#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2klc s LYS 24 N 0.00 4.37 0.35 -0.52 2.20 -1.26 -5.08 119.74 119.81 2klc s LYS 24 Ca 0.00 1.37 -0.13 0.00 -0.36 0.00 0.00 55.97 56.86 2klc s LYS 24 Cb 0.00 -2.62 -0.08 0.00 -1.51 0.00 0.00 37.83 33.63 2klc s LYS 24 CO 0.00 0.07 0.74 -1.50 -0.36 0.00 0.00 175.35 174.30 2klc s ILE 25 N -1.71 4.73 -0.48 5.43 2.07 -1.26 -4.98 121.20 125.00 2klc s ILE 25 Ca 0.55 0.79 -0.28 0.00 -1.41 0.00 0.00 60.65 60.30 2klc s ILE 25 Cb -0.19 -3.66 0.03 0.00 0.13 0.00 0.00 42.46 38.77 2klc s ILE 25 CO 0.24 -0.32 1.11 -0.04 -1.91 0.00 0.00 174.94 174.02 2klc s MET 26 N -3.33 3.68 -0.97 3.50 -1.94 -0.57 -4.81 119.30 114.85 2klc s MET 26 Ca 0.53 0.47 -0.22 0.00 -1.71 0.00 0.00 55.69 54.76 2klc s MET 26 Cb -0.10 -3.92 0.07 0.00 2.01 0.00 0.00 34.83 32.89 2klc s MET 26 CO 0.23 -1.38 1.34 0.15 -0.01 0.00 0.00 175.02 175.35 2klc s LYS 27 N 4.38 3.56 -0.42 2.03 -0.14 -1.26 -1.24 119.74 126.65 2klc s LYS 27 Ca 0.46 -1.26 -0.19 0.00 -1.36 0.00 0.00 55.97 53.62 2klc s LYS 27 Cb -0.08 -5.16 0.02 0.00 -1.68 0.00 0.00 37.83 30.94 2klc s LYS 27 CO 0.31 -2.07 0.55 0.08 -0.76 0.00 0.00 175.35 173.45 2klc s VAL 28 N 4.34 4.95 -0.14 3.17 1.01 0.04 -1.51 120.40 132.25 2klc s VAL 28 Ca 0.41 -0.06 -0.25 0.00 0.00 0.00 0.00 61.98 62.08 2klc s VAL 28 Cb -0.02 -4.12 -0.02 0.00 0.00 0.00 0.00 36.38 32.22 2klc s VAL 28 CO -0.08 -0.50 0.81 -0.89 0.00 0.00 0.00 175.10 174.44 2klc s THR 29 N 2.51 4.91 -0.25 3.92 2.01 -0.94 -0.77 115.64 127.03 2klc s THR 29 Ca 0.18 1.61 -0.05 0.00 0.31 0.00 0.00 61.69 63.74 2klc s THR 29 Cb -0.15 -4.13 -0.00 0.00 0.01 0.00 0.00 72.50 68.23 2klc s THR 29 CO 0.16 0.07 0.02 -0.69 -0.69 0.00 0.00 174.62 173.49 2klc s VAL 30 N 1.87 3.69 -0.07 3.82 1.01 -0.26 -1.49 120.40 128.97 2klc s VAL 30 Ca 0.39 -0.57 -0.08 0.00 0.00 0.00 0.00 61.98 61.72 2klc s VAL 30 Cb -0.17 -2.79 -0.04 0.00 0.00 0.00 0.00 36.38 33.38 2klc s VAL 30 CO 0.14 0.26 0.21 -0.75 0.00 0.00 0.00 175.10 174.96 2klc s LYS 31 N 1.49 3.54 0.20 2.72 2.20 -0.94 -1.47 119.74 127.47 2klc s LYS 31 Ca 0.04 -0.05 -0.00 0.00 -0.36 0.00 0.00 55.97 55.60 2klc s LYS 31 Cb -0.16 -3.17 -0.04 0.00 -1.51 0.00 0.00 37.83 32.95 2klc s LYS 31 CO -0.00 0.74 0.10 0.95 -0.36 0.00 0.00 175.35 176.77 2klc s THR 32 N -1.11 0.19 -1.13 3.43 -4.23 -0.22 -1.97 115.64 110.60 2klc s THR 32 Ca 0.20 -1.98 0.10 0.00 -1.18 0.00 0.00 61.69 58.82 2klc s THR 32 Cb -0.13 -2.41 0.11 0.00 1.34 0.00 0.00 72.50 71.41 2klc s THR 32 CO 0.09 -0.13 1.27 -0.81 -0.54 0.00 0.00 174.62 174.51 2klc n PRO 33 N -0.28 0.04 0.03 3.99 -0.04 -1.26 -2.92 135.00 134.56 2klc n PRO 33 Ca -0.01 0.29 -0.02 0.00 -0.04 0.00 0.00 63.50 63.73 2klc n PRO 33 Cb 0.65 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.60 2klc n PRO 33 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 2klc h LYS 34 N 0.00 -0.13 0.00 0.54 6.56 -1.95 -3.51 116.57 118.08 2klc h LYS 34 Ca 0.00 0.01 0.20 0.00 -1.06 0.00 0.00 60.65 59.80 2klc h LYS 34 Cb 0.14 0.03 -0.04 0.00 -0.57 0.00 0.00 32.23 31.79 2klc h LYS 34 CO 0.00 -0.09 0.59 -0.85 -2.06 0.00 0.00 179.45 177.04 2klc n GLU 35 N -3.47 0.28 -4.34 3.15 0.28 -1.15 -5.17 120.64 110.23 2klc n GLU 35 Ca -0.02 -0.80 -0.35 0.00 -0.16 0.00 0.00 57.16 55.84 2klc n GLU 35 Cb 0.05 1.18 -0.10 0.00 1.43 0.00 0.00 31.44 34.01 2klc n GLU 35 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 177.13 175.38 2klc s LYS 36 N -2.02 3.21 -0.08 3.44 -2.85 -1.26 -1.05 119.74 119.13 2klc s LYS 36 Ca 0.21 -0.42 -0.00 0.00 -1.00 0.00 0.00 55.97 54.75 2klc s LYS 36 Cb -0.01 -2.86 0.02 0.00 -2.06 0.00 0.00 37.83 32.92 2klc s LYS 36 CO 0.01 0.57 -0.05 -2.00 0.10 0.00 0.00 175.35 173.99 2klc s GLU 37 N -0.52 1.07 -0.42 1.78 2.56 -0.54 -4.98 118.70 117.64 2klc s GLU 37 Ca 0.09 -0.11 -0.18 0.00 0.00 0.00 0.00 54.97 54.77 2klc s GLU 37 Cb -0.12 -1.19 0.02 0.00 2.00 0.00 0.00 34.13 34.84 2klc s GLU 37 CO 0.02 -0.21 0.47 -2.00 -0.56 0.00 0.00 175.26 172.98 2klc s GLU 38 N 1.52 3.14 0.52 4.30 2.12 -1.26 -1.10 118.70 127.94 2klc s GLU 38 Ca -0.01 -0.69 -0.03 0.00 0.36 0.00 0.00 54.97 54.61 2klc s GLU 38 Cb -0.13 -3.96 -0.00 0.00 0.26 0.00 0.00 34.13 30.30 2klc s GLU 38 CO -0.04 -0.87 0.79 -0.06 -0.54 0.00 0.00 175.26 174.54 2klc s PHE 39 N 2.25 3.28 -0.12 5.30 0.40 0.05 -4.89 117.98 124.25 2klc s PHE 39 Ca 0.14 0.49 0.02 0.00 -0.60 0.00 0.00 56.93 56.98 2klc s PHE 39 Cb -0.17 -2.51 0.01 0.00 0.51 0.00 0.00 43.02 40.86 2klc s PHE 39 CO 0.14 -0.57 -0.18 0.00 0.70 0.00 0.00 175.22 175.31 2klc s ALA 40 N -2.78 1.92 -0.04 5.36 0.00 -1.26 -0.78 121.76 124.18 2klc s ALA 40 Ca 0.51 -0.88 0.00 0.00 0.00 0.00 0.00 51.96 51.60 2klc s ALA 40 Cb -0.10 -0.89 0.02 0.00 0.00 0.00 0.00 23.12 22.16 2klc s ALA 40 CO 0.42 -0.03 -0.02 0.14 0.00 0.00 0.00 175.76 176.27 2klc s VAL 41 N 0.87 0.35 -1.42 0.00 -7.23 -0.37 -4.93 120.40 107.68 2klc s VAL 41 Ca -0.08 0.00 -0.11 0.00 -1.81 0.00 0.00 61.98 59.99 2klc s VAL 41 Cb -0.15 -0.43 -0.06 0.00 0.56 0.00 0.00 36.38 36.30 2klc s VAL 41 CO -0.01 0.19 2.59 -0.81 -0.31 0.00 0.00 175.10 176.75 2klc n PRO 42 N 4.23 3.10 -0.89 4.82 -0.04 -1.26 -1.51 135.00 143.45 2klc n PRO 42 Ca -0.23 -2.15 -0.05 0.00 -0.04 0.00 0.00 63.50 61.03 2klc n PRO 42 Cb 0.51 -2.86 -0.02 0.00 -0.04 0.00 0.00 33.50 31.08 2klc n PRO 42 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2klc n GLU 43 N 4.49 -1.52 0.00 0.54 0.28 -1.26 -4.42 120.64 118.74 2klc n GLU 43 Ca 0.65 0.37 0.00 0.00 -0.16 0.00 0.00 57.16 58.02 2klc n GLU 43 Cb 0.26 -4.17 0.00 0.00 1.43 0.00 0.00 31.44 28.96 2klc n GLU 43 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 2klc n ASN 44 N 0.61 0.00 -4.64 -1.84 5.15 -1.26 -4.96 115.26 108.32 2klc n ASN 44 Ca -0.05 0.00 -0.43 0.00 -0.60 0.00 0.00 54.58 53.50 2klc n ASN 44 Cb 0.24 0.00 -0.03 0.00 -0.53 0.00 0.00 39.78 39.46 2klc n ASN 44 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 2klc n SER 45 N -0.07 3.82 -4.77 1.20 7.64 -1.26 -4.96 113.62 115.21 2klc n SER 45 Ca 0.00 0.64 -0.30 0.00 1.01 0.00 0.00 58.87 60.22 2klc n SER 45 Cb 0.00 -1.53 0.09 0.00 -1.01 0.00 0.00 64.21 61.76 2klc n SER 45 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2klc s SER 46 N 5.90 4.43 0.48 6.43 0.01 -1.26 -4.19 113.70 125.50 2klc s SER 46 Ca 0.94 1.59 0.13 0.00 1.31 0.00 0.00 55.95 59.92 2klc s SER 46 Cb -0.41 -2.33 1.12 0.00 0.21 0.00 0.00 66.02 64.61 2klc s SER 46 CO 0.40 -2.05 2.10 0.58 0.41 0.00 0.00 173.24 174.69 2klc h VAL 47 N -1.14 1.02 -0.13 3.43 2.07 -1.61 0.68 116.25 120.56 2klc h VAL 47 Ca -0.46 -0.07 0.05 0.00 0.82 0.00 0.00 66.70 67.04 2klc h VAL 47 Cb 1.25 0.79 -0.06 0.00 -1.52 0.00 0.00 31.29 31.75 2klc h VAL 47 CO 0.55 0.04 -0.29 -0.61 0.02 0.00 0.00 177.57 177.28 2klc h GLN 48 N 0.21 -0.35 0.00 1.57 5.75 -1.79 -2.08 115.11 118.43 2klc h GLN 48 Ca 0.08 0.02 -0.12 0.00 -0.15 0.00 0.00 58.65 58.48 2klc h GLN 48 Cb 0.04 0.08 -0.02 0.00 1.07 0.00 0.00 27.48 28.66 2klc h GLN 48 CO -0.01 -0.23 -0.58 1.96 -2.65 0.00 0.00 178.83 177.31 2klc h GLN 49 N -0.36 0.00 0.02 1.69 4.20 -1.58 -3.32 115.11 115.77 2klc h GLN 49 Ca 0.10 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.72 2klc h GLN 49 Cb 0.51 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.30 2klc h GLN 49 CO -0.34 0.58 -0.36 0.35 -0.67 0.00 0.00 178.83 178.39 2klc h PHE 50 N 0.00 0.32 0.00 2.96 3.57 -0.79 -3.15 116.94 119.85 2klc h PHE 50 Ca -0.01 -0.19 0.00 0.00 3.53 0.00 0.00 57.97 61.30 2klc h PHE 50 Cb 1.30 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 40.01 2klc h PHE 50 CO 0.00 1.04 0.00 1.57 -2.23 0.00 0.00 178.31 178.69 2klc h LYS 51 N -0.49 0.00 -0.02 1.11 -0.00 -1.50 -1.67 116.57 113.99 2klc h LYS 51 Ca -0.05 0.00 -0.15 0.00 -0.00 0.00 0.00 60.65 60.45 2klc h LYS 51 Cb 1.16 0.00 -0.02 0.00 -0.00 0.00 0.00 32.23 33.37 2klc h LYS 51 CO 0.07 0.00 -0.69 0.93 -0.00 0.00 0.00 179.45 179.76 2klc h GLU 52 N 0.00 0.09 -0.33 0.07 5.08 -1.65 -0.43 114.58 117.41 2klc h GLU 52 Ca 0.00 -0.07 -0.14 0.00 -1.00 0.00 0.00 59.36 58.14 2klc h GLU 52 Cb 0.49 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.75 2klc h GLU 52 CO 0.00 0.74 -0.34 0.93 -1.00 0.00 0.00 179.01 179.34 2klc h GLU 53 N 0.06 0.82 -0.99 2.33 4.39 -1.29 -3.15 114.58 116.75 2klc h GLU 53 Ca -0.01 -0.44 0.04 0.00 0.34 0.00 0.00 59.36 59.29 2klc h GLU 53 Cb 1.22 0.02 -0.06 0.00 -0.10 0.00 0.00 28.75 29.83 2klc h GLU 53 CO 0.10 1.07 0.65 0.82 -1.16 0.00 0.00 179.01 180.49 2klc h ILE 54 N 0.60 1.18 -0.90 3.13 2.04 -1.25 -3.10 117.51 119.21 2klc h ILE 54 Ca 0.05 -0.43 0.08 0.00 1.00 0.00 0.00 64.86 65.56 2klc h ILE 54 Cb 0.93 -0.19 -0.06 0.00 -0.74 0.00 0.00 36.82 36.76 2klc h ILE 54 CO 0.08 0.23 0.58 -1.28 0.00 0.00 0.00 178.15 177.76 2klc h SER 55 N 1.25 0.86 1.02 1.72 0.87 -1.03 -0.96 113.55 117.28 2klc h SER 55 Ca 0.39 0.01 -0.20 0.00 -1.23 0.00 0.00 61.79 60.77 2klc h SER 55 Cb -0.00 -0.17 -0.03 0.00 -0.44 0.00 0.00 62.40 61.76 2klc h SER 55 CO -0.12 0.53 -1.01 0.07 -0.53 0.00 0.00 176.83 175.77 2klc h LYS 56 N 0.96 0.00 0.21 2.24 2.10 -1.59 -1.16 116.57 119.32 2klc h LYS 56 Ca 0.40 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 59.04 2klc h LYS 56 Cb 0.30 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.63 2klc h LYS 56 CO -0.16 0.79 -0.10 0.00 -2.00 0.00 0.00 179.45 177.98 2klc h ARG 57 N 0.00 -0.27 -0.00 0.07 -0.00 -1.45 -3.34 114.38 109.38 2klc h ARG 57 Ca -0.05 0.02 0.00 0.00 -0.50 0.00 0.00 59.98 59.45 2klc h ARG 57 Cb 1.71 0.06 0.00 0.00 0.00 0.00 0.00 29.97 31.74 2klc h ARG 57 CO 0.11 -0.02 -0.04 1.19 0.00 0.00 0.00 179.97 181.20 2klc n PHE 58 N -4.96 0.00 -2.73 3.04 3.01 -0.41 -4.92 117.46 110.50 2klc n PHE 58 Ca -0.06 0.00 -0.21 0.00 1.01 0.00 0.00 57.45 58.20 2klc n PHE 58 Cb 0.19 -0.25 0.01 0.00 -0.01 0.00 0.00 39.48 39.42 2klc n PHE 58 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 2klc n LYS 59 N -1.18 -3.19 -5.08 -1.08 4.76 -0.47 -4.97 118.16 106.95 2klc n LYS 59 Ca 0.14 0.89 -0.29 0.00 -2.87 0.00 0.00 58.31 56.19 2klc n LYS 59 Cb 0.25 -5.64 -0.16 0.00 -1.84 0.00 0.00 35.03 27.65 2klc n LYS 59 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 2klc s SER 60 N -2.36 2.73 0.52 4.39 0.01 -1.05 -5.03 113.70 112.91 2klc s SER 60 Ca 0.15 -0.44 -0.22 0.00 1.31 0.00 0.00 55.95 56.75 2klc s SER 60 Cb -0.07 -0.29 -0.06 0.00 0.21 0.00 0.00 66.02 65.80 2klc s SER 60 CO 0.19 0.27 1.21 1.41 0.41 0.00 0.00 173.24 176.73 2klc n HIS 61 N 2.38 1.81 0.14 2.43 8.25 -1.26 -4.36 115.22 124.60 2klc n HIS 61 Ca -0.16 0.46 0.02 0.00 -0.26 0.00 0.00 57.72 57.78 2klc n HIS 61 Cb 0.52 -2.30 0.36 0.00 1.12 0.00 0.00 29.99 29.69 2klc n HIS 61 CO 0.00 0.00 0.00 1.79 0.64 0.00 0.00 176.34 178.77 2klc h THR 62 N 1.35 1.21 0.00 1.59 1.35 -1.94 -2.08 112.91 114.39 2klc h THR 62 Ca -0.49 -1.00 -0.02 0.00 -0.55 0.00 0.00 66.41 64.35 2klc h THR 62 Cb 1.32 1.40 -0.00 0.00 -1.73 0.00 0.00 68.15 69.13 2klc h THR 62 CO 0.56 0.30 -0.12 -2.24 -0.25 0.00 0.00 175.52 173.77 2klc h ASP 63 N 0.16 0.00 0.42 5.36 2.03 -1.96 -2.68 116.42 119.75 2klc h ASP 63 Ca 0.03 0.00 -0.23 0.00 -0.73 0.00 0.00 57.03 56.10 2klc h ASP 63 Cb 0.50 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.00 2klc h ASP 63 CO 0.03 0.12 -0.98 1.56 -1.03 0.00 0.00 179.24 178.94 2klc h GLN 64 N 0.00 0.36 -6.22 4.15 4.20 -1.68 -3.44 115.11 112.47 2klc h GLN 64 Ca -0.00 -0.42 -0.53 0.00 0.06 0.00 0.00 58.65 57.77 2klc h GLN 64 Cb 0.57 0.13 -0.06 0.00 0.30 0.00 0.00 27.48 28.41 2klc h GLN 64 CO 0.02 1.10 1.17 -0.51 -0.67 0.00 0.00 178.83 179.94 2klc s LEU 65 N -7.59 3.21 -0.25 1.46 1.43 -1.01 -1.30 118.68 114.63 2klc s LEU 65 Ca -0.05 -0.15 -0.05 0.00 -1.03 0.00 0.00 54.13 52.85 2klc s LEU 65 Cb 0.09 -2.56 -0.00 0.00 0.03 0.00 0.00 46.19 43.74 2klc s LEU 65 CO 0.86 -2.04 0.02 0.68 0.23 0.00 0.00 176.35 176.11 2klc s VAL 66 N 6.98 3.73 0.05 -1.59 -7.23 -1.04 -4.99 120.40 116.32 2klc s VAL 66 Ca 0.47 -0.53 -0.17 0.00 -1.81 0.00 0.00 61.98 59.95 2klc s VAL 66 Cb -0.10 -2.80 -0.06 0.00 0.56 0.00 0.00 36.38 33.98 2klc s VAL 66 CO 0.17 0.28 0.50 -0.76 -0.31 0.00 0.00 175.10 174.98 2klc s LEU 67 N 1.50 4.49 -0.05 1.32 1.43 -1.26 -1.66 118.68 124.45 2klc s LEU 67 Ca 0.04 1.12 0.01 0.00 -1.03 0.00 0.00 54.13 54.27 2klc s LEU 67 Cb -0.16 -2.81 0.02 0.00 0.03 0.00 0.00 46.19 43.27 2klc s LEU 67 CO 0.00 0.28 -0.06 -0.63 0.23 0.00 0.00 176.35 176.17 2klc s ILE 68 N -1.14 0.68 -0.06 -0.59 1.09 0.63 -1.37 121.20 120.45 2klc s ILE 68 Ca 0.28 -0.20 -0.12 0.00 -1.10 0.00 0.00 60.65 59.51 2klc s ILE 68 Cb -0.18 -0.68 0.02 0.00 -1.06 0.00 0.00 42.46 40.56 2klc s ILE 68 CO 0.17 0.26 0.28 0.12 -0.10 0.00 0.00 174.94 175.67 2klc s PHE 69 N 0.92 -0.22 -1.68 3.97 5.36 -0.23 -1.31 117.98 124.80 2klc s PHE 69 Ca -0.11 0.47 0.00 0.00 -0.96 0.00 0.00 56.93 56.33 2klc s PHE 69 Cb -0.15 0.09 0.00 0.00 -0.34 0.00 0.00 43.02 42.62 2klc s PHE 69 CO 0.00 -0.27 0.00 0.00 -1.46 0.00 0.00 175.22 173.50 2klc n ALA 70 N 2.07 -0.38 -1.90 11.12 0.00 -1.26 -2.18 120.51 127.98 2klc n ALA 70 Ca -0.18 0.22 -0.12 0.00 0.00 0.00 0.00 53.44 53.36 2klc n ALA 70 Cb 0.57 -1.84 -0.02 0.00 0.00 0.00 0.00 19.45 18.15 2klc n ALA 70 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2klc n GLY 71 N -0.93 0.39 3.21 0.00 0.00 -1.26 -5.03 105.19 101.57 2klc n GLY 71 Ca -0.19 -0.43 -0.10 0.00 0.00 0.00 0.00 46.02 45.30 2klc n GLY 71 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2klc s LYS 72 N -4.01 0.82 0.22 1.61 0.00 -0.93 -5.15 119.74 112.30 2klc s LYS 72 Ca 0.00 -0.79 -0.30 0.00 0.00 0.00 0.00 55.97 54.88 2klc s LYS 72 Cb 0.00 0.34 -0.08 0.00 0.00 0.00 0.00 37.83 38.08 2klc s LYS 72 CO 0.00 -0.26 0.95 0.96 0.00 0.00 0.00 175.35 177.00 2klc s ILE 73 N -3.34 4.13 0.31 3.79 -0.00 -1.26 -1.07 121.20 123.76 2klc s ILE 73 Ca 0.01 2.07 -0.14 0.00 -0.00 0.00 0.00 60.65 62.58 2klc s ILE 73 Cb 0.02 -4.32 -0.09 0.00 -0.00 0.00 0.00 42.46 38.08 2klc s ILE 73 CO -0.08 0.46 0.71 -0.76 -0.00 0.00 0.00 174.94 175.27 2klc s LEU 74 N -0.96 4.08 0.20 0.37 1.43 -0.47 -4.93 118.68 118.40 2klc s LEU 74 Ca 0.42 1.23 0.10 0.00 -1.03 0.00 0.00 54.13 54.85 2klc s LEU 74 Cb -0.26 -4.01 -0.04 0.00 0.03 0.00 0.00 46.19 41.90 2klc s LEU 74 CO 0.32 -0.18 -0.19 -0.54 0.23 0.00 0.00 176.35 175.99 2klc s LYS 75 N -2.94 1.42 0.47 1.70 -0.14 -1.26 -4.71 119.74 114.28 2klc s LYS 75 Ca 0.53 -1.54 0.31 0.00 -1.36 0.00 0.00 55.97 53.91 2klc s LYS 75 Cb -0.10 -1.49 1.37 0.00 -1.68 0.00 0.00 37.83 35.92 2klc s LYS 75 CO 0.18 0.29 1.94 0.38 -0.76 0.00 0.00 175.35 177.38 2klc h ASP 76 N 2.90 0.00 1.44 2.83 2.03 -1.98 -1.92 116.42 121.72 2klc h ASP 76 Ca -0.42 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.88 2klc h ASP 76 Cb 1.22 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.72 2klc h ASP 76 CO 0.54 0.00 0.00 0.06 -1.03 0.00 0.00 179.24 178.81 2klc h GLN 77 N 0.00 0.00 -5.64 4.15 3.07 -1.98 -3.37 115.11 111.34 2klc h GLN 77 Ca 0.00 0.00 -0.62 0.00 0.09 0.00 0.00 58.65 58.12 2klc h GLN 77 Cb 0.39 0.00 -0.08 0.00 0.08 0.00 0.00 27.48 27.87 2klc h GLN 77 CO 0.00 0.00 -0.39 0.16 0.09 0.00 0.00 178.83 178.69 2klc s ASP 78 N -5.87 4.43 0.27 0.06 1.47 -0.72 -5.06 116.67 111.26 2klc s ASP 78 Ca 0.04 -1.41 0.09 0.00 1.18 0.00 0.00 52.55 52.45 2klc s ASP 78 Cb 0.07 0.46 -0.04 0.00 -0.34 0.00 0.00 42.92 43.07 2klc s ASP 78 CO 0.59 -1.00 0.03 0.42 0.68 0.00 0.00 175.17 175.89 2klc s THR 79 N -2.81 3.51 0.40 2.11 -4.23 -1.26 -2.04 115.64 111.32 2klc s THR 79 Ca 0.23 -1.84 0.08 0.00 -1.18 0.00 0.00 61.69 58.98 2klc s THR 79 Cb -0.01 -2.92 0.22 0.00 1.34 0.00 0.00 72.50 71.14 2klc s THR 79 CO 0.14 -0.35 2.01 0.17 -0.54 0.00 0.00 174.62 176.04 2klc h LEU 80 N 1.81 0.38 -1.38 4.79 8.10 -1.89 -2.63 115.31 124.50 2klc h LEU 80 Ca -0.45 -0.03 -0.05 0.00 0.11 0.00 0.00 57.88 57.46 2klc h LEU 80 Cb 1.25 -0.10 -0.01 0.00 -0.44 0.00 0.00 40.66 41.36 2klc h LEU 80 CO 0.61 0.36 -0.23 -1.28 -4.11 0.00 0.00 178.44 173.78 2klc h SER 81 N 0.43 0.00 0.41 0.17 0.87 -1.85 -0.99 113.55 112.59 2klc h SER 81 Ca 0.11 0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.62 2klc h SER 81 Cb 0.10 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.05 2klc h SER 81 CO -0.01 0.23 -0.24 1.56 -0.53 0.00 0.00 176.83 177.84 2klc h GLN 82 N 0.00 0.00 -0.18 2.24 1.08 -1.80 -1.76 115.11 114.70 2klc h GLN 82 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2klc h GLN 82 Cb 0.62 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.05 2klc h GLN 82 CO 0.03 0.24 0.00 0.72 -0.95 0.00 0.00 178.83 178.87 2klc n HIS 83 N -3.87 0.22 -0.93 2.96 8.25 -0.46 -4.93 115.22 116.46 2klc n HIS 83 Ca -0.02 -0.11 0.00 0.00 -0.26 0.00 0.00 57.72 57.33 2klc n HIS 83 Cb 0.33 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.44 2klc n HIS 83 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2klc n GLY 84 N 1.20 0.45 3.60 -1.41 0.00 -0.66 -4.96 105.19 103.41 2klc n GLY 84 Ca 0.17 -0.77 -0.43 0.00 0.00 0.00 0.00 46.02 45.00 2klc n GLY 84 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2klc s ILE 85 N -2.00 4.61 0.00 -0.61 1.01 -0.72 -4.97 121.20 118.52 2klc s ILE 85 Ca 0.00 1.12 0.00 0.00 0.00 0.00 0.00 60.65 61.77 2klc s ILE 85 Cb 0.00 -4.32 0.00 0.00 0.01 0.00 0.00 42.46 38.15 2klc s ILE 85 CO 0.00 -0.53 0.00 1.41 0.00 0.00 0.00 174.94 175.82 2klc n HIS 86 N 6.73 0.00 -1.63 3.97 8.25 -1.26 -3.64 115.22 127.63 2klc n HIS 86 Ca 0.06 0.00 -0.44 0.00 -0.26 0.00 0.00 57.72 57.08 2klc n HIS 86 Cb 0.48 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.55 2klc n HIS 86 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 2klc n ASP 87 N -1.29 3.64 0.00 0.41 5.75 -1.26 -2.06 116.55 121.75 2klc n ASP 87 Ca 0.00 0.69 0.00 0.00 -0.01 0.00 0.00 54.79 55.47 2klc n ASP 87 Cb 0.00 -1.49 0.00 0.00 -1.03 0.00 0.00 41.12 38.60 2klc n ASP 87 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2klc n GLY 88 N 4.99 3.01 3.80 6.12 0.00 -0.57 -4.84 105.19 117.69 2klc n GLY 88 Ca 0.25 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.91 2klc n GLY 88 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2klc s LEU 89 N 0.00 4.17 -0.07 0.99 2.01 -0.87 -4.90 118.68 120.01 2klc s LEU 89 Ca 0.00 1.80 0.04 0.00 0.01 0.00 0.00 54.13 55.98 2klc s LEU 89 Cb 0.00 -4.23 -0.01 0.00 0.01 0.00 0.00 46.19 41.96 2klc s LEU 89 CO 0.00 -0.22 -0.20 -0.89 1.01 0.00 0.00 176.35 176.05 2klc s THR 90 N -1.83 2.49 0.08 5.49 2.01 -1.26 -2.21 115.64 120.41 2klc s THR 90 Ca 0.55 -0.91 0.04 0.00 0.31 0.00 0.00 61.69 61.69 2klc s THR 90 Cb -0.15 -1.95 -0.04 0.00 0.01 0.00 0.00 72.50 70.36 2klc s THR 90 CO 0.20 0.57 -0.00 -0.69 -0.69 0.00 0.00 174.62 174.00 2klc s VAL 91 N -0.19 4.01 -0.47 3.82 1.01 -0.55 -5.01 120.40 123.02 2klc s VAL 91 Ca -0.02 -0.95 -0.23 0.00 0.00 0.00 0.00 61.98 60.79 2klc s VAL 91 Cb -0.14 -2.89 0.03 0.00 0.00 0.00 0.00 36.38 33.38 2klc s VAL 91 CO 0.03 0.16 0.79 -1.00 0.00 0.00 0.00 175.10 175.08 2klc s HIS 92 N -1.28 2.97 -0.21 5.22 3.76 -0.43 -2.22 115.29 123.10 2klc s HIS 92 Ca 0.25 0.09 -0.08 0.00 -0.15 0.00 0.00 55.06 55.16 2klc s HIS 92 Cb -0.12 -3.70 -0.04 0.00 1.11 0.00 0.00 32.58 29.83 2klc s HIS 92 CO 0.17 -1.04 0.09 -1.17 -0.85 0.00 0.00 174.74 171.94 2klc s LEU 93 N 3.33 3.81 -0.26 0.89 2.96 -0.83 -0.27 118.68 128.31 2klc s LEU 93 Ca 0.29 0.03 0.01 0.00 -0.22 0.00 0.00 54.13 54.23 2klc s LEU 93 Cb -0.13 -1.99 0.05 0.00 0.50 0.00 0.00 46.19 44.62 2klc s LEU 93 CO 0.21 0.10 -0.07 -0.69 -1.32 0.00 0.00 176.35 174.58 2klc s VAL 94 N 0.82 2.54 -0.37 1.68 1.01 -0.66 -4.42 120.40 121.00 2klc s VAL 94 Ca 0.05 -1.40 -0.23 0.00 0.00 0.00 0.00 61.98 60.39 2klc s VAL 94 Cb -0.13 -2.42 0.01 0.00 0.00 0.00 0.00 36.38 33.84 2klc s VAL 94 CO 0.02 0.03 0.79 -0.63 0.00 0.00 0.00 175.10 175.31 2klc s ILE 95 N 1.20 4.73 -0.69 2.22 1.01 -1.26 -2.48 121.20 125.93 2klc s ILE 95 Ca -0.05 0.88 -0.05 0.00 0.00 0.00 0.00 60.65 61.42 2klc s ILE 95 Cb -0.19 -4.22 -0.01 0.00 0.01 0.00 0.00 42.46 38.05 2klc s ILE 95 CO -0.04 -0.45 2.89 0.29 0.00 0.00 0.00 174.94 177.64 2klc n LYS 96 N 6.44 2.98 -1.41 2.79 4.76 -0.42 -4.90 118.16 128.40 2klc n LYS 96 Ca 0.03 -2.30 -0.05 0.00 -2.87 0.00 0.00 58.31 53.12 2klc n LYS 96 Cb 0.48 -2.30 0.02 0.00 -1.84 0.00 0.00 35.03 31.40 2klc n LYS 96 CO 0.00 0.00 0.00 -2.37 -1.37 0.00 0.00 177.40 173.66 2klc n THR 97 N 1.73 0.00 0.00 -0.18 5.66 -1.26 -4.78 114.28 115.44 2klc n THR 97 Ca 0.54 -0.48 0.00 0.00 -3.05 0.00 0.00 64.05 61.06 2klc n THR 97 Cb 0.53 -0.98 0.00 0.00 -1.55 0.00 0.00 70.33 68.32 2klc n THR 97 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2klc n GLN 98 N -1.38 3.27 -1.37 1.09 10.64 -1.26 -4.95 117.38 123.42 2klc n GLN 98 Ca 0.04 0.00 -0.07 0.00 -1.83 0.00 0.00 57.00 55.15 2klc n GLN 98 Cb 0.16 -0.29 0.11 0.00 -0.86 0.00 0.00 30.24 29.36 2klc n GLN 98 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 2klc n ASN 99 N -0.02 2.95 -4.38 2.61 3.02 -1.26 -5.01 115.26 113.16 2klc n ASN 99 Ca 0.00 -3.60 -0.30 0.00 -0.03 0.00 0.00 54.58 50.65 2klc n ASN 99 Cb 0.00 -0.43 -0.14 0.00 -0.61 0.00 0.00 39.78 38.60 2klc n ASN 99 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2klc s ARG 100 N -3.19 1.78 0.00 3.52 1.81 -1.26 -5.17 118.95 116.44 2klc s ARG 100 Ca 0.42 -1.13 0.00 0.00 -1.72 0.00 0.00 55.73 53.30 2klc s ARG 100 Cb 0.38 -2.01 0.00 0.00 -0.45 0.00 0.00 34.95 32.87 2klc s ARG 100 CO -0.03 0.51 0.27 -2.30 -0.68 0.00 0.00 175.30 173.06