#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 0.76 -4.28 2.12 1.13 -1.26 -5.01 117.38 110.83 2klg n GLN 2 Ca 0.00 0.26 -0.17 0.00 -1.94 0.00 0.00 57.00 55.15 2klg n GLN 2 Cb 0.00 -1.71 -0.09 0.00 0.11 0.00 0.00 30.24 28.55 2klg n GLN 2 CO 0.00 0.00 0.00 0.96 -1.44 0.00 0.00 177.06 176.58 2klg s ILE 3 N -2.56 0.09 -0.56 5.09 -4.36 -1.26 -2.54 121.20 115.11 2klg s ILE 3 Ca -0.22 -2.00 0.03 0.00 -0.26 0.00 0.00 60.65 58.20 2klg s ILE 3 Cb 0.07 -2.50 0.14 0.00 1.25 0.00 0.00 42.46 41.42 2klg s ILE 3 CO 0.77 0.00 0.32 -0.36 0.24 0.00 0.00 174.94 175.91 2klg s PHE 4 N -3.67 3.26 -0.17 1.37 0.08 -1.26 -4.86 117.98 112.72 2klg s PHE 4 Ca 0.39 -3.12 -0.04 0.00 0.12 0.00 0.00 56.93 54.27 2klg s PHE 4 Cb 0.04 -2.87 -0.03 0.00 -0.57 0.00 0.00 43.02 39.59 2klg s PHE 4 CO 0.21 -0.74 -0.03 0.08 -0.10 0.00 0.00 175.22 174.64 2klg s VAL 5 N -0.39 3.91 0.15 -0.44 1.01 -1.26 -4.21 120.40 119.17 2klg s VAL 5 Ca 0.18 -0.34 0.05 0.00 0.00 0.00 0.00 61.98 61.87 2klg s VAL 5 Cb -0.23 -2.73 -0.04 0.00 0.00 0.00 0.00 36.38 33.38 2klg s VAL 5 CO -0.02 0.47 0.07 -1.59 0.00 0.00 0.00 175.10 174.04 2klg s LYS 6 N 0.55 2.71 0.00 2.72 -2.85 -1.26 -4.29 119.74 117.32 2klg s LYS 6 Ca -0.02 -0.91 0.00 0.00 -1.00 0.00 0.00 55.97 54.03 2klg s LYS 6 Cb -0.14 -2.56 0.00 0.00 -2.06 0.00 0.00 37.83 33.07 2klg s LYS 6 CO 0.02 0.49 0.00 2.41 0.10 0.00 0.00 175.35 178.38 2klg n THR 7 N -0.07 0.00 0.02 3.79 -1.04 -1.26 -4.09 114.28 111.63 2klg n THR 7 Ca -0.09 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 61.91 2klg n THR 7 Cb 0.54 0.00 0.27 0.00 -1.82 0.00 0.00 70.33 69.32 2klg n THR 7 CO 0.00 0.00 0.00 0.17 -0.64 0.00 0.00 175.07 174.60 2klg h LEU 8 N 0.00 0.46 0.00 -4.42 -0.00 -1.97 -3.38 115.31 106.00 2klg h LEU 8 Ca 0.00 -0.11 -0.07 0.00 -0.00 0.00 0.00 57.88 57.70 2klg h LEU 8 Cb 0.00 -0.12 -0.01 0.00 -0.00 0.00 0.00 40.66 40.53 2klg h LEU 8 CO 0.00 0.60 -0.88 0.35 -0.00 0.00 0.00 178.44 178.51 2klg n THR 9 N -4.22 1.12 0.00 0.15 -2.24 -1.26 -4.86 114.28 102.97 2klg n THR 9 Ca 0.01 0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.91 2klg n THR 9 Cb 0.30 -1.84 0.00 0.00 -2.10 0.00 0.00 70.33 66.69 2klg n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2klg n GLY 10 N 2.46 -1.18 3.86 3.38 0.00 -1.26 -5.12 105.19 107.33 2klg n GLY 10 Ca -0.13 0.35 -0.31 0.00 0.00 0.00 0.00 46.02 45.93 2klg n GLY 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2klg s LYS 11 N 0.00 3.86 -0.33 1.61 -0.14 -1.26 -4.86 119.74 118.61 2klg s LYS 11 Ca 0.00 0.65 -0.11 0.00 -1.36 0.00 0.00 55.97 55.15 2klg s LYS 11 Cb 0.00 -2.31 -0.00 0.00 -1.68 0.00 0.00 37.83 33.83 2klg s LYS 11 CO 0.00 -0.09 0.19 -0.08 -0.76 0.00 0.00 175.35 174.62 2klg s THR 12 N -2.41 4.82 0.08 2.17 -1.32 -1.26 -4.39 115.64 113.34 2klg s THR 12 Ca 0.54 -0.45 0.09 0.00 -1.21 0.00 0.00 61.69 60.66 2klg s THR 12 Cb -0.10 -3.51 -0.04 0.00 -1.51 0.00 0.00 72.50 67.34 2klg s THR 12 CO 0.29 -0.03 -0.23 0.27 -2.21 0.00 0.00 174.62 172.72 2klg s ILE 13 N 1.64 2.49 -0.31 5.08 -4.36 -1.26 -5.12 121.20 119.35 2klg s ILE 13 Ca 0.05 -1.47 -0.09 0.00 -0.26 0.00 0.00 60.65 58.88 2klg s ILE 13 Cb -0.18 -2.06 0.00 0.00 1.25 0.00 0.00 42.46 41.48 2klg s ILE 13 CO 0.08 0.23 0.13 0.42 0.24 0.00 0.00 174.94 176.04 2klg s THR 14 N -0.98 4.35 -0.02 8.37 -4.23 -1.26 -4.65 115.64 117.23 2klg s THR 14 Ca 0.14 -0.59 0.04 0.00 -1.18 0.00 0.00 61.69 60.10 2klg s THR 14 Cb -0.10 -3.26 -0.01 0.00 1.34 0.00 0.00 72.50 70.47 2klg s THR 14 CO 0.06 0.03 -0.14 -0.22 -0.54 0.00 0.00 174.62 173.81 2klg s LEU 15 N 1.56 1.98 0.37 4.79 0.20 -1.26 -5.02 118.68 121.30 2klg s LEU 15 Ca 0.03 -0.26 0.02 0.00 0.69 0.00 0.00 54.13 54.61 2klg s LEU 15 Cb -0.17 -0.73 -0.02 0.00 -0.43 0.00 0.00 46.19 44.84 2klg s LEU 15 CO 0.05 0.15 0.56 -1.61 -0.29 0.00 0.00 176.35 175.21 2klg s GLU 16 N -0.21 3.32 -0.14 1.98 0.41 -1.26 -4.09 118.70 118.70 2klg s GLU 16 Ca 0.03 -0.49 -0.01 0.00 -0.41 0.00 0.00 54.97 54.09 2klg s GLU 16 Cb -0.07 -2.67 0.04 0.00 -1.78 0.00 0.00 34.13 29.65 2klg s GLU 16 CO -0.00 0.04 -0.05 0.08 -0.49 0.00 0.00 175.26 174.84 2klg s VAL 17 N -2.34 1.00 0.31 2.63 1.01 -1.26 -5.04 120.40 116.72 2klg s VAL 17 Ca 0.42 -0.45 0.06 0.00 0.00 0.00 0.00 61.98 62.01 2klg s VAL 17 Cb -0.10 -1.14 -0.01 0.00 0.00 0.00 0.00 36.38 35.13 2klg s VAL 17 CO 0.35 0.21 0.43 -1.61 0.00 0.00 0.00 175.10 174.48 2klg s GLU 18 N 1.69 3.15 0.03 2.72 2.02 -1.26 -4.91 118.70 122.15 2klg s GLU 18 Ca 0.02 -0.99 -0.13 0.00 0.02 0.00 0.00 54.97 53.90 2klg s GLU 18 Cb -0.14 -2.80 -0.06 0.00 0.10 0.00 0.00 34.13 31.23 2klg s GLU 18 CO -0.08 0.14 1.20 -1.00 0.02 0.00 0.00 175.26 175.55 2klg h PRO 19 N 0.98 -0.32 -1.28 0.39 0.13 -2.05 -2.81 132.00 127.04 2klg h PRO 19 Ca -0.47 0.02 -0.32 0.00 -0.87 0.00 0.00 66.00 64.36 2klg h PRO 19 Cb 1.25 0.07 -0.15 0.00 0.13 0.00 0.00 31.00 32.30 2klg h PRO 19 CO 0.55 -0.21 0.41 0.43 -0.23 0.00 0.00 178.00 178.95 2klg n SER 20 N -3.50 5.27 -4.62 1.44 7.64 -1.26 -4.87 113.62 113.72 2klg n SER 20 Ca -0.04 -3.00 -0.43 0.00 1.01 0.00 0.00 58.87 56.41 2klg n SER 20 Cb 0.16 -0.90 -0.02 0.00 -1.01 0.00 0.00 64.21 62.44 2klg n SER 20 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2klg s ASP 21 N -0.07 6.55 0.78 6.43 2.15 -1.06 -5.01 116.67 126.43 2klg s ASP 21 Ca 0.32 1.07 -0.08 0.00 0.43 0.00 0.00 52.55 54.29 2klg s ASP 21 Cb 0.26 -2.54 0.11 0.00 -0.30 0.00 0.00 42.92 40.45 2klg s ASP 21 CO 0.02 -1.21 1.10 0.28 -0.17 0.00 0.00 175.17 175.19 2klg s THR 22 N 4.77 2.16 0.15 1.71 -1.32 -1.26 -3.32 115.64 118.53 2klg s THR 22 Ca 0.58 -0.26 -0.11 0.00 -1.21 0.00 0.00 61.69 60.70 2klg s THR 22 Cb -0.16 -2.90 -0.00 0.00 -1.51 0.00 0.00 72.50 67.93 2klg s THR 22 CO 0.27 0.00 1.54 0.40 -2.21 0.00 0.00 174.62 174.62 2klg h ILE 23 N -0.88 1.27 -1.01 5.08 1.08 -1.66 -3.04 117.51 118.35 2klg h ILE 23 Ca -0.43 -1.36 0.14 0.00 -0.39 0.00 0.00 64.86 62.82 2klg h ILE 23 Cb 1.28 1.15 -0.09 0.00 -3.07 0.00 0.00 36.82 36.09 2klg h ILE 23 CO 0.50 0.47 0.63 -0.08 -0.69 0.00 0.00 178.15 178.98 2klg h GLU 24 N 0.81 0.92 0.41 2.37 4.81 -1.84 0.41 114.58 122.47 2klg h GLU 24 Ca 0.11 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.26 2klg h GLU 24 Cb 0.78 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.95 2klg h GLU 24 CO 0.06 0.61 -0.20 -0.91 -0.73 0.00 0.00 179.01 177.85 2klg h ASN 25 N 0.95 -0.47 -0.46 1.04 4.21 -1.92 -2.60 115.58 116.33 2klg h ASN 25 Ca 0.52 -0.06 -0.05 0.00 1.21 0.00 0.00 56.30 57.91 2klg h ASN 25 Cb 0.58 0.12 -0.02 0.00 -1.12 0.00 0.00 38.32 37.87 2klg h ASN 25 CO -0.29 -0.22 0.11 1.62 -1.29 0.00 0.00 177.43 177.35 2klg h VAL 26 N -0.69 1.23 -0.92 2.81 3.04 -1.39 -2.77 116.25 117.55 2klg h VAL 26 Ca -0.06 -0.84 0.09 0.00 -1.01 0.00 0.00 66.70 64.88 2klg h VAL 26 Cb 0.50 0.71 -0.07 0.00 -2.01 0.00 0.00 31.29 30.42 2klg h VAL 26 CO 0.09 0.31 0.57 0.50 -1.01 0.00 0.00 177.57 178.03 2klg h LYS 27 N 0.78 0.94 -0.86 4.17 3.64 -0.10 -1.19 116.57 123.95 2klg h LYS 27 Ca 0.17 -0.06 0.05 0.00 -1.27 0.00 0.00 60.65 59.55 2klg h LYS 27 Cb 0.32 -0.21 -0.05 0.00 -0.41 0.00 0.00 32.23 31.87 2klg h LYS 27 CO 0.00 0.62 0.56 0.00 -2.27 0.00 0.00 179.45 178.37 2klg h ALA 28 N 1.47 1.53 -0.51 5.00 0.00 -1.16 -0.49 119.26 125.09 2klg h ALA 28 Ca 0.43 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.27 2klg h ALA 28 Cb 0.32 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 2klg h ALA 28 CO -0.22 0.35 0.17 0.87 0.00 0.00 0.00 179.25 180.42 2klg h LYS 29 N 0.99 0.79 -0.05 0.00 6.56 -1.26 0.35 116.57 123.94 2klg h LYS 29 Ca 0.36 -0.16 -0.01 0.00 -1.06 0.00 0.00 60.65 59.78 2klg h LYS 29 Cb 0.15 -0.12 -0.00 0.00 -0.57 0.00 0.00 32.23 31.69 2klg h LYS 29 CO -0.12 0.73 -0.00 0.82 -2.06 0.00 0.00 179.45 178.81 2klg h ILE 30 N 0.70 1.26 -0.79 1.86 2.04 -1.12 -2.70 117.51 118.76 2klg h ILE 30 Ca 0.17 -0.80 0.01 0.00 1.00 0.00 0.00 64.86 65.24 2klg h ILE 30 Cb 0.26 1.69 -0.04 0.00 -0.74 0.00 0.00 36.82 37.99 2klg h ILE 30 CO -0.01 0.22 0.52 -0.61 0.00 0.00 0.00 178.15 178.27 2klg h GLN 31 N -0.21 1.02 0.00 2.37 5.75 -1.05 -1.40 115.11 121.59 2klg h GLN 31 Ca 0.01 -0.06 -0.01 0.00 -0.15 0.00 0.00 58.65 58.45 2klg h GLN 31 Cb 0.35 -0.23 -0.00 0.00 1.07 0.00 0.00 27.48 28.67 2klg h GLN 31 CO 0.00 0.68 -0.03 -0.44 -2.65 0.00 0.00 178.83 176.39 2klg h ASP 32 N 1.05 0.00 0.22 -0.69 5.19 -0.86 0.93 116.42 122.26 2klg h ASP 32 Ca 0.29 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.69 2klg h ASP 32 Cb -0.10 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.41 2klg h ASP 32 CO -0.07 0.03 -0.10 0.11 -3.12 0.00 0.00 179.24 176.08 2klg h LYS 33 N 0.00 -0.28 0.00 3.56 1.57 -0.92 -3.43 116.57 117.07 2klg h LYS 33 Ca -0.00 0.02 -0.37 0.00 -1.87 0.00 0.00 60.65 58.43 2klg h LYS 33 Cb 0.07 0.06 -0.06 0.00 0.08 0.00 0.00 32.23 32.39 2klg h LYS 33 CO 0.00 -0.19 -2.29 0.39 -0.57 0.00 0.00 179.45 176.80 2klg n GLU 34 N -4.50 0.51 -1.76 3.15 4.71 -1.07 -5.05 120.64 116.63 2klg n GLU 34 Ca -0.04 0.19 0.00 0.00 -0.01 0.00 0.00 57.16 57.30 2klg n GLU 34 Cb 0.12 -1.37 0.00 0.00 -1.01 0.00 0.00 31.44 29.17 2klg n GLU 34 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2klg n GLY 35 N 1.86 0.82 3.60 0.62 0.00 0.32 -5.02 105.19 107.39 2klg n GLY 35 Ca -0.44 -0.46 -0.43 0.00 0.00 0.00 0.00 46.02 44.69 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 -2.67 4.15 0.16 -0.61 2.07 -1.26 -4.93 121.20 118.10 2klg s ILE 36 Ca 0.00 1.19 -0.15 0.00 -1.41 0.00 0.00 60.65 60.27 2klg s ILE 36 Cb 0.00 -4.50 0.03 0.00 0.13 0.00 0.00 42.46 38.12 2klg s ILE 36 CO 0.00 -0.91 1.82 -0.65 -1.91 0.00 0.00 174.94 173.28 2klg h PRO 37 N 9.50 0.56 -5.35 3.50 0.11 -1.98 -3.45 132.00 134.89 2klg h PRO 37 Ca -0.24 -0.03 -0.76 0.00 0.11 0.00 0.00 66.00 65.07 2klg h PRO 37 Cb 1.07 -0.13 0.02 0.00 0.11 0.00 0.00 31.00 32.07 2klg h PRO 37 CO 1.11 0.37 0.47 -2.30 -0.21 0.00 0.00 178.00 177.45 2klg n PRO 38 N -4.79 0.00 0.00 1.05 -0.02 -1.26 -4.80 135.00 125.17 2klg n PRO 38 Ca 0.01 0.00 0.07 0.00 -2.02 0.00 0.00 63.50 61.57 2klg n PRO 38 Cb 0.03 -1.34 0.39 0.00 -0.02 0.00 0.00 33.50 32.56 2klg n PRO 38 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2klg n ASP 39 N 3.01 0.00 -0.77 2.55 -0.08 -1.26 -2.81 116.55 117.19 2klg n ASP 39 Ca 0.25 -0.09 0.06 0.00 -1.51 0.00 0.00 54.79 53.50 2klg n ASP 39 Cb -0.02 -0.19 0.17 0.00 2.34 0.00 0.00 41.12 43.42 2klg n ASP 39 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2klg n GLN 40 N -1.19 2.02 -2.90 -0.67 6.02 -1.26 -4.70 117.38 114.70 2klg n GLN 40 Ca 0.08 -1.41 -0.44 0.00 -0.01 0.00 0.00 57.00 55.23 2klg n GLN 40 Cb 0.09 -1.37 -0.01 0.00 1.02 0.00 0.00 30.24 29.98 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 -1.54 3.96 0.19 -1.09 -0.44 -1.12 -4.87 119.66 114.75 2klg s GLN 41 Ca 0.26 -2.32 0.03 0.00 -2.50 0.00 0.00 55.36 50.83 2klg s GLN 41 Cb 0.14 -5.08 -0.01 0.00 -1.64 0.00 0.00 33.01 26.42 2klg s GLN 41 CO 0.16 -1.82 0.12 0.54 0.50 0.00 0.00 175.29 174.80 2klg n ARG 42 N 6.15 0.41 -3.79 1.67 1.74 -1.26 -4.93 116.66 116.64 2klg n ARG 42 Ca 0.35 -1.80 -0.28 0.00 -0.77 0.00 0.00 57.85 55.35 2klg n ARG 42 Cb 0.45 1.30 -0.03 0.00 -1.02 0.00 0.00 32.46 33.15 2klg n ARG 42 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2klg s LEU 43 N 0.00 4.27 -0.84 0.55 1.43 -1.26 -1.87 118.68 120.96 2klg s LEU 43 Ca 0.18 0.33 0.01 0.00 -1.03 0.00 0.00 54.13 53.62 2klg s LEU 43 Cb 0.01 -3.08 0.27 0.00 0.03 0.00 0.00 46.19 43.42 2klg s LEU 43 CO 0.12 0.01 1.05 0.00 0.23 0.00 0.00 176.35 177.76 2klg n ILE 44 N -0.50 3.63 -3.71 -0.59 3.06 -0.72 -4.72 119.36 115.81 2klg n ILE 44 Ca -0.05 -5.50 -0.11 0.00 -2.50 0.00 0.00 62.75 54.59 2klg n ILE 44 Cb 0.53 -2.12 -0.11 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 -2.49 -0.54 -1.54 9.51 2.19 -1.26 -4.82 117.98 119.03 2klg s PHE 45 Ca 0.35 1.19 0.00 0.00 0.33 0.00 0.00 56.93 58.80 2klg s PHE 45 Cb 0.09 0.22 0.00 0.00 -1.31 0.00 0.00 43.02 42.02 2klg s PHE 45 CO 0.02 -0.30 0.00 0.00 1.83 0.00 0.00 175.22 176.77 2klg n ALA 46 N 3.97 -0.63 -4.30 11.12 0.00 -1.26 -2.31 120.51 127.10 2klg n ALA 46 Ca -0.21 0.16 -0.38 0.00 0.00 0.00 0.00 53.44 53.01 2klg n ALA 46 Cb 0.55 -1.89 -0.04 0.00 0.00 0.00 0.00 19.45 18.08 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 -0.84 -0.43 3.70 0.00 0.00 -1.26 -4.92 105.19 101.44 2klg n GLY 47 Ca -0.20 0.12 -0.36 0.00 0.00 0.00 0.00 46.02 45.58 2klg n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2klg s LYS 48 N -7.01 4.14 0.27 1.61 0.00 -0.98 -5.09 119.74 112.69 2klg s LYS 48 Ca 0.76 -0.24 -0.11 0.00 0.00 0.00 0.00 55.97 56.38 2klg s LYS 48 Cb -0.42 -3.47 -0.08 0.00 0.00 0.00 0.00 37.83 33.86 2klg s LYS 48 CO 0.95 0.20 0.62 -0.65 0.00 0.00 0.00 175.35 176.47 2klg s GLN 49 N 0.66 3.85 0.42 1.78 -0.21 -1.26 -4.60 119.66 120.30 2klg s GLN 49 Ca 0.08 0.39 0.22 0.00 0.02 0.00 0.00 55.36 56.07 2klg s GLN 49 Cb -0.12 -2.56 0.37 0.00 1.00 0.00 0.00 33.01 31.70 2klg s GLN 49 CO 0.01 0.24 1.61 1.25 -2.12 0.00 0.00 175.29 176.27 2klg h LEU 50 N 2.30 0.00 0.04 2.90 5.85 -1.91 -3.27 115.31 121.22 2klg h LEU 50 Ca -0.47 0.00 -0.26 0.00 0.84 0.00 0.00 57.88 57.99 2klg h LEU 50 Cb 1.17 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.21 2klg h LEU 50 CO 0.67 0.09 -1.16 1.05 -0.34 0.00 0.00 178.44 178.75 2klg h GLU 51 N 0.00 0.33 -6.07 1.25 4.11 -1.94 -3.43 114.58 108.83 2klg h GLU 51 Ca -0.00 -0.48 -0.72 0.00 0.07 0.00 0.00 59.36 58.23 2klg h GLU 51 Cb 1.03 0.17 -0.00 0.00 0.50 0.00 0.00 28.75 30.44 2klg h GLU 51 CO 0.01 1.20 1.14 -0.25 0.07 0.00 0.00 179.01 181.18 2klg n ASP 52 N -3.61 2.07 -2.18 3.06 9.92 -1.24 -4.75 116.55 119.83 2klg n ASP 52 Ca -0.08 0.79 -0.05 0.00 -0.53 0.00 0.00 54.79 54.92 2klg n ASP 52 Cb 0.97 -1.15 -0.07 0.00 -0.64 0.00 0.00 41.12 40.23 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 5.49 1.91 2.64 0.44 0.00 -1.26 -4.69 105.19 109.71 2klg n GLY 53 Ca 0.36 -0.51 -0.17 0.00 0.00 0.00 0.00 46.02 45.70 2klg n GLY 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2klg n ARG 54 N 2.60 0.88 -3.77 1.61 1.74 -1.26 -4.92 116.66 113.54 2klg n ARG 54 Ca 0.18 -2.32 -0.36 0.00 -0.77 0.00 0.00 57.85 54.58 2klg n ARG 54 Cb 0.42 0.14 -0.07 0.00 -1.02 0.00 0.00 32.46 31.94 2klg n ARG 54 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2klg s THR 55 N -1.78 5.43 0.34 0.55 2.01 -1.26 -1.92 115.64 119.00 2klg s THR 55 Ca 0.27 0.26 0.09 0.00 0.31 0.00 0.00 61.69 62.62 2klg s THR 55 Cb -0.02 -3.46 0.32 0.00 0.01 0.00 0.00 72.50 69.35 2klg s THR 55 CO 0.17 0.52 1.80 0.17 -0.69 0.00 0.00 174.62 176.59 2klg h LEU 56 N 5.85 0.68 -2.07 4.42 8.10 -1.84 0.30 115.31 130.75 2klg h LEU 56 Ca -0.48 0.08 0.09 0.00 0.11 0.00 0.00 57.88 57.68 2klg h LEU 56 Cb 1.19 -0.05 -0.01 0.00 -0.44 0.00 0.00 40.66 41.35 2klg h LEU 56 CO 0.68 0.26 0.26 -1.28 -4.11 0.00 0.00 178.44 174.24 2klg h SER 57 N 0.67 0.00 -0.82 0.17 0.87 -1.81 -1.53 113.55 111.10 2klg h SER 57 Ca 0.55 0.00 0.16 0.00 -1.23 0.00 0.00 61.79 61.27 2klg h SER 57 Cb 0.97 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 62.87 2klg h SER 57 CO -0.31 0.00 0.54 0.44 -0.53 0.00 0.00 176.83 176.97 2klg h ASP 58 N 0.00 0.45 -0.60 6.23 3.32 -0.78 0.96 116.42 126.00 2klg h ASP 58 Ca 0.15 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.23 2klg h ASP 58 Cb 0.66 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.15 2klg h ASP 58 CO -0.00 0.22 0.00 -1.22 -1.72 0.00 0.00 179.24 176.52 2klg n TYR 59 N -4.50 1.88 -1.28 4.55 4.02 -0.59 -4.92 117.16 116.32 2klg n TYR 59 Ca 0.16 -0.69 -0.10 0.00 -0.01 0.00 0.00 57.90 57.26 2klg n TYR 59 Cb 0.56 -0.42 -0.04 0.00 -0.02 0.00 0.00 39.34 39.41 2klg n TYR 59 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 2klg n ASN 60 N 0.78 -5.05 -3.94 7.72 2.85 0.33 -4.91 115.26 113.05 2klg n ASN 60 Ca 0.27 0.24 -0.43 0.00 -0.11 0.00 0.00 54.58 54.56 2klg n ASN 60 Cb 1.10 -3.41 0.00 0.00 1.24 0.00 0.00 39.78 38.71 2klg n ASN 60 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2klg n ILE 61 N -2.43 4.38 -2.70 -1.44 0.13 -1.15 -4.97 119.36 111.18 2klg n ILE 61 Ca -0.10 -4.50 -0.18 0.00 -1.10 0.00 0.00 62.75 56.87 2klg n ILE 61 Cb 0.47 -2.36 0.09 0.00 -0.84 0.00 0.00 39.64 36.99 2klg n ILE 61 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 2klg n GLN 62 N 3.95 0.22 -1.47 9.51 10.64 -1.26 -4.46 117.38 134.50 2klg n GLN 62 Ca 0.39 -2.36 -0.41 0.00 -1.83 0.00 0.00 57.00 52.79 2klg n GLN 62 Cb 0.37 -0.44 0.01 0.00 -0.86 0.00 0.00 30.24 29.32 2klg n GLN 62 CO 0.00 0.00 0.00 0.36 -1.83 0.00 0.00 177.06 175.59 2klg n LYS 63 N -2.38 0.64 -1.12 2.61 2.85 -1.26 -1.21 118.16 118.29 2klg n LYS 63 Ca 0.14 0.24 -0.04 0.00 -1.05 0.00 0.00 58.31 57.59 2klg n LYS 63 Cb 0.49 -1.59 -0.02 0.00 -0.65 0.00 0.00 35.03 33.27 2klg n LYS 63 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 2klg n GLU 64 N 0.45 -1.34 -1.60 -1.58 0.00 -1.05 -4.99 120.64 110.52 2klg n GLU 64 Ca 0.11 0.54 -0.30 0.00 0.00 0.00 0.00 57.16 57.51 2klg n GLU 64 Cb 0.41 -4.64 0.22 0.00 0.00 0.00 0.00 31.44 27.43 2klg n GLU 64 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 2klg n SER 65 N -0.65 -0.71 -4.18 4.31 2.88 -0.35 -4.92 113.62 110.00 2klg n SER 65 Ca -0.04 -1.37 -0.39 0.00 -1.33 0.00 0.00 58.87 55.74 2klg n SER 65 Cb 0.40 -1.02 -0.04 0.00 -0.75 0.00 0.00 64.21 62.79 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 -3.60 4.89 -0.28 2.46 -4.23 -1.26 -4.35 115.64 109.27 2klg s THR 66 Ca 0.75 -3.70 -0.12 0.00 -1.18 0.00 0.00 61.69 57.44 2klg s THR 66 Cb -0.04 -4.00 -0.04 0.00 1.34 0.00 0.00 72.50 69.76 2klg s THR 66 CO 0.54 -1.12 0.24 -1.48 -0.54 0.00 0.00 174.62 172.26 2klg s LEU 67 N -1.29 4.05 -0.11 4.79 0.05 -1.26 -5.00 118.68 119.92 2klg s LEU 67 Ca 0.28 0.04 -0.03 0.00 0.05 0.00 0.00 54.13 54.48 2klg s LEU 67 Cb -0.08 -2.20 -0.03 0.00 -2.05 0.00 0.00 46.19 41.82 2klg s LEU 67 CO -0.11 -0.10 -0.00 -1.00 -0.55 0.00 0.00 176.35 174.59 2klg s HIS 68 N 1.84 3.13 0.57 3.48 3.76 -1.26 -4.37 115.29 122.43 2klg s HIS 68 Ca 0.09 0.08 0.02 0.00 -0.15 0.00 0.00 55.06 55.10 2klg s HIS 68 Cb -0.16 -1.85 0.05 0.00 1.11 0.00 0.00 32.58 31.73 2klg s HIS 68 CO 0.11 0.33 0.79 -1.17 -0.85 0.00 0.00 174.74 173.95 2klg s LEU 69 N -0.51 3.25 -0.18 0.89 2.96 -1.26 -1.76 118.68 122.07 2klg s LEU 69 Ca 0.09 -0.14 -0.07 0.00 -0.22 0.00 0.00 54.13 53.79 2klg s LEU 69 Cb -0.12 -2.67 -0.04 0.00 0.50 0.00 0.00 46.19 43.86 2klg s LEU 69 CO 0.02 -1.23 0.06 -0.69 -1.32 0.00 0.00 176.35 173.20 2klg s VAL 70 N -2.78 4.77 -0.80 1.68 1.01 -0.78 -4.73 120.40 118.77 2klg s VAL 70 Ca 0.59 -0.04 -0.26 0.00 0.00 0.00 0.00 61.98 62.27 2klg s VAL 70 Cb -0.09 -3.15 0.02 0.00 0.00 0.00 0.00 36.38 33.15 2klg s VAL 70 CO 0.39 0.46 1.51 -1.48 0.00 0.00 0.00 175.10 175.97 2klg s LEU 71 N 0.42 3.27 -0.16 3.92 0.05 -1.26 -4.79 118.68 120.12 2klg s LEU 71 Ca 0.03 -0.56 -0.05 0.00 0.05 0.00 0.00 54.13 53.60 2klg s LEU 71 Cb -0.12 -2.56 -0.23 0.00 -2.05 0.00 0.00 46.19 41.23 2klg s LEU 71 CO 0.00 -1.96 0.19 -1.14 -0.55 0.00 0.00 176.35 172.89 2klg n ARG 72 N 9.17 0.72 0.04 1.48 0.00 -1.26 -3.03 116.66 123.78 2klg n ARG 72 Ca 0.17 0.25 -0.05 0.00 -0.00 0.00 0.00 57.85 58.22 2klg n ARG 72 Cb 0.50 -1.66 0.15 0.00 0.00 0.00 0.00 32.46 31.45 2klg n ARG 72 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.63 177.56 2klg h LEU 73 N -0.02 0.43 0.24 6.15 4.07 -1.97 -3.20 115.31 121.01 2klg h LEU 73 Ca -0.47 -0.20 -0.33 0.00 0.08 0.00 0.00 57.88 56.96 2klg h LEU 73 Cb 1.96 -0.12 0.04 0.00 1.08 0.00 0.00 40.66 43.61 2klg h LEU 73 CO 0.02 0.82 -1.45 -0.09 -1.08 0.00 0.00 178.44 176.66 2klg h ARG 74 N 0.33 0.54 -6.96 1.13 2.43 -1.89 -3.45 114.38 106.50 2klg h ARG 74 Ca 0.02 -0.90 -0.50 0.00 -0.81 0.00 0.00 59.98 57.79 2klg h ARG 74 Cb 0.91 0.33 0.05 0.00 -0.42 0.00 0.00 29.97 30.84 2klg h ARG 74 CO 0.08 1.43 0.49 0.20 -1.51 0.00 0.00 179.97 180.65 2klg s GLY 75 N -4.59 2.83 0.00 2.80 0.00 -1.17 -5.16 107.32 102.04 2klg s GLY 75 Ca -0.09 0.92 0.00 0.00 0.00 0.00 0.00 44.72 45.55 2klg s GLY 75 CO 0.94 1.41 0.46 0.61 0.00 0.00 0.00 173.10 176.53