#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k7r s GLU 3 N 0.00 4.44 -0.39 0.00 2.56 -1.26 -5.03 118.70 119.02 3k7r s GLU 3 Ca 0.00 0.95 -0.27 0.00 0.00 0.00 0.00 54.97 55.65 3k7r s GLU 3 Cb 0.00 -3.39 0.02 0.00 2.00 0.00 0.00 34.13 32.76 3k7r s GLU 3 CO 0.00 0.21 1.01 0.42 -0.56 0.00 0.00 175.26 176.33 3k7r s ILE 4 N 0.28 4.47 0.20 -3.70 1.01 -1.26 -4.31 121.20 117.88 3k7r s ILE 4 Ca 0.37 1.26 -0.04 0.00 0.00 0.00 0.00 60.65 62.24 3k7r s ILE 4 Cb -0.19 -4.43 -0.05 0.00 0.01 0.00 0.00 42.46 37.80 3k7r s ILE 4 CO 0.20 -0.67 0.44 -0.54 0.00 0.00 0.00 174.94 174.37 3k7r s LYS 5 N 3.77 3.61 -0.21 2.79 1.02 0.85 -4.80 119.74 126.77 3k7r s LYS 5 Ca 0.42 -0.10 -0.05 0.00 0.02 0.00 0.00 55.97 56.25 3k7r s LYS 5 Cb -0.11 -2.78 -0.02 0.00 -0.52 0.00 0.00 37.83 34.40 3k7r s LYS 5 CO 0.22 0.38 0.01 -1.58 -0.92 0.00 0.00 175.35 173.46 3k7r s HIS 6 N -1.82 3.05 0.12 3.18 5.65 -1.26 -0.62 115.29 123.58 3k7r s HIS 6 Ca 0.42 -0.46 0.10 0.00 0.25 0.00 0.00 55.06 55.36 3k7r s HIS 6 Cb -0.11 -2.11 -0.04 0.00 -1.18 0.00 0.00 32.58 29.13 3k7r s HIS 6 CO 0.27 -0.26 -0.21 0.71 -0.65 0.00 0.00 174.74 174.59 3k7r s TYR 7 N 1.11 2.46 -0.11 3.88 2.02 0.66 -4.98 117.35 122.40 3k7r s TYR 7 Ca 0.03 -0.30 0.01 0.00 -0.37 0.00 0.00 57.07 56.44 3k7r s TYR 7 Cb -0.14 -1.32 0.02 0.00 -0.40 0.00 0.00 41.96 40.12 3k7r s TYR 7 CO 0.02 0.37 -0.12 -1.14 -1.57 0.00 0.00 175.55 173.11 3k7r s GLN 8 N -2.12 1.92 0.00 -0.62 0.74 -1.26 -0.64 119.66 117.69 3k7r s GLN 8 Ca 0.17 -0.44 0.01 0.00 0.05 0.00 0.00 55.36 55.15 3k7r s GLN 8 Cb -0.10 -1.73 -0.04 0.00 1.10 0.00 0.00 33.01 32.24 3k7r s GLN 8 CO 0.09 -0.13 0.01 -0.06 -0.55 0.00 0.00 175.29 174.65 3k7r s PHE 9 N 1.21 3.10 -0.56 1.67 0.08 0.19 -4.93 117.98 118.73 3k7r s PHE 9 Ca -0.03 0.09 -0.18 0.00 0.12 0.00 0.00 56.93 56.93 3k7r s PHE 9 Cb -0.14 -1.67 0.10 0.00 -0.57 0.00 0.00 43.02 40.74 3k7r s PHE 9 CO -0.04 0.47 0.63 1.21 -0.10 0.00 0.00 175.22 177.39 3k7r s ASN 10 N -1.63 6.19 -0.15 1.36 2.47 -1.26 -0.78 114.94 121.13 3k7r s ASN 10 Ca 0.20 -1.46 -0.01 0.00 0.42 0.00 0.00 52.86 52.02 3k7r s ASN 10 Cb -0.12 -2.27 -0.01 0.00 -1.45 0.00 0.00 41.25 37.40 3k7r s ASN 10 CO 0.11 -1.00 -0.12 -0.69 -3.72 0.00 0.00 177.10 171.68 3k7r s VAL 11 N 2.35 2.98 -1.11 -5.21 1.01 -0.67 0.05 120.40 119.80 3k7r s VAL 11 Ca 0.09 -0.67 -0.22 0.00 0.00 0.00 0.00 61.98 61.18 3k7r s VAL 11 Cb -0.25 -2.27 -0.01 0.00 0.00 0.00 0.00 36.38 33.85 3k7r s VAL 11 CO 0.06 0.50 1.79 -0.69 0.00 0.00 0.00 175.10 176.76 3k7r s VAL 12 N 0.70 3.74 -0.16 2.92 1.01 0.75 -4.54 120.40 124.83 3k7r s VAL 12 Ca -0.06 -1.00 -0.07 0.00 0.00 0.00 0.00 61.98 60.85 3k7r s VAL 12 Cb -0.15 -4.69 -0.04 0.00 0.00 0.00 0.00 36.38 31.49 3k7r s VAL 12 CO 0.02 -1.44 0.07 -0.04 0.00 0.00 0.00 175.10 173.70 3k7r s MET 13 N 5.73 3.74 -0.02 2.72 -1.94 -1.26 -4.33 119.30 123.95 3k7r s MET 13 Ca 0.60 -0.32 0.01 0.00 -1.71 0.00 0.00 55.69 54.28 3k7r s MET 13 Cb -0.01 -3.15 -0.02 0.00 2.01 0.00 0.00 34.83 33.67 3k7r s MET 13 CO 0.04 0.42 0.00 2.41 -0.01 0.00 0.00 175.02 177.88 3k7r n THR 14 N 3.07 0.11 -4.38 2.05 -1.04 -1.26 -4.84 114.28 107.99 3k7r n THR 14 Ca -0.17 -0.06 -0.21 0.00 -2.04 0.00 0.00 64.05 61.56 3k7r n THR 14 Cb 0.53 -0.90 -0.09 0.00 -1.82 0.00 0.00 70.33 68.05 3k7r n THR 14 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3k7r h SER 16 N 2.08 0.00 -0.05 0.00 4.64 -2.00 -0.35 113.55 117.88 3k7r h SER 16 Ca -0.33 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 60.84 3k7r h SER 16 Cb 1.25 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.34 3k7r h SER 16 CO 0.52 0.00 -0.48 1.23 -0.87 0.00 0.00 176.83 177.23 3k7r h GLY 17 N 1.21 0.66 0.90 -0.77 0.00 -1.98 -1.54 103.07 101.56 3k7r h GLY 17 Ca 0.00 -0.72 -0.01 0.00 0.00 0.00 0.00 47.33 46.60 3k7r h GLY 17 CO 0.00 0.65 0.07 0.00 0.00 0.00 0.00 176.54 177.26 3k7r h SER 19 N 0.12 0.68 -0.93 0.00 4.64 -1.57 -2.73 113.55 113.76 3k7r h SER 19 Ca 0.05 -0.43 0.01 0.00 -0.47 0.00 0.00 61.79 60.95 3k7r h SER 19 Cb 0.13 -0.20 -0.05 0.00 -0.31 0.00 0.00 62.40 61.98 3k7r h SER 19 CO -0.01 1.19 0.61 1.23 -0.87 0.00 0.00 176.83 178.99 3k7r h GLY 20 N 0.98 1.31 1.09 -0.77 0.00 -1.24 0.24 103.07 104.68 3k7r h GLY 20 Ca -0.03 -0.49 -0.14 0.00 0.00 0.00 0.00 47.33 46.67 3k7r h GLY 20 CO 0.14 0.48 -0.27 0.00 0.00 0.00 0.00 176.54 176.89 3k7r h ALA 21 N 1.34 0.60 -0.14 3.60 0.00 -1.09 0.15 119.26 123.72 3k7r h ALA 21 Ca 0.34 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 3k7r h ALA 21 Cb -0.14 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 3k7r h ALA 21 CO -0.07 0.62 0.08 0.28 0.00 0.00 0.00 179.25 180.16 3k7r h VAL 22 N 0.76 1.08 -0.76 0.00 2.07 -1.21 -2.45 116.25 115.74 3k7r h VAL 22 Ca 0.09 -0.20 0.14 0.00 0.82 0.00 0.00 66.70 67.54 3k7r h VAL 22 Cb 0.85 0.96 -0.09 0.00 -1.52 0.00 0.00 31.29 31.48 3k7r h VAL 22 CO 0.07 0.07 0.32 -1.13 0.02 0.00 0.00 177.57 176.93 3k7r h ASN 23 N 0.15 0.32 -0.42 0.57 -1.24 -0.28 -2.39 115.58 112.29 3k7r h ASN 23 Ca 0.05 0.10 -0.02 0.00 0.71 0.00 0.00 56.30 57.14 3k7r h ASN 23 Cb 0.04 0.07 -0.02 0.00 0.73 0.00 0.00 38.32 39.15 3k7r h ASN 23 CO -0.01 0.13 0.18 0.50 -1.29 0.00 0.00 177.43 176.94 3k7r h LYS 24 N 0.47 0.61 0.00 6.67 3.64 -0.43 0.12 116.57 127.66 3k7r h LYS 24 Ca 0.41 -0.10 -0.15 0.00 -1.27 0.00 0.00 60.65 59.54 3k7r h LYS 24 Cb 0.61 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.30 3k7r h LYS 24 CO -0.39 0.55 -0.70 -0.39 -2.27 0.00 0.00 179.45 176.25 3k7r h VAL 25 N 0.53 1.30 -0.20 2.00 -1.51 -1.28 -2.83 116.25 114.27 3k7r h VAL 25 Ca 0.14 -2.59 -0.18 0.00 -1.23 0.00 0.00 66.70 62.85 3k7r h VAL 25 Cb 0.16 2.48 -0.00 0.00 -2.13 0.00 0.00 31.29 31.79 3k7r h VAL 25 CO -0.01 0.69 -0.59 -0.07 -1.23 0.00 0.00 177.57 176.36 3k7r h LEU 26 N 0.00 0.74 -1.24 4.19 3.38 -1.11 -3.26 115.31 118.00 3k7r h LEU 26 Ca -0.01 -0.41 -0.08 0.00 0.09 0.00 0.00 57.88 57.47 3k7r h LEU 26 Cb 1.42 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 3k7r h LEU 26 CO 0.09 1.16 -0.33 0.74 0.09 0.00 0.00 178.44 180.20 3k7r h THR 27 N 0.50 1.25 0.00 0.22 2.02 -0.67 -1.17 112.91 115.06 3k7r h THR 27 Ca 0.00 -1.20 0.00 0.00 0.77 0.00 0.00 66.41 65.98 3k7r h THR 27 Cb 1.16 1.59 0.00 0.00 -1.74 0.00 0.00 68.15 69.16 3k7r h THR 27 CO 0.12 0.35 0.00 0.11 0.37 0.00 0.00 175.52 176.47 3k7r h LYS 28 N 0.08 0.00 -0.14 6.66 1.57 -1.55 -3.02 116.57 120.18 3k7r h LYS 28 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3k7r h LYS 28 Cb 0.62 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.93 3k7r h LYS 28 CO 0.05 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.21 3k7r n LEU 29 N -2.34 2.75 -4.77 2.94 4.77 -0.44 -4.96 117.00 114.95 3k7r n LEU 29 Ca -0.01 -1.21 -0.35 0.00 -0.03 0.00 0.00 56.01 54.42 3k7r n LEU 29 Cb 0.06 -0.08 0.02 0.00 -2.33 0.00 0.00 43.42 41.09 3k7r n LEU 29 CO 0.12 0.53 0.78 -1.61 -1.33 0.00 0.00 177.39 175.88 3k7r s GLU 30 N -1.44 3.17 0.00 3.23 2.02 -1.14 -1.84 118.70 122.70 3k7r s GLU 30 Ca 0.25 1.57 0.30 0.00 0.02 0.00 0.00 54.97 57.12 3k7r s GLU 30 Cb 0.16 -1.98 1.51 0.00 0.10 0.00 0.00 34.13 33.92 3k7r s GLU 30 CO 0.24 -0.99 2.01 -0.35 0.02 0.00 0.00 175.26 176.19 3k7r n PRO 31 N -1.62 1.28 -0.23 0.39 -0.04 -1.26 -4.82 135.00 128.69 3k7r n PRO 31 Ca 0.11 -0.43 -0.06 0.00 -0.04 0.00 0.00 63.50 63.09 3k7r n PRO 31 Cb 0.51 -1.49 0.04 0.00 -0.04 0.00 0.00 33.50 32.52 3k7r n PRO 31 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 3k7r h ASP 32 N 1.04 0.81 -3.29 3.54 3.32 -1.80 -3.25 116.42 116.80 3k7r h ASP 32 Ca 0.00 -0.09 -0.58 0.00 0.02 0.00 0.00 57.03 56.38 3k7r h ASP 32 Cb 0.23 -0.21 -0.07 0.00 0.22 0.00 0.00 39.33 39.50 3k7r h ASP 32 CO 0.00 0.67 0.74 -0.69 -1.72 0.00 0.00 179.24 178.24 3k7r s VAL 33 N -5.87 4.60 -0.06 -1.35 1.01 -0.77 -2.57 120.40 115.39 3k7r s VAL 33 Ca -0.13 1.68 0.19 0.00 0.00 0.00 0.00 61.98 63.72 3k7r s VAL 33 Cb 0.14 -4.34 -0.28 0.00 0.00 0.00 0.00 36.38 31.89 3k7r s VAL 33 CO 0.78 -0.37 0.42 -1.54 0.00 0.00 0.00 175.10 174.39 3k7r n SER 34 N 6.63 0.78 -3.75 3.32 3.41 -0.25 -4.10 113.62 119.66 3k7r n SER 34 Ca 0.10 -0.04 -0.12 0.00 -0.26 0.00 0.00 58.87 58.55 3k7r n SER 34 Cb 0.47 1.81 -0.11 0.00 -0.26 0.00 0.00 64.21 66.12 3k7r n SER 34 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 3k7r s LYS 35 N -3.26 0.35 -0.11 4.33 2.20 -1.17 -5.01 119.74 117.06 3k7r s LYS 35 Ca -0.06 0.51 0.02 0.00 -0.36 0.00 0.00 55.97 56.08 3k7r s LYS 35 Cb 0.12 0.09 0.01 0.00 -1.51 0.00 0.00 37.83 36.55 3k7r s LYS 35 CO 0.77 -0.08 -0.17 0.42 -0.36 0.00 0.00 175.35 175.92 3k7r s ILE 36 N 0.56 1.67 -0.26 5.43 1.01 -1.26 -1.41 121.20 126.94 3k7r s ILE 36 Ca -0.03 -0.75 -0.00 0.00 0.00 0.00 0.00 60.65 59.87 3k7r s ILE 36 Cb -0.05 -1.50 0.08 0.00 0.01 0.00 0.00 42.46 41.00 3k7r s ILE 36 CO -0.03 0.47 0.03 -0.62 0.00 0.00 0.00 174.94 174.79 3k7r s ASP 37 N 0.89 3.82 -0.21 3.58 2.15 -0.29 -4.99 116.67 121.60 3k7r s ASP 37 Ca -0.08 -1.37 -0.05 0.00 0.43 0.00 0.00 52.55 51.48 3k7r s ASP 37 Cb -0.15 -0.99 -0.02 0.00 -0.30 0.00 0.00 42.92 41.46 3k7r s ASP 37 CO -0.01 -0.33 0.01 -0.63 -0.17 0.00 0.00 175.17 174.04 3k7r s ILE 38 N 1.52 3.93 -0.41 4.11 1.01 -1.26 0.21 121.20 130.31 3k7r s ILE 38 Ca 0.03 -0.31 -0.09 0.00 0.00 0.00 0.00 60.65 60.27 3k7r s ILE 38 Cb -0.18 -2.79 0.07 0.00 0.01 0.00 0.00 42.46 39.57 3k7r s ILE 38 CO -0.14 0.41 0.25 -0.55 0.00 0.00 0.00 174.94 174.91 3k7r s SER 39 N 1.22 5.65 0.18 3.58 0.15 0.72 -4.97 113.70 120.23 3k7r s SER 39 Ca 0.03 -1.45 -0.13 0.00 0.70 0.00 0.00 55.95 55.11 3k7r s SER 39 Cb -0.15 -1.99 0.11 0.00 -1.71 0.00 0.00 66.02 62.28 3k7r s SER 39 CO 0.01 -0.52 1.82 0.25 1.20 0.00 0.00 173.24 176.00 3k7r h LEU 40 N 8.41 0.54 -0.75 3.45 6.46 -1.95 -0.28 115.31 131.20 3k7r h LEU 40 Ca -0.23 0.00 -0.08 0.00 -0.12 0.00 0.00 57.88 57.44 3k7r h LEU 40 Cb 1.09 -0.12 -0.02 0.00 -0.73 0.00 0.00 40.66 40.88 3k7r h LEU 40 CO 0.75 0.38 0.02 -0.33 -0.62 0.00 0.00 178.44 178.65 3k7r h GLU 41 N 0.66 0.98 -0.01 1.25 3.07 -1.93 -2.51 114.58 116.08 3k7r h GLU 41 Ca 0.22 -0.28 0.00 0.00 -0.50 0.00 0.00 59.36 58.79 3k7r h GLU 41 Cb 0.01 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 27.81 3k7r h GLU 41 CO -0.09 0.95 -0.22 1.63 -1.40 0.00 0.00 179.01 179.88 3k7r n LYS 42 N -4.20 1.32 -3.72 2.33 5.02 -1.21 -4.95 118.16 112.76 3k7r n LYS 42 Ca 0.03 -0.92 -0.25 0.00 -2.02 0.00 0.00 58.31 55.15 3k7r n LYS 42 Cb 0.32 -1.48 0.05 0.00 -0.02 0.00 0.00 35.03 33.90 3k7r n LYS 42 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 3k7r n GLN 43 N -0.03 -6.44 -4.71 1.97 6.02 -0.18 -4.96 117.38 109.04 3k7r n GLN 43 Ca 0.13 0.71 -0.26 0.00 -0.01 0.00 0.00 57.00 57.57 3k7r n GLN 43 Cb 0.41 -5.63 -0.14 0.00 1.02 0.00 0.00 30.24 25.90 3k7r n GLN 43 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3k7r s LEU 44 N -7.11 2.16 -0.15 1.08 1.43 -0.78 -1.67 118.68 113.63 3k7r s LEU 44 Ca 0.47 -0.52 -0.01 0.00 -1.03 0.00 0.00 54.13 53.04 3k7r s LEU 44 Cb -0.22 -1.02 0.04 0.00 0.03 0.00 0.00 46.19 45.01 3k7r s LEU 44 CO 0.78 0.18 -0.06 -0.69 0.23 0.00 0.00 176.35 176.79 3k7r s VAL 45 N -0.77 1.07 -0.20 -1.59 1.01 0.04 -0.20 120.40 119.75 3k7r s VAL 45 Ca 0.08 -0.51 -0.09 0.00 0.00 0.00 0.00 61.98 61.46 3k7r s VAL 45 Cb -0.09 -1.20 -0.05 0.00 0.00 0.00 0.00 36.38 35.05 3k7r s VAL 45 CO 0.02 0.20 0.10 -1.81 0.00 0.00 0.00 175.10 173.61 3k7r s ASP 46 N 1.66 5.90 -0.06 3.32 1.01 0.13 0.55 116.67 129.19 3k7r s ASP 46 Ca 0.02 0.14 0.04 0.00 0.71 0.00 0.00 52.55 53.46 3k7r s ASP 46 Cb -0.14 -2.03 0.00 0.00 1.01 0.00 0.00 42.92 41.76 3k7r s ASP 46 CO -0.08 0.16 -0.17 -0.69 0.21 0.00 0.00 175.17 174.61 3k7r s VAL 47 N 0.45 1.43 -0.19 -1.27 1.01 0.19 -1.14 120.40 120.87 3k7r s VAL 47 Ca 0.06 -0.69 -0.01 0.00 0.00 0.00 0.00 61.98 61.34 3k7r s VAL 47 Cb -0.12 -1.24 0.00 0.00 0.00 0.00 0.00 36.38 35.02 3k7r s VAL 47 CO -0.00 0.41 -0.12 -0.31 0.00 0.00 0.00 175.10 175.08 3k7r s TYR 48 N 0.26 2.86 0.03 5.22 1.51 -0.50 -0.24 117.35 126.50 3k7r s TYR 48 Ca -0.09 -1.21 -0.27 0.00 -1.01 0.00 0.00 57.07 54.49 3k7r s TYR 48 Cb -0.14 -2.00 0.08 0.00 -0.11 0.00 0.00 41.96 39.79 3k7r s TYR 48 CO 0.04 -0.63 0.69 -0.08 -1.11 0.00 0.00 175.55 174.46 3k7r s THR 49 N 1.29 0.00 -1.05 -0.71 -1.32 0.21 -1.09 115.64 112.96 3k7r s THR 49 Ca 0.04 0.00 0.27 0.00 -1.21 0.00 0.00 61.69 60.79 3k7r s THR 49 Cb -0.14 -1.00 0.16 0.00 -1.51 0.00 0.00 72.50 70.01 3k7r s THR 49 CO -0.06 0.00 1.72 0.35 -2.21 0.00 0.00 174.62 174.41 3k7r n THR 50 N 0.23 0.00 -2.73 5.08 -2.24 -1.06 -0.10 114.28 113.45 3k7r n THR 50 Ca -0.16 -0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.30 3k7r n THR 50 Cb 0.61 -0.17 -0.03 0.00 -2.10 0.00 0.00 70.33 68.64 3k7r n THR 50 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3k7r s LEU 51 N -2.96 3.78 0.61 3.22 1.43 -1.26 -4.89 118.68 118.61 3k7r s LEU 51 Ca 0.14 1.27 -0.17 0.00 -1.03 0.00 0.00 54.13 54.34 3k7r s LEU 51 Cb 0.18 -4.16 -0.03 0.00 0.03 0.00 0.00 46.19 42.21 3k7r s LEU 51 CO 0.60 -0.44 1.10 -2.84 0.23 0.00 0.00 176.35 175.00 3k7r s PRO 52 N -3.87 3.07 0.20 1.29 0.02 -1.26 -4.89 135.00 129.57 3k7r s PRO 52 Ca 0.54 1.42 -0.13 0.00 0.02 0.00 0.00 61.00 62.85 3k7r s PRO 52 Cb -0.10 -1.98 0.23 0.00 0.02 0.00 0.00 34.50 32.66 3k7r s PRO 52 CO 0.30 -1.04 1.67 -0.92 -0.33 0.00 0.00 177.00 176.68 3k7r h TYR 53 N 0.48 -0.09 -0.08 6.54 3.20 -1.98 -2.58 116.97 122.46 3k7r h TYR 53 Ca -0.48 0.04 -0.09 0.00 3.14 0.00 0.00 58.73 61.35 3k7r h TYR 53 Cb 1.25 0.13 -0.01 0.00 1.54 0.00 0.00 36.73 39.63 3k7r h TYR 53 CO 0.54 -0.16 -0.36 -0.44 -1.64 0.00 0.00 178.16 176.10 3k7r h ASP 54 N 0.09 0.16 -0.01 -2.11 3.45 -1.99 0.36 116.42 116.37 3k7r h ASP 54 Ca 0.28 -0.06 -0.00 0.00 0.43 0.00 0.00 57.03 57.68 3k7r h ASP 54 Cb 0.44 -0.04 -0.00 0.00 -0.56 0.00 0.00 39.33 39.17 3k7r h ASP 54 CO -0.49 0.52 0.00 0.15 -1.57 0.00 0.00 179.24 177.85 3k7r h PHE 55 N 0.14 0.01 -0.64 4.55 3.57 -1.86 -1.76 116.94 120.95 3k7r h PHE 55 Ca 0.02 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.48 3k7r h PHE 55 Cb 0.71 -0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.42 3k7r h PHE 55 CO 0.01 0.12 0.25 0.82 -2.23 0.00 0.00 178.31 177.28 3k7r h ILE 56 N -0.10 1.24 -0.24 1.41 1.08 -1.02 -2.09 117.51 117.78 3k7r h ILE 56 Ca 0.00 -0.74 0.04 0.00 -0.39 0.00 0.00 64.86 63.77 3k7r h ILE 56 Cb 0.11 0.52 -0.04 0.00 -3.07 0.00 0.00 36.82 34.34 3k7r h ILE 56 CO -0.00 0.29 -0.03 0.25 -0.69 0.00 0.00 178.15 177.97 3k7r h LEU 57 N 0.90 -0.15 -0.39 1.44 5.85 -0.81 -1.26 115.31 120.90 3k7r h LEU 57 Ca 0.21 0.06 -0.03 0.00 0.84 0.00 0.00 57.88 58.97 3k7r h LEU 57 Cb 0.21 0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.34 3k7r h LEU 57 CO -0.02 -0.05 0.14 -0.08 -0.34 0.00 0.00 178.44 178.10 3k7r h GLU 58 N 0.04 0.58 -0.75 1.25 4.57 -1.12 0.41 114.58 119.57 3k7r h GLU 58 Ca 0.12 -0.11 0.12 0.00 -1.18 0.00 0.00 59.36 58.30 3k7r h GLU 58 Cb 0.16 -0.09 -0.08 0.00 -0.16 0.00 0.00 28.75 28.58 3k7r h GLU 58 CO -0.22 0.57 0.35 0.87 -1.18 0.00 0.00 179.01 179.40 3k7r h LYS 59 N 0.48 0.53 -0.42 1.92 1.79 -1.13 0.64 116.57 120.37 3k7r h LYS 59 Ca 0.13 -0.03 -0.10 0.00 -2.18 0.00 0.00 60.65 58.47 3k7r h LYS 59 Cb 0.21 -0.12 -0.01 0.00 -1.58 0.00 0.00 32.23 30.73 3k7r h LYS 59 CO -0.01 0.35 -0.11 0.82 -1.08 0.00 0.00 179.45 179.42 3k7r h ILE 60 N 0.55 1.27 -0.65 1.86 2.04 -0.66 -2.90 117.51 119.02 3k7r h ILE 60 Ca 0.39 -1.22 -0.00 0.00 1.00 0.00 0.00 64.86 65.03 3k7r h ILE 60 Cb 0.50 1.19 -0.03 0.00 -0.74 0.00 0.00 36.82 37.74 3k7r h ILE 60 CO -0.33 0.41 0.39 0.11 0.00 0.00 0.00 178.15 178.73 3k7r h LYS 61 N 0.64 0.88 -1.10 2.37 1.57 -0.59 -1.74 116.57 118.60 3k7r h LYS 61 Ca 0.11 -0.08 0.32 0.00 -1.87 0.00 0.00 60.65 59.13 3k7r h LYS 61 Cb 0.65 -0.19 -0.04 0.00 0.08 0.00 0.00 32.23 32.73 3k7r h LYS 61 CO 0.04 0.62 0.83 0.87 -0.57 0.00 0.00 179.45 181.24 3k7r h LYS 62 N 0.90 0.00 0.00 3.15 1.57 -0.66 0.28 116.57 121.81 3k7r h LYS 62 Ca 0.23 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 3k7r h LYS 62 Cb -0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.28 3k7r h LYS 62 CO -0.04 0.00 0.00 1.79 -0.57 0.00 0.00 179.45 180.63 3k7r h THR 63 N 0.00 0.00 0.00 -0.16 1.35 -1.41 -3.46 112.91 109.23 3k7r h THR 63 Ca 0.52 -0.32 0.00 0.00 -0.55 0.00 0.00 66.41 66.06 3k7r h THR 63 Cb 2.18 1.13 0.00 0.00 -1.73 0.00 0.00 68.15 69.73 3k7r h THR 63 CO -0.01 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.87 3k7r n GLY 64 N 0.13 1.13 3.77 5.82 0.00 0.99 -5.05 105.19 111.98 3k7r n GLY 64 Ca 0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 3k7r n GLY 64 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3k7r s LYS 65 N -0.57 3.73 0.15 1.61 -0.14 -1.26 -5.01 119.74 118.25 3k7r s LYS 65 Ca 0.00 1.69 -0.30 0.00 -1.36 0.00 0.00 55.97 56.00 3k7r s LYS 65 Cb 0.00 -2.33 -0.07 0.00 -1.68 0.00 0.00 37.83 33.76 3k7r s LYS 65 CO 0.00 -0.55 0.99 -2.00 -0.76 0.00 0.00 175.35 173.03 3k7r s GLU 66 N -2.82 4.70 -0.24 1.68 2.12 -1.26 -4.69 118.70 118.19 3k7r s GLU 66 Ca 0.65 1.53 -0.07 0.00 0.36 0.00 0.00 54.97 57.44 3k7r s GLU 66 Cb -0.26 -3.34 -0.02 0.00 0.26 0.00 0.00 34.13 30.77 3k7r s GLU 66 CO 0.31 0.23 0.04 0.08 -0.54 0.00 0.00 175.26 175.39 3k7r s VAL 67 N -0.26 4.12 0.56 3.70 1.01 -1.26 -0.18 120.40 128.09 3k7r s VAL 67 Ca 0.47 -0.24 0.06 0.00 0.00 0.00 0.00 61.98 62.27 3k7r s VAL 67 Cb -0.25 -2.91 0.10 0.00 0.00 0.00 0.00 36.38 33.31 3k7r s VAL 67 CO 0.31 0.36 0.77 0.54 0.00 0.00 0.00 175.10 177.09 3k7r n ARG 68 N 4.84 0.45 0.00 2.72 1.74 0.11 -5.01 116.66 121.51 3k7r n ARG 68 Ca -0.17 -2.69 0.16 0.00 -0.77 0.00 0.00 57.85 54.39 3k7r n ARG 68 Cb 0.51 -0.33 0.88 0.00 -1.02 0.00 0.00 32.46 32.51 3k7r n ARG 68 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54