#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k7r s ILE 4 N 0.00 5.21 0.19 6.31 1.01 -1.26 -4.45 121.20 128.20 3k7r s ILE 4 Ca 0.00 0.75 0.05 0.00 0.00 0.00 0.00 60.65 61.45 3k7r s ILE 4 Cb 0.00 -3.74 -0.04 0.00 0.01 0.00 0.00 42.46 38.70 3k7r s ILE 4 CO 0.00 0.28 0.20 -0.54 0.00 0.00 0.00 174.94 174.88 3k7r s LYS 5 N 1.06 3.05 -0.33 2.79 -0.14 0.37 -4.87 119.74 121.67 3k7r s LYS 5 Ca 0.20 -0.85 -0.03 0.00 -1.36 0.00 0.00 55.97 53.93 3k7r s LYS 5 Cb -0.15 -2.71 0.06 0.00 -1.68 0.00 0.00 37.83 33.35 3k7r s LYS 5 CO 0.08 0.47 0.06 -1.58 -0.76 0.00 0.00 175.35 173.61 3k7r s HIS 6 N -1.86 3.31 0.06 3.18 5.65 -1.26 -1.24 115.29 123.13 3k7r s HIS 6 Ca 0.32 -1.84 0.02 0.00 0.25 0.00 0.00 55.06 53.81 3k7r s HIS 6 Cb -0.10 -2.33 -0.04 0.00 -1.18 0.00 0.00 32.58 28.94 3k7r s HIS 6 CO 0.25 -0.81 0.11 0.71 -0.65 0.00 0.00 174.74 174.35 3k7r s TYR 7 N 1.27 3.29 -0.04 3.88 2.02 0.65 0.30 117.35 128.72 3k7r s TYR 7 Ca -0.02 0.14 0.01 0.00 -0.37 0.00 0.00 57.07 56.83 3k7r s TYR 7 Cb -0.20 -1.68 0.02 0.00 -0.40 0.00 0.00 41.96 39.70 3k7r s TYR 7 CO -0.01 0.54 -0.04 -1.14 -1.57 0.00 0.00 175.55 173.34 3k7r s GLN 8 N -2.29 0.70 -0.01 -0.62 0.74 -0.15 -0.12 119.66 117.91 3k7r s GLN 8 Ca 0.29 -0.07 0.07 0.00 0.05 0.00 0.00 55.36 55.70 3k7r s GLN 8 Cb -0.12 -0.74 -0.02 0.00 1.10 0.00 0.00 33.01 33.23 3k7r s GLN 8 CO 0.22 -0.08 -0.23 -0.06 -0.55 0.00 0.00 175.29 174.59 3k7r s PHE 9 N 0.88 2.04 -0.34 1.67 0.08 0.63 0.04 117.98 122.98 3k7r s PHE 9 Ca -0.11 -0.38 -0.15 0.00 0.12 0.00 0.00 56.93 56.40 3k7r s PHE 9 Cb -0.14 -1.31 -0.01 0.00 -0.57 0.00 0.00 43.02 40.99 3k7r s PHE 9 CO -0.00 -0.03 0.36 1.21 -0.10 0.00 0.00 175.22 176.66 3k7r s ASN 10 N -0.57 6.18 -0.10 1.36 3.04 -0.09 -1.17 114.94 123.59 3k7r s ASN 10 Ca 0.09 -0.20 0.02 0.00 0.04 0.00 0.00 52.86 52.81 3k7r s ASN 10 Cb -0.09 -2.19 0.01 0.00 -1.54 0.00 0.00 41.25 37.44 3k7r s ASN 10 CO -0.01 -0.32 -0.16 -0.69 -3.04 0.00 0.00 177.10 172.88 3k7r s VAL 11 N 2.01 1.51 -0.67 -5.21 1.01 -0.37 -1.12 120.40 117.56 3k7r s VAL 11 Ca 0.12 -0.66 -0.26 0.00 0.00 0.00 0.00 61.98 61.18 3k7r s VAL 11 Cb -0.16 -1.36 -0.05 0.00 0.00 0.00 0.00 36.38 34.81 3k7r s VAL 11 CO 0.12 0.44 2.04 -0.69 0.00 0.00 0.00 175.10 177.01 3k7r s VAL 12 N 0.84 3.27 -0.17 2.92 1.01 -0.24 -4.52 120.40 123.51 3k7r s VAL 12 Ca -0.10 0.01 0.02 0.00 0.00 0.00 0.00 61.98 61.91 3k7r s VAL 12 Cb -0.15 -3.69 0.02 0.00 0.00 0.00 0.00 36.38 32.55 3k7r s VAL 12 CO 0.01 -0.66 -0.21 -0.04 0.00 0.00 0.00 175.10 174.20 3k7r s MET 13 N 7.45 3.00 -0.15 2.72 -1.94 -1.26 -4.26 119.30 124.87 3k7r s MET 13 Ca 0.76 -0.84 0.12 0.00 -1.71 0.00 0.00 55.69 54.02 3k7r s MET 13 Cb -0.12 -2.52 -0.17 0.00 2.01 0.00 0.00 34.83 34.02 3k7r s MET 13 CO 0.16 -0.14 0.03 2.41 -0.01 0.00 0.00 175.02 177.46 3k7r n THR 14 N 4.42 1.00 -4.33 2.05 -1.04 -1.26 -4.93 114.28 110.20 3k7r n THR 14 Ca -0.21 -0.60 -0.20 0.00 -2.04 0.00 0.00 64.05 61.00 3k7r n THR 14 Cb 0.51 -0.67 -0.08 0.00 -1.82 0.00 0.00 70.33 68.26 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 2.09 0.00 -0.11 0.00 4.64 -1.99 -1.28 113.55 116.90 3k7r h SER 16 Ca -0.28 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.06 3k7r h SER 16 Cb 1.24 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.32 3k7r h SER 16 CO 0.42 0.03 0.01 1.23 -0.87 0.00 0.00 176.83 177.65 3k7r h GLY 17 N 1.92 0.11 0.83 -0.77 0.00 -1.98 0.93 103.07 104.12 3k7r h GLY 17 Ca -0.00 0.00 0.01 0.00 0.00 0.00 0.00 47.33 47.35 3k7r h GLY 17 CO 0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 176.54 176.49 3k7r h SER 19 N -0.06 0.75 -0.61 0.00 4.64 -1.47 -2.47 113.55 114.33 3k7r h SER 19 Ca 0.03 -0.26 0.04 0.00 -0.47 0.00 0.00 61.79 61.14 3k7r h SER 19 Cb 0.11 -0.21 -0.04 0.00 -0.31 0.00 0.00 62.40 61.95 3k7r h SER 19 CO -0.08 0.94 0.36 1.23 -0.87 0.00 0.00 176.83 178.40 3k7r h GLY 20 N 0.97 0.88 0.84 -0.77 0.00 -0.50 0.14 103.07 104.64 3k7r h GLY 20 Ca 0.10 -0.26 0.03 0.00 0.00 0.00 0.00 47.33 47.20 3k7r h GLY 20 CO 0.05 0.19 0.28 0.00 0.00 0.00 0.00 176.54 177.06 3k7r h ALA 21 N 1.29 0.62 -0.49 3.60 0.00 -0.65 0.08 119.26 123.70 3k7r h ALA 21 Ca 0.26 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 3k7r h ALA 21 Cb 0.09 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3k7r h ALA 21 CO -0.13 -0.04 0.22 0.28 0.00 0.00 0.00 179.25 179.57 3k7r h VAL 22 N 0.55 1.20 -0.95 0.00 2.07 -1.18 -2.87 116.25 115.07 3k7r h VAL 22 Ca 0.20 -0.60 0.03 0.00 0.82 0.00 0.00 66.70 67.15 3k7r h VAL 22 Cb 0.05 0.68 -0.05 0.00 -1.52 0.00 0.00 31.29 30.44 3k7r h VAL 22 CO -0.11 0.23 0.62 -1.13 0.02 0.00 0.00 177.57 177.21 3k7r h ASN 23 N 0.66 1.04 -0.27 0.57 -1.24 -0.25 -2.95 115.58 113.13 3k7r h ASN 23 Ca 0.17 -0.01 -0.05 0.00 0.71 0.00 0.00 56.30 57.11 3k7r h ASN 23 Cb 0.16 -0.24 -0.01 0.00 0.73 0.00 0.00 38.32 38.96 3k7r h ASN 23 CO -0.02 0.72 -0.03 0.50 -1.29 0.00 0.00 177.43 177.31 3k7r h LYS 24 N 1.21 0.51 0.00 6.67 3.64 -0.82 -1.24 116.57 126.54 3k7r h LYS 24 Ca 0.37 -0.18 -0.08 0.00 -1.27 0.00 0.00 60.65 59.50 3k7r h LYS 24 Cb -0.01 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.76 3k7r h LYS 24 CO -0.11 0.69 -0.37 -0.39 -2.27 0.00 0.00 179.45 177.00 3k7r h VAL 25 N 0.28 1.11 0.00 2.00 -1.51 -1.49 -2.41 116.25 114.22 3k7r h VAL 25 Ca 0.07 -1.35 -0.17 0.00 -1.23 0.00 0.00 66.70 64.03 3k7r h VAL 25 Cb 0.49 1.76 -0.02 0.00 -2.13 0.00 0.00 31.29 31.39 3k7r h VAL 25 CO 0.02 0.37 -0.79 -0.07 -1.23 0.00 0.00 177.57 175.87 3k7r h LEU 26 N 0.00 0.00 -0.68 4.19 3.38 -1.32 -3.16 115.31 117.72 3k7r h LEU 26 Ca -0.00 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.82 3k7r h LEU 26 Cb 0.73 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 3k7r h LEU 26 CO 0.05 0.79 -0.61 0.71 0.09 0.00 0.00 178.44 179.47 3k7r h THR 27 N 0.00 1.40 0.00 0.22 1.35 -0.98 -2.99 112.91 111.90 3k7r h THR 27 Ca -0.01 -2.00 0.00 0.00 -0.55 0.00 0.00 66.41 63.85 3k7r h THR 27 Cb 1.53 2.03 0.00 0.00 -1.73 0.00 0.00 68.15 69.97 3k7r h THR 27 CO 0.10 0.59 0.19 0.11 -0.25 0.00 0.00 175.52 176.26 3k7r h LYS 28 N 0.14 0.00 -0.51 4.72 1.57 -1.40 -0.30 116.57 120.80 3k7r h LYS 28 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 3k7r h LYS 28 Cb 1.10 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.41 3k7r h LYS 28 CO 0.09 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.25 3k7r n LEU 29 N -2.60 4.41 -4.77 2.94 4.77 -1.13 -4.95 117.00 115.67 3k7r n LEU 29 Ca -0.02 -2.57 -0.38 0.00 -0.03 0.00 0.00 56.01 53.02 3k7r n LEU 29 Cb 0.24 -0.53 -0.01 0.00 -2.33 0.00 0.00 43.42 40.79 3k7r n LEU 29 CO 0.12 0.75 0.86 -1.61 -1.33 0.00 0.00 177.39 176.18 3k7r s GLU 30 N -2.05 3.78 0.00 3.23 2.02 -0.12 -1.66 118.70 123.90 3k7r s GLU 30 Ca 0.45 1.89 0.20 0.00 0.02 0.00 0.00 54.97 57.53 3k7r s GLU 30 Cb 0.31 -2.49 0.54 0.00 0.10 0.00 0.00 34.13 32.58 3k7r s GLU 30 CO 0.19 -0.56 1.44 -0.35 0.02 0.00 0.00 175.26 176.00 3k7r n PRO 31 N -0.34 2.18 0.09 0.39 -0.04 -1.26 -4.87 135.00 131.15 3k7r n PRO 31 Ca 0.06 -1.81 -0.05 0.00 -0.04 0.00 0.00 63.50 61.67 3k7r n PRO 31 Cb 0.47 -1.44 0.12 0.00 -0.04 0.00 0.00 33.50 32.60 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 3.32 0.24 -3.33 3.54 5.19 -1.79 -3.29 116.42 120.31 3k7r h ASP 32 Ca 0.00 -0.14 -0.59 0.00 -0.62 0.00 0.00 57.03 55.68 3k7r h ASP 32 Cb 0.74 -0.07 -0.08 0.00 0.18 0.00 0.00 39.33 40.10 3k7r h ASP 32 CO 0.00 0.81 0.57 -0.69 -3.12 0.00 0.00 179.24 176.80 3k7r s VAL 33 N -3.70 4.72 -1.26 -1.35 1.01 -0.66 -2.24 120.40 116.92 3k7r s VAL 33 Ca -0.04 1.50 0.12 0.00 0.00 0.00 0.00 61.98 63.56 3k7r s VAL 33 Cb 0.12 -4.22 0.20 0.00 0.00 0.00 0.00 36.38 32.47 3k7r s VAL 33 CO 0.80 -0.26 1.05 -1.54 0.00 0.00 0.00 175.10 175.15 3k7r n SER 34 N 6.34 2.42 -3.64 3.32 3.41 -0.48 -4.42 113.62 120.57 3k7r n SER 34 Ca 0.07 -1.72 -0.06 0.00 -0.26 0.00 0.00 58.87 56.90 3k7r n SER 34 Cb 0.47 -0.11 -0.07 0.00 -0.26 0.00 0.00 64.21 64.25 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 -0.99 0.57 -0.12 4.33 2.20 -1.20 -4.98 119.74 119.54 3k7r s LYS 35 Ca 0.19 0.89 0.03 0.00 -0.36 0.00 0.00 55.97 56.71 3k7r s LYS 35 Cb 0.11 0.17 0.01 0.00 -1.51 0.00 0.00 37.83 36.60 3k7r s LYS 35 CO 0.16 -0.10 -0.22 0.42 -0.36 0.00 0.00 175.35 175.24 3k7r s ILE 36 N 1.15 2.00 -0.30 5.43 1.01 -1.26 -1.80 121.20 127.41 3k7r s ILE 36 Ca -0.06 -0.96 -0.00 0.00 0.00 0.00 0.00 60.65 59.63 3k7r s ILE 36 Cb -0.04 -1.75 0.10 0.00 0.01 0.00 0.00 42.46 40.77 3k7r s ILE 36 CO -0.13 0.54 0.08 -0.62 0.00 0.00 0.00 174.94 174.81 3k7r s ASP 37 N 0.66 4.05 -0.18 3.58 -1.08 0.01 -5.03 116.67 118.67 3k7r s ASP 37 Ca -0.11 -1.63 -0.04 0.00 -0.52 0.00 0.00 52.55 50.24 3k7r s ASP 37 Cb -0.16 -0.95 -0.02 0.00 -1.46 0.00 0.00 42.92 40.32 3k7r s ASP 37 CO 0.02 -0.40 -0.03 -0.63 0.52 0.00 0.00 175.17 174.66 3k7r s ILE 38 N 1.54 3.84 -0.29 4.11 1.01 -1.26 -0.97 121.20 129.18 3k7r s ILE 38 Ca 0.09 -0.36 0.03 0.00 0.00 0.00 0.00 60.65 60.40 3k7r s ILE 38 Cb -0.17 -2.71 0.08 0.00 0.01 0.00 0.00 42.46 39.66 3k7r s ILE 38 CO -0.22 0.46 -0.04 -0.55 0.00 0.00 0.00 174.94 174.60 3k7r s SER 39 N 0.73 4.47 0.08 3.58 0.15 0.29 -4.97 113.70 118.03 3k7r s SER 39 Ca -0.01 -1.65 -0.23 0.00 0.70 0.00 0.00 55.95 54.75 3k7r s SER 39 Cb -0.14 -1.50 -0.16 0.00 -1.71 0.00 0.00 66.02 62.51 3k7r s SER 39 CO 0.02 -0.27 1.68 0.25 1.20 0.00 0.00 173.24 176.12 3k7r h LEU 40 N 7.75 -0.01 -0.64 3.45 5.85 -1.96 -0.76 115.31 129.00 3k7r h LEU 40 Ca -0.13 -0.06 0.13 0.00 0.84 0.00 0.00 57.88 58.66 3k7r h LEU 40 Cb 1.04 0.00 -0.11 0.00 0.37 0.00 0.00 40.66 41.95 3k7r h LEU 40 CO 0.48 0.05 -0.05 -0.33 -0.34 0.00 0.00 178.44 178.25 3k7r h GLU 41 N -0.07 0.07 -0.00 1.25 3.07 -1.93 -1.49 114.58 115.48 3k7r h GLU 41 Ca -0.00 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3k7r h GLU 41 Cb 0.06 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 27.96 3k7r h GLU 41 CO 0.00 0.05 -0.34 1.63 -1.40 0.00 0.00 179.01 178.94 3k7r n LYS 42 N -5.34 0.20 -3.55 2.33 5.02 -1.20 -4.94 118.16 110.67 3k7r n LYS 42 Ca 0.09 -0.10 -0.22 0.00 -2.02 0.00 0.00 58.31 56.06 3k7r n LYS 42 Cb 0.36 -1.50 0.08 0.00 -0.02 0.00 0.00 35.03 33.95 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 -1.32 -7.53 -4.57 1.97 6.02 -0.35 -4.96 117.38 106.64 3k7r n GLN 43 Ca 0.08 0.83 -0.25 0.00 -0.01 0.00 0.00 57.00 57.65 3k7r n GLN 43 Cb 0.33 -5.87 -0.14 0.00 1.02 0.00 0.00 30.24 25.58 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 -7.02 2.18 -0.21 1.08 1.43 -0.85 -1.23 118.68 114.07 3k7r s LEU 44 Ca 0.40 -0.54 -0.02 0.00 -1.03 0.00 0.00 54.13 52.95 3k7r s LEU 44 Cb -0.18 -0.93 0.06 0.00 0.03 0.00 0.00 46.19 45.17 3k7r s LEU 44 CO 0.73 0.14 0.03 -0.69 0.23 0.00 0.00 176.35 176.78 3k7r s VAL 45 N -0.85 0.73 -0.18 -1.59 1.01 -0.32 -0.54 120.40 118.66 3k7r s VAL 45 Ca 0.07 -0.75 -0.09 0.00 0.00 0.00 0.00 61.98 61.20 3k7r s VAL 45 Cb -0.09 -1.22 -0.05 0.00 0.00 0.00 0.00 36.38 35.02 3k7r s VAL 45 CO 0.02 -0.23 0.14 -1.81 0.00 0.00 0.00 175.10 173.22 3k7r s ASP 46 N 1.76 6.26 -0.06 3.32 1.01 -0.14 -0.27 116.67 128.54 3k7r s ASP 46 Ca -0.01 0.30 0.01 0.00 0.71 0.00 0.00 52.55 53.56 3k7r s ASP 46 Cb -0.17 -2.09 0.02 0.00 1.01 0.00 0.00 42.92 41.69 3k7r s ASP 46 CO -0.09 0.23 -0.06 -0.69 0.21 0.00 0.00 175.17 174.76 3k7r s VAL 47 N 0.04 0.74 -0.19 -1.27 1.01 0.82 -0.81 120.40 120.74 3k7r s VAL 47 Ca 0.10 -0.21 -0.05 0.00 0.00 0.00 0.00 61.98 61.83 3k7r s VAL 47 Cb -0.11 -0.75 -0.02 0.00 0.00 0.00 0.00 36.38 35.49 3k7r s VAL 47 CO -0.00 0.28 -0.01 -0.31 0.00 0.00 0.00 175.10 175.06 3k7r s TYR 48 N 1.10 3.03 0.33 5.22 1.51 -0.75 -0.25 117.35 127.54 3k7r s TYR 48 Ca -0.08 -0.45 -0.18 0.00 -1.01 0.00 0.00 57.07 55.35 3k7r s TYR 48 Cb -0.14 -2.06 0.05 0.00 -0.11 0.00 0.00 41.96 39.69 3k7r s TYR 48 CO -0.01 -0.22 0.79 -0.08 -1.11 0.00 0.00 175.55 174.93 3k7r s THR 49 N 0.90 0.00 -0.15 -0.71 -1.32 -0.37 -1.38 115.64 112.61 3k7r s THR 49 Ca 0.01 -0.96 0.01 0.00 -1.21 0.00 0.00 61.69 59.54 3k7r s THR 49 Cb -0.14 -2.55 0.00 0.00 -1.51 0.00 0.00 72.50 68.30 3k7r s THR 49 CO 0.02 0.00 0.37 0.35 -2.21 0.00 0.00 174.62 173.15 3k7r n THR 50 N -0.51 0.00 -1.65 5.08 -2.24 -0.95 0.14 114.28 114.15 3k7r n THR 50 Ca -0.07 -0.49 -0.33 0.00 -2.27 0.00 0.00 64.05 60.90 3k7r n THR 50 Cb 0.60 1.02 0.06 0.00 -2.10 0.00 0.00 70.33 69.91 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 -0.83 3.35 0.65 3.22 1.43 -1.26 -4.97 118.68 120.26 3k7r s LEU 51 Ca 0.01 2.07 -0.14 0.00 -1.03 0.00 0.00 54.13 55.04 3k7r s LEU 51 Cb 0.01 -4.56 -0.01 0.00 0.03 0.00 0.00 46.19 41.67 3k7r s LEU 51 CO 0.03 -1.80 1.09 -2.16 0.23 0.00 0.00 176.35 173.74 3k7r s PRO 52 N -4.10 2.93 0.07 1.29 0.04 -1.26 -4.95 135.00 129.02 3k7r s PRO 52 Ca 0.68 1.27 -0.34 0.00 0.04 0.00 0.00 61.00 62.66 3k7r s PRO 52 Cb -0.22 -1.98 -0.18 0.00 0.04 0.00 0.00 34.50 32.16 3k7r s PRO 52 CO 0.43 -1.13 1.61 -0.92 0.04 0.00 0.00 177.00 177.03 3k7r h TYR 53 N -0.01 -0.98 0.00 0.56 3.20 -2.00 -3.02 116.97 114.72 3k7r h TYR 53 Ca -0.46 -0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.39 3k7r h TYR 53 Cb 1.23 0.34 -0.00 0.00 1.54 0.00 0.00 36.73 39.84 3k7r h TYR 53 CO 0.57 -0.58 -0.01 -0.44 -1.64 0.00 0.00 178.16 176.06 3k7r h ASP 54 N -0.98 0.00 -0.01 -2.11 3.32 -1.99 -0.25 116.42 114.41 3k7r h ASP 54 Ca -0.09 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.96 3k7r h ASP 54 Cb 0.77 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.32 3k7r h ASP 54 CO 0.12 0.01 -0.00 0.15 -1.72 0.00 0.00 179.24 177.80 3k7r h PHE 55 N 0.00 0.02 -0.53 4.55 3.57 -1.94 0.13 116.94 122.74 3k7r h PHE 55 Ca -0.00 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.55 3k7r h PHE 55 Cb 0.02 -0.01 -0.05 0.00 2.79 0.00 0.00 35.95 38.70 3k7r h PHE 55 CO 0.00 0.40 0.25 0.82 -2.23 0.00 0.00 178.31 177.55 3k7r h ILE 56 N -0.36 0.91 -0.33 1.41 1.08 -1.03 -1.00 117.51 118.18 3k7r h ILE 56 Ca 0.00 -0.16 0.04 0.00 -0.39 0.00 0.00 64.86 64.35 3k7r h ILE 56 Cb 0.39 0.39 -0.04 0.00 -3.07 0.00 0.00 36.82 34.49 3k7r h ILE 56 CO 0.00 0.09 0.10 0.25 -0.69 0.00 0.00 178.15 177.90 3k7r h LEU 57 N 0.48 0.09 -0.63 1.44 5.85 -1.06 -2.04 115.31 119.43 3k7r h LEU 57 Ca 0.25 0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.98 3k7r h LEU 57 Cb 0.20 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.24 3k7r h LEU 57 CO -0.20 0.09 0.27 -0.08 -0.34 0.00 0.00 178.44 178.18 3k7r h GLU 58 N 0.23 0.93 -0.12 1.25 4.81 -0.61 -1.69 114.58 119.38 3k7r h GLU 58 Ca 0.15 -0.16 -0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3k7r h GLU 58 Cb 0.14 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.36 3k7r h GLU 58 CO -0.17 0.77 0.07 0.87 -0.73 0.00 0.00 179.01 179.82 3k7r h LYS 59 N 0.88 0.16 0.16 1.92 1.79 -0.99 -2.01 116.57 118.48 3k7r h LYS 59 Ca 0.21 -0.01 -0.22 0.00 -2.18 0.00 0.00 60.65 58.45 3k7r h LYS 59 Cb 0.17 -0.04 0.03 0.00 -1.58 0.00 0.00 32.23 30.81 3k7r h LYS 59 CO -0.02 0.11 -0.98 0.82 -1.08 0.00 0.00 179.45 178.31 3k7r h ILE 60 N 0.16 1.45 -0.28 1.86 2.04 -0.88 -3.34 117.51 118.53 3k7r h ILE 60 Ca 0.04 -2.56 -0.01 0.00 1.00 0.00 0.00 64.86 63.34 3k7r h ILE 60 Cb -0.00 3.14 -0.01 0.00 -0.74 0.00 0.00 36.82 39.20 3k7r h ILE 60 CO -0.01 0.74 0.15 0.11 0.00 0.00 0.00 178.15 179.13 3k7r h LYS 61 N -0.23 0.38 0.00 2.37 1.57 -1.08 -1.63 116.57 117.96 3k7r h LYS 61 Ca -0.17 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.58 3k7r h LYS 61 Cb 1.77 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.99 3k7r h LYS 61 CO 0.18 0.29 0.00 1.63 -0.57 0.00 0.00 179.45 180.99 3k7r n LYS 62 N -4.45 0.11 0.09 3.15 4.76 -0.78 -1.17 118.16 119.87 3k7r n LYS 62 Ca 0.01 0.49 0.11 0.00 -2.87 0.00 0.00 58.31 56.05 3k7r n LYS 62 Cb 0.10 -1.78 0.44 0.00 -1.84 0.00 0.00 35.03 31.95 3k7r n LYS 62 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 3k7r n THR 63 N -2.00 0.86 0.00 -0.18 -2.24 -0.61 -4.87 114.28 105.24 3k7r n THR 63 Ca 0.01 0.22 0.00 0.00 -2.27 0.00 0.00 64.05 62.00 3k7r n THR 63 Cb 0.10 -1.09 0.00 0.00 -2.10 0.00 0.00 70.33 67.24 3k7r n THR 63 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3k7r n GLY 64 N 0.05 3.06 3.77 3.38 0.00 -0.32 -5.05 105.19 110.08 3k7r n GLY 64 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.75 4.11 0.14 1.61 -0.14 -1.26 -5.01 119.74 118.44 3k7r s LYS 65 Ca 0.00 1.79 -0.30 0.00 -1.36 0.00 0.00 55.97 56.10 3k7r s LYS 65 Cb 0.00 -2.69 -0.06 0.00 -1.68 0.00 0.00 37.83 33.39 3k7r s LYS 65 CO 0.00 -0.25 0.98 -2.00 -0.76 0.00 0.00 175.35 173.32 3k7r s GLU 66 N -2.26 4.70 -0.28 1.68 2.12 -1.26 -4.57 118.70 118.82 3k7r s GLU 66 Ca 0.56 1.50 -0.07 0.00 0.36 0.00 0.00 54.97 57.33 3k7r s GLU 66 Cb -0.30 -3.35 -0.00 0.00 0.26 0.00 0.00 34.13 30.74 3k7r s GLU 66 CO 0.37 0.22 0.08 0.08 -0.54 0.00 0.00 175.26 175.47 3k7r s VAL 67 N -0.16 4.09 -0.06 3.70 1.01 -1.26 -1.08 120.40 126.63 3k7r s VAL 67 Ca 0.47 -0.54 -0.25 0.00 0.00 0.00 0.00 61.98 61.65 3k7r s VAL 67 Cb -0.25 -3.05 -0.23 0.00 0.00 0.00 0.00 36.38 32.85 3k7r s VAL 67 CO 0.31 0.15 1.04 0.03 0.00 0.00 0.00 175.10 176.63 3k7r h ARG 68 N 8.24 0.11 -3.42 2.72 3.08 -1.51 -3.48 114.38 120.12 3k7r h ARG 68 Ca -0.34 -0.11 -0.04 0.00 0.07 0.00 0.00 59.98 59.56 3k7r h ARG 68 Cb 1.14 0.03 -0.11 0.00 0.08 0.00 0.00 29.97 31.11 3k7r h ARG 68 CO 0.60 0.84 -0.06 -1.54 -1.07 0.00 0.00 179.97 178.74 3k7r s SER 69 N -6.16 -0.20 0.04 7.04 1.04 -1.24 -5.02 113.70 109.19 3k7r s SER 69 Ca -0.16 -0.48 -0.04 0.00 0.48 0.00 0.00 55.95 55.74 3k7r s SER 69 Cb 0.00 0.52 -0.02 0.00 0.10 0.00 0.00 66.02 66.63 3k7r s SER 69 CO 0.72 -0.96 0.05 -0.83 0.98 0.00 0.00 173.24 173.20 3k7r s GLY 70 N -2.86 0.25 0.23 7.32 0.00 -1.26 -0.91 107.32 110.08 3k7r s GLY 70 Ca 0.08 -0.72 -0.06 0.00 0.00 0.00 0.00 44.72 44.02 3k7r s GLY 70 CO -0.06 -0.85 0.30 -1.59 0.00 0.00 0.00 173.10 170.90 3k7r s LYS 71 N -2.85 1.39 -0.19 2.90 -2.85 0.11 -4.98 119.74 113.27 3k7r s LYS 71 Ca -0.03 -1.49 -0.02 0.00 -1.00 0.00 0.00 55.97 53.43 3k7r s LYS 71 Cb 0.00 0.36 -0.00 0.00 -2.06 0.00 0.00 37.83 36.13 3k7r s LYS 71 CO -0.06 -0.52 -0.11 -1.14 0.10 0.00 0.00 175.35 173.62 3k7r s GLN 72 N -4.03 3.26 0.00 1.78 0.74 -1.26 -0.98 119.66 119.18 3k7r s GLN 72 Ca 0.32 -0.70 0.27 0.00 0.05 0.00 0.00 55.36 55.30 3k7r s GLN 72 Cb 0.03 -2.81 0.90 0.00 1.10 0.00 0.00 33.01 32.23 3k7r s GLN 72 CO 0.12 -0.13 1.66 1.28 -0.55 0.00 0.00 175.29 177.67