#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 4.11 0.34 0.54 2.20 -1.26 -5.07 119.74 120.60 2klc s LYS 24 Ca 0.00 1.21 -0.14 0.00 -0.36 0.00 0.00 55.97 56.69 2klc s LYS 24 Cb 0.00 -2.19 -0.08 0.00 -1.51 0.00 0.00 37.83 34.05 2klc s LYS 24 CO 0.00 -0.14 0.74 -1.50 -0.36 0.00 0.00 175.35 174.09 2klc s ILE 25 N -2.08 4.71 -0.47 5.43 2.07 -1.26 -5.01 121.20 124.59 2klc s ILE 25 Ca 0.63 0.86 -0.29 0.00 -1.41 0.00 0.00 60.65 60.45 2klc s ILE 25 Cb -0.12 -3.64 0.03 0.00 0.13 0.00 0.00 42.46 38.86 2klc s ILE 25 CO 0.16 -0.26 1.11 -0.32 -1.91 0.00 0.00 174.94 173.72 2klc s MET 26 N -3.18 3.73 -0.42 3.50 -2.45 -0.19 -4.87 119.30 115.42 2klc s MET 26 Ca 0.53 0.56 -0.26 0.00 -1.25 0.00 0.00 55.69 55.27 2klc s MET 26 Cb -0.10 -3.90 0.02 0.00 1.25 0.00 0.00 34.83 32.10 2klc s MET 26 CO 0.21 -1.34 0.96 0.15 1.05 0.00 0.00 175.02 176.05 2klc s LYS 27 N 4.34 3.71 -0.21 4.11 -0.14 -1.26 -1.93 119.74 128.35 2klc s LYS 27 Ca 0.47 0.43 -0.00 0.00 -1.36 0.00 0.00 55.97 55.51 2klc s LYS 27 Cb -0.08 -3.86 0.02 0.00 -1.68 0.00 0.00 37.83 32.23 2klc s LYS 27 CO 0.30 -1.12 -0.13 0.08 -0.76 0.00 0.00 175.35 173.72 2klc s VAL 28 N 3.74 2.48 0.19 3.17 1.01 -0.50 -1.78 120.40 128.70 2klc s VAL 28 Ca 0.39 -0.98 -0.28 0.00 0.00 0.00 0.00 61.98 61.12 2klc s VAL 28 Cb -0.10 -2.16 -0.08 0.00 0.00 0.00 0.00 36.38 34.03 2klc s VAL 28 CO 0.24 0.37 0.86 -0.89 0.00 0.00 0.00 175.10 175.68 2klc s THR 29 N 1.31 4.26 -0.11 3.92 2.01 -0.72 -0.79 115.64 125.52 2klc s THR 29 Ca 0.02 1.90 0.01 0.00 0.31 0.00 0.00 61.69 63.94 2klc s THR 29 Cb -0.15 -4.24 0.02 0.00 0.01 0.00 0.00 72.50 68.14 2klc s THR 29 CO -0.08 0.49 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.52 2klc s VAL 30 N -1.02 1.33 -0.41 3.82 1.01 -0.12 -1.21 120.40 123.80 2klc s VAL 30 Ca 0.39 -0.52 -0.18 0.00 0.00 0.00 0.00 61.98 61.67 2klc s VAL 30 Cb -0.24 -1.25 0.02 0.00 0.00 0.00 0.00 36.38 34.91 2klc s VAL 30 CO 0.29 0.41 0.46 -0.75 0.00 0.00 0.00 175.10 175.51 2klc s LYS 31 N 1.19 3.23 0.36 2.72 2.36 -0.30 -2.05 119.74 127.24 2klc s LYS 31 Ca -0.03 -0.61 0.09 0.00 -2.55 0.00 0.00 55.97 52.86 2klc s LYS 31 Cb -0.14 -3.93 -0.06 0.00 -1.05 0.00 0.00 37.83 32.65 2klc s LYS 31 CO -0.04 -0.81 0.01 0.95 1.55 0.00 0.00 175.35 177.01 2klc s THR 32 N 2.23 2.38 0.25 3.43 -4.23 -0.55 -1.96 115.64 117.20 2klc s THR 32 Ca 0.14 -2.00 0.34 0.00 -1.18 0.00 0.00 61.69 58.99 2klc s THR 32 Cb -0.16 -2.82 0.34 0.00 1.34 0.00 0.00 72.50 71.19 2klc s THR 32 CO 0.14 -0.14 2.03 1.55 -0.54 0.00 0.00 174.62 177.66 2klc h PRO 33 N 1.81 0.00 0.00 3.99 0.13 -1.98 -3.13 132.00 132.83 2klc h PRO 33 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2klc h PRO 33 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 2klc h PRO 33 CO 0.71 0.00 -0.05 0.87 -0.23 0.00 0.00 178.00 179.30 2klc h LYS 34 N 0.00 0.00 0.00 0.86 6.56 -1.93 -3.52 116.57 118.54 2klc h LYS 34 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 2klc h LYS 34 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.66 2klc h LYS 34 CO 0.00 0.00 0.00 -0.85 -2.06 0.00 0.00 179.45 176.54 2klc n GLU 35 N -2.66 0.00 -3.88 3.15 0.28 -1.18 -5.15 120.64 111.19 2klc n GLU 35 Ca -0.01 0.00 -0.35 0.00 -0.16 0.00 0.00 57.16 56.64 2klc n GLU 35 Cb 0.02 0.00 -0.10 0.00 1.43 0.00 0.00 31.44 32.79 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 -1.11 3.92 -0.06 3.44 -2.85 -1.26 -1.48 119.74 120.34 2klc s LYS 36 Ca 0.00 -0.36 0.05 0.00 -1.00 0.00 0.00 55.97 54.65 2klc s LYS 36 Cb 0.00 -3.31 -0.00 0.00 -2.06 0.00 0.00 37.83 32.46 2klc s LYS 36 CO 0.00 0.12 -0.20 -2.00 0.10 0.00 0.00 175.35 173.37 2klc s GLU 37 N 0.82 2.24 -0.27 1.78 -6.30 -0.87 -4.95 118.70 111.14 2klc s GLU 37 Ca 0.04 -0.72 -0.07 0.00 -2.50 0.00 0.00 54.97 51.72 2klc s GLU 37 Cb -0.13 -1.85 -0.01 0.00 0.00 0.00 0.00 34.13 32.13 2klc s GLU 37 CO 0.02 0.24 0.07 -2.00 0.02 0.00 0.00 175.26 173.62 2klc s GLU 38 N 0.12 3.44 0.36 4.30 2.12 -1.26 -0.94 118.70 126.82 2klc s GLU 38 Ca -0.08 -0.62 0.03 0.00 0.36 0.00 0.00 54.97 54.66 2klc s GLU 38 Cb -0.14 -3.34 -0.01 0.00 0.26 0.00 0.00 34.13 30.89 2klc s GLU 38 CO 0.04 -0.29 0.52 -0.06 -0.54 0.00 0.00 175.26 174.94 2klc s PHE 39 N 1.57 3.27 -0.23 5.30 0.40 0.03 -4.89 117.98 123.44 2klc s PHE 39 Ca 0.05 0.05 0.00 0.00 -0.60 0.00 0.00 56.93 56.43 2klc s PHE 39 Cb -0.16 -2.00 0.06 0.00 0.51 0.00 0.00 43.02 41.43 2klc s PHE 39 CO 0.03 -0.02 -0.05 0.00 0.70 0.00 0.00 175.22 175.89 2klc s ALA 40 N -2.28 1.84 -0.01 5.36 0.00 -1.26 -1.41 121.76 124.00 2klc s ALA 40 Ca 0.43 -1.25 0.04 0.00 0.00 0.00 0.00 51.96 51.17 2klc s ALA 40 Cb -0.10 -1.39 -0.01 0.00 0.00 0.00 0.00 23.12 21.63 2klc s ALA 40 CO 0.34 -1.16 -0.12 0.14 0.00 0.00 0.00 175.76 174.96 2klc s VAL 41 N 1.45 0.92 -0.05 0.00 -7.23 -0.81 -4.94 120.40 109.74 2klc s VAL 41 Ca -0.05 -0.49 0.00 0.00 -1.81 0.00 0.00 61.98 59.63 2klc s VAL 41 Cb -0.18 -0.77 0.05 0.00 0.56 0.00 0.00 36.38 36.04 2klc s VAL 41 CO -0.06 0.26 1.43 -0.81 -0.31 0.00 0.00 175.10 175.61 2klc n PRO 42 N 2.85 1.13 -0.81 4.82 -0.04 -1.26 -1.02 135.00 140.66 2klc n PRO 42 Ca -0.14 -0.28 0.00 0.00 -0.04 0.00 0.00 63.50 63.03 2klc n PRO 42 Cb 0.56 -1.11 0.00 0.00 -0.04 0.00 0.00 33.50 32.91 2klc n PRO 42 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2klc n GLU 43 N 0.70 -1.30 -0.01 0.54 1.02 -1.26 -4.71 120.64 115.63 2klc n GLU 43 Ca 0.06 0.32 0.03 0.00 -0.02 0.00 0.00 57.16 57.55 2klc n GLU 43 Cb 0.57 -4.77 -0.06 0.00 -0.02 0.00 0.00 31.44 27.16 2klc n GLU 43 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2klc n ASN 44 N -0.60 3.19 -4.69 1.62 2.85 -1.26 -4.81 115.26 111.56 2klc n ASN 44 Ca 0.00 0.00 -0.42 0.00 -0.11 0.00 0.00 54.58 54.05 2klc n ASN 44 Cb 0.32 1.29 -0.03 0.00 1.24 0.00 0.00 39.78 42.60 2klc n ASN 44 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 2klc s SER 45 N -3.02 6.45 0.87 1.20 0.01 -1.26 -5.02 113.70 112.93 2klc s SER 45 Ca -0.03 2.71 -0.11 0.00 1.31 0.00 0.00 55.95 59.82 2klc s SER 45 Cb 0.05 -2.56 0.16 0.00 0.21 0.00 0.00 66.02 63.88 2klc s SER 45 CO 0.33 -1.00 1.21 -0.44 0.41 0.00 0.00 173.24 173.75 2klc s SER 46 N 2.91 3.66 0.32 2.44 0.01 -1.26 -4.39 113.70 117.39 2klc s SER 46 Ca 0.81 0.18 0.01 0.00 1.31 0.00 0.00 55.95 58.25 2klc s SER 46 Cb -0.45 -0.39 0.53 0.00 0.21 0.00 0.00 66.02 65.93 2klc s SER 46 CO 0.36 -2.37 1.93 0.58 0.41 0.00 0.00 173.24 174.15 2klc h VAL 47 N -1.25 1.19 -0.21 3.43 2.07 -1.45 -0.06 116.25 119.97 2klc h VAL 47 Ca -0.43 -0.55 0.06 0.00 0.82 0.00 0.00 66.70 66.61 2klc h VAL 47 Cb 1.26 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.48 2klc h VAL 47 CO 0.43 0.23 0.17 0.06 0.02 0.00 0.00 177.57 178.47 2klc h GLN 48 N 0.81 0.00 0.07 1.57 -0.00 -1.77 -1.72 115.11 114.07 2klc h GLN 48 Ca 0.20 0.00 -0.37 0.00 -0.00 0.00 0.00 58.65 58.49 2klc h GLN 48 Cb 0.09 0.00 -0.04 0.00 -0.00 0.00 0.00 27.48 27.54 2klc h GLN 48 CO -0.03 0.00 -2.12 0.94 -0.00 0.00 0.00 178.83 177.62 2klc n GLN 49 N -4.22 0.72 -0.08 0.06 -0.06 -0.88 -4.53 117.38 108.38 2klc n GLN 49 Ca 0.02 0.22 -0.12 0.00 -2.00 0.00 0.00 57.00 55.12 2klc n GLN 49 Cb 0.31 -1.66 -0.05 0.00 -4.06 0.00 0.00 30.24 24.78 2klc n GLN 49 CO 0.00 0.00 0.00 0.35 -0.20 0.00 0.00 177.06 177.21 2klc h PHE 50 N 0.04 0.62 0.00 3.69 3.57 -0.47 -3.02 116.94 121.38 2klc h PHE 50 Ca -0.46 -0.16 0.00 0.00 3.53 0.00 0.00 57.97 60.88 2klc h PHE 50 Cb 2.01 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 40.61 2klc h PHE 50 CO 0.05 0.81 0.00 1.57 -2.23 0.00 0.00 178.31 178.52 2klc h LYS 51 N 0.25 0.00 -0.10 1.11 -0.00 -1.59 -2.25 116.57 113.99 2klc h LYS 51 Ca 0.05 0.00 -0.15 0.00 -0.00 0.00 0.00 60.65 60.55 2klc h LYS 51 Cb 0.66 0.00 -0.01 0.00 -0.00 0.00 0.00 32.23 32.88 2klc h LYS 51 CO 0.04 0.00 -0.59 0.93 -0.00 0.00 0.00 179.45 179.83 2klc h GLU 52 N 0.00 0.33 -0.30 0.07 5.08 -1.76 0.10 114.58 118.10 2klc h GLU 52 Ca 0.00 -0.22 -0.16 0.00 -1.00 0.00 0.00 59.36 57.98 2klc h GLU 52 Cb 0.44 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.72 2klc h GLU 52 CO 0.00 0.82 -0.46 0.93 -1.00 0.00 0.00 179.01 179.30 2klc h GLU 53 N 0.24 0.77 -0.62 2.33 4.39 -1.48 -2.95 114.58 117.27 2klc h GLU 53 Ca -0.00 -0.44 -0.03 0.00 0.34 0.00 0.00 59.36 59.23 2klc h GLU 53 Cb 1.10 0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.75 2klc h GLU 53 CO 0.10 1.07 0.26 0.82 -1.16 0.00 0.00 179.01 180.09 2klc h ILE 54 N 0.62 1.21 -0.31 3.13 2.04 -1.33 -3.09 117.51 119.79 2klc h ILE 54 Ca 0.04 -0.66 -0.00 0.00 1.00 0.00 0.00 64.86 65.23 2klc h ILE 54 Cb 1.03 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 37.56 2klc h ILE 54 CO 0.10 0.26 0.17 -1.28 0.00 0.00 0.00 178.15 177.41 2klc h SER 55 N 0.88 0.38 0.65 1.72 0.87 -0.80 -1.82 113.55 115.43 2klc h SER 55 Ca 0.21 -0.07 -0.11 0.00 -1.23 0.00 0.00 61.79 60.59 2klc h SER 55 Cb 0.16 -0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 62.01 2klc h SER 55 CO -0.02 0.34 -0.51 0.07 -0.53 0.00 0.00 176.83 176.18 2klc h LYS 56 N 0.38 0.00 -0.34 2.24 2.10 -1.58 0.15 116.57 119.52 2klc h LYS 56 Ca 0.11 0.00 -0.17 0.00 -2.00 0.00 0.00 60.65 58.59 2klc h LYS 56 Cb 0.04 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.37 2klc h LYS 56 CO -0.02 0.51 -0.44 0.00 -2.00 0.00 0.00 179.45 177.50 2klc h ARG 57 N 0.00 0.91 -0.12 0.07 2.47 -1.37 -3.33 114.38 113.01 2klc h ARG 57 Ca -0.01 -0.51 0.00 0.00 -1.26 0.00 0.00 59.98 58.20 2klc h ARG 57 Cb 0.97 0.04 0.00 0.00 -1.65 0.00 0.00 29.97 29.33 2klc h ARG 57 CO 0.07 1.16 0.00 1.19 0.56 0.00 0.00 179.97 182.95 2klc n PHE 58 N -4.06 0.14 -2.44 3.04 3.72 -0.72 -4.99 117.46 112.15 2klc n PHE 58 Ca -0.03 -0.15 -0.15 0.00 -0.05 0.00 0.00 57.45 57.07 2klc n PHE 58 Cb 0.57 -0.01 -0.01 0.00 -0.94 0.00 0.00 39.48 39.10 2klc n PHE 58 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 2klc n LYS 59 N 0.60 -2.11 -4.49 -1.08 5.02 0.50 -4.89 118.16 111.71 2klc n LYS 59 Ca 0.08 0.72 -0.30 0.00 -2.02 0.00 0.00 58.31 56.78 2klc n LYS 59 Cb 0.33 -5.34 -0.17 0.00 -0.02 0.00 0.00 35.03 29.83 2klc n LYS 59 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2klc s SER 60 N -2.05 2.77 0.86 4.39 0.01 -1.11 -5.04 113.70 113.53 2klc s SER 60 Ca 0.01 -0.52 -0.13 0.00 1.31 0.00 0.00 55.95 56.62 2klc s SER 60 Cb -0.00 -1.26 0.07 0.00 0.21 0.00 0.00 66.02 65.04 2klc s SER 60 CO 0.01 0.03 0.90 1.41 0.41 0.00 0.00 173.24 176.00 2klc n HIS 61 N 4.22 0.21 0.08 2.43 8.25 -1.26 -4.42 115.22 124.73 2klc n HIS 61 Ca -0.19 0.35 0.04 0.00 -0.26 0.00 0.00 57.72 57.66 2klc n HIS 61 Cb 0.51 -1.97 0.45 0.00 1.12 0.00 0.00 29.99 30.10 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 -1.26 1.11 -0.41 1.59 1.35 -1.93 -1.05 112.91 112.30 2klc h THR 62 Ca -0.45 -0.34 -0.10 0.00 -0.55 0.00 0.00 66.41 64.97 2klc h THR 62 Cb 1.29 0.82 -0.02 0.00 -1.73 0.00 0.00 68.15 68.51 2klc h THR 62 CO 0.41 0.13 -0.16 -0.78 -0.25 0.00 0.00 175.52 174.88 2klc h ASP 63 N 0.35 0.77 1.04 5.36 3.58 -1.97 -3.08 116.42 122.48 2klc h ASP 63 Ca 0.09 -0.25 -0.03 0.00 0.42 0.00 0.00 57.03 57.26 2klc h ASP 63 Cb 0.09 -0.21 -0.00 0.00 1.72 0.00 0.00 39.33 40.93 2klc h ASP 63 CO -0.01 0.93 -0.13 1.56 -2.88 0.00 0.00 179.24 178.71 2klc h GLN 64 N 0.69 0.00 -5.62 0.28 4.20 -1.53 -3.43 115.11 109.69 2klc h GLN 64 Ca 0.11 0.00 -0.60 0.00 0.06 0.00 0.00 58.65 58.22 2klc h GLN 64 Cb 0.65 0.00 -0.10 0.00 0.30 0.00 0.00 27.48 28.33 2klc h GLN 64 CO 0.05 0.13 0.14 -0.51 -0.67 0.00 0.00 178.83 177.97 2klc s LEU 65 N -6.53 4.12 -0.14 1.46 1.43 -1.07 -1.02 118.68 116.93 2klc s LEU 65 Ca 0.01 0.80 0.02 0.00 -1.03 0.00 0.00 54.13 53.94 2klc s LEU 65 Cb 0.09 -2.89 0.01 0.00 0.03 0.00 0.00 46.19 43.44 2klc s LEU 65 CO 0.61 -0.31 -0.19 0.68 0.23 0.00 0.00 176.35 177.37 2klc s VAL 66 N 2.11 1.83 0.21 -1.59 -7.23 -0.85 -4.97 120.40 109.92 2klc s VAL 66 Ca 0.28 -0.83 -0.16 0.00 -1.81 0.00 0.00 61.98 59.46 2klc s VAL 66 Cb -0.16 -1.65 -0.08 0.00 0.56 0.00 0.00 36.38 35.06 2klc s VAL 66 CO 0.10 0.51 0.64 -0.76 -0.31 0.00 0.00 175.10 175.27 2klc s LEU 67 N 1.00 4.27 -0.03 1.32 1.43 -1.26 -1.57 118.68 123.83 2klc s LEU 67 Ca -0.04 1.21 0.02 0.00 -1.03 0.00 0.00 54.13 54.29 2klc s LEU 67 Cb -0.15 -3.57 0.01 0.00 0.03 0.00 0.00 46.19 42.50 2klc s LEU 67 CO -0.04 0.00 -0.10 -0.63 0.23 0.00 0.00 176.35 175.82 2klc s ILE 68 N -1.62 0.85 -0.18 -0.59 1.09 0.06 -0.81 121.20 120.00 2klc s ILE 68 Ca 0.44 -0.38 -0.30 0.00 -1.10 0.00 0.00 60.65 59.31 2klc s ILE 68 Cb -0.14 -0.76 0.14 0.00 -1.06 0.00 0.00 42.46 40.63 2klc s ILE 68 CO 0.20 0.27 1.06 0.12 -0.10 0.00 0.00 174.94 176.49 2klc s PHE 69 N 0.30 -0.30 -1.37 3.97 2.19 -0.36 -2.04 117.98 120.36 2klc s PHE 69 Ca -0.05 0.50 0.00 0.00 0.33 0.00 0.00 56.93 57.71 2klc s PHE 69 Cb -0.10 0.46 0.00 0.00 -1.31 0.00 0.00 43.02 42.07 2klc s PHE 69 CO 0.01 -0.29 0.00 0.00 1.83 0.00 0.00 175.22 176.77 2klc n ALA 70 N 0.63 -0.22 -1.26 11.12 0.00 -1.26 -2.38 120.51 127.14 2klc n ALA 70 Ca -0.08 0.20 -0.04 0.00 0.00 0.00 0.00 53.44 53.52 2klc n ALA 70 Cb 0.58 -1.49 -0.02 0.00 0.00 0.00 0.00 19.45 18.52 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 -1.33 0.64 3.41 0.00 0.00 -1.26 -5.03 105.19 101.63 2klc n GLY 71 Ca -0.13 -0.85 -0.09 0.00 0.00 0.00 0.00 46.02 44.94 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 -2.62 1.24 -0.09 1.61 0.00 -1.00 -5.16 119.74 113.72 2klc s LYS 72 Ca 0.00 -1.07 -0.23 0.00 0.00 0.00 0.00 55.97 54.67 2klc s LYS 72 Cb 0.00 0.43 -0.03 0.00 0.00 0.00 0.00 37.83 38.23 2klc s LYS 72 CO 0.00 -0.48 0.69 0.96 0.00 0.00 0.00 175.35 176.51 2klc s ILE 73 N -3.94 5.04 -0.10 3.79 -0.00 -1.26 -1.22 121.20 123.50 2klc s ILE 73 Ca 0.14 1.40 -0.29 0.00 -0.00 0.00 0.00 60.65 61.90 2klc s ILE 73 Cb 0.02 -4.02 -0.01 0.00 -0.00 0.00 0.00 42.46 38.44 2klc s ILE 73 CO -0.01 0.22 0.99 -0.76 -0.00 0.00 0.00 174.94 175.39 2klc s LEU 74 N 1.03 4.25 0.40 0.37 1.43 0.01 -4.97 118.68 121.20 2klc s LEU 74 Ca 0.36 1.51 0.08 0.00 -1.03 0.00 0.00 54.13 55.05 2klc s LEU 74 Cb -0.17 -3.53 -0.02 0.00 0.03 0.00 0.00 46.19 42.50 2klc s LEU 74 CO 0.16 -0.43 0.40 -0.54 0.23 0.00 0.00 176.35 176.17 2klc s LYS 75 N 1.96 2.61 0.41 1.70 -0.14 -1.26 -4.27 119.74 120.75 2klc s LYS 75 Ca 0.48 -1.45 0.09 0.00 -1.36 0.00 0.00 55.97 53.73 2klc s LYS 75 Cb -0.18 -2.46 0.91 0.00 -1.68 0.00 0.00 37.83 34.42 2klc s LYS 75 CO 0.18 -0.16 2.02 -0.44 -0.76 0.00 0.00 175.35 176.19 2klc h ASP 76 N 0.99 0.46 -0.37 2.83 3.32 -1.97 -1.37 116.42 120.31 2klc h ASP 76 Ca -0.42 -0.00 0.04 0.00 0.02 0.00 0.00 57.03 56.67 2klc h ASP 76 Cb 1.27 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 40.69 2klc h ASP 76 CO 0.55 0.31 0.25 0.06 -1.72 0.00 0.00 179.24 178.69 2klc h GLN 77 N 0.53 0.33 -7.02 3.56 3.07 -1.98 -3.32 115.11 110.28 2klc h GLN 77 Ca 0.21 -0.02 -0.50 0.00 0.09 0.00 0.00 58.65 58.44 2klc h GLN 77 Cb 0.19 -0.07 0.04 0.00 0.08 0.00 0.00 27.48 27.71 2klc h GLN 77 CO -0.06 0.22 0.17 -0.51 0.09 0.00 0.00 178.83 178.74 2klc s ASP 78 N -6.63 6.25 -0.01 0.06 1.01 -0.52 -4.97 116.67 111.87 2klc s ASP 78 Ca -0.07 1.02 0.06 0.00 0.71 0.00 0.00 52.55 54.27 2klc s ASP 78 Cb 0.18 -2.29 -0.03 0.00 1.01 0.00 0.00 42.92 41.80 2klc s ASP 78 CO 0.72 -0.64 -0.18 0.42 0.21 0.00 0.00 175.17 175.70 2klc s THR 79 N -2.83 2.72 0.26 -1.27 -4.23 -1.26 -1.44 115.64 107.59 2klc s THR 79 Ca 0.49 -0.99 -0.02 0.00 -1.18 0.00 0.00 61.69 59.99 2klc s THR 79 Cb -0.10 -2.07 0.24 0.00 1.34 0.00 0.00 72.50 71.90 2klc s THR 79 CO 0.47 0.49 1.81 0.17 -0.54 0.00 0.00 174.62 177.02 2klc h LEU 80 N 5.07 0.72 -1.06 4.79 -0.00 -1.86 -2.82 115.31 120.15 2klc h LEU 80 Ca -0.46 0.06 -0.03 0.00 -0.00 0.00 0.00 57.88 57.45 2klc h LEU 80 Cb 1.15 -0.08 -0.03 0.00 -0.00 0.00 0.00 40.66 41.69 2klc h LEU 80 CO 0.48 0.38 0.32 -1.28 -0.00 0.00 0.00 178.44 178.35 2klc h SER 81 N 0.82 0.89 1.09 0.17 0.87 -1.84 -1.94 113.55 113.61 2klc h SER 81 Ca 0.44 -0.10 -0.03 0.00 -1.23 0.00 0.00 61.79 60.87 2klc h SER 81 Cb 0.46 -0.23 -0.00 0.00 -0.44 0.00 0.00 62.40 62.19 2klc h SER 81 CO -0.28 0.76 -0.15 1.56 -0.53 0.00 0.00 176.83 178.20 2klc h GLN 82 N 0.97 0.00 -0.02 2.24 1.08 -1.80 -2.59 115.11 114.99 2klc h GLN 82 Ca 0.24 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.44 2klc h GLN 82 Cb 0.12 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.55 2klc h GLN 82 CO -0.03 0.15 0.00 0.72 -0.95 0.00 0.00 178.83 178.72 2klc n HIS 83 N -3.26 0.02 0.00 2.96 8.25 -0.78 -4.89 115.22 117.52 2klc n HIS 83 Ca 0.01 -0.01 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2klc n HIS 83 Cb 0.42 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.53 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 1.04 0.28 3.60 -1.41 0.00 -0.98 -4.83 105.19 102.89 2klc n GLY 84 Ca 0.20 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.79 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 3.78 0.01 -0.61 1.01 -0.90 -4.95 121.20 117.54 2klc s ILE 85 Ca 0.00 0.80 0.00 0.00 0.00 0.00 0.00 60.65 61.45 2klc s ILE 85 Cb 0.00 -4.04 -0.00 0.00 0.01 0.00 0.00 42.46 38.43 2klc s ILE 85 CO 0.00 -0.65 0.00 1.41 0.00 0.00 0.00 174.94 175.71 2klc n HIS 86 N 9.19 -0.00 -1.64 3.97 8.25 -1.26 -3.65 115.22 130.07 2klc n HIS 86 Ca 0.18 -0.05 -0.52 0.00 -0.26 0.00 0.00 57.72 57.07 2klc n HIS 86 Cb 0.48 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.53 2klc n HIS 86 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 2klc n ASP 87 N -2.35 2.83 0.00 0.41 -0.08 -1.26 -1.93 116.55 114.18 2klc n ASP 87 Ca -0.00 0.87 0.00 0.00 -1.51 0.00 0.00 54.79 54.15 2klc n ASP 87 Cb 0.01 -1.28 0.00 0.00 2.34 0.00 0.00 41.12 42.19 2klc n ASP 87 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2klc n GLY 88 N 4.84 0.48 3.96 0.27 0.00 -0.74 -4.97 105.19 109.04 2klc n GLY 88 Ca 0.28 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.07 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 3.07 -0.06 0.99 1.02 -0.81 -4.91 118.68 117.98 2klc s LEU 89 Ca 0.00 0.07 0.02 0.00 0.02 0.00 0.00 54.13 54.25 2klc s LEU 89 Cb 0.00 -2.78 0.01 0.00 0.02 0.00 0.00 46.19 43.44 2klc s LEU 89 CO 0.00 -1.43 -0.12 -0.89 0.02 0.00 0.00 176.35 173.93 2klc s THR 90 N -2.99 1.08 0.02 5.49 2.01 -1.25 -1.76 115.64 118.24 2klc s THR 90 Ca 0.60 -0.45 -0.12 0.00 0.31 0.00 0.00 61.69 62.04 2klc s THR 90 Cb -0.09 -0.99 -0.06 0.00 0.01 0.00 0.00 72.50 71.37 2klc s THR 90 CO 0.42 0.34 0.37 -0.69 -0.69 0.00 0.00 174.62 174.37 2klc s VAL 91 N 0.68 5.11 -0.46 3.82 1.01 -0.35 -4.95 120.40 125.25 2klc s VAL 91 Ca -0.14 0.60 -0.18 0.00 0.00 0.00 0.00 61.98 62.25 2klc s VAL 91 Cb -0.16 -3.65 0.04 0.00 0.00 0.00 0.00 36.38 32.61 2klc s VAL 91 CO 0.03 0.46 0.53 -1.00 0.00 0.00 0.00 175.10 175.12 2klc s HIS 92 N -1.21 3.12 -0.07 5.22 3.76 -0.87 -1.15 115.29 124.08 2klc s HIS 92 Ca 0.27 -0.43 -0.16 0.00 -0.15 0.00 0.00 55.06 54.59 2klc s HIS 92 Cb -0.15 -3.20 -0.05 0.00 1.11 0.00 0.00 32.58 30.29 2klc s HIS 92 CO 0.15 -0.85 0.43 -1.17 -0.85 0.00 0.00 174.74 172.45 2klc s LEU 93 N 2.36 4.35 -0.20 0.89 2.96 -0.83 -0.76 118.68 127.46 2klc s LEU 93 Ca 0.14 0.84 0.01 0.00 -0.22 0.00 0.00 54.13 54.90 2klc s LEU 93 Cb -0.18 -2.61 0.04 0.00 0.50 0.00 0.00 46.19 43.93 2klc s LEU 93 CO 0.13 0.14 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.47 2klc s VAL 94 N -0.08 1.94 0.08 1.68 1.01 -0.61 -4.45 120.40 119.97 2klc s VAL 94 Ca 0.24 -1.10 -0.19 0.00 0.00 0.00 0.00 61.98 60.93 2klc s VAL 94 Cb -0.15 -1.89 -0.07 0.00 0.00 0.00 0.00 36.38 34.27 2klc s VAL 94 CO 0.11 0.30 0.57 -0.63 0.00 0.00 0.00 175.10 175.45 2klc s ILE 95 N 1.29 4.75 -2.15 2.22 1.01 -1.26 -2.00 121.20 125.05 2klc s ILE 95 Ca 0.00 1.19 0.17 0.00 0.00 0.00 0.00 60.65 62.01 2klc s ILE 95 Cb -0.15 -3.88 0.42 0.00 0.01 0.00 0.00 42.46 38.85 2klc s ILE 95 CO -0.10 0.52 1.41 1.17 0.00 0.00 0.00 174.94 177.95 2klc n LYS 96 N 1.62 1.97 0.00 2.79 4.81 -0.19 -4.73 118.16 124.43 2klc n LYS 96 Ca -0.10 -1.49 0.00 0.00 -0.87 0.00 0.00 58.31 55.85 2klc n LYS 96 Cb 0.51 -1.38 0.00 0.00 0.02 0.00 0.00 35.03 34.18 2klc n LYS 96 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 2klc n THR 97 N 0.71 0.00 -1.80 3.15 -1.04 -1.26 -5.10 114.28 108.94 2klc n THR 97 Ca 0.16 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.17 2klc n THR 97 Cb 0.38 -0.31 0.00 0.00 -1.82 0.00 0.00 70.33 68.59 2klc n THR 97 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2klc n GLN 98 N -0.12 -1.93 -2.20 -2.82 10.64 -1.26 -5.09 117.38 114.59 2klc n GLN 98 Ca 0.00 0.00 -0.35 0.00 -1.83 0.00 0.00 57.00 54.82 2klc n GLN 98 Cb 0.00 0.00 -0.04 0.00 -0.86 0.00 0.00 30.24 29.34 2klc n GLN 98 CO 0.00 0.00 0.00 -0.80 -1.83 0.00 0.00 177.06 174.43 2klc s ASN 99 N -2.32 5.55 -0.12 2.61 0.01 -1.26 -4.99 114.94 114.43 2klc s ASN 99 Ca 0.00 -0.41 -0.02 0.00 -0.71 0.00 0.00 52.86 51.72 2klc s ASN 99 Cb 0.00 -2.55 -0.03 0.00 0.41 0.00 0.00 41.25 39.08 2klc s ASN 99 CO 0.00 -2.29 -0.03 -0.13 -1.51 0.00 0.00 177.10 173.14 2klc s ARG 100 N 6.51 3.30 0.00 -0.60 0.52 -1.26 -5.24 118.95 122.18 2klc s ARG 100 Ca 0.60 -0.49 0.02 0.00 -0.52 0.00 0.00 55.73 55.34 2klc s ARG 100 Cb -0.08 -2.82 0.12 0.00 0.52 0.00 0.00 34.95 32.70 2klc s ARG 100 CO 0.08 0.45 0.61 -2.30 0.02 0.00 0.00 175.30 174.16