#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 4.15 -0.19 0.00 2.12 -1.26 -5.02 118.70 118.50 3k7r s GLU 3 Ca 0.00 2.51 -0.11 0.00 0.36 0.00 0.00 54.97 57.73 3k7r s GLU 3 Cb 0.00 -2.99 -0.05 0.00 0.26 0.00 0.00 34.13 31.35 3k7r s GLU 3 CO 0.00 -0.48 0.17 0.42 -0.54 0.00 0.00 175.26 174.84 3k7r s ILE 4 N -1.06 5.38 0.12 -3.70 1.01 -1.26 -4.29 121.20 117.40 3k7r s ILE 4 Ca 0.53 0.28 0.08 0.00 0.00 0.00 0.00 60.65 61.54 3k7r s ILE 4 Cb -0.45 -3.51 -0.04 0.00 0.01 0.00 0.00 42.46 38.46 3k7r s ILE 4 CO 0.60 0.42 -0.20 -0.54 0.00 0.00 0.00 174.94 175.22 3k7r s LYS 5 N 0.46 1.17 -0.34 2.79 1.02 0.18 -4.94 119.74 120.08 3k7r s LYS 5 Ca 0.10 -1.24 -0.00 0.00 0.02 0.00 0.00 55.97 54.85 3k7r s LYS 5 Cb -0.12 -1.35 0.08 0.00 -0.52 0.00 0.00 37.83 35.92 3k7r s LYS 5 CO 0.00 0.30 0.07 -1.58 -0.92 0.00 0.00 175.35 173.22 3k7r s HIS 6 N -1.48 3.50 0.24 3.18 5.65 -1.26 -0.39 115.29 124.73 3k7r s HIS 6 Ca 0.09 -2.38 0.05 0.00 0.25 0.00 0.00 55.06 53.08 3k7r s HIS 6 Cb -0.08 -2.66 -0.03 0.00 -1.18 0.00 0.00 32.58 28.63 3k7r s HIS 6 CO 0.05 -0.90 0.35 0.71 -0.65 0.00 0.00 174.74 174.29 3k7r s TYR 7 N 1.11 3.40 -0.12 3.88 2.02 0.32 0.08 117.35 128.05 3k7r s TYR 7 Ca 0.03 -0.04 -0.05 0.00 -0.37 0.00 0.00 57.07 56.64 3k7r s TYR 7 Cb -0.21 -1.57 0.05 0.00 -0.40 0.00 0.00 41.96 39.84 3k7r s TYR 7 CO -0.04 0.43 0.25 -1.14 -1.57 0.00 0.00 175.55 173.48 3k7r s GLN 8 N -3.97 0.17 0.22 -0.62 0.74 -0.80 -0.48 119.66 114.93 3k7r s GLN 8 Ca 0.34 0.63 0.08 0.00 0.05 0.00 0.00 55.36 56.46 3k7r s GLN 8 Cb -0.09 -0.09 -0.04 0.00 1.10 0.00 0.00 33.01 33.90 3k7r s GLN 8 CO 0.29 -0.22 0.07 -0.06 -0.55 0.00 0.00 175.29 174.81 3k7r s PHE 9 N 1.82 2.91 -0.38 1.67 0.08 -0.10 -0.98 117.98 123.01 3k7r s PHE 9 Ca -0.04 -0.14 -0.07 0.00 0.12 0.00 0.00 56.93 56.80 3k7r s PHE 9 Cb -0.11 -1.35 0.06 0.00 -0.57 0.00 0.00 43.02 41.05 3k7r s PHE 9 CO -0.08 0.55 0.17 1.21 -0.10 0.00 0.00 175.22 176.97 3k7r s ASN 10 N -3.41 5.45 -0.09 1.36 3.84 -0.06 -2.24 114.94 119.79 3k7r s ASN 10 Ca 0.30 -1.35 0.03 0.00 0.21 0.00 0.00 52.86 52.06 3k7r s ASN 10 Cb -0.08 -1.91 -0.01 0.00 -0.55 0.00 0.00 41.25 38.69 3k7r s ASN 10 CO 0.21 -0.43 -0.18 -0.69 -2.79 0.00 0.00 177.10 173.23 3k7r s VAL 11 N 1.39 2.68 -1.04 -5.21 1.01 -0.69 -0.77 120.40 117.77 3k7r s VAL 11 Ca 0.01 -0.82 -0.23 0.00 0.00 0.00 0.00 61.98 60.94 3k7r s VAL 11 Cb -0.21 -2.06 0.04 0.00 0.00 0.00 0.00 36.38 34.15 3k7r s VAL 11 CO 0.02 0.56 1.55 -0.69 0.00 0.00 0.00 175.10 176.54 3k7r s VAL 12 N -0.01 3.88 -0.20 2.92 1.01 0.57 -4.70 120.40 123.87 3k7r s VAL 12 Ca -0.05 -0.85 -0.02 0.00 0.00 0.00 0.00 61.98 61.06 3k7r s VAL 12 Cb -0.15 -4.95 0.00 0.00 0.00 0.00 0.00 36.38 31.29 3k7r s VAL 12 CO 0.05 -1.82 -0.12 -0.04 0.00 0.00 0.00 175.10 173.17 3k7r s MET 13 N 5.15 3.20 -0.20 2.72 -1.94 -1.26 -4.28 119.30 122.69 3k7r s MET 13 Ca 0.50 -0.72 -0.01 0.00 -1.71 0.00 0.00 55.69 53.75 3k7r s MET 13 Cb -0.00 -2.80 -0.12 0.00 2.01 0.00 0.00 34.83 33.91 3k7r s MET 13 CO -0.06 -0.20 -0.20 2.41 -0.01 0.00 0.00 175.02 176.96 3k7r n THR 14 N 4.71 1.14 -4.51 2.05 -1.04 -1.26 -4.85 114.28 110.52 3k7r n THR 14 Ca -0.19 -0.40 -0.25 0.00 -2.04 0.00 0.00 64.05 61.16 3k7r n THR 14 Cb 0.50 -1.33 -0.07 0.00 -1.82 0.00 0.00 70.33 67.61 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 1.47 0.00 -0.34 0.00 4.64 -1.99 -1.25 113.55 116.08 3k7r h SER 16 Ca -0.31 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.96 3k7r h SER 16 Cb 1.15 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.23 3k7r h SER 16 CO 0.50 0.00 0.04 1.23 -0.87 0.00 0.00 176.83 177.73 3k7r h GLY 17 N 1.44 0.61 0.65 -0.77 0.00 -1.98 -0.59 103.07 102.43 3k7r h GLY 17 Ca 0.00 -0.42 0.06 0.00 0.00 0.00 0.00 47.33 46.97 3k7r h GLY 17 CO 0.00 0.39 0.37 0.00 0.00 0.00 0.00 176.54 177.30 3k7r h SER 19 N 0.68 0.48 -0.25 0.00 4.64 -1.46 -2.81 113.55 114.84 3k7r h SER 19 Ca 0.31 -0.50 -0.04 0.00 -0.47 0.00 0.00 61.79 61.09 3k7r h SER 19 Cb 0.21 -0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 62.13 3k7r h SER 19 CO -0.19 1.39 0.04 1.23 -0.87 0.00 0.00 176.83 178.42 3k7r h GLY 20 N 1.40 0.54 0.91 -0.77 0.00 -0.82 -0.64 103.07 103.71 3k7r h GLY 20 Ca -0.14 -0.30 -0.09 0.00 0.00 0.00 0.00 47.33 46.80 3k7r h GLY 20 CO 0.21 0.28 -0.18 0.00 0.00 0.00 0.00 176.54 176.85 3k7r h ALA 21 N 1.56 0.41 -0.71 3.60 0.00 -0.62 -1.43 119.26 122.07 3k7r h ALA 21 Ca 0.11 -0.35 0.02 0.00 0.00 0.00 0.00 54.91 54.69 3k7r h ALA 21 Cb 0.26 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 3k7r h ALA 21 CO 0.00 0.33 0.46 0.28 0.00 0.00 0.00 179.25 180.32 3k7r h VAL 22 N 0.37 1.15 -0.37 0.00 2.07 -1.34 -2.89 116.25 115.24 3k7r h VAL 22 Ca 0.06 -0.32 0.04 0.00 0.82 0.00 0.00 66.70 67.30 3k7r h VAL 22 Cb 0.71 0.14 -0.04 0.00 -1.52 0.00 0.00 31.29 30.58 3k7r h VAL 22 CO 0.05 0.17 0.13 -1.13 0.02 0.00 0.00 177.57 176.81 3k7r h ASN 23 N 0.93 0.14 -0.92 0.57 -1.24 -0.89 -2.59 115.58 111.58 3k7r h ASN 23 Ca 0.27 0.04 -0.00 0.00 0.71 0.00 0.00 56.30 57.32 3k7r h ASN 23 Cb -0.07 0.03 -0.04 0.00 0.73 0.00 0.00 38.32 38.97 3k7r h ASN 23 CO -0.07 0.12 0.57 0.50 -1.29 0.00 0.00 177.43 177.25 3k7r h LYS 24 N 0.28 1.25 -0.01 6.67 1.63 -1.06 0.13 116.57 125.47 3k7r h LYS 24 Ca 0.17 -0.10 -0.20 0.00 -0.85 0.00 0.00 60.65 59.67 3k7r h LYS 24 Cb 0.15 -0.27 -0.01 0.00 -0.60 0.00 0.00 32.23 31.50 3k7r h LYS 24 CO -0.17 0.86 -0.86 -0.39 -3.45 0.00 0.00 179.45 175.44 3k7r h VAL 25 N 1.27 1.46 -0.19 2.00 -1.51 -1.41 -2.84 116.25 115.03 3k7r h VAL 25 Ca 0.33 -2.51 -0.16 0.00 -1.23 0.00 0.00 66.70 63.14 3k7r h VAL 25 Cb -0.08 2.40 -0.01 0.00 -2.13 0.00 0.00 31.29 31.47 3k7r h VAL 25 CO -0.07 0.74 -0.54 -0.07 -1.23 0.00 0.00 177.57 176.40 3k7r h LEU 26 N 0.15 0.60 -1.02 4.19 3.38 -1.01 -3.18 115.31 118.42 3k7r h LEU 26 Ca -0.05 -0.32 -0.02 0.00 0.09 0.00 0.00 57.88 57.58 3k7r h LEU 26 Cb 1.48 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 42.02 3k7r h LEU 26 CO 0.14 1.02 0.40 0.74 0.09 0.00 0.00 178.44 180.83 3k7r h THR 27 N 0.42 1.24 -0.05 0.22 2.02 -0.73 -2.42 112.91 113.61 3k7r h THR 27 Ca 0.01 -0.62 0.01 0.00 0.77 0.00 0.00 66.41 66.58 3k7r h THR 27 Cb 1.08 0.21 -0.00 0.00 -1.74 0.00 0.00 68.15 67.69 3k7r h THR 27 CO 0.10 0.27 0.05 0.11 0.37 0.00 0.00 175.52 176.43 3k7r h LYS 28 N 1.09 0.00 0.00 6.66 1.57 -1.48 -1.89 116.57 122.53 3k7r h LYS 28 Ca 0.27 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.05 3k7r h LYS 28 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 3k7r h LYS 28 CO -0.04 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.12 3k7r n LEU 29 N -3.86 0.66 -4.75 2.94 4.77 -0.91 -4.86 117.00 110.99 3k7r n LEU 29 Ca -0.02 0.59 -0.42 0.00 -0.03 0.00 0.00 56.01 56.13 3k7r n LEU 29 Cb 0.14 -0.41 -0.01 0.00 -2.33 0.00 0.00 43.42 40.81 3k7r n LEU 29 CO 0.28 -0.27 1.18 -0.62 -1.33 0.00 0.00 177.39 176.62 3k7r n GLU 30 N -2.15 2.63 0.00 3.23 1.02 -0.71 -1.35 120.64 123.31 3k7r n GLU 30 Ca 0.05 0.93 0.13 0.00 -0.02 0.00 0.00 57.16 58.25 3k7r n GLU 30 Cb 0.36 -2.68 0.42 0.00 -0.02 0.00 0.00 31.44 29.52 3k7r n GLU 30 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 3k7r n PRO 31 N 1.47 1.26 0.22 3.49 -0.04 -1.26 -4.87 135.00 135.28 3k7r n PRO 31 Ca 0.06 -0.76 0.10 0.00 -0.04 0.00 0.00 63.50 62.85 3k7r n PRO 31 Cb 0.37 -1.48 0.47 0.00 -0.04 0.00 0.00 33.50 32.82 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 1.86 0.00 -3.51 3.54 3.32 -1.62 -3.28 116.42 116.73 3k7r h ASP 32 Ca 0.00 0.00 -0.61 0.00 0.02 0.00 0.00 57.03 56.44 3k7r h ASP 32 Cb 0.53 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 39.96 3k7r h ASP 32 CO 0.00 0.23 0.03 -0.69 -1.72 0.00 0.00 179.24 177.09 3k7r s VAL 33 N -3.71 5.06 -0.11 -1.35 1.01 -1.04 -1.93 120.40 118.33 3k7r s VAL 33 Ca 0.00 0.98 0.17 0.00 0.00 0.00 0.00 61.98 63.13 3k7r s VAL 33 Cb 0.11 -3.86 -0.18 0.00 0.00 0.00 0.00 36.38 32.44 3k7r s VAL 33 CO 0.64 0.10 0.68 -1.54 0.00 0.00 0.00 175.10 174.98 3k7r n SER 34 N 5.31 0.69 -3.70 3.32 3.41 -0.03 -4.06 113.62 118.56 3k7r n SER 34 Ca -0.03 0.31 -0.12 0.00 -0.26 0.00 0.00 58.87 58.77 3k7r n SER 34 Cb 0.50 0.35 -0.10 0.00 -0.26 0.00 0.00 64.21 64.70 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 -2.86 0.49 -0.10 4.33 2.20 -1.20 -5.01 119.74 117.60 3k7r s LYS 35 Ca -0.04 0.74 0.02 0.00 -0.36 0.00 0.00 55.97 56.33 3k7r s LYS 35 Cb 0.09 0.14 0.01 0.00 -1.51 0.00 0.00 37.83 36.55 3k7r s LYS 35 CO 0.82 -0.11 -0.15 0.42 -0.36 0.00 0.00 175.35 175.97 3k7r s ILE 36 N 0.82 1.46 -0.23 5.43 1.01 -1.26 -1.24 121.20 127.20 3k7r s ILE 36 Ca -0.05 -0.63 0.02 0.00 0.00 0.00 0.00 60.65 59.99 3k7r s ILE 36 Cb -0.05 -1.33 0.05 0.00 0.01 0.00 0.00 42.46 41.13 3k7r s ILE 36 CO -0.06 0.43 -0.10 -1.81 0.00 0.00 0.00 174.94 173.40 3k7r s ASP 37 N 0.91 3.90 -0.12 3.58 1.01 -0.33 -5.00 116.67 120.61 3k7r s ASP 37 Ca -0.08 -1.15 -0.03 0.00 0.71 0.00 0.00 52.55 52.00 3k7r s ASP 37 Cb -0.15 -1.34 -0.03 0.00 1.01 0.00 0.00 42.92 42.40 3k7r s ASP 37 CO -0.00 -0.18 0.01 -0.63 0.21 0.00 0.00 175.17 174.58 3k7r s ILE 38 N 1.29 4.36 -0.28 0.77 1.01 -1.26 -0.67 121.20 126.41 3k7r s ILE 38 Ca -0.05 -0.22 0.01 0.00 0.00 0.00 0.00 60.65 60.39 3k7r s ILE 38 Cb -0.18 -2.87 0.08 0.00 0.01 0.00 0.00 42.46 39.50 3k7r s ILE 38 CO -0.07 0.56 0.02 -0.55 0.00 0.00 0.00 174.94 174.90 3k7r s SER 39 N -0.46 4.08 0.24 3.58 0.15 0.29 -4.97 113.70 116.61 3k7r s SER 39 Ca 0.08 -1.53 -0.06 0.00 0.70 0.00 0.00 55.95 55.15 3k7r s SER 39 Cb -0.12 -1.17 0.29 0.00 -1.71 0.00 0.00 66.02 63.31 3k7r s SER 39 CO 0.02 -0.32 1.89 0.25 1.20 0.00 0.00 173.24 176.27 3k7r h LEU 40 N 7.92 0.98 0.02 3.45 5.85 -1.96 -0.19 115.31 131.38 3k7r h LEU 40 Ca -0.13 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.59 3k7r h LEU 40 Cb 1.04 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.84 3k7r h LEU 40 CO 0.45 0.67 -0.08 -0.33 -0.34 0.00 0.00 178.44 178.81 3k7r h GLU 41 N 1.14 -0.14 -0.00 1.25 3.07 -1.93 -2.38 114.58 115.58 3k7r h GLU 41 Ca 0.37 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.24 3k7r h GLU 41 Cb 0.02 0.03 0.00 0.00 -0.84 0.00 0.00 28.75 27.96 3k7r h GLU 41 CO -0.12 -0.10 -0.21 1.63 -1.40 0.00 0.00 179.01 178.81 3k7r n LYS 42 N -5.20 0.40 -3.52 2.33 5.02 -1.14 -4.92 118.16 111.12 3k7r n LYS 42 Ca -0.06 -0.16 -0.26 0.00 -2.02 0.00 0.00 58.31 55.81 3k7r n LYS 42 Cb 0.13 -1.50 0.03 0.00 -0.02 0.00 0.00 35.03 33.67 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 -1.16 -5.19 -4.25 1.97 6.02 -0.10 -4.94 117.38 109.73 3k7r n GLN 43 Ca 0.10 0.68 -0.32 0.00 -0.01 0.00 0.00 57.00 57.45 3k7r n GLN 43 Cb 0.31 -5.54 -0.09 0.00 1.02 0.00 0.00 30.24 25.94 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 -6.95 3.46 -0.22 1.08 1.43 -1.08 -1.70 118.68 114.69 3k7r s LEU 44 Ca 0.50 -0.08 -0.02 0.00 -1.03 0.00 0.00 54.13 53.51 3k7r s LEU 44 Cb -0.25 -2.06 0.07 0.00 0.03 0.00 0.00 46.19 43.98 3k7r s LEU 44 CO 0.62 0.25 0.03 -0.69 0.23 0.00 0.00 176.35 176.79 3k7r s VAL 45 N -1.15 0.78 -0.05 -1.59 1.01 -0.95 -0.55 120.40 117.89 3k7r s VAL 45 Ca 0.21 -0.83 -0.16 0.00 0.00 0.00 0.00 61.98 61.20 3k7r s VAL 45 Cb -0.12 -1.29 -0.05 0.00 0.00 0.00 0.00 36.38 34.92 3k7r s VAL 45 CO 0.13 -0.27 0.43 -1.81 0.00 0.00 0.00 175.10 173.57 3k7r s ASP 46 N 1.73 6.74 -0.06 3.32 -0.00 0.15 -0.92 116.67 127.64 3k7r s ASP 46 Ca -0.00 0.88 0.02 0.00 -0.00 0.00 0.00 52.55 53.46 3k7r s ASP 46 Cb -0.17 -2.26 0.01 0.00 -0.00 0.00 0.00 42.92 40.49 3k7r s ASP 46 CO -0.11 0.19 -0.12 -0.69 -0.00 0.00 0.00 175.17 174.44 3k7r s VAL 47 N -0.34 1.08 -0.23 -1.27 1.01 0.37 -1.19 120.40 119.84 3k7r s VAL 47 Ca 0.24 -0.46 -0.06 0.00 0.00 0.00 0.00 61.98 61.70 3k7r s VAL 47 Cb -0.16 -0.99 -0.02 0.00 0.00 0.00 0.00 36.38 35.21 3k7r s VAL 47 CO 0.12 0.34 0.02 -0.31 0.00 0.00 0.00 175.10 175.27 3k7r s TYR 48 N 0.58 3.05 0.18 5.22 1.51 -0.37 -0.52 117.35 127.00 3k7r s TYR 48 Ca -0.12 -0.54 -0.21 0.00 -1.01 0.00 0.00 57.07 55.18 3k7r s TYR 48 Cb -0.15 -2.16 0.05 0.00 -0.11 0.00 0.00 41.96 39.60 3k7r s TYR 48 CO 0.03 -0.36 0.58 -0.08 -1.11 0.00 0.00 175.55 174.61 3k7r s THR 49 N 1.38 0.01 -1.37 -0.71 -1.32 0.48 -0.85 115.64 113.26 3k7r s THR 49 Ca 0.05 -0.32 0.22 0.00 -1.21 0.00 0.00 61.69 60.43 3k7r s THR 49 Cb -0.15 -1.23 -0.10 0.00 -1.51 0.00 0.00 72.50 69.51 3k7r s THR 49 CO 0.01 -0.06 1.06 0.35 -2.21 0.00 0.00 174.62 173.77 3k7r n THR 50 N -0.36 0.00 -2.25 5.08 -2.24 -0.81 0.50 114.28 114.20 3k7r n THR 50 Ca -0.14 -0.09 -0.29 0.00 -2.27 0.00 0.00 64.05 61.26 3k7r n THR 50 Cb 0.64 0.96 0.01 0.00 -2.10 0.00 0.00 70.33 69.83 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 -2.81 3.41 0.38 3.22 1.43 -1.26 -4.81 118.68 118.24 3k7r s LEU 51 Ca 0.13 1.15 -0.25 0.00 -1.03 0.00 0.00 54.13 54.13 3k7r s LEU 51 Cb 0.17 -4.14 -0.09 0.00 0.03 0.00 0.00 46.19 42.15 3k7r s LEU 51 CO 0.74 -0.75 1.05 -2.84 0.23 0.00 0.00 176.35 174.78 3k7r s PRO 52 N -4.97 4.25 0.28 1.29 0.02 -1.26 -4.90 135.00 129.71 3k7r s PRO 52 Ca 0.51 1.55 -0.03 0.00 0.02 0.00 0.00 61.00 63.06 3k7r s PRO 52 Cb -0.11 -2.65 0.60 0.00 0.02 0.00 0.00 34.50 32.36 3k7r s PRO 52 CO 0.49 -0.08 1.59 -0.92 -0.33 0.00 0.00 177.00 177.76 3k7r h TYR 53 N 2.72 -0.14 0.00 6.54 3.20 -1.99 0.30 116.97 127.60 3k7r h TYR 53 Ca -0.48 0.07 -0.10 0.00 3.14 0.00 0.00 58.73 61.36 3k7r h TYR 53 Cb 1.21 0.21 -0.01 0.00 1.54 0.00 0.00 36.73 39.68 3k7r h TYR 53 CO 0.58 -0.37 -0.50 -0.44 -1.64 0.00 0.00 178.16 175.79 3k7r h ASP 54 N 0.04 0.00 -0.20 -2.11 3.32 -1.99 -1.93 116.42 113.55 3k7r h ASP 54 Ca 0.52 0.00 -0.20 0.00 0.02 0.00 0.00 57.03 57.37 3k7r h ASP 54 Cb 0.98 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.54 3k7r h ASP 54 CO -0.87 0.50 -0.65 0.15 -1.72 0.00 0.00 179.24 176.66 3k7r h PHE 55 N 0.00 1.06 -0.01 4.55 3.57 -1.33 -1.84 116.94 122.94 3k7r h PHE 55 Ca -0.00 -0.42 -0.00 0.00 3.53 0.00 0.00 57.97 61.08 3k7r h PHE 55 Cb 0.92 -0.18 -0.00 0.00 2.79 0.00 0.00 35.95 39.48 3k7r h PHE 55 CO 0.00 1.24 0.00 0.82 -2.23 0.00 0.00 178.31 178.15 3k7r h ILE 56 N 0.60 1.20 -0.88 1.41 1.08 -1.20 -2.52 117.51 117.19 3k7r h ILE 56 Ca -0.01 -0.59 0.16 0.00 -0.39 0.00 0.00 64.86 64.03 3k7r h ILE 56 Cb 1.26 1.58 -0.16 0.00 -3.07 0.00 0.00 36.82 36.43 3k7r h ILE 56 CO 0.14 0.15 -0.28 -0.11 -0.69 0.00 0.00 178.15 177.37 3k7r n LEU 57 N -4.96 -0.43 -0.09 1.44 7.94 -0.74 -1.77 117.00 118.39 3k7r n LEU 57 Ca -0.08 1.53 -0.10 0.00 -1.11 0.00 0.00 56.01 56.25 3k7r n LEU 57 Cb 0.14 -0.41 -0.03 0.00 0.53 0.00 0.00 43.42 43.65 3k7r n LEU 57 CO 0.33 -1.43 0.83 -0.08 -1.11 0.00 0.00 177.39 175.94 3k7r h GLU 58 N 0.00 0.44 -0.65 1.96 4.81 -0.91 -2.09 114.58 118.13 3k7r h GLU 58 Ca 0.37 -0.11 0.04 0.00 -0.13 0.00 0.00 59.36 59.54 3k7r h GLU 58 Cb 0.59 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.88 3k7r h GLU 58 CO -0.90 0.53 0.43 0.87 -0.73 0.00 0.00 179.01 179.21 3k7r h LYS 59 N 0.27 0.71 0.14 1.92 1.79 -1.08 -0.74 116.57 119.57 3k7r h LYS 59 Ca 0.09 -0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 58.51 3k7r h LYS 59 Cb 0.29 -0.16 0.00 0.00 -1.58 0.00 0.00 32.23 30.78 3k7r h LYS 59 CO 0.00 0.47 -0.07 0.82 -1.08 0.00 0.00 179.45 179.59 3k7r h ILE 60 N 0.73 1.02 -0.33 1.86 2.04 -0.98 -3.15 117.51 118.70 3k7r h ILE 60 Ca 0.27 -1.00 0.00 0.00 1.00 0.00 0.00 64.86 65.13 3k7r h ILE 60 Cb 0.15 1.61 -0.02 0.00 -0.74 0.00 0.00 36.82 37.82 3k7r h ILE 60 CO -0.08 0.22 0.20 0.11 0.00 0.00 0.00 178.15 178.61 3k7r h LYS 61 N -0.69 0.44 0.00 2.37 1.57 -0.86 -2.28 116.57 117.11 3k7r h LYS 61 Ca -0.02 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 3k7r h LYS 61 Cb 0.51 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.72 3k7r h LYS 61 CO 0.03 0.30 0.00 0.36 -0.57 0.00 0.00 179.45 179.57 3k7r n LYS 62 N -4.47 0.10 0.22 3.15 2.85 -0.33 -0.98 118.16 118.69 3k7r n LYS 62 Ca 0.02 0.22 0.09 0.00 -1.05 0.00 0.00 58.31 57.59 3k7r n LYS 62 Cb 0.08 -1.50 0.48 0.00 -0.65 0.00 0.00 35.03 33.43 3k7r n LYS 62 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 177.40 179.14 3k7r h THR 63 N 0.00 0.71 0.00 0.58 1.35 -1.52 -3.47 112.91 110.57 3k7r h THR 63 Ca 0.00 -1.12 0.00 0.00 -0.55 0.00 0.00 66.41 64.74 3k7r h THR 63 Cb 0.07 1.71 0.00 0.00 -1.73 0.00 0.00 68.15 68.20 3k7r h THR 63 CO 0.00 0.25 0.00 0.61 -0.25 0.00 0.00 175.52 176.13 3k7r n GLY 64 N -0.07 0.89 3.87 5.82 0.00 -0.15 -5.08 105.19 110.46 3k7r n GLY 64 Ca -0.01 -0.09 -0.36 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.65 3.61 0.15 1.61 -0.14 -1.25 -5.08 119.74 118.00 3k7r s LYS 65 Ca 0.00 0.00 -0.25 0.00 -1.36 0.00 0.00 55.97 54.36 3k7r s LYS 65 Cb 0.00 -3.13 -0.08 0.00 -1.68 0.00 0.00 37.83 32.94 3k7r s LYS 65 CO 0.00 0.69 0.78 -2.00 -0.76 0.00 0.00 175.35 174.06 3k7r s GLU 66 N -1.46 4.56 -0.22 1.68 2.12 -1.26 -4.49 118.70 119.64 3k7r s GLU 66 Ca 0.24 1.15 -0.08 0.00 0.36 0.00 0.00 54.97 56.64 3k7r s GLU 66 Cb -0.14 -3.28 -0.04 0.00 0.26 0.00 0.00 34.13 30.94 3k7r s GLU 66 CO 0.13 0.53 0.08 0.08 -0.54 0.00 0.00 175.26 175.54 3k7r s VAL 67 N -1.00 4.70 -0.03 3.70 1.01 -1.26 -0.32 120.40 127.20 3k7r s VAL 67 Ca 0.36 -0.05 0.07 0.00 0.00 0.00 0.00 61.98 62.36 3k7r s VAL 67 Cb -0.23 -3.16 -0.24 0.00 0.00 0.00 0.00 36.38 32.75 3k7r s VAL 67 CO 0.26 0.39 0.70 0.03 0.00 0.00 0.00 175.10 176.48 3k7r h ARG 68 N 7.46 0.07 -2.31 2.72 3.08 -1.34 -3.49 114.38 120.56 3k7r h ARG 68 Ca -0.37 -0.12 0.14 0.00 0.07 0.00 0.00 59.98 59.70 3k7r h ARG 68 Cb 1.17 0.04 -0.12 0.00 0.08 0.00 0.00 29.97 31.15 3k7r h ARG 68 CO 0.64 0.73 0.49 0.45 -1.07 0.00 0.00 179.97 181.20 3k7r s SER 69 N -6.40 -0.29 -0.30 7.04 0.15 -1.25 -5.01 113.70 107.64 3k7r s SER 69 Ca -0.07 -0.17 -0.24 0.00 0.70 0.00 0.00 55.95 56.17 3k7r s SER 69 Cb 0.08 0.43 0.20 0.00 -1.71 0.00 0.00 66.02 65.02 3k7r s SER 69 CO 0.82 -0.74 1.45 -0.83 1.20 0.00 0.00 173.24 175.14 3k7r s GLY 70 N -2.68 0.45 0.10 9.45 0.00 -1.26 -0.88 107.32 112.50 3k7r s GLY 70 Ca 0.08 3.66 -0.06 0.00 0.00 0.00 0.00 44.72 48.39 3k7r s GLY 70 CO -0.04 2.09 0.15 1.25 0.00 0.00 0.00 173.10 176.54 3k7r s LYS 71 N 0.17 0.87 -0.10 2.90 2.20 -0.15 -5.00 119.74 120.62 3k7r s LYS 71 Ca 0.05 -1.10 -0.01 0.00 -0.36 0.00 0.00 55.97 54.55 3k7r s LYS 71 Cb -0.05 0.31 -0.03 0.00 -1.51 0.00 0.00 37.83 36.56 3k7r s LYS 71 CO -0.15 -0.27 -0.04 -1.14 -0.36 0.00 0.00 175.35 173.39 3k7r s GLN 72 N -3.91 3.08 0.00 4.03 0.74 -1.26 -1.90 119.66 120.43 3k7r s GLN 72 Ca 0.10 -0.50 0.03 0.00 0.05 0.00 0.00 55.36 55.04 3k7r s GLN 72 Cb 0.05 -2.74 0.02 0.00 1.10 0.00 0.00 33.01 31.45 3k7r s GLN 72 CO -0.07 0.56 0.60 -0.11 -0.55 0.00 0.00 175.29 175.71