#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kp7 h VAL 2 N 0.00 1.09 0.00 1.12 -1.51 -2.05 -2.38 116.25 112.51 3kp7 h VAL 2 Ca 0.00 -1.51 0.00 0.00 -1.23 0.00 0.00 66.70 63.96 3kp7 h VAL 2 Cb 0.00 1.87 0.00 0.00 -2.13 0.00 0.00 31.29 31.03 3kp7 h VAL 2 CO 0.00 0.40 -0.17 0.54 -1.23 0.00 0.00 177.57 177.11 3kp7 n ARG 3 N -3.75 0.12 0.04 5.19 1.74 -1.26 -2.71 116.66 116.03 3kp7 n ARG 3 Ca -0.01 0.08 -0.22 0.00 -0.77 0.00 0.00 57.85 56.92 3kp7 n ARG 3 Cb 0.48 -1.62 -0.14 0.00 -1.02 0.00 0.00 32.46 30.16 3kp7 n ARG 3 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 3kp7 h ARG 4 N 0.00 0.33 -0.04 5.56 1.12 -1.88 -2.96 114.38 116.51 3kp7 h ARG 4 Ca 0.00 -0.57 -0.10 0.00 -1.11 0.00 0.00 59.98 58.21 3kp7 h ARG 4 Cb 0.61 0.21 -0.01 0.00 -0.01 0.00 0.00 29.97 30.76 3kp7 h ARG 4 CO 0.00 1.27 -0.42 0.82 -3.11 0.00 0.00 179.97 178.53 3kp7 h ILE 5 N 0.03 1.31 -0.38 1.20 1.08 -1.55 -2.27 117.51 116.94 3kp7 h ILE 5 Ca -0.37 -1.50 -0.07 0.00 -0.39 0.00 0.00 64.86 62.54 3kp7 h ILE 5 Cb 2.03 1.76 -0.01 0.00 -3.07 0.00 0.00 36.82 37.53 3kp7 h ILE 5 CO 0.13 0.43 -0.04 -0.33 -0.69 0.00 0.00 178.15 177.65 3kp7 h GLU 6 N 0.07 0.69 -1.01 2.37 5.08 -1.62 -2.24 114.58 117.92 3kp7 h GLU 6 Ca 0.00 -0.24 0.03 0.00 -1.00 0.00 0.00 59.36 58.16 3kp7 h GLU 6 Cb 0.78 -0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.92 3kp7 h GLU 6 CO 0.06 0.81 0.66 0.22 -1.00 0.00 0.00 179.01 179.76 3kp7 h ASP 7 N 0.50 1.11 -0.15 1.42 3.58 -1.29 -1.18 116.42 120.40 3kp7 h ASP 7 Ca 0.10 -0.01 -0.03 0.00 0.42 0.00 0.00 57.03 57.51 3kp7 h ASP 7 Cb 0.53 -0.26 -0.00 0.00 1.72 0.00 0.00 39.33 41.32 3kp7 h ASP 7 CO 0.03 0.76 -0.03 0.45 -2.88 0.00 0.00 179.24 177.57 3kp7 h HIS 8 N 1.28 0.32 -0.36 0.28 3.86 -1.30 -0.18 115.15 119.06 3kp7 h HIS 8 Ca 0.40 -0.07 0.03 0.00 -1.16 0.00 0.00 60.37 59.57 3kp7 h HIS 8 Cb -0.01 -0.08 -0.03 0.00 1.06 0.00 0.00 27.41 28.34 3kp7 h HIS 8 CO -0.00 0.55 0.18 0.82 0.86 0.00 0.00 177.93 180.34 3kp7 h ILE 9 N 0.00 0.98 -0.02 2.45 2.04 -1.22 0.16 117.51 121.90 3kp7 h ILE 9 Ca 0.04 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.78 3kp7 h ILE 9 Cb 0.44 0.58 -0.00 0.00 -0.74 0.00 0.00 36.82 37.10 3kp7 h ILE 9 CO 0.01 0.07 0.01 0.28 0.00 0.00 0.00 178.15 178.52 3kp7 h SER 10 N 0.36 0.02 -0.45 1.72 0.02 -1.15 0.12 113.55 114.19 3kp7 h SER 10 Ca 0.15 0.00 0.05 0.00 -0.84 0.00 0.00 61.79 61.15 3kp7 h SER 10 Cb 0.06 -0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.55 3kp7 h SER 10 CO -0.11 0.02 0.18 0.15 -1.14 0.00 0.00 176.83 175.93 3kp7 h PHE 11 N 0.03 0.33 -0.77 3.45 3.57 -0.71 0.34 116.94 123.18 3kp7 h PHE 11 Ca 0.01 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.55 3kp7 h PHE 11 Cb -0.00 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 38.61 3kp7 h PHE 11 CO -0.08 0.14 0.50 1.25 -2.23 0.00 0.00 178.31 177.89 3kp7 h LEU 12 N 0.37 0.84 -0.34 0.59 5.85 -0.38 0.40 115.31 122.66 3kp7 h LEU 12 Ca 0.21 -0.01 -0.12 0.00 0.84 0.00 0.00 57.88 58.79 3kp7 h LEU 12 Cb 0.18 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.00 3kp7 h LEU 12 CO -0.19 0.60 -0.27 -0.33 -0.34 0.00 0.00 178.44 177.91 3kp7 h GLU 13 N 1.00 0.77 -0.55 1.25 5.08 -0.06 -1.75 114.58 120.32 3kp7 h GLU 13 Ca 0.29 -0.39 -0.02 0.00 -1.00 0.00 0.00 59.36 58.25 3kp7 h GLU 13 Cb -0.05 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.17 3kp7 h GLU 13 CO -0.09 1.01 0.26 -0.22 -1.00 0.00 0.00 179.01 178.98 3kp7 h LYS 14 N 0.55 0.78 -0.23 2.33 3.64 0.13 -1.09 116.57 122.68 3kp7 h LYS 14 Ca 0.06 -0.10 -0.03 0.00 -1.27 0.00 0.00 60.65 59.32 3kp7 h LYS 14 Cb 0.84 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.50 3kp7 h LYS 14 CO 0.07 0.61 0.03 0.35 -2.27 0.00 0.00 179.45 178.24 3kp7 h PHE 15 N 0.78 0.41 -0.09 1.91 3.57 -0.61 0.55 116.94 123.46 3kp7 h PHE 15 Ca 0.19 -0.06 0.01 0.00 3.53 0.00 0.00 57.97 61.64 3kp7 h PHE 15 Cb 0.08 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.70 3kp7 h PHE 15 CO 0.01 0.52 0.04 0.82 -2.23 0.00 0.00 178.31 177.46 3kp7 h ILE 16 N 0.19 0.99 -0.87 1.41 2.04 -0.99 -0.70 117.51 119.57 3kp7 h ILE 16 Ca 0.07 -0.03 -0.01 0.00 1.00 0.00 0.00 64.86 65.89 3kp7 h ILE 16 Cb 0.33 0.90 -0.04 0.00 -0.74 0.00 0.00 36.82 37.27 3kp7 h ILE 16 CO 0.01 0.02 0.50 0.78 0.00 0.00 0.00 178.15 179.45 3kp7 h ASN 17 N 0.09 1.07 -0.96 1.72 2.35 -1.05 0.17 115.58 118.96 3kp7 h ASN 17 Ca 0.04 -0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.70 3kp7 h ASN 17 Cb 0.01 -0.27 -0.05 0.00 0.05 0.00 0.00 38.32 38.06 3kp7 h ASN 17 CO -0.03 0.85 0.61 0.44 -1.65 0.00 0.00 177.43 177.64 3kp7 h ASP 18 N 1.21 1.13 -0.41 5.81 3.32 -0.44 0.30 116.42 127.34 3kp7 h ASP 18 Ca 0.31 -0.05 -0.05 0.00 0.02 0.00 0.00 57.03 57.26 3kp7 h ASP 18 Cb -0.01 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.24 3kp7 h ASP 18 CO -0.05 0.85 0.06 0.58 -1.72 0.00 0.00 179.24 178.95 3kp7 h VAL 19 N 1.32 1.24 -0.76 -1.35 2.07 -0.17 -0.70 116.25 117.91 3kp7 h VAL 19 Ca 0.35 -0.88 -0.06 0.00 0.82 0.00 0.00 66.70 66.93 3kp7 h VAL 19 Cb -0.10 1.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 3kp7 h VAL 19 CO -0.07 0.30 0.25 0.78 0.02 0.00 0.00 177.57 178.85 3kp7 h ASN 20 N 0.53 1.09 0.38 0.57 2.35 -0.09 0.17 115.58 120.58 3kp7 h ASN 20 Ca 0.12 -0.20 -0.02 0.00 -0.55 0.00 0.00 56.30 55.66 3kp7 h ASN 20 Cb 0.38 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.47 3kp7 h ASN 20 CO 0.01 1.00 -0.18 0.74 -1.65 0.00 0.00 177.43 177.35 3kp7 h THR 21 N 1.12 0.63 -0.86 2.81 2.02 -0.23 -1.74 112.91 116.66 3kp7 h THR 21 Ca 0.25 -0.14 0.01 0.00 0.77 0.00 0.00 66.41 67.29 3kp7 h THR 21 Cb 0.29 0.71 -0.04 0.00 -1.74 0.00 0.00 68.15 67.37 3kp7 h THR 21 CO -0.01 0.03 0.57 0.25 0.37 0.00 0.00 175.52 176.73 3kp7 h LEU 22 N -0.59 0.99 -0.89 2.58 5.85 -0.91 -2.25 115.31 120.08 3kp7 h LEU 22 Ca -0.05 -0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.67 3kp7 h LEU 22 Cb 0.44 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 41.17 3kp7 h LEU 22 CO 0.09 0.71 0.58 0.74 -0.34 0.00 0.00 178.44 180.22 3kp7 h THR 23 N 1.16 1.17 -0.10 1.05 2.02 -0.46 -1.63 112.91 116.12 3kp7 h THR 23 Ca 0.32 -0.39 -0.00 0.00 0.77 0.00 0.00 66.41 67.10 3kp7 h THR 23 Cb -0.13 -0.07 -0.00 0.00 -1.74 0.00 0.00 68.15 66.20 3kp7 h THR 23 CO -0.07 0.21 0.05 0.00 0.37 0.00 0.00 175.52 176.08 3kp7 h ALA 24 N 1.35 0.13 -0.54 6.16 0.00 -0.79 -2.67 119.26 122.91 3kp7 h ALA 24 Ca 0.35 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 55.12 3kp7 h ALA 24 Cb -0.04 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3kp7 h ALA 24 CO -0.10 -0.30 0.09 0.87 0.00 0.00 0.00 179.25 179.81 3kp7 h LYS 25 N 0.04 0.85 0.00 0.00 1.57 -1.15 -2.88 116.57 115.00 3kp7 h LYS 25 Ca 0.04 -0.19 -0.09 0.00 -1.87 0.00 0.00 60.65 58.53 3kp7 h LYS 25 Cb 0.12 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 3kp7 h LYS 25 CO -0.00 0.79 -0.41 -0.07 -0.57 0.00 0.00 179.45 179.18 3kp7 h LEU 26 N 0.81 0.00 -1.44 2.94 3.38 -1.21 -3.23 115.31 116.56 3kp7 h LEU 26 Ca 0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.14 3kp7 h LEU 26 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 3kp7 h LEU 26 CO 0.01 0.41 -0.17 0.18 0.09 0.00 0.00 178.44 178.96 3kp7 n LEU 27 N -3.91 2.40 -0.29 1.67 4.77 -1.02 -4.58 117.00 116.05 3kp7 n LEU 27 Ca -0.01 -0.82 -0.03 0.00 -0.03 0.00 0.00 56.01 55.12 3kp7 n LEU 27 Cb 0.46 -0.01 0.09 0.00 -2.33 0.00 0.00 43.42 41.63 3kp7 n LEU 27 CO 0.39 0.41 1.19 0.50 -1.33 0.00 0.00 177.39 178.55 3kp7 h LYS 28 N 3.50 0.98 -0.36 3.23 3.64 -1.53 -0.21 116.57 125.83 3kp7 h LYS 28 Ca 0.00 -0.06 -0.12 0.00 -1.27 0.00 0.00 60.65 59.20 3kp7 h LYS 28 Cb 0.84 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.42 3kp7 h LYS 28 CO 0.00 0.65 -0.26 -0.44 -2.27 0.00 0.00 179.45 177.13 3kp7 h ASP 29 N 1.01 0.76 -0.38 4.20 3.32 -1.83 -0.82 116.42 122.68 3kp7 h ASP 29 Ca 0.31 -0.29 -0.15 0.00 0.02 0.00 0.00 57.03 56.93 3kp7 h ASP 29 Cb -0.02 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.31 3kp7 h ASP 29 CO -0.10 0.99 -0.34 0.25 -1.72 0.00 0.00 179.24 178.32 3kp7 h LEU 30 N 0.64 0.96 -0.61 1.55 5.85 -1.71 0.16 115.31 122.15 3kp7 h LEU 30 Ca 0.08 -0.45 -0.04 0.00 0.84 0.00 0.00 57.88 58.31 3kp7 h LEU 30 Cb 0.77 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 3kp7 h LEU 30 CO 0.06 1.22 0.24 1.56 -0.34 0.00 0.00 178.44 181.18 3kp7 h GLN 31 N 0.72 0.92 -0.66 1.25 4.20 -0.98 -1.48 115.11 119.09 3kp7 h GLN 31 Ca 0.07 -0.17 -0.06 0.00 0.06 0.00 0.00 58.65 58.55 3kp7 h GLN 31 Cb 0.93 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 28.53 3kp7 h GLN 31 CO 0.09 0.79 0.19 1.15 -0.67 0.00 0.00 178.83 180.38 3kp7 h THR 32 N 0.86 1.25 -0.15 -0.54 2.02 -0.85 -0.86 112.91 114.64 3kp7 h THR 32 Ca 0.20 -0.89 -0.03 0.00 0.77 0.00 0.00 66.41 66.47 3kp7 h THR 32 Cb 0.22 0.58 -0.01 0.00 -1.74 0.00 0.00 68.15 67.19 3kp7 h THR 32 CO -0.02 0.34 -0.03 -0.08 0.37 0.00 0.00 175.52 176.10 3kp7 h GLU 33 N 0.96 0.22 -0.01 6.66 4.57 -0.27 -1.93 114.58 124.79 3kp7 h GLU 33 Ca 0.21 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.36 3kp7 h GLU 33 Cb 0.32 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 28.87 3kp7 h GLU 33 CO -0.00 0.27 -0.32 0.66 -1.18 0.00 0.00 179.01 178.44 3kp7 n TYR 34 N -4.37 0.00 -0.99 0.92 4.02 -0.59 -4.96 117.16 111.18 3kp7 n TYR 34 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.88 3kp7 n TYR 34 Cb 0.19 -0.12 0.00 0.00 -0.02 0.00 0.00 39.34 39.39 3kp7 n TYR 34 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3kp7 n GLY 35 N 1.37 0.41 3.52 2.72 0.00 -0.43 -5.05 105.19 107.74 3kp7 n GLY 35 Ca 0.11 -0.84 -0.25 0.00 0.00 0.00 0.00 46.02 45.04 3kp7 n GLY 35 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3kp7 s ILE 36 N -2.00 2.43 0.46 -0.61 -4.36 -0.60 -5.02 121.20 111.49 3kp7 s ILE 36 Ca 0.00 -2.27 0.03 0.00 -0.26 0.00 0.00 60.65 58.16 3kp7 s ILE 36 Cb 0.00 -2.51 0.01 0.00 1.25 0.00 0.00 42.46 41.21 3kp7 s ILE 36 CO 0.00 -0.30 0.65 -0.94 0.24 0.00 0.00 174.94 174.59 3kp7 s SER 37 N -3.58 5.62 0.18 4.36 1.04 -1.26 -4.10 113.70 115.96 3kp7 s SER 37 Ca 0.31 -0.06 -0.14 0.00 0.48 0.00 0.00 55.95 56.54 3kp7 s SER 37 Cb -0.01 -1.05 0.14 0.00 0.10 0.00 0.00 66.02 65.20 3kp7 s SER 37 CO 0.16 -0.82 1.73 0.00 0.98 0.00 0.00 173.24 175.29 3kp7 h ALA 38 N 0.43 0.51 0.00 5.32 0.00 -1.97 -0.97 119.26 122.57 3kp7 h ALA 38 Ca -0.43 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 3kp7 h ALA 38 Cb 1.27 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.16 3kp7 h ALA 38 CO 0.52 -0.29 -0.07 0.93 0.00 0.00 0.00 179.25 180.34 3kp7 h GLU 39 N 0.25 0.00 0.00 0.00 3.07 -2.00 0.66 114.58 116.56 3kp7 h GLU 39 Ca 0.22 0.00 -0.15 0.00 -0.50 0.00 0.00 59.36 58.93 3kp7 h GLU 39 Cb 0.26 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.15 3kp7 h GLU 39 CO -0.27 0.07 -0.93 1.96 -1.40 0.00 0.00 179.01 178.44 3kp7 h GLN 40 N 0.00 0.00 -0.06 2.33 4.20 -1.81 -3.23 115.11 116.53 3kp7 h GLN 40 Ca -0.00 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.60 3kp7 h GLN 40 Cb 0.17 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.94 3kp7 h GLN 40 CO 0.01 0.50 -0.45 0.66 -0.67 0.00 0.00 178.83 178.88 3kp7 h SER 41 N 0.00 0.15 -0.27 1.46 4.64 0.45 -2.62 113.55 117.36 3kp7 h SER 41 Ca -0.07 -0.07 -0.07 0.00 -0.47 0.00 0.00 61.79 61.11 3kp7 h SER 41 Cb 1.53 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 63.56 3kp7 h SER 41 CO 0.07 0.59 -0.05 0.45 -0.87 0.00 0.00 176.83 177.02 3kp7 h HIS 42 N 0.12 0.68 -0.29 4.77 3.86 -1.29 0.37 115.15 123.36 3kp7 h HIS 42 Ca 0.01 -0.09 -0.10 0.00 -1.16 0.00 0.00 60.37 59.02 3kp7 h HIS 42 Cb 0.84 -0.19 -0.01 0.00 1.06 0.00 0.00 27.41 29.11 3kp7 h HIS 42 CO 0.01 0.68 -0.26 0.28 0.86 0.00 0.00 177.93 179.50 3kp7 h VAL 43 N 0.60 1.27 -0.21 2.45 2.07 -1.57 -1.86 116.25 118.99 3kp7 h VAL 43 Ca 0.12 -1.32 -0.07 0.00 0.82 0.00 0.00 66.70 66.25 3kp7 h VAL 43 Cb 0.45 1.33 -0.00 0.00 -1.52 0.00 0.00 31.29 31.54 3kp7 h VAL 43 CO 0.02 0.43 -0.12 -0.07 0.02 0.00 0.00 177.57 177.84 3kp7 h LEU 44 N 0.50 0.47 -0.53 2.57 3.38 -0.99 -2.50 115.31 118.22 3kp7 h LEU 44 Ca 0.07 -0.43 0.09 0.00 0.09 0.00 0.00 57.88 57.70 3kp7 h LEU 44 Cb 0.71 -0.13 -0.10 0.00 0.09 0.00 0.00 40.66 41.23 3kp7 h LEU 44 CO 0.05 0.80 -0.41 0.78 0.09 0.00 0.00 178.44 179.75 3kp7 h ASN 45 N 0.15 -1.40 0.38 -0.43 2.35 -0.51 0.42 115.58 116.54 3kp7 h ASN 45 Ca 0.04 0.23 -0.01 0.00 -0.55 0.00 0.00 56.30 56.02 3kp7 h ASN 45 Cb 0.63 0.64 -0.03 0.00 0.05 0.00 0.00 38.32 39.61 3kp7 h ASN 45 CO 0.04 -0.34 -0.50 0.24 -1.65 0.00 0.00 177.43 175.22 3kp7 h MET 46 N -0.24 -0.88 0.00 0.81 2.86 -1.32 -0.85 114.93 115.31 3kp7 h MET 46 Ca 0.18 0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.88 3kp7 h MET 46 Cb 0.57 0.20 0.00 0.00 0.06 0.00 0.00 31.60 32.42 3kp7 h MET 46 CO -0.65 -0.58 0.19 1.28 1.06 0.00 0.00 176.91 178.20 3kp7 n LEU 47 N -5.42 0.33 0.17 1.22 4.77 -0.81 0.09 117.00 117.36 3kp7 n LEU 47 Ca -0.11 0.57 0.04 0.00 -0.03 0.00 0.00 56.01 56.49 3kp7 n LEU 47 Cb 0.44 -0.56 0.23 0.00 -2.33 0.00 0.00 43.42 41.19 3kp7 n LEU 47 CO 0.22 -0.69 0.60 -1.28 -1.33 0.00 0.00 177.39 174.92 3kp7 h SER 48 N 0.00 0.00 0.00 -1.43 0.87 0.57 -3.30 113.55 110.26 3kp7 h SER 48 Ca 0.00 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.54 3kp7 h SER 48 Cb 0.38 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.33 3kp7 h SER 48 CO 0.00 0.43 -0.12 0.40 -0.53 0.00 0.00 176.83 177.01 3kp7 h ILE 49 N 0.00 1.10 -2.55 2.23 1.08 -0.35 -3.48 117.51 115.54 3kp7 h ILE 49 Ca -0.00 -1.87 -0.10 0.00 -0.39 0.00 0.00 64.86 62.50 3kp7 h ILE 49 Cb 1.08 2.12 -0.22 0.00 -3.07 0.00 0.00 36.82 36.74 3kp7 h ILE 49 CO 0.06 0.37 -0.11 -1.83 -0.69 0.00 0.00 178.15 175.95 3kp7 s GLU 50 N -2.03 0.68 0.13 2.37 -1.05 -1.15 -5.13 118.70 112.53 3kp7 s GLU 50 Ca -0.14 0.42 -0.31 0.00 -0.15 0.00 0.00 54.97 54.79 3kp7 s GLU 50 Cb -0.01 0.32 -0.09 0.00 -0.44 0.00 0.00 34.13 33.91 3kp7 s GLU 50 CO 0.45 -0.14 1.58 0.00 0.95 0.00 0.00 175.26 178.10 3kp7 s ALA 51 N -0.34 3.74 0.36 -0.84 0.00 -1.26 -4.22 121.76 119.19 3kp7 s ALA 51 Ca -0.05 1.31 0.02 0.00 0.00 0.00 0.00 51.96 53.24 3kp7 s ALA 51 Cb -0.03 -3.64 -0.01 0.00 0.00 0.00 0.00 23.12 19.44 3kp7 s ALA 51 CO 0.03 -0.85 0.08 1.28 0.00 0.00 0.00 175.76 176.30 3kp7 n LEU 52 N 4.41 0.00 -4.38 0.00 4.77 -0.78 -4.91 117.00 116.11 3kp7 n LEU 52 Ca 0.14 -2.55 -0.19 0.00 -0.03 0.00 0.00 56.01 53.38 3kp7 n LEU 52 Cb 0.39 0.68 -0.10 0.00 -2.33 0.00 0.00 43.42 42.06 3kp7 n LEU 52 CO 0.62 -0.38 -0.33 0.42 -1.33 0.00 0.00 177.39 176.38 3kp7 s THR 53 N -2.70 1.26 -0.22 -5.08 -4.23 -1.26 -0.07 115.64 103.34 3kp7 s THR 53 Ca 0.12 -2.06 0.12 0.00 -1.18 0.00 0.00 61.69 58.69 3kp7 s THR 53 Cb 0.01 -2.47 0.12 0.00 1.34 0.00 0.00 72.50 71.50 3kp7 s THR 53 CO 0.08 -0.25 1.27 0.52 -0.54 0.00 0.00 174.62 175.70 3kp7 n VAL 54 N -0.52 0.92 0.19 2.29 0.31 -1.26 -1.96 118.33 118.29 3kp7 n VAL 54 Ca -0.05 0.68 -0.08 0.00 -0.01 0.00 0.00 64.34 64.88 3kp7 n VAL 54 Cb 0.64 -1.68 -0.04 0.00 -0.91 0.00 0.00 33.84 31.85 3kp7 n VAL 54 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 3kp7 h GLY 55 N 0.00 -0.57 0.67 2.92 0.00 -1.94 -2.74 103.07 101.41 3kp7 h GLY 55 Ca 0.00 0.21 0.05 0.00 0.00 0.00 0.00 47.33 47.59 3kp7 h GLY 55 CO 0.00 -0.21 0.19 1.46 0.00 0.00 0.00 176.54 177.98 3kp7 h GLN 56 N -1.09 0.37 -0.52 4.80 7.50 -1.80 -2.92 115.11 121.46 3kp7 h GLN 56 Ca -0.06 -0.02 0.09 0.00 0.50 0.00 0.00 58.65 59.16 3kp7 h GLN 56 Cb 0.42 -0.08 -0.07 0.00 0.05 0.00 0.00 27.48 27.79 3kp7 h GLN 56 CO 0.09 0.24 0.13 0.82 -1.50 0.00 0.00 178.83 178.61 3kp7 h ILE 57 N 0.38 0.74 -0.77 2.54 2.04 -1.61 -2.44 117.51 118.39 3kp7 h ILE 57 Ca 0.20 -0.09 -0.04 0.00 1.00 0.00 0.00 64.86 65.93 3kp7 h ILE 57 Cb 0.16 0.44 -0.03 0.00 -0.74 0.00 0.00 36.82 36.65 3kp7 h ILE 57 CO -0.18 0.05 0.31 0.74 0.00 0.00 0.00 178.15 179.07 3kp7 h THR 58 N 0.27 1.25 0.00 -0.27 2.02 -1.29 -1.93 112.91 112.96 3kp7 h THR 58 Ca 0.26 -0.80 0.00 0.00 0.77 0.00 0.00 66.41 66.64 3kp7 h THR 58 Cb 0.34 0.33 0.00 0.00 -1.74 0.00 0.00 68.15 67.08 3kp7 h THR 58 CO -0.32 0.33 0.00 -0.62 0.37 0.00 0.00 175.52 175.28 3kp7 n GLU 59 N -4.28 0.00 -0.27 6.66 -0.58 -0.96 -1.07 120.64 120.14 3kp7 n GLU 59 Ca 0.07 0.39 0.05 0.00 -0.42 0.00 0.00 57.16 57.25 3kp7 n GLU 59 Cb 0.18 -1.30 0.14 0.00 -0.57 0.00 0.00 31.44 29.90 3kp7 n GLU 59 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 3kp7 h LYS 60 N 0.00 0.05 -0.05 3.49 1.57 -1.57 0.41 116.57 120.48 3kp7 h LYS 60 Ca 0.00 -0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.80 3kp7 h LYS 60 Cb 0.00 -0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.24 3kp7 h LYS 60 CO 0.00 0.04 -0.53 0.37 -0.57 0.00 0.00 179.45 178.76 3kp7 h GLN 61 N 0.06 -0.61 0.00 3.15 5.75 -1.41 -3.48 115.11 118.57 3kp7 h GLN 61 Ca 0.41 0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.95 3kp7 h GLN 61 Cb 0.71 0.14 0.00 0.00 1.07 0.00 0.00 27.48 29.40 3kp7 h GLN 61 CO -0.73 -0.41 0.00 0.41 -2.65 0.00 0.00 178.83 175.45 3kp7 n GLY 62 N -1.45 0.12 3.56 2.39 0.00 0.14 -4.97 105.19 104.98 3kp7 n GLY 62 Ca -0.07 -1.75 -0.25 0.00 0.00 0.00 0.00 46.02 43.95 3kp7 n GLY 62 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3kp7 s VAL 63 N -0.82 3.13 -0.36 1.61 -7.23 -1.26 -4.49 120.40 110.98 3kp7 s VAL 63 Ca 0.00 -0.04 -0.05 0.00 -1.81 0.00 0.00 61.98 60.08 3kp7 s VAL 63 Cb 0.00 -3.31 0.20 0.00 0.56 0.00 0.00 36.38 33.83 3kp7 s VAL 63 CO 0.00 -0.29 1.01 0.20 -0.31 0.00 0.00 175.10 175.70 3kp7 s ASN 64 N 10.41 -0.53 0.03 4.85 0.01 -1.26 -5.02 114.94 123.44 3kp7 s ASN 64 Ca 0.87 -0.48 -0.16 0.00 -0.71 0.00 0.00 52.86 52.38 3kp7 s ASN 64 Cb -0.13 0.68 -0.35 0.00 0.41 0.00 0.00 41.25 41.86 3kp7 s ASN 64 CO 0.13 -0.03 1.01 0.11 -1.51 0.00 0.00 177.10 176.81 3kp7 h LYS 65 N 4.88 0.55 0.00 -0.60 1.57 -1.91 -3.39 116.57 117.68 3kp7 h LYS 65 Ca -0.00 -0.92 0.00 0.00 -1.87 0.00 0.00 60.65 57.86 3kp7 h LYS 65 Cb 1.18 0.34 0.00 0.00 0.08 0.00 0.00 32.23 33.83 3kp7 h LYS 65 CO -0.07 1.44 0.00 0.00 -0.57 0.00 0.00 179.45 180.25 3kp7 n ALA 66 N -2.71 1.66 0.21 3.86 0.00 -1.26 -4.47 120.51 117.80 3kp7 n ALA 66 Ca -0.16 -0.17 0.10 0.00 0.00 0.00 0.00 53.44 53.20 3kp7 n ALA 66 Cb 1.10 0.00 0.21 0.00 0.00 0.00 0.00 19.45 20.75 3kp7 n ALA 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3kp7 h ALA 67 N 0.00 0.92 0.16 0.00 0.00 -1.96 -2.91 119.26 115.48 3kp7 h ALA 67 Ca 0.00 -0.13 -0.34 0.00 0.00 0.00 0.00 54.91 54.44 3kp7 h ALA 67 Cb 0.06 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.83 3kp7 h ALA 67 CO 0.00 0.18 -1.74 -0.24 0.00 0.00 0.00 179.25 177.44 3kp7 h VAL 68 N 0.00 0.93 -0.39 0.00 3.04 -1.82 -3.11 116.25 114.90 3kp7 h VAL 68 Ca -0.00 -2.55 -0.01 0.00 -1.01 0.00 0.00 66.70 63.13 3kp7 h VAL 68 Cb 1.03 2.72 -0.02 0.00 -2.01 0.00 0.00 31.29 33.00 3kp7 h VAL 68 CO 0.02 0.84 0.21 -1.28 -1.01 0.00 0.00 177.57 176.35 3kp7 h SER 69 N 0.09 0.47 0.27 3.17 0.87 -1.77 -1.60 113.55 115.05 3kp7 h SER 69 Ca -0.33 -0.03 -0.01 0.00 -1.23 0.00 0.00 61.79 60.19 3kp7 h SER 69 Cb 2.07 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 63.92 3kp7 h SER 69 CO 0.16 0.38 -0.13 0.03 -0.53 0.00 0.00 176.83 176.74 3kp7 h ARG 70 N 0.54 -0.34 -0.65 2.24 3.08 -1.60 -1.63 114.38 116.00 3kp7 h ARG 70 Ca 0.14 0.02 0.14 0.00 0.07 0.00 0.00 59.98 60.35 3kp7 h ARG 70 Cb 0.02 0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.11 3kp7 h ARG 70 CO -0.02 0.00 0.44 0.00 -1.07 0.00 0.00 179.97 179.32 3kp7 h ARG 71 N -0.78 0.29 -0.22 0.04 -0.00 -1.44 -0.67 114.38 111.60 3kp7 h ARG 71 Ca -0.04 -0.02 -0.07 0.00 -0.50 0.00 0.00 59.98 59.35 3kp7 h ARG 71 Cb 0.50 -0.07 -0.00 0.00 0.00 0.00 0.00 29.97 30.40 3kp7 h ARG 71 CO 0.06 0.19 -0.15 0.28 0.00 0.00 0.00 179.97 180.35 3kp7 h VAL 72 N 0.30 1.31 -0.08 2.04 2.07 -1.19 -1.83 116.25 118.87 3kp7 h VAL 72 Ca 0.31 -1.26 0.04 0.00 0.82 0.00 0.00 66.70 66.61 3kp7 h VAL 72 Cb 0.82 1.67 -0.04 0.00 -1.52 0.00 0.00 31.29 32.21 3kp7 h VAL 72 CO -0.08 0.39 -0.18 0.11 0.02 0.00 0.00 177.57 177.83 3kp7 h LYS 73 N 0.18 -0.24 -0.82 1.57 1.57 -0.17 0.33 116.57 118.99 3kp7 h LYS 73 Ca 0.04 0.02 0.07 0.00 -1.87 0.00 0.00 60.65 58.91 3kp7 h LYS 73 Cb 0.67 0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.98 3kp7 h LYS 73 CO 0.04 -0.16 0.53 0.87 -0.57 0.00 0.00 179.45 180.16 3kp7 h LYS 74 N -0.25 0.84 -0.16 3.15 1.57 -1.17 -1.09 116.57 119.46 3kp7 h LYS 74 Ca 0.08 -0.05 -0.17 0.00 -1.87 0.00 0.00 60.65 58.64 3kp7 h LYS 74 Cb 0.37 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 3kp7 h LYS 74 CO -0.23 0.56 -0.59 -0.07 -0.57 0.00 0.00 179.45 178.54 3kp7 h LEU 75 N 0.87 0.60 -1.00 2.94 3.38 -0.39 -2.11 115.31 119.60 3kp7 h LEU 75 Ca 0.36 -0.34 -0.05 0.00 0.09 0.00 0.00 57.88 57.94 3kp7 h LEU 75 Cb 0.28 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 3kp7 h LEU 75 CO -0.13 1.05 0.15 -0.07 0.09 0.00 0.00 178.44 179.53 3kp7 h LEU 76 N 0.40 0.81 -0.20 1.67 3.38 0.60 -2.54 115.31 119.43 3kp7 h LEU 76 Ca -0.00 -0.14 -0.12 0.00 0.09 0.00 0.00 57.88 57.70 3kp7 h LEU 76 Cb 1.15 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.67 3kp7 h LEU 76 CO 0.11 0.79 -0.57 0.78 0.09 0.00 0.00 178.44 179.64 3kp7 h ASN 77 N 0.84 0.00 0.87 -0.43 2.35 -1.19 -3.10 115.58 114.93 3kp7 h ASN 77 Ca 0.19 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.94 3kp7 h ASN 77 Cb 0.29 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.66 3kp7 h ASN 77 CO -0.00 0.57 0.00 0.00 -1.65 0.00 0.00 177.43 176.34 3kp7 n ALA 78 N -2.26 2.30 -1.53 -0.83 0.00 -0.80 -4.92 120.51 112.47 3kp7 n ALA 78 Ca 0.01 -0.10 -0.05 0.00 0.00 0.00 0.00 53.44 53.30 3kp7 n ALA 78 Cb 0.72 -1.45 -0.01 0.00 0.00 0.00 0.00 19.45 18.71 3kp7 n ALA 78 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3kp7 n GLU 79 N -1.46 -0.36 -0.07 0.00 1.02 -1.04 -4.92 120.64 113.82 3kp7 n GLU 79 Ca 0.08 0.49 -0.11 0.00 -0.02 0.00 0.00 57.16 57.60 3kp7 n GLU 79 Cb 0.30 -4.22 -0.15 0.00 -0.02 0.00 0.00 31.44 27.35 3kp7 n GLU 79 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3kp7 n LEU 80 N -0.61 0.62 -4.72 -4.62 4.77 -1.00 -4.49 117.00 106.95 3kp7 n LEU 80 Ca -0.05 0.13 -0.23 0.00 -0.03 0.00 0.00 56.01 55.83 3kp7 n LEU 80 Cb 0.32 0.22 -0.06 0.00 -2.33 0.00 0.00 43.42 41.57 3kp7 n LEU 80 CO 0.07 0.51 -0.24 -0.69 -1.33 0.00 0.00 177.39 175.71 3kp7 s VAL 81 N -2.53 3.67 -0.07 4.08 1.01 -1.19 -0.76 120.40 124.61 3kp7 s VAL 81 Ca -0.11 -1.70 -0.06 0.00 0.00 0.00 0.00 61.98 60.11 3kp7 s VAL 81 Cb 0.07 -3.05 0.02 0.00 0.00 0.00 0.00 36.38 33.42 3kp7 s VAL 81 CO 0.81 -0.32 0.18 -0.75 0.00 0.00 0.00 175.10 175.02 3kp7 s LYS 82 N -3.77 0.22 0.39 2.72 2.20 0.13 -4.67 119.74 116.96 3kp7 s LYS 82 Ca 0.33 0.24 0.06 0.00 -0.36 0.00 0.00 55.97 56.25 3kp7 s LYS 82 Cb -0.06 0.11 0.00 0.00 -1.51 0.00 0.00 37.83 36.37 3kp7 s LYS 82 CO 0.22 -0.03 0.54 -0.51 -0.36 0.00 0.00 175.35 175.22 3kp7 s LEU 83 N 0.07 3.79 0.00 5.43 1.43 -1.26 -0.71 118.68 127.43 3kp7 s LEU 83 Ca -0.00 -0.22 0.00 0.00 -1.03 0.00 0.00 54.13 52.88 3kp7 s LEU 83 Cb -0.01 -2.76 0.00 0.00 0.03 0.00 0.00 46.19 43.44 3kp7 s LEU 83 CO 0.00 -0.62 0.00 0.29 0.23 0.00 0.00 176.35 176.25 3kp7 n LYS 95 N -1.80 0.00 -3.13 1.70 5.02 -1.26 -5.01 118.16 113.68 3kp7 n LYS 95 Ca 0.03 0.00 -0.44 0.00 -2.02 0.00 0.00 58.31 55.89 3kp7 n LYS 95 Cb 0.58 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.54 3kp7 n LYS 95 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3kp7 s ILE 96 N 0.00 4.83 -0.34 -0.18 1.01 -1.26 -4.25 121.20 121.01 3kp7 s ILE 96 Ca 0.00 -0.55 -0.15 0.00 0.00 0.00 0.00 60.65 59.95 3kp7 s ILE 96 Cb 0.00 -4.36 -0.01 0.00 0.01 0.00 0.00 42.46 38.10 3kp7 s ILE 96 CO 0.00 -0.90 0.37 -0.63 0.00 0.00 0.00 174.94 173.78 3kp7 s ILE 97 N 2.74 5.16 0.42 2.92 1.01 0.90 -4.93 121.20 129.42 3kp7 s ILE 97 Ca 0.15 0.05 0.03 0.00 0.00 0.00 0.00 60.65 60.88 3kp7 s ILE 97 Cb -0.20 -3.83 -0.04 0.00 0.01 0.00 0.00 42.46 38.41 3kp7 s ILE 97 CO 0.11 -0.10 0.05 -0.54 0.00 0.00 0.00 174.94 174.46 3kp7 s LYS 98 N 2.03 1.96 0.23 2.79 1.02 0.11 -1.86 119.74 126.03 3kp7 s LYS 98 Ca 0.12 -2.18 -0.09 0.00 0.02 0.00 0.00 55.97 53.84 3kp7 s LYS 98 Cb -0.17 -1.12 -0.07 0.00 -0.52 0.00 0.00 37.83 35.96 3kp7 s LYS 98 CO 0.12 -0.31 0.54 -0.51 -0.92 0.00 0.00 175.35 174.26 3kp7 s LEU 99 N -3.68 4.16 0.52 3.17 1.43 -1.26 0.17 118.68 123.18 3kp7 s LEU 99 Ca 0.23 0.87 0.09 0.00 -1.03 0.00 0.00 54.13 54.28 3kp7 s LEU 99 Cb 0.05 -3.64 0.06 0.00 0.03 0.00 0.00 46.19 42.69 3kp7 s LEU 99 CO 0.12 -0.08 0.71 -0.94 0.23 0.00 0.00 176.35 176.38 3kp7 s SER 100 N -2.48 5.31 0.37 2.29 1.04 0.06 -4.70 113.70 115.59 3kp7 s SER 100 Ca 0.46 -0.66 0.27 0.00 0.48 0.00 0.00 55.95 56.50 3kp7 s SER 100 Cb -0.11 -0.10 1.29 0.00 0.10 0.00 0.00 66.02 67.21 3kp7 s SER 100 CO 0.23 -1.12 1.81 0.78 0.98 0.00 0.00 173.24 175.91 3kp7 h ASN 101 N 0.34 0.00 0.61 7.02 4.21 -1.88 0.51 115.58 126.39 3kp7 h ASN 101 Ca -0.34 0.00 -0.27 0.00 1.21 0.00 0.00 56.30 56.90 3kp7 h ASN 101 Cb 1.28 0.00 -0.05 0.00 -1.12 0.00 0.00 38.32 38.44 3kp7 h ASN 101 CO 0.43 0.00 -1.55 0.50 -1.29 0.00 0.00 177.43 175.52 3kp7 h LYS 102 N 0.00 0.00 -0.02 0.81 3.64 -1.87 -2.89 116.57 116.24 3kp7 h LYS 102 Ca 0.00 0.00 -0.20 0.00 -1.27 0.00 0.00 60.65 59.18 3kp7 h LYS 102 Cb 0.18 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.00 3kp7 h LYS 102 CO 0.00 0.60 -0.84 0.78 -2.27 0.00 0.00 179.45 177.72 3kp7 h GLY 103 N 3.40 0.32 2.00 5.01 0.00 -1.11 -2.79 103.07 109.90 3kp7 h GLY 103 Ca -0.22 -0.52 -0.14 0.00 0.00 0.00 0.00 47.33 46.45 3kp7 h GLY 103 CO 0.09 0.46 -0.65 0.50 0.00 0.00 0.00 176.54 176.94 3kp7 h LYS 104 N 0.17 0.00 -0.00 4.80 1.57 -1.08 -2.37 116.57 119.66 3kp7 h LYS 104 Ca -0.05 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.63 3kp7 h LYS 104 Cb 1.44 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.74 3kp7 h LYS 104 CO 0.13 0.65 -0.49 -0.22 -0.57 0.00 0.00 179.45 178.95 3kp7 h LYS 105 N 0.00 0.01 -0.22 3.15 3.64 -1.41 -0.96 116.57 120.77 3kp7 h LYS 105 Ca -0.01 -0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.25 3kp7 h LYS 105 Cb 1.19 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.01 3kp7 h LYS 105 CO 0.08 0.50 -0.33 -0.92 -2.27 0.00 0.00 179.45 176.51 3kp7 h TYR 106 N 0.01 0.77 -0.47 1.91 3.20 -1.20 -2.44 116.97 118.75 3kp7 h TYR 106 Ca -0.00 -0.26 -0.08 0.00 3.14 0.00 0.00 58.73 61.53 3kp7 h TYR 106 Cb 0.88 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.97 3kp7 h TYR 106 CO 0.00 1.00 -0.02 0.82 -1.64 0.00 0.00 178.16 178.32 3kp7 h ILE 107 N 0.31 1.24 -0.25 1.81 1.08 -1.18 -1.17 117.51 119.36 3kp7 h ILE 107 Ca 0.02 -1.02 -0.18 0.00 -0.39 0.00 0.00 64.86 63.28 3kp7 h ILE 107 Cb 0.92 0.91 0.00 0.00 -3.07 0.00 0.00 36.82 35.57 3kp7 h ILE 107 CO 0.08 0.36 -0.58 0.11 -0.69 0.00 0.00 178.15 177.43 3kp7 h LYS 108 N 0.73 0.79 0.00 2.37 1.79 -1.17 0.56 116.57 121.64 3kp7 h LYS 108 Ca 0.14 -0.52 -0.08 0.00 -2.18 0.00 0.00 60.65 58.01 3kp7 h LYS 108 Cb 0.47 0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 31.18 3kp7 h LYS 108 CO 0.02 1.15 -0.40 0.93 -1.08 0.00 0.00 179.45 180.07 3kp7 h GLU 109 N 0.60 0.00 -0.33 3.15 5.08 -1.34 -0.95 114.58 120.80 3kp7 h GLU 109 Ca 0.01 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.27 3kp7 h GLU 109 Cb 1.17 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.41 3kp7 h GLU 109 CO 0.12 0.40 -0.15 -0.09 -1.00 0.00 0.00 179.01 178.29 3kp7 h ARG 110 N 0.00 0.68 -0.79 2.33 2.43 -0.80 -2.31 114.38 115.93 3kp7 h ARG 110 Ca -0.00 -0.29 -0.03 0.00 -0.81 0.00 0.00 59.98 58.84 3kp7 h ARG 110 Cb 0.72 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 30.21 3kp7 h ARG 110 CO 0.05 0.89 0.36 0.87 -1.51 0.00 0.00 179.97 180.63 3kp7 h LYS 111 N 0.45 1.14 -0.55 0.20 1.57 -0.49 -2.25 116.57 116.62 3kp7 h LYS 111 Ca 0.07 -0.17 -0.09 0.00 -1.87 0.00 0.00 60.65 58.59 3kp7 h LYS 111 Cb 0.68 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.77 3kp7 h LYS 111 CO 0.05 0.89 0.01 0.00 -0.57 0.00 0.00 179.45 179.83 3kp7 h ALA 112 N 1.27 0.75 -0.22 3.86 0.00 -1.06 -0.83 119.26 123.03 3kp7 h ALA 112 Ca 0.27 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 3kp7 h ALA 112 Cb 0.14 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3kp7 h ALA 112 CO -0.03 0.56 0.05 0.82 0.00 0.00 0.00 179.25 180.66 3kp7 h ILE 113 N 0.85 1.21 -0.26 0.00 2.04 -1.14 -2.64 117.51 117.57 3kp7 h ILE 113 Ca 0.16 -0.68 -0.04 0.00 1.00 0.00 0.00 64.86 65.30 3kp7 h ILE 113 Cb 0.52 1.23 -0.01 0.00 -0.74 0.00 0.00 36.82 37.83 3kp7 h ILE 113 CO 0.03 0.21 0.01 0.24 0.00 0.00 0.00 178.15 178.64 3kp7 h MET 114 N 0.18 0.46 -0.55 2.37 2.86 -1.34 -2.75 114.93 116.15 3kp7 h MET 114 Ca 0.07 -0.14 0.02 0.00 -2.06 0.00 0.00 59.70 57.59 3kp7 h MET 114 Cb 0.28 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 31.86 3kp7 h MET 114 CO 0.00 0.61 0.34 0.66 1.06 0.00 0.00 176.91 179.58 3kp7 h SER 115 N 0.25 0.55 -0.64 1.22 4.64 -1.17 0.29 113.55 118.69 3kp7 h SER 115 Ca 0.08 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.34 3kp7 h SER 115 Cb 0.40 -0.12 -0.03 0.00 -0.31 0.00 0.00 62.40 62.35 3kp7 h SER 115 CO 0.01 0.39 0.20 0.45 -0.87 0.00 0.00 176.83 177.01 3kp7 h HIS 116 N 0.67 1.04 -0.04 4.77 -0.00 -1.48 0.66 115.15 120.78 3kp7 h HIS 116 Ca 0.22 -0.11 -0.01 0.00 -0.00 0.00 0.00 60.37 60.47 3kp7 h HIS 116 Cb 0.01 -0.30 -0.00 0.00 -0.00 0.00 0.00 27.41 27.12 3kp7 h HIS 116 CO -0.06 0.85 -0.03 0.82 -0.00 0.00 0.00 177.93 179.51 3kp7 h ILE 117 N 0.93 1.37 -0.85 2.45 1.08 -1.14 -2.65 117.51 118.70 3kp7 h ILE 117 Ca 0.21 -1.15 0.04 0.00 -0.39 0.00 0.00 64.86 63.57 3kp7 h ILE 117 Cb 0.30 2.06 -0.05 0.00 -3.07 0.00 0.00 36.82 36.06 3kp7 h ILE 117 CO -0.01 0.31 0.55 0.00 -0.69 0.00 0.00 178.15 178.31 3kp7 h ALA 118 N 0.55 1.14 -0.39 1.87 0.00 -0.28 -1.76 119.26 120.38 3kp7 h ALA 118 Ca 0.01 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.76 3kp7 h ALA 118 Cb 0.52 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3kp7 h ALA 118 CO 0.01 0.37 -0.26 0.66 0.00 0.00 0.00 179.25 180.03 3kp7 h SER 119 N 1.05 0.84 -1.01 0.00 4.64 -0.90 -2.74 113.55 115.44 3kp7 h SER 119 Ca 0.35 -0.32 0.03 0.00 -0.47 0.00 0.00 61.79 61.37 3kp7 h SER 119 Cb 0.04 -0.23 -0.06 0.00 -0.31 0.00 0.00 62.40 61.84 3kp7 h SER 119 CO -0.13 1.05 0.66 0.44 -0.87 0.00 0.00 176.83 177.99 3kp7 h ASP 120 N 0.70 1.12 0.00 4.97 3.45 -1.02 0.50 116.42 126.14 3kp7 h ASP 120 Ca 0.09 -0.02 0.00 0.00 0.43 0.00 0.00 57.03 57.53 3kp7 h ASP 120 Cb 0.79 -0.26 0.00 0.00 -0.56 0.00 0.00 39.33 39.30 3kp7 h ASP 120 CO 0.07 0.78 0.00 0.23 -1.57 0.00 0.00 179.24 178.74 3kp7 n MET 121 N -4.42 0.85 0.00 3.56 2.81 -0.72 -3.76 117.12 115.43 3kp7 n MET 121 Ca 0.13 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.02 3kp7 n MET 121 Cb 0.07 -1.47 0.00 0.00 -0.71 0.00 0.00 33.22 31.11 3kp7 n MET 121 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 3kp7 n THR 122 N -0.97 0.00 -0.13 2.03 -1.04 0.01 -4.84 114.28 109.34 3kp7 n THR 122 Ca 0.19 -0.17 0.26 0.00 -2.04 0.00 0.00 64.05 62.29 3kp7 n THR 122 Cb 0.09 0.81 0.72 0.00 -1.82 0.00 0.00 70.33 70.12 3kp7 n THR 122 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 3kp7 h SER 123 N 0.00 0.00 0.49 8.00 4.64 -0.19 -1.43 113.55 125.05 3kp7 h SER 123 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3kp7 h SER 123 Cb 0.00 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3kp7 h SER 123 CO 0.00 0.00 -0.19 -0.90 -0.87 0.00 0.00 176.83 174.87 3kp7 n ASP 124 N -4.30 0.46 -4.85 4.97 5.68 -1.26 -4.89 116.55 112.35 3kp7 n ASP 124 Ca 0.16 -0.35 -0.31 0.00 -0.50 0.00 0.00 54.79 53.78 3kp7 n ASP 124 Cb 0.87 -0.06 -0.04 0.00 -1.14 0.00 0.00 41.12 40.76 3kp7 n ASP 124 CO 0.00 0.00 0.00 -0.36 -1.33 0.00 0.00 177.20 175.51 3kp7 s PHE 125 N -2.68 3.45 0.11 2.11 0.40 -0.54 -5.03 117.98 115.80 3kp7 s PHE 125 Ca 0.22 1.31 -0.30 0.00 -0.60 0.00 0.00 56.93 57.55 3kp7 s PHE 125 Cb 0.19 -2.65 -0.07 0.00 0.51 0.00 0.00 43.02 41.00 3kp7 s PHE 125 CO 0.54 -0.25 1.21 0.34 0.70 0.00 0.00 175.22 177.77 3kp7 s ASP 126 N -3.04 7.06 0.39 1.36 2.15 -1.26 -4.93 116.67 118.40 3kp7 s ASP 126 Ca 0.56 2.12 0.17 0.00 0.43 0.00 0.00 52.55 55.84 3kp7 s ASP 126 Cb -0.10 -2.59 1.07 0.00 -0.30 0.00 0.00 42.92 41.00 3kp7 s ASP 126 CO 0.30 -0.44 1.79 0.77 -0.17 0.00 0.00 175.17 177.42 3kp7 h SER 127 N 6.20 0.47 1.61 -0.34 4.64 -1.95 0.26 113.55 124.43 3kp7 h SER 127 Ca -0.43 0.07 -0.00 0.00 -0.47 0.00 0.00 61.79 60.96 3kp7 h SER 127 Cb 1.21 -0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.30 3kp7 h SER 127 CO 0.79 0.12 -0.01 0.07 -0.87 0.00 0.00 176.83 176.93 3kp7 h LYS 128 N 0.43 0.00 0.01 4.77 2.10 -1.98 -1.26 116.57 120.64 3kp7 h LYS 128 Ca 0.56 0.00 -0.16 0.00 -2.00 0.00 0.00 60.65 59.06 3kp7 h LYS 128 Cb 1.38 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 32.72 3kp7 h LYS 128 CO -0.27 0.01 -0.63 0.93 -2.00 0.00 0.00 179.45 177.48 3kp7 h GLU 129 N 0.00 0.40 -0.76 0.07 5.08 -0.88 -2.16 114.58 116.33 3kp7 h GLU 129 Ca -0.00 -0.45 -0.04 0.00 -1.00 0.00 0.00 59.36 57.87 3kp7 h GLU 129 Cb 0.82 0.13 -0.03 0.00 0.50 0.00 0.00 28.75 30.17 3kp7 h GLU 129 CO 0.00 1.12 0.32 0.82 -1.00 0.00 0.00 179.01 180.27 3kp7 h ILE 130 N -0.12 1.25 -0.39 3.13 1.08 -1.32 -2.67 117.51 118.48 3kp7 h ILE 130 Ca -0.08 -0.78 -0.04 0.00 -0.39 0.00 0.00 64.86 63.56 3kp7 h ILE 130 Cb 1.35 0.34 -0.02 0.00 -3.07 0.00 0.00 36.82 35.43 3kp7 h ILE 130 CO 0.12 0.32 0.06 -0.33 -0.69 0.00 0.00 178.15 177.63 3kp7 h GLU 131 N 1.10 0.59 -0.66 2.37 5.08 -1.22 -0.03 114.58 121.80 3kp7 h GLU 131 Ca 0.26 -0.11 -0.06 0.00 -1.00 0.00 0.00 59.36 58.45 3kp7 h GLU 131 Cb 0.20 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.33 3kp7 h GLU 131 CO -0.02 0.57 0.19 -0.22 -1.00 0.00 0.00 179.01 178.52 3kp7 h LYS 132 N 0.57 1.04 -0.33 2.33 3.11 -1.08 0.80 116.57 123.00 3kp7 h LYS 132 Ca 0.13 -0.23 -0.02 0.00 -2.81 0.00 0.00 60.65 57.71 3kp7 h LYS 132 Cb 0.27 -0.14 -0.01 0.00 -1.00 0.00 0.00 32.23 31.34 3kp7 h LYS 132 CO 0.00 0.92 0.12 0.28 -2.81 0.00 0.00 179.45 177.95 3kp7 h VAL 133 N 0.97 1.20 -0.55 2.00 2.07 -1.07 -1.75 116.25 119.11 3kp7 h VAL 133 Ca 0.21 -0.63 0.03 0.00 0.82 0.00 0.00 66.70 67.13 3kp7 h VAL 133 Cb 0.33 0.99 -0.04 0.00 -1.52 0.00 0.00 31.29 31.04 3kp7 h VAL 133 CO -0.00 0.22 0.31 -0.09 0.02 0.00 0.00 177.57 178.03 3kp7 h ARG 134 N 0.39 0.59 -0.54 1.57 9.65 -0.64 -1.62 114.38 123.78 3kp7 h ARG 134 Ca 0.11 -0.04 -0.06 0.00 -1.10 0.00 0.00 59.98 58.90 3kp7 h ARG 134 Cb 0.22 -0.13 -0.02 0.00 -1.39 0.00 0.00 29.97 28.65 3kp7 h ARG 134 CO -0.01 0.39 0.12 1.96 2.80 0.00 0.00 179.97 185.24 3kp7 h GLN 135 N 0.61 0.88 -0.66 0.20 4.20 -0.67 0.22 115.11 119.88 3kp7 h GLN 135 Ca 0.23 -0.22 -0.07 0.00 0.06 0.00 0.00 58.65 58.65 3kp7 h GLN 135 Cb 0.07 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 27.71 3kp7 h GLN 135 CO -0.12 0.83 0.14 0.28 -0.67 0.00 0.00 178.83 179.29 3kp7 h VAL 136 N 0.78 1.26 -0.05 -0.54 2.07 -1.18 -1.06 116.25 117.52 3kp7 h VAL 136 Ca 0.17 -0.98 -0.13 0.00 0.82 0.00 0.00 66.70 66.58 3kp7 h VAL 136 Cb 0.36 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 3kp7 h VAL 136 CO 0.00 0.37 -0.57 -0.07 0.02 0.00 0.00 177.57 177.32 3kp7 h LEU 137 N 0.99 0.18 -0.38 2.57 3.38 -1.02 -1.54 115.31 119.49 3kp7 h LEU 137 Ca 0.20 -0.10 -0.15 0.00 0.09 0.00 0.00 57.88 57.93 3kp7 h LEU 137 Cb 0.39 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 3kp7 h LEU 137 CO 0.01 0.72 -0.33 -0.33 0.09 0.00 0.00 178.44 178.59 3kp7 h GLU 138 N 0.13 0.90 -0.44 1.13 5.08 -0.32 0.66 114.58 121.72 3kp7 h GLU 138 Ca -0.00 -0.46 -0.07 0.00 -1.00 0.00 0.00 59.36 57.83 3kp7 h GLU 138 Cb 1.04 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.28 3kp7 h GLU 138 CO 0.08 1.11 -0.01 0.97 -1.00 0.00 0.00 179.01 180.16 3kp7 h ILE 139 N 0.71 1.23 -0.18 3.13 2.10 -1.00 0.66 117.51 124.17 3kp7 h ILE 139 Ca 0.07 -0.96 -0.05 0.00 1.08 0.00 0.00 64.86 65.00 3kp7 h ILE 139 Cb 0.92 0.90 -0.01 0.00 -1.09 0.00 0.00 36.82 37.54 3kp7 h ILE 139 CO 0.08 0.34 -0.06 0.40 -1.08 0.00 0.00 178.15 177.82 3kp7 h ILE 140 N 0.68 1.30 -0.86 2.19 2.04 -1.05 -2.45 117.51 119.36 3kp7 h ILE 140 Ca 0.13 -1.08 -0.02 0.00 1.00 0.00 0.00 64.86 64.90 3kp7 h ILE 140 Cb 0.43 1.64 -0.04 0.00 -0.74 0.00 0.00 36.82 38.10 3kp7 h ILE 140 CO 0.02 0.32 0.46 -0.78 0.00 0.00 0.00 178.15 178.17 3kp7 h ASP 141 N 0.06 1.08 -0.14 1.72 -0.00 -0.58 0.57 116.42 119.12 3kp7 h ASP 141 Ca 0.04 -0.10 0.05 0.00 -0.00 0.00 0.00 57.03 57.02 3kp7 h ASP 141 Cb 0.53 -0.27 -0.06 0.00 -0.00 0.00 0.00 39.33 39.53 3kp7 h ASP 141 CO 0.02 0.87 -0.23 0.22 -0.00 0.00 0.00 179.24 180.12 3kp7 h TYR 142 N 1.20 -0.60 -0.43 0.28 3.20 -0.77 -1.03 116.97 118.83 3kp7 h TYR 142 Ca 0.30 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 62.13 3kp7 h TYR 142 Cb 0.04 0.29 -0.02 0.00 1.54 0.00 0.00 36.73 38.57 3kp7 h TYR 142 CO 0.01 -0.31 -0.04 0.00 -1.64 0.00 0.00 178.16 176.18 3kp7 h ARG 143 N -0.28 0.72 0.16 1.82 3.08 -0.94 -1.27 114.38 117.68 3kp7 h ARG 143 Ca 0.10 -0.20 -0.01 0.00 0.07 0.00 0.00 59.98 59.94 3kp7 h ARG 143 Cb 0.44 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.41 3kp7 h ARG 143 CO -0.30 0.77 -0.08 0.82 -1.07 0.00 0.00 179.97 180.11 3kp7 h ILE 144 N 0.67 0.95 -0.90 2.04 2.04 -0.55 -2.05 117.51 119.71 3kp7 h ILE 144 Ca 0.13 -0.57 0.08 0.00 1.00 0.00 0.00 64.86 65.50 3kp7 h ILE 144 Cb 0.48 1.29 -0.06 0.00 -0.74 0.00 0.00 36.82 37.79 3kp7 h ILE 144 CO 0.02 0.13 0.58 1.56 0.00 0.00 0.00 178.15 180.45 3kp7 h GLN 145 N -0.50 0.93 0.00 2.37 4.20 -1.12 0.14 115.11 121.13 3kp7 h GLN 145 Ca -0.02 -0.06 -0.06 0.00 0.06 0.00 0.00 58.65 58.57 3kp7 h GLN 145 Cb 0.38 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 3kp7 h GLN 145 CO 0.04 0.61 -0.27 1.03 -0.67 0.00 0.00 178.83 179.57 3kp7 h SER 146 N 0.96 0.00 0.11 1.46 0.87 -1.14 -2.60 113.55 113.20 3kp7 h SER 146 Ca 0.40 0.00 -0.22 0.00 -1.23 0.00 0.00 61.79 60.74 3kp7 h SER 146 Cb 0.31 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.27 3kp7 h SER 146 CO -0.16 0.27 -1.07 0.22 -0.53 0.00 0.00 176.83 175.55 3kp7 h TYR 147 N 0.00 0.43 0.00 2.24 5.03 -0.06 -3.24 116.97 121.36 3kp7 h TYR 147 Ca -0.00 -0.31 0.00 0.00 2.58 0.00 0.00 58.73 61.00 3kp7 h TYR 147 Cb 0.52 -0.02 0.00 0.00 1.55 0.00 0.00 36.73 38.78 3kp7 h TYR 147 CO 0.00 1.42 0.00 1.15 -1.32 0.00 0.00 178.16 179.41 3kp7 h THR 148 N -0.42 0.00 -0.17 1.81 2.02 -1.09 -1.44 112.91 113.62 3kp7 h THR 148 Ca -0.22 -0.21 -0.07 0.00 0.77 0.00 0.00 66.41 66.68 3kp7 h THR 148 Cb 1.64 0.98 -0.00 0.00 -1.74 0.00 0.00 68.15 69.02 3kp7 h THR 148 CO 0.08 0.00 -0.16 -1.28 0.37 0.00 0.00 175.52 174.52 3kp7 h SER 149 N 0.00 0.44 0.01 4.18 0.87 -1.52 -3.31 113.55 114.22 3kp7 h SER 149 Ca 0.00 -0.47 -0.00 0.00 -1.23 0.00 0.00 61.79 60.09 3kp7 h SER 149 Cb 0.27 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 62.11 3kp7 h SER 149 CO 0.00 0.83 -0.01 0.11 -0.53 0.00 0.00 176.83 177.23 3kp7 h LYS 150 N 0.07 -0.01 0.00 2.24 1.57 -1.30 -3.52 116.57 115.61 3kp7 h LYS 150 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 3kp7 h LYS 150 Cb 0.70 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.01 3kp7 h LYS 150 CO 0.04 0.53 0.00 1.28 -0.57 0.00 0.00 179.45 180.73