VAL 121 N -0.19 -0.13 0.45 2.92 1.01 0.30 -4.95 120.40 119.81 2duw s VAL 121 Ca 0.27 0.21 0.05 0.00 0.00 0.00 0.00 61.98 62.51 2duw s VAL 121 Cb -0.17 -0.32 -0.05 0.00 0.00 0.00 0.00 36.38 35.84 2duw s VAL 121 CO 0.14 0.01 0.07 0.00 0.00 0.00 0.00 175.10 175.32 2duw s MET 122 N 2.18 2.11 -1.38 2.72 0.23 -1.26 -1.43 119.30 122.47 2duw s MET 122 Ca 0.04 -2.14 -0.01 0.00 -1.03 0.00 0.00 55.69 52.55 2duw s MET 122 Cb -0.13 -1.71 0.01 0.00 -1.53 0.00 0.00 34.83 31.46 2duw s MET 122 CO -0.06 -0.20 0.12 -3.47 -2.03 0.00 0.00 175.02 169.38 2duw n ASP 123 N -1.17 -4.83 -3.75 -1.18 2.03 -1.03 -4.95 116.55 101.68 2duw n ASP 123 Ca -0.08 0.01 -0.13 0.00 0.52 0.00 0.00 54.79 55.11 2duw n ASP 123 Cb 0.66 -4.03 -0.11 0.00 -0.72 0.00 0.00 41.12 36.93 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 -5.21 0.40 0.05 -0.67 6.06 -1.26 -4.54 118.95 113.77 2duw s ARG 124 Ca 0.08 0.50 0.04 0.00 -2.50 0.00 0.00 55.73 53.84 2duw s ARG 124 Cb -0.04 0.17 -0.02 0.00 0.06 0.00 0.00 34.95 35.12 2duw s ARG 124 CO 0.09 -0.06 -0.11 0.00 -2.50 0.00 0.00 175.30 172.73 2duw h PRO 126 N 4.52 0.00 -0.41 0.00 0.13 -1.97 -1.18 132.00 133.09 2duw h PRO 126 Ca -0.38 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.78 2duw h PRO 126 Cb 1.20 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.30 2duw h PRO 126 CO 0.41 0.48 0.27 0.00 -0.23 0.00 0.00 178.00 178.94 2duw h ALA 127 N 1.52 1.83 0.00 -0.56 0.00 -1.99 0.83 119.26 120.89 2duw h ALA 127 Ca -0.00 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 2duw h ALA 127 Cb 0.86 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 2duw h ALA 127 CO 0.06 0.12 -2.00 -0.89 0.00 0.00 0.00 179.25 176.55 2duw n ILE 128 N -4.48 0.43 0.13 0.00 2.08 -1.13 -4.25 119.36 112.14 2duw n ILE 128 Ca 0.04 -0.60 0.00 0.00 0.56 0.00 0.00 62.75 62.76 2duw n ILE 128 Cb 0.15 -0.17 0.11 0.00 -0.75 0.00 0.00 39.64 38.98 2duw n ILE 128 CO 0.00 0.00 0.00 -0.08 0.56 0.00 0.00 176.55 177.03 2duw h GLU 129 N 0.00 0.00 0.51 0.38 4.57 -0.71 -2.90 114.58 116.43 2duw h GLU 129 Ca -0.14 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.02 2duw h GLU 129 Cb 1.32 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.92 2duw h GLU 129 CO 0.01 0.61 -0.24 1.25 -1.18 0.00 0.00 179.01 179.45 2duw h LEU 130 N 0.00 -0.58 0.00 1.64 5.85 -1.03 -3.04 115.31 118.16 2duw h LEU 130 Ca -0.01 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.65 2duw h LEU 130 Cb 1.28 0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.46 2duw h LEU 130 CO 0.08 -0.21 0.00 -0.81 -0.34 0.00 0.00 178.44 177.16 2duw n PRO 131 N -5.27 0.17 -0.13 5.25 -0.04 -1.25 -3.30 135.00 130.44 2duw n PRO 131 Ca -0.10 0.17 0.27 0.00 -0.04 0.00 0.00 63.50 63.79 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 -1.38 0.01 114.38 113.66 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 0.16 0.00 -0.06 0.00 1.11 0.00 0.00 29.97 31.18 2duw h ARG 132 CO 0.00 0.00 -2.10 -0.11 0.10 0.00 0.00 179.97 177.86 2duw n LEU 133 N -4.25 0.50 -0.18 0.08 -0.00 -1.21 -5.02 117.00 106.93 2duw n LEU 133 Ca 0.16 0.18 0.00 0.00 -0.00 0.00 0.00 56.01 56.35 2duw n LEU 133 Cb 0.88 0.29 0.00 0.00 -0.00 0.00 0.00 43.42 44.59 2duw n LEU 133 CO 0.38 0.47 0.00 0.61 -0.00 0.00 0.00 177.39 178.85 2duw n GLY 134 N 1.69 1.00 0.00 -3.96 0.00 -0.01 -5.00 105.19 98.90 2duw n GLY 134 Ca -0.26 -0.25 0.02 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.18 0.00 -4.47 0.99 4.32 -1.26 -5.05 117.00 111.35 2duw n LEU 135 Ca 0.00 0.00 -0.36 0.00 -0.02 0.00 0.00 56.01 55.63 2duw n LEU 135 Cb 0.18 0.01 0.07 0.00 -1.62 0.00 0.00 43.42 42.06 2duw n LEU 135 CO 0.00 0.01 0.09 0.00 -1.22 0.00 0.00 177.39 176.26 2duw n ALA 136 N -1.68 -1.43 1.68 -1.18 0.00 -1.26 -5.10 120.51 111.54 2duw n ALA 136 Ca -0.01 -0.23 0.13 0.00 0.00 0.00 0.00 53.44 53.33 2duw n ALA 136 Cb 0.14 -1.87 0.80 0.00 0.00 0.00 0.00 19.45 18.53 2duw n ALA 136 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13