#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2klg n GLN 2 N 0.00 2.05 -4.06 3.17 1.13 -1.26 -4.93 117.38 113.48 2klg n GLN 2 Ca 0.00 -1.55 -0.09 0.00 -1.94 0.00 0.00 57.00 53.42 2klg n GLN 2 Cb 0.00 -1.46 -0.11 0.00 0.11 0.00 0.00 30.24 28.78 2klg n GLN 2 CO 0.00 0.00 0.00 -1.50 -1.44 0.00 0.00 177.06 174.12 2klg s ILE 3 N -1.87 0.29 -0.70 5.09 2.07 -1.26 -2.71 121.20 122.11 2klg s ILE 3 Ca 0.34 -1.40 0.04 0.00 -1.41 0.00 0.00 60.65 58.22 2klg s ILE 3 Cb 0.20 -0.95 0.17 0.00 0.13 0.00 0.00 42.46 42.01 2klg s ILE 3 CO 0.31 -0.72 0.50 -0.36 -1.91 0.00 0.00 174.94 172.76 2klg s PHE 4 N -2.63 3.56 0.15 3.50 0.40 -1.26 -4.79 117.98 116.91 2klg s PHE 4 Ca -0.03 -3.28 0.06 0.00 -0.60 0.00 0.00 56.93 53.08 2klg s PHE 4 Cb -0.01 -2.79 -0.04 0.00 0.51 0.00 0.00 43.02 40.68 2klg s PHE 4 CO -0.05 -0.60 0.03 0.08 0.70 0.00 0.00 175.22 175.39 2klg s VAL 5 N -1.28 3.96 -0.10 -0.44 1.01 -1.26 -3.56 120.40 118.73 2klg s VAL 5 Ca 0.24 -1.25 -0.02 0.00 0.00 0.00 0.00 61.98 60.95 2klg s VAL 5 Cb -0.08 -2.98 -0.03 0.00 0.00 0.00 0.00 36.38 33.29 2klg s VAL 5 CO -0.14 -0.06 0.00 -0.54 0.00 0.00 0.00 175.10 174.37 2klg s LYS 6 N -2.83 3.09 0.00 2.72 3.01 -1.24 -4.60 119.74 119.88 2klg s LYS 6 Ca 0.28 -0.41 0.00 0.00 -1.01 0.00 0.00 55.97 54.83 2klg s LYS 6 Cb -0.10 -2.82 0.00 0.00 -1.01 0.00 0.00 37.83 33.90 2klg s LYS 6 CO 0.20 0.64 0.00 0.25 0.51 0.00 0.00 175.35 176.95 2klg n THR 7 N 2.32 0.00 -0.08 2.17 -2.24 -1.26 -4.52 114.28 110.67 2klg n THR 7 Ca -0.18 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.62 2klg n THR 7 Cb 0.53 -1.01 0.35 0.00 -2.10 0.00 0.00 70.33 68.11 2klg n THR 7 CO 0.00 0.00 0.00 0.17 -0.57 0.00 0.00 175.07 174.67 2klg h LEU 8 N 0.00 0.62 0.00 3.22 -0.00 -1.95 -3.38 115.31 113.82 2klg h LEU 8 Ca 0.00 -0.02 0.00 0.00 -0.00 0.00 0.00 57.88 57.86 2klg h LEU 8 Cb 0.00 -0.16 0.00 0.00 -0.00 0.00 0.00 40.66 40.50 2klg h LEU 8 CO 0.00 0.47 -0.15 0.41 -0.00 0.00 0.00 178.44 179.17 2klg n THR 9 N -4.44 0.46 0.00 0.15 -1.04 -1.26 -4.89 114.28 103.27 2klg n THR 9 Ca 0.05 0.24 0.00 0.00 -2.04 0.00 0.00 64.05 62.30 2klg n THR 9 Cb 0.06 -1.45 0.00 0.00 -1.82 0.00 0.00 70.33 67.12 2klg n THR 9 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2klg n GLY 10 N 2.65 0.00 3.91 3.41 0.00 -1.26 -5.14 105.19 108.76 2klg n GLY 10 Ca -0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.72 2klg n GLY 10 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2klg s LYS 11 N 0.00 2.99 -0.24 1.61 2.20 -1.26 -4.91 119.74 120.13 2klg s LYS 11 Ca 0.00 0.13 -0.09 0.00 -0.36 0.00 0.00 55.97 55.65 2klg s LYS 11 Cb 0.00 -2.23 -0.04 0.00 -1.51 0.00 0.00 37.83 34.05 2klg s LYS 11 CO 0.00 -0.72 0.11 0.95 -0.36 0.00 0.00 175.35 175.33 2klg s THR 12 N -3.05 4.82 -0.03 3.43 -4.23 -1.26 -4.31 115.64 111.02 2klg s THR 12 Ca 0.54 -0.00 0.05 0.00 -1.18 0.00 0.00 61.69 61.09 2klg s THR 12 Cb -0.11 -3.24 -0.03 0.00 1.34 0.00 0.00 72.50 70.46 2klg s THR 12 CO 0.47 0.35 -0.16 -0.51 -0.54 0.00 0.00 174.62 174.23 2klg s ILE 13 N 1.21 2.94 -0.26 2.99 2.07 -1.26 -5.09 121.20 123.80 2klg s ILE 13 Ca 0.06 -0.83 -0.07 0.00 -1.41 0.00 0.00 60.65 58.39 2klg s ILE 13 Cb -0.14 -2.15 -0.03 0.00 0.13 0.00 0.00 42.46 40.27 2klg s ILE 13 CO 0.05 0.55 0.08 0.42 -1.91 0.00 0.00 174.94 174.12 2klg s THR 14 N -0.76 4.33 0.02 4.00 -4.23 -1.26 -4.52 115.64 113.22 2klg s THR 14 Ca 0.12 -0.20 0.01 0.00 -1.18 0.00 0.00 61.69 60.44 2klg s THR 14 Cb -0.11 -3.05 -0.01 0.00 1.34 0.00 0.00 72.50 70.68 2klg s THR 14 CO 0.01 0.31 -0.04 -0.76 -0.54 0.00 0.00 174.62 173.60 2klg s LEU 15 N 1.61 2.14 0.33 4.79 1.43 -1.26 -5.00 118.68 122.71 2klg s LEU 15 Ca 0.06 -0.30 0.07 0.00 -1.03 0.00 0.00 54.13 52.92 2klg s LEU 15 Cb -0.15 -0.08 -0.01 0.00 0.03 0.00 0.00 46.19 45.98 2klg s LEU 15 CO 0.04 -0.12 0.43 -0.70 0.23 0.00 0.00 176.35 176.23 2klg s GLU 16 N -0.85 3.09 -0.25 1.70 2.12 -1.26 -4.19 118.70 119.06 2klg s GLU 16 Ca -0.07 -1.03 -0.01 0.00 0.36 0.00 0.00 54.97 54.23 2klg s GLU 16 Cb -0.06 -2.77 0.08 0.00 0.26 0.00 0.00 34.13 31.63 2klg s GLU 16 CO -0.00 0.10 0.03 0.08 -0.54 0.00 0.00 175.26 174.93 2klg s VAL 17 N -2.18 1.08 0.30 3.70 1.01 -1.26 -5.02 120.40 118.04 2klg s VAL 17 Ca 0.43 -1.16 0.06 0.00 0.00 0.00 0.00 61.98 61.31 2klg s VAL 17 Cb -0.09 -1.59 -0.02 0.00 0.00 0.00 0.00 36.38 34.68 2klg s VAL 17 CO 0.30 -0.35 0.37 -1.83 0.00 0.00 0.00 175.10 173.59 2klg s GLU 18 N 1.57 3.08 0.18 2.72 1.03 -1.26 -4.87 118.70 121.15 2klg s GLU 18 Ca 0.02 -1.02 -0.15 0.00 0.03 0.00 0.00 54.97 53.85 2klg s GLU 18 Cb -0.18 -2.73 0.15 0.00 -0.80 0.00 0.00 34.13 30.57 2klg s GLU 18 CO -0.13 0.20 1.69 -1.35 -1.33 0.00 0.00 175.26 174.34 2klg h PRO 19 N 1.11 0.11 -1.20 -4.83 0.11 -2.06 -1.46 132.00 123.77 2klg h PRO 19 Ca -0.47 -0.01 -0.30 0.00 0.11 0.00 0.00 66.00 65.33 2klg h PRO 19 Cb 1.25 -0.02 -0.16 0.00 0.11 0.00 0.00 31.00 32.18 2klg h PRO 19 CO 0.57 0.07 0.39 -1.13 -0.21 0.00 0.00 178.00 177.69 2klg n SER 20 N -5.21 4.72 -4.58 -2.05 3.41 -1.26 -4.91 113.62 103.73 2klg n SER 20 Ca 0.04 -2.95 -0.42 0.00 -0.26 0.00 0.00 58.87 55.28 2klg n SER 20 Cb 0.24 -0.83 -0.02 0.00 -0.26 0.00 0.00 64.21 63.33 2klg n SER 20 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2klg s ASP 21 N -0.09 6.15 0.20 4.04 -1.08 -0.55 -4.99 116.67 120.33 2klg s ASP 21 Ca 0.31 0.50 -0.22 0.00 -0.52 0.00 0.00 52.55 52.62 2klg s ASP 21 Cb 0.25 -2.54 -0.08 0.00 -1.46 0.00 0.00 42.92 39.09 2klg s ASP 21 CO 0.03 -1.65 0.74 -0.89 0.52 0.00 0.00 175.17 173.92 2klg s THR 22 N 6.02 4.50 0.27 1.71 2.01 -1.26 -3.22 115.64 125.67 2klg s THR 22 Ca 0.57 1.45 0.27 0.00 0.31 0.00 0.00 61.69 64.29 2klg s THR 22 Cb -0.12 -3.96 0.28 0.00 0.01 0.00 0.00 72.50 68.71 2klg s THR 22 CO 0.28 0.34 1.97 -0.29 -0.69 0.00 0.00 174.62 176.22 2klg h ILE 23 N 3.00 0.49 0.07 1.82 6.09 -1.35 -2.97 117.51 124.66 2klg h ILE 23 Ca -0.48 -0.77 -0.30 0.00 -1.37 0.00 0.00 64.86 61.95 2klg h ILE 23 Cb 1.20 1.53 -0.02 0.00 0.47 0.00 0.00 36.82 40.00 2klg h ILE 23 CO 0.65 0.15 -1.56 1.05 -3.07 0.00 0.00 178.15 175.37 2klg h GLU 24 N 0.00 0.15 -0.74 2.19 4.11 -1.74 -3.34 114.58 115.21 2klg h GLU 24 Ca -0.00 -0.26 -0.04 0.00 0.07 0.00 0.00 59.36 59.13 2klg h GLU 24 Cb 0.52 0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.83 2klg h GLU 24 CO 0.02 0.94 0.31 -0.97 0.07 0.00 0.00 179.01 179.38 2klg h ASN 25 N 0.04 1.00 0.08 3.06 -1.24 -1.82 -2.43 115.58 114.28 2klg h ASN 25 Ca -0.25 -0.14 -0.04 0.00 0.71 0.00 0.00 56.30 56.58 2klg h ASN 25 Cb 1.99 -0.26 -0.01 0.00 0.73 0.00 0.00 38.32 40.77 2klg h ASN 25 CO 0.13 0.88 -0.14 1.62 -1.29 0.00 0.00 177.43 178.62 2klg h VAL 26 N 1.07 1.15 -0.74 2.57 3.04 -1.67 -2.74 116.25 118.93 2klg h VAL 26 Ca 0.25 -0.68 0.07 0.00 -1.01 0.00 0.00 66.70 65.34 2klg h VAL 26 Cb 0.18 1.24 -0.06 0.00 -2.01 0.00 0.00 31.29 30.64 2klg h VAL 26 CO -0.02 0.20 0.41 0.50 -1.01 0.00 0.00 177.57 177.65 2klg h LYS 27 N 0.13 0.70 -0.07 4.17 3.64 -1.55 -0.79 116.57 122.80 2klg h LYS 27 Ca 0.03 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.32 2klg h LYS 27 Cb 0.33 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.98 2klg h LYS 27 CO 0.02 0.47 -0.15 0.00 -2.27 0.00 0.00 179.45 177.51 2klg h ALA 28 N 1.40 1.62 -0.72 5.00 0.00 -1.55 -2.58 119.26 122.42 2klg h ALA 28 Ca 0.34 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 55.02 2klg h ALA 28 Cb 0.26 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 2klg h ALA 28 CO -0.21 0.28 0.23 0.87 0.00 0.00 0.00 179.25 180.42 2klg h LYS 29 N 0.10 1.11 -0.21 0.00 1.57 -1.16 0.11 116.57 118.09 2klg h LYS 29 Ca 0.02 -0.23 -0.02 0.00 -1.87 0.00 0.00 60.65 58.55 2klg h LYS 29 Cb 0.34 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 2klg h LYS 29 CO 0.02 0.94 0.04 0.82 -0.57 0.00 0.00 179.45 180.70 2klg h ILE 30 N 1.07 1.22 -0.48 1.86 1.08 -1.24 -2.21 117.51 118.81 2klg h ILE 30 Ca 0.23 -0.72 -0.06 0.00 -0.39 0.00 0.00 64.86 63.93 2klg h ILE 30 Cb 0.29 1.29 -0.02 0.00 -3.07 0.00 0.00 36.82 35.31 2klg h ILE 30 CO -0.01 0.22 0.07 -0.61 -0.69 0.00 0.00 178.15 177.13 2klg h GLN 31 N 0.16 0.80 0.00 2.37 -0.00 -1.37 -2.53 115.11 114.54 2klg h GLN 31 Ca 0.07 -0.22 -0.00 0.00 -0.00 0.00 0.00 58.65 58.49 2klg h GLN 31 Cb 0.30 -0.09 -0.00 0.00 0.00 0.00 0.00 27.48 27.69 2klg h GLN 31 CO 0.00 0.81 -0.02 0.22 0.00 0.00 0.00 178.83 179.85 2klg h ASP 32 N 0.67 0.00 -0.04 -0.69 1.82 -0.69 0.43 116.42 117.93 2klg h ASP 32 Ca 0.14 0.00 -0.14 0.00 -0.39 0.00 0.00 57.03 56.64 2klg h ASP 32 Cb 0.41 0.00 0.01 0.00 0.68 0.00 0.00 39.33 40.42 2klg h ASP 32 CO 0.01 0.02 -0.52 0.11 -1.61 0.00 0.00 179.24 177.25 2klg h LYS 33 N 0.00 0.43 0.00 0.28 1.57 -0.95 -3.45 116.57 114.45 2klg h LYS 33 Ca -0.00 -0.40 0.00 0.00 -1.87 0.00 0.00 60.65 58.38 2klg h LYS 33 Cb 0.08 0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.49 2klg h LYS 33 CO 0.00 1.06 -0.15 0.39 -0.57 0.00 0.00 179.45 180.18 2klg n GLU 34 N -4.26 0.00 0.00 3.15 1.02 -0.95 -5.11 120.64 114.49 2klg n GLU 34 Ca -0.09 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.05 2klg n GLU 34 Cb 0.62 -0.08 0.00 0.00 -0.02 0.00 0.00 31.44 31.96 2klg n GLU 34 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2klg n GLY 35 N 1.75 0.60 3.60 0.62 0.00 0.15 -5.03 105.19 106.88 2klg n GLY 35 Ca 0.00 -0.73 -0.43 0.00 0.00 0.00 0.00 46.02 44.86 2klg n GLY 35 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2klg s ILE 36 N -0.31 4.11 0.15 -0.61 2.07 -1.26 -4.93 121.20 120.42 2klg s ILE 36 Ca 0.00 1.13 -0.16 0.00 -1.41 0.00 0.00 60.65 60.21 2klg s ILE 36 Cb 0.00 -4.48 0.01 0.00 0.13 0.00 0.00 42.46 38.12 2klg s ILE 36 CO 0.00 -0.93 1.80 -0.65 -1.91 0.00 0.00 174.94 173.25 2klg h PRO 37 N 9.68 0.54 -4.78 3.50 0.11 -1.99 -3.43 132.00 135.63 2klg h PRO 37 Ca -0.24 -0.04 -0.41 0.00 0.11 0.00 0.00 66.00 65.42 2klg h PRO 37 Cb 1.07 -0.12 -0.10 0.00 0.11 0.00 0.00 31.00 31.97 2klg h PRO 37 CO 1.12 0.37 1.81 -2.30 -0.21 0.00 0.00 178.00 178.79 2klg n PRO 38 N -4.79 0.00 0.22 1.05 -0.02 -1.26 -4.73 135.00 125.46 2klg n PRO 38 Ca 0.01 0.00 0.15 0.00 -2.02 0.00 0.00 63.50 61.64 2klg n PRO 38 Cb 0.03 -1.20 0.65 0.00 -0.02 0.00 0.00 33.50 32.96 2klg n PRO 38 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 2klg h ASP 39 N 11.00 0.00 -0.67 2.55 3.04 -2.04 -2.91 116.42 127.38 2klg h ASP 39 Ca -0.01 0.00 -0.36 0.00 -3.24 0.00 0.00 57.03 53.42 2klg h ASP 39 Cb 1.17 0.00 -0.21 0.00 -1.04 0.00 0.00 39.33 39.25 2klg h ASP 39 CO 1.44 0.00 0.46 0.00 -2.04 0.00 0.00 179.24 179.10 2klg n GLN 40 N -2.70 1.87 -2.76 4.15 6.02 -1.26 -4.91 117.38 117.79 2klg n GLN 40 Ca 0.01 -2.05 -0.43 0.00 -0.01 0.00 0.00 57.00 54.52 2klg n GLN 40 Cb 0.24 -1.80 -0.03 0.00 1.02 0.00 0.00 30.24 29.67 2klg n GLN 40 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.06 174.91 2klg s GLN 41 N -2.26 3.98 0.18 -1.09 0.74 -1.10 -5.01 119.66 115.10 2klg s GLN 41 Ca 0.39 0.83 -0.03 0.00 0.05 0.00 0.00 55.36 56.59 2klg s GLN 41 Cb 0.33 -3.75 -0.03 0.00 1.10 0.00 0.00 33.01 30.65 2klg s GLN 41 CO 0.07 -0.86 0.17 0.50 -0.55 0.00 0.00 175.29 174.62 2klg s ARG 42 N 3.44 1.17 0.38 1.67 3.00 -1.26 -4.87 118.95 122.47 2klg s ARG 42 Ca 0.40 -1.48 0.07 0.00 -1.00 0.00 0.00 55.73 53.73 2klg s ARG 42 Cb -0.13 0.30 -0.01 0.00 0.00 0.00 0.00 34.95 35.11 2klg s ARG 42 CO 0.15 -0.39 0.41 -0.48 0.00 0.00 0.00 175.30 174.99 2klg s LEU 43 N -3.09 3.62 -0.86 -0.88 2.34 -1.26 -2.94 118.68 115.61 2klg s LEU 43 Ca 0.30 -0.49 0.00 0.00 0.06 0.00 0.00 54.13 54.00 2klg s LEU 43 Cb 0.06 -2.36 0.25 0.00 -0.56 0.00 0.00 46.19 43.58 2klg s LEU 43 CO 0.08 -0.54 0.96 0.00 -1.06 0.00 0.00 176.35 175.78 2klg n ILE 44 N -1.57 3.41 -3.44 1.48 3.06 0.00 -4.76 119.36 117.54 2klg n ILE 44 Ca 0.02 -5.37 -0.10 0.00 -2.50 0.00 0.00 62.75 54.81 2klg n ILE 44 Cb 0.60 -2.20 -0.09 0.00 0.54 0.00 0.00 39.64 38.49 2klg n ILE 44 CO 0.00 0.00 0.00 0.12 -2.50 0.00 0.00 176.55 174.17 2klg s PHE 45 N -2.13 -0.77 -1.97 9.51 2.19 -1.26 -4.75 117.98 118.80 2klg s PHE 45 Ca 0.33 0.95 0.00 0.00 0.33 0.00 0.00 56.93 58.54 2klg s PHE 45 Cb 0.03 0.06 0.00 0.00 -1.31 0.00 0.00 43.02 41.80 2klg s PHE 45 CO -0.03 -0.64 0.00 0.00 1.83 0.00 0.00 175.22 176.38 2klg n ALA 46 N 5.37 -0.48 -4.26 11.12 0.00 -1.26 -2.85 120.51 128.14 2klg n ALA 46 Ca -0.05 0.24 -0.33 0.00 0.00 0.00 0.00 53.44 53.30 2klg n ALA 46 Cb 0.50 -2.12 -0.06 0.00 0.00 0.00 0.00 19.45 17.76 2klg n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2klg n GLY 47 N -0.73 -0.28 3.81 0.00 0.00 -1.26 -4.92 105.19 101.82 2klg n GLY 47 Ca -0.23 0.14 -0.36 0.00 0.00 0.00 0.00 46.02 45.57 2klg n GLY 47 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2klg s LYS 48 N -7.06 3.77 0.47 1.61 2.47 -1.13 -5.10 119.74 114.76 2klg s LYS 48 Ca 0.35 -0.17 -0.04 0.00 -1.56 0.00 0.00 55.97 54.55 2klg s LYS 48 Cb -0.20 -3.29 -0.03 0.00 -1.46 0.00 0.00 37.83 32.86 2klg s LYS 48 CO 0.96 0.57 0.74 -1.14 0.16 0.00 0.00 175.35 176.65 2klg s GLN 49 N -0.43 3.40 0.44 4.03 -0.44 -1.26 -4.65 119.66 120.75 2klg s GLN 49 Ca 0.12 0.00 0.23 0.00 -2.50 0.00 0.00 55.36 53.22 2klg s GLN 49 Cb -0.12 -2.43 0.41 0.00 -1.64 0.00 0.00 33.01 29.23 2klg s GLN 49 CO 0.01 -0.21 1.63 1.25 0.50 0.00 0.00 175.29 178.48 2klg h LEU 50 N 0.29 0.00 0.16 3.68 5.85 -1.89 -3.29 115.31 120.11 2klg h LEU 50 Ca -0.47 0.00 -0.29 0.00 0.84 0.00 0.00 57.88 57.96 2klg h LEU 50 Cb 1.22 0.00 0.03 0.00 0.37 0.00 0.00 40.66 42.28 2klg h LEU 50 CO 0.61 0.04 -1.23 -0.33 -0.34 0.00 0.00 178.44 177.19 2klg h GLU 51 N 0.00 0.55 -6.13 1.25 4.39 -1.94 -2.89 114.58 109.81 2klg h GLU 51 Ca -0.00 -0.81 -0.74 0.00 0.34 0.00 0.00 59.36 58.16 2klg h GLU 51 Cb 0.98 0.28 0.01 0.00 -0.10 0.00 0.00 28.75 29.92 2klg h GLU 51 CO 0.00 1.37 0.96 -0.25 -1.16 0.00 0.00 179.01 179.93 2klg n ASP 52 N -3.84 2.34 -2.62 1.42 9.92 -1.24 -4.74 116.55 117.79 2klg n ASP 52 Ca -0.15 1.02 -0.09 0.00 -0.53 0.00 0.00 54.79 55.04 2klg n ASP 52 Cb 0.99 -1.14 -0.05 0.00 -0.64 0.00 0.00 41.12 40.28 2klg n ASP 52 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2klg n GLY 53 N 4.48 2.14 3.83 0.44 0.00 -1.26 -4.50 105.19 110.31 2klg n GLY 53 Ca 0.28 -0.52 -0.22 0.00 0.00 0.00 0.00 46.02 45.57 2klg n GLY 53 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2klg s ARG 54 N 2.87 2.67 -0.18 1.61 3.00 -1.26 -4.96 118.95 122.70 2klg s ARG 54 Ca 0.27 -1.32 -0.10 0.00 0.00 0.00 0.00 55.73 54.57 2klg s ARG 54 Cb 0.10 -2.43 -0.05 0.00 0.00 0.00 0.00 34.95 32.58 2klg s ARG 54 CO -0.01 0.12 0.17 0.99 0.00 0.00 0.00 175.30 176.57 2klg s THR 55 N -2.31 5.40 0.45 0.02 2.01 -1.26 -1.04 115.64 118.90 2klg s THR 55 Ca 0.40 0.27 0.22 0.00 0.31 0.00 0.00 61.69 62.89 2klg s THR 55 Cb -0.05 -3.50 0.41 0.00 0.01 0.00 0.00 72.50 69.37 2klg s THR 55 CO 0.26 0.45 1.86 0.17 -0.69 0.00 0.00 174.62 176.67 2klg h LEU 56 N 6.43 0.29 -1.12 4.42 -0.00 -1.82 0.12 115.31 123.62 2klg h LEU 56 Ca -0.43 0.03 -0.04 0.00 -0.00 0.00 0.00 57.88 57.44 2klg h LEU 56 Cb 1.16 -0.02 -0.02 0.00 -0.00 0.00 0.00 40.66 41.78 2klg h LEU 56 CO 0.73 0.10 0.13 -1.28 -0.00 0.00 0.00 178.44 178.13 2klg h SER 57 N 0.28 0.70 -0.52 0.17 0.87 -1.83 0.21 113.55 113.43 2klg h SER 57 Ca 0.47 -0.11 0.12 0.00 -1.23 0.00 0.00 61.79 61.03 2klg h SER 57 Cb 1.37 -0.18 -0.03 0.00 -0.44 0.00 0.00 62.40 63.12 2klg h SER 57 CO -0.14 0.68 0.36 -2.24 -0.53 0.00 0.00 176.83 174.96 2klg h ASP 58 N 0.73 0.16 -0.79 6.23 3.04 -1.12 -0.71 116.42 123.96 2klg h ASP 58 Ca 0.17 0.01 -0.40 0.00 -3.24 0.00 0.00 57.03 53.56 2klg h ASP 58 Cb 0.26 -0.03 -0.24 0.00 -1.04 0.00 0.00 39.33 38.28 2klg h ASP 58 CO -0.00 0.10 0.42 -1.22 -2.04 0.00 0.00 179.24 176.49 2klg n TYR 59 N -4.44 2.45 -1.13 4.15 4.01 -1.02 -4.90 117.16 116.28 2klg n TYR 59 Ca 0.09 -1.75 -0.05 0.00 -0.16 0.00 0.00 57.90 56.03 2klg n TYR 59 Cb 0.46 -0.80 -0.02 0.00 -0.31 0.00 0.00 39.34 38.67 2klg n TYR 59 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2klg n ASN 60 N -1.10 -5.12 -3.59 7.72 2.85 -0.27 -4.89 115.26 110.85 2klg n ASN 60 Ca 0.51 0.11 -0.41 0.00 -0.11 0.00 0.00 54.58 54.69 2klg n ASN 60 Cb 1.47 -3.03 -0.00 0.00 1.24 0.00 0.00 39.78 39.46 2klg n ASN 60 CO 0.00 0.00 0.00 -0.38 -2.11 0.00 0.00 177.26 174.77 2klg n ILE 61 N -2.34 4.98 -3.27 -1.44 5.41 0.70 -4.83 119.36 118.57 2klg n ILE 61 Ca -0.05 -4.33 -0.07 0.00 1.00 0.00 0.00 62.75 59.31 2klg n ILE 61 Cb 0.41 -2.16 0.01 0.00 -0.71 0.00 0.00 39.64 37.19 2klg n ILE 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2klg n GLN 62 N 2.35 1.03 -1.53 0.38 10.64 -1.26 -3.85 117.38 125.13 2klg n GLN 62 Ca 0.56 -1.03 -0.46 0.00 -1.83 0.00 0.00 57.00 54.24 2klg n GLN 62 Cb 0.28 0.01 -0.02 0.00 -0.86 0.00 0.00 30.24 29.64 2klg n GLN 62 CO 0.00 0.00 0.00 1.17 -1.83 0.00 0.00 177.06 176.40 2klg n LYS 63 N -1.19 0.90 -1.26 2.61 4.81 -1.26 -0.56 118.16 122.21 2klg n LYS 63 Ca 0.03 0.32 -0.09 0.00 -0.87 0.00 0.00 58.31 57.69 2klg n LYS 63 Cb 0.19 -1.58 -0.04 0.00 0.02 0.00 0.00 35.03 33.63 2klg n LYS 63 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2klg n GLU 64 N 0.88 -1.24 -1.18 1.64 1.02 -1.10 -4.99 120.64 115.66 2klg n GLU 64 Ca 0.13 0.76 -0.22 0.00 -0.02 0.00 0.00 57.16 57.80 2klg n GLU 64 Cb 0.29 -4.89 0.17 0.00 -0.02 0.00 0.00 31.44 26.99 2klg n GLU 64 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2klg n SER 65 N -0.60 -0.66 -4.21 1.62 2.88 0.28 -4.91 113.62 108.01 2klg n SER 65 Ca -0.09 -1.22 -0.42 0.00 -1.33 0.00 0.00 58.87 55.81 2klg n SER 65 Cb 0.45 -0.76 -0.06 0.00 -0.75 0.00 0.00 64.21 63.08 2klg n SER 65 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2klg s THR 66 N -2.92 4.60 -0.52 2.46 -4.23 -1.26 -4.34 115.64 109.43 2klg s THR 66 Ca 0.56 -2.59 -0.17 0.00 -1.18 0.00 0.00 61.69 58.31 2klg s THR 66 Cb -0.03 -3.92 0.10 0.00 1.34 0.00 0.00 72.50 69.99 2klg s THR 66 CO 0.40 -0.93 0.50 -0.76 -0.54 0.00 0.00 174.62 173.30 2klg s LEU 67 N 0.22 5.76 -0.36 4.79 1.02 -1.23 -4.97 118.68 123.91 2klg s LEU 67 Ca 0.16 -1.49 -0.09 0.00 0.02 0.00 0.00 54.13 52.73 2klg s LEU 67 Cb -0.17 -2.24 0.04 0.00 0.02 0.00 0.00 46.19 43.84 2klg s LEU 67 CO -0.05 -0.82 0.17 -2.28 0.02 0.00 0.00 176.35 173.38 2klg s HIS 68 N 1.86 3.26 0.71 0.29 2.46 -1.26 -3.69 115.29 118.92 2klg s HIS 68 Ca 0.06 -1.26 0.02 0.00 0.47 0.00 0.00 55.06 54.35 2klg s HIS 68 Cb -0.26 -2.43 0.13 0.00 -0.13 0.00 0.00 32.58 29.89 2klg s HIS 68 CO 0.06 -0.71 0.97 -1.17 -2.47 0.00 0.00 174.74 171.42 2klg s LEU 69 N 1.47 2.96 0.46 8.88 2.96 -1.26 -0.82 118.68 133.33 2klg s LEU 69 Ca 0.00 -0.57 0.08 0.00 -0.22 0.00 0.00 54.13 53.42 2klg s LEU 69 Cb -0.20 -1.71 0.01 0.00 0.50 0.00 0.00 46.19 44.80 2klg s LEU 69 CO 0.04 -1.84 0.51 0.68 -1.32 0.00 0.00 176.35 174.42 2klg s VAL 70 N -3.07 2.57 0.36 1.68 -7.23 -1.15 -4.86 120.40 108.70 2klg s VAL 70 Ca 0.67 -1.19 -0.25 0.00 -1.81 0.00 0.00 61.98 59.40 2klg s VAL 70 Cb -0.04 -2.76 -0.09 0.00 0.56 0.00 0.00 36.38 34.04 2klg s VAL 70 CO 0.44 0.00 1.01 -0.22 -0.31 0.00 0.00 175.10 176.02 2klg s LEU 71 N -4.31 4.23 0.68 1.32 2.96 -1.26 -4.82 118.68 117.47 2klg s LEU 71 Ca 0.51 1.97 0.01 0.00 -0.22 0.00 0.00 54.13 56.40 2klg s LEU 71 Cb -0.06 -4.10 0.11 0.00 0.50 0.00 0.00 46.19 42.64 2klg s LEU 71 CO 0.31 -0.31 0.93 0.00 -1.32 0.00 0.00 176.35 175.96 2klg s ARG 72 N -2.29 1.89 0.07 1.98 1.70 -1.26 -5.03 118.95 116.01 2klg s ARG 72 Ca 0.54 -1.12 -0.06 0.00 -0.47 0.00 0.00 55.73 54.63 2klg s ARG 72 Cb -0.21 -2.39 -0.29 0.00 -0.57 0.00 0.00 34.95 31.48 2klg s ARG 72 CO 0.27 -1.26 1.12 -0.07 -1.08 0.00 0.00 175.30 174.28 2klg h LEU 73 N -0.35 0.47 -9.37 -1.89 -0.00 -1.97 -3.45 115.31 98.76 2klg h LEU 73 Ca -0.37 -0.51 -0.54 0.00 -0.00 0.00 0.00 57.88 56.46 2klg h LEU 73 Cb 1.27 -0.15 -0.02 0.00 -0.00 0.00 0.00 40.66 41.76 2klg h LEU 73 CO 0.42 1.40 0.43 -0.13 -0.00 0.00 0.00 178.44 180.56 2klg s ARG 74 N -2.65 4.52 0.00 1.13 3.00 -1.26 -4.09 118.95 119.60 2klg s ARG 74 Ca -0.05 1.43 0.00 0.00 0.00 0.00 0.00 55.73 57.11 2klg s ARG 74 Cb 0.07 -3.48 0.00 0.00 0.00 0.00 0.00 34.95 31.54 2klg s ARG 74 CO 0.89 -0.13 0.00 0.41 0.00 0.00 0.00 175.30 176.47 2klg n GLY 75 N 2.97 4.60 0.00 -3.53 0.00 -1.26 -5.01 105.19 102.95 2klg n GLY 75 Ca 0.07 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.33 2klg n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93