#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k7r s GLU 2 N 0.00 2.70 -1.08 3.17 1.03 -1.26 -5.05 118.70 118.22 2k7r s GLU 2 Ca 0.00 -0.67 -0.22 0.00 0.03 0.00 0.00 54.97 54.11 2k7r s GLU 2 Cb 0.00 -2.62 0.04 0.00 -0.80 0.00 0.00 34.13 30.76 2k7r s GLU 2 CO 0.00 0.61 1.56 -2.14 -1.33 0.00 0.00 175.26 173.96 2k7r s PRO 3 N -1.66 3.57 0.03 -4.83 0.02 -1.26 -4.79 135.00 126.08 2k7r s PRO 3 Ca 0.20 -1.25 -0.19 0.00 0.02 0.00 0.00 61.00 59.79 2k7r s PRO 3 Cb -0.11 -5.37 -0.20 0.00 0.02 0.00 0.00 34.50 28.83 2k7r s PRO 3 CO 0.11 -2.36 1.18 0.82 -0.33 0.00 0.00 177.00 176.42 2k7r h ILE 4 N 6.55 1.39 0.00 2.83 2.04 -2.06 -3.50 117.51 124.77 2k7r h ILE 4 Ca 0.25 -1.89 0.00 0.00 1.00 0.00 0.00 64.86 64.21 2k7r h ILE 4 Cb 0.98 2.34 0.00 0.00 -0.74 0.00 0.00 36.82 39.40 2k7r h ILE 4 CO 1.41 0.56 0.00 0.61 0.00 0.00 0.00 178.15 180.73 2k7r n GLY 5 N 0.82 2.98 0.00 5.37 0.00 -1.26 -5.02 105.19 108.08 2k7r n GLY 5 Ca -0.09 -1.23 0.02 0.00 0.00 0.00 0.00 46.02 44.72 2k7r n GLY 5 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2k7r n ARG 6 N 1.00 5.68 -3.72 1.61 0.00 -1.26 -4.85 116.66 115.13 2k7r n ARG 6 Ca 0.00 -0.02 -0.29 0.00 -0.00 0.00 0.00 57.85 57.54 2k7r n ARG 6 Cb 0.00 -0.67 -0.13 0.00 -0.00 0.00 0.00 32.46 31.66 2k7r n ARG 6 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 2k7r s SER 7 N -1.30 3.65 -0.13 2.89 0.15 -1.26 -4.96 113.70 112.74 2k7r s SER 7 Ca 0.01 -2.73 -0.09 0.00 0.70 0.00 0.00 55.95 53.85 2k7r s SER 7 Cb 0.03 -1.07 -0.03 0.00 -1.71 0.00 0.00 66.02 63.24 2k7r s SER 7 CO 0.14 -0.25 -0.17 0.18 1.20 0.00 0.00 173.24 174.33 2k7r n LEU 8 N 3.41 1.72 -3.72 3.45 4.32 -1.26 -5.00 117.00 119.91 2k7r n LEU 8 Ca 0.10 0.61 -0.12 0.00 -0.02 0.00 0.00 56.01 56.58 2k7r n LEU 8 Cb 0.35 -0.85 -0.12 0.00 -1.62 0.00 0.00 43.42 41.18 2k7r n LEU 8 CO 0.24 -0.47 -0.02 0.00 -1.22 0.00 0.00 177.39 175.92 2k7r s GLN 9 N -2.19 0.33 -0.43 3.23 -2.07 -1.26 -5.12 119.66 112.14 2k7r s GLN 9 Ca -0.14 0.61 -0.14 0.00 -1.82 0.00 0.00 55.36 53.87 2k7r s GLN 9 Cb 0.02 0.01 0.05 0.00 -1.09 0.00 0.00 33.01 31.99 2k7r s GLN 9 CO 0.21 -0.13 0.33 0.20 -1.32 0.00 0.00 175.29 174.58 2k7r s GLY 10 N 1.00 2.01 0.10 2.60 0.00 -1.26 -5.06 107.32 106.72 2k7r s GLY 10 Ca -0.07 -1.92 -0.30 0.00 0.00 0.00 0.00 44.72 42.43 2k7r s GLY 10 CO -0.08 0.97 1.01 -1.34 0.00 0.00 0.00 173.10 173.67 2k7r s VAL 11 N 1.63 4.39 -2.55 1.40 -7.23 -1.26 -4.91 120.40 111.86 2k7r s VAL 11 Ca 0.04 1.93 0.24 0.00 -1.81 0.00 0.00 61.98 62.38 2k7r s VAL 11 Cb -0.22 -4.23 0.41 0.00 0.56 0.00 0.00 36.38 32.91 2k7r s VAL 11 CO 0.07 0.27 1.51 0.35 -0.31 0.00 0.00 175.10 176.99 2k7r n THR 12 N 2.97 0.16 0.00 5.32 -2.24 -1.26 -5.05 114.28 114.18 2k7r n THR 12 Ca 0.04 -0.44 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 2k7r n THR 12 Cb 0.49 0.80 0.00 0.00 -2.10 0.00 0.00 70.33 69.51 2k7r n THR 12 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2k7r n GLY 13 N 1.27 0.61 2.44 3.38 0.00 -1.26 -4.95 105.19 106.67 2k7r n GLY 13 Ca 0.17 -1.93 -0.24 0.00 0.00 0.00 0.00 46.02 44.02 2k7r n GLY 13 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k7r s ARG 14 N -1.02 0.92 -0.34 1.61 3.00 -1.26 -5.10 118.95 116.75 2k7r s ARG 14 Ca 0.00 -1.98 -0.28 0.00 0.00 0.00 0.00 55.73 53.48 2k7r s ARG 14 Cb 0.00 -1.24 -0.04 0.00 0.00 0.00 0.00 34.95 33.67 2k7r s ARG 14 CO 0.00 -1.38 2.07 -1.25 0.00 0.00 0.00 175.30 174.74 2k7r s PRO 15 N 0.17 2.98 0.47 3.54 0.04 -1.26 -4.85 135.00 136.09 2k7r s PRO 15 Ca 0.32 1.58 0.26 0.00 0.04 0.00 0.00 61.00 63.20 2k7r s PRO 15 Cb 0.03 -4.35 1.11 0.00 0.04 0.00 0.00 34.50 31.34 2k7r s PRO 15 CO -0.18 -2.27 1.91 0.22 0.04 0.00 0.00 177.00 176.72 2k7r h ASP 16 N 15.03 0.00 -0.10 6.66 3.58 -1.99 -2.68 116.42 136.92 2k7r h ASP 16 Ca -0.34 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.09 2k7r h ASP 16 Cb 1.21 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.26 2k7r h ASP 16 CO 1.04 0.18 0.01 0.15 -2.88 0.00 0.00 179.24 177.74 2k7r h PHE 17 N 0.00 0.19 -0.07 0.28 3.57 -1.99 0.05 116.94 118.96 2k7r h PHE 17 Ca -0.00 -0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.36 2k7r h PHE 17 Cb 0.61 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.29 2k7r h PHE 17 CO 0.00 0.40 -0.45 -0.56 -2.23 0.00 0.00 178.31 175.47 2k7r h GLN 18 N -0.07 0.16 0.01 1.11 -0.00 -1.94 0.13 115.11 114.51 2k7r h GLN 18 Ca 0.03 -0.08 -0.00 0.00 -0.00 0.00 0.00 58.65 58.60 2k7r h GLN 18 Cb 0.31 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.79 2k7r h GLN 18 CO 0.00 0.58 -0.01 0.87 -0.00 0.00 0.00 178.83 180.28 2k7r h LYS 19 N 0.13 -0.01 -0.31 0.06 1.57 -1.28 -0.05 116.57 116.68 2k7r h LYS 19 Ca 0.01 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 2k7r h LYS 19 Cb 0.85 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.15 2k7r h LYS 19 CO 0.07 0.01 0.10 -0.09 -0.57 0.00 0.00 179.45 178.97 2k7r h ARG 20 N -0.04 0.48 -0.08 3.15 2.43 -0.62 0.30 114.38 119.99 2k7r h ARG 20 Ca -0.00 -0.10 0.02 0.00 -0.81 0.00 0.00 59.98 59.09 2k7r h ARG 20 Cb 0.03 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.50 2k7r h ARG 20 CO 0.00 0.52 -0.03 1.25 -1.51 0.00 0.00 179.97 180.20 2k7r h LEU 21 N 0.34 -0.11 -0.49 3.80 5.85 -0.63 -1.03 115.31 123.05 2k7r h LEU 21 Ca 0.10 0.03 -0.11 0.00 0.84 0.00 0.00 57.88 58.73 2k7r h LEU 21 Cb 0.24 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 2k7r h LEU 21 CO -0.00 -0.04 -0.55 -0.33 -0.34 0.00 0.00 178.44 177.18 2k7r h GLU 22 N -0.02 0.00 0.55 1.25 4.39 -0.99 -0.79 114.58 118.98 2k7r h GLU 22 Ca 0.04 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.72 2k7r h GLU 22 Cb 0.08 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.73 2k7r h GLU 22 CO -0.10 0.55 -0.36 0.37 -1.16 0.00 0.00 179.01 178.31 2k7r h GLN 23 N 0.00 -0.84 -0.40 2.33 5.75 0.03 0.26 115.11 122.25 2k7r h GLN 23 Ca -0.01 0.06 -0.08 0.00 -0.15 0.00 0.00 58.65 58.47 2k7r h GLN 23 Cb 1.21 0.19 -0.02 0.00 1.07 0.00 0.00 27.48 29.93 2k7r h GLN 23 CO 0.07 -0.56 -0.07 0.00 -2.65 0.00 0.00 178.83 175.62 2k7r h MET 24 N -0.87 0.67 -0.12 1.69 -0.00 -1.21 0.17 114.93 115.26 2k7r h MET 24 Ca -0.06 -0.20 0.04 0.00 -0.00 0.00 0.00 59.70 59.48 2k7r h MET 24 Cb 0.72 -0.07 -0.05 0.00 -0.00 0.00 0.00 31.60 32.20 2k7r h MET 24 CO 0.05 0.74 -0.19 -0.22 -0.00 0.00 0.00 176.91 177.29 2k7r h LYS 25 N 0.62 -0.24 -0.37 -0.10 1.63 -0.89 0.24 116.57 117.46 2k7r h LYS 25 Ca 0.12 0.02 -0.07 0.00 -0.85 0.00 0.00 60.65 59.86 2k7r h LYS 25 Cb 0.50 0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 32.17 2k7r h LYS 25 CO 0.03 -0.16 -0.04 1.49 -3.45 0.00 0.00 179.45 177.32 2k7r h GLU 26 N -0.24 0.69 -0.86 1.90 4.81 -0.21 -2.69 114.58 117.98 2k7r h GLU 26 Ca 0.09 -0.24 0.08 0.00 -0.13 0.00 0.00 59.36 59.17 2k7r h GLU 26 Cb 0.38 -0.05 -0.07 0.00 0.63 0.00 0.00 28.75 29.64 2k7r h GLU 26 CO -0.26 0.81 0.52 0.87 -0.73 0.00 0.00 179.01 180.22 2k7r h LYS 27 N 0.49 0.87 -0.43 1.92 1.57 -0.67 0.25 116.57 120.58 2k7r h LYS 27 Ca 0.10 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.79 2k7r h LYS 27 Cb 0.53 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.63 2k7r h LYS 27 CO 0.03 0.58 0.11 0.28 -0.57 0.00 0.00 179.45 179.88 2k7r h VAL 28 N 0.90 1.23 -0.02 0.50 2.07 -0.85 -1.94 116.25 118.15 2k7r h VAL 28 Ca 0.40 -0.78 0.00 0.00 0.82 0.00 0.00 66.70 67.13 2k7r h VAL 28 Cb 0.28 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 30.97 2k7r h VAL 28 CO -0.21 0.28 0.00 1.15 0.02 0.00 0.00 177.57 178.80 2k7r n MET 29 N -4.54 1.14 -0.05 1.57 0.00 -0.73 -2.86 117.12 111.65 2k7r n MET 29 Ca 0.00 -0.21 -0.08 0.00 0.00 0.00 0.00 57.70 57.41 2k7r n MET 29 Cb 0.20 -1.40 -0.14 0.00 0.00 0.00 0.00 33.22 31.88 2k7r n MET 29 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 175.97 177.14 2k7r n LYS 30 N -0.66 0.66 -2.08 3.17 3.00 0.82 -4.83 118.16 118.23 2k7r n LYS 30 Ca 0.19 0.14 -0.39 0.00 -0.00 0.00 0.00 58.31 58.25 2k7r n LYS 30 Cb 0.14 -1.67 -0.00 0.00 0.00 0.00 0.00 35.03 33.50 2k7r n LYS 30 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 2k7r s ASP 31 N -5.75 6.17 0.03 3.14 2.15 -0.81 -4.95 116.67 116.65 2k7r s ASP 31 Ca -0.07 2.57 -0.21 0.00 0.43 0.00 0.00 52.55 55.27 2k7r s ASP 31 Cb 0.07 -2.63 -0.15 0.00 -0.30 0.00 0.00 42.92 39.92 2k7r s ASP 31 CO 0.83 -0.94 1.36 1.56 -0.17 0.00 0.00 175.17 177.81 2k7r h GLN 32 N 2.40 0.28 -0.20 4.34 4.20 -1.93 -2.62 115.11 121.58 2k7r h GLN 32 Ca -0.50 -0.13 -0.14 0.00 0.06 0.00 0.00 58.65 57.94 2k7r h GLN 32 Cb 1.25 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.03 2k7r h GLN 32 CO 0.61 0.65 -0.41 -0.44 -0.67 0.00 0.00 178.83 178.58 2k7r h ASP 33 N -0.09 0.71 0.21 1.46 3.32 -1.96 -2.66 116.42 117.41 2k7r h ASP 33 Ca 0.02 -0.55 0.01 0.00 0.02 0.00 0.00 57.03 56.53 2k7r h ASP 33 Cb 0.58 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.91 2k7r h ASP 33 CO 0.02 1.13 -0.26 0.58 -1.72 0.00 0.00 179.24 178.99 2k7r h VAL 34 N 0.32 0.45 -0.04 -1.35 2.07 -1.85 -0.83 116.25 115.01 2k7r h VAL 34 Ca 0.01 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.46 2k7r h VAL 34 Cb 1.01 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.21 2k7r h VAL 34 CO 0.09 0.00 -0.27 0.06 0.02 0.00 0.00 177.57 177.47 2k7r h GLN 35 N -0.52 0.08 -0.48 1.57 3.07 -1.52 0.72 115.11 118.02 2k7r h GLN 35 Ca 0.01 -0.02 -0.02 0.00 0.09 0.00 0.00 58.65 58.70 2k7r h GLN 35 Cb 0.50 -0.01 -0.02 0.00 0.08 0.00 0.00 27.48 28.03 2k7r h GLN 35 CO -0.09 0.35 0.23 0.00 0.09 0.00 0.00 178.83 179.41 2k7r h ALA 36 N 1.65 0.62 -0.72 0.06 0.00 -1.16 -1.67 119.26 118.05 2k7r h ALA 36 Ca 0.01 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 2k7r h ALA 36 Cb 0.52 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 2k7r h ALA 36 CO 0.04 0.19 0.21 0.35 0.00 0.00 0.00 179.25 180.04 2k7r h PHE 37 N 0.64 1.17 0.09 0.00 3.57 0.01 -2.40 116.94 120.01 2k7r h PHE 37 Ca 0.17 -0.12 0.01 0.00 3.53 0.00 0.00 57.97 61.55 2k7r h PHE 37 Cb 0.13 -0.34 -0.01 0.00 2.79 0.00 0.00 35.95 38.52 2k7r h PHE 37 CO -0.01 0.93 -0.11 -0.07 -2.23 0.00 0.00 178.31 176.83 2k7r h LEU 38 N 1.08 -0.28 -1.37 0.59 -0.00 -0.58 -1.02 115.31 113.72 2k7r h LEU 38 Ca 0.23 0.03 -0.06 0.00 -0.00 0.00 0.00 57.88 58.08 2k7r h LEU 38 Cb 0.32 0.10 -0.01 0.00 -0.00 0.00 0.00 40.66 41.08 2k7r h LEU 38 CO -0.00 -0.16 -0.30 0.07 -0.00 0.00 0.00 178.44 178.04 2k7r h LYS 39 N -0.22 0.00 0.00 1.13 2.10 -1.26 0.74 116.57 119.05 2k7r h LYS 39 Ca 0.01 0.00 -0.11 0.00 -2.00 0.00 0.00 60.65 58.55 2k7r h LYS 39 Cb 0.23 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.54 2k7r h LYS 39 CO -0.05 0.30 -0.53 0.93 -2.00 0.00 0.00 179.45 178.11 2k7r h GLU 40 N 0.00 0.00 0.00 0.07 3.07 -1.01 -3.29 114.58 113.42 2k7r h GLU 40 Ca -0.00 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 58.84 2k7r h GLU 40 Cb 0.60 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.48 2k7r h GLU 40 CO 0.04 0.53 -0.42 0.09 -1.40 0.00 0.00 179.01 177.85 2k7r n ASN 41 N -3.66 1.73 0.18 1.42 3.02 -0.42 -4.73 115.26 112.80 2k7r n ASN 41 Ca -0.01 -3.41 0.13 0.00 -0.03 0.00 0.00 54.58 51.27 2k7r n ASN 41 Cb 0.59 -0.46 0.61 0.00 -0.61 0.00 0.00 39.78 39.90 2k7r n ASN 41 CO 0.00 0.00 0.00 1.05 -2.62 0.00 0.00 177.26 175.69 2k7r h GLU 42 N 0.68 0.00 -0.15 3.52 4.11 -0.95 0.22 114.58 122.00 2k7r h GLU 42 Ca -0.02 0.00 -0.15 0.00 0.07 0.00 0.00 59.36 59.26 2k7r h GLU 42 Cb 1.11 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.35 2k7r h GLU 42 CO 0.01 0.00 -0.53 1.49 0.07 0.00 0.00 179.01 180.05 2k7r h GLU 43 N 0.00 0.44 0.00 1.06 4.81 -1.86 -3.37 114.58 115.67 2k7r h GLU 43 Ca 0.00 -0.27 -0.34 0.00 -0.13 0.00 0.00 59.36 58.63 2k7r h GLU 43 Cb 0.26 0.03 -0.06 0.00 0.63 0.00 0.00 28.75 29.61 2k7r h GLU 43 CO 0.00 0.86 -2.28 0.28 -0.73 0.00 0.00 179.01 177.13 2k7r n VAL 44 N -3.95 1.29 -2.55 0.32 0.31 -0.09 -4.97 118.33 108.70 2k7r n VAL 44 Ca -0.03 -0.51 -0.40 0.00 -0.01 0.00 0.00 64.34 63.39 2k7r n VAL 44 Cb 0.58 -1.27 -0.05 0.00 -0.91 0.00 0.00 33.84 32.20 2k7r n VAL 44 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 2k7r s ILE 45 N -2.45 3.75 0.33 2.52 1.01 0.57 -5.02 121.20 121.91 2k7r s ILE 45 Ca -0.29 1.66 0.04 0.00 0.00 0.00 0.00 60.65 62.05 2k7r s ILE 45 Cb 0.08 -4.06 -0.01 0.00 0.01 0.00 0.00 42.46 38.47 2k7r s ILE 45 CO 0.53 0.36 0.13 -0.90 0.00 0.00 0.00 174.94 175.06 2k7r n ASP 46 N 1.68 1.02 -0.32 3.58 5.75 -1.26 -4.79 116.55 122.21 2k7r n ASP 46 Ca 0.00 -2.76 -0.00 0.00 -0.01 0.00 0.00 54.79 52.02 2k7r n ASP 46 Cb 0.46 0.88 0.13 0.00 -1.03 0.00 0.00 41.12 41.56 2k7r n ASP 46 CO 0.00 0.00 0.00 1.56 -0.11 0.00 0.00 177.20 178.65 2k7r h GLN 47 N 0.00 1.02 -0.25 0.11 4.20 -2.00 -1.79 115.11 116.40 2k7r h GLN 47 Ca -0.25 -0.06 -0.15 0.00 0.06 0.00 0.00 58.65 58.25 2k7r h GLN 47 Cb 0.98 -0.23 -0.00 0.00 0.30 0.00 0.00 27.48 28.53 2k7r h GLN 47 CO 0.40 0.67 -0.42 0.87 -0.67 0.00 0.00 178.83 179.68 2k7r h LYS 48 N 1.05 0.72 -0.77 1.46 1.79 -1.99 -2.73 116.57 116.09 2k7r h LYS 48 Ca 0.37 -0.44 0.09 0.00 -2.18 0.00 0.00 60.65 58.49 2k7r h LYS 48 Cb 0.09 0.05 -0.05 0.00 -1.58 0.00 0.00 32.23 30.73 2k7r h LYS 48 CO -0.14 1.06 0.50 1.98 -1.08 0.00 0.00 179.45 181.77 2k7r h MET 49 N 0.44 0.67 -0.06 3.15 4.05 -1.84 0.29 114.93 121.63 2k7r h MET 49 Ca 0.02 -0.04 -0.00 0.00 -0.28 0.00 0.00 59.70 59.39 2k7r h MET 49 Cb 1.01 -0.15 -0.00 0.00 -0.80 0.00 0.00 31.60 31.66 2k7r h MET 49 CO 0.09 0.44 0.02 0.82 0.23 0.00 0.00 176.91 178.52 2k7r h ILE 50 N 0.69 1.17 -0.36 1.77 1.08 -1.09 -1.11 117.51 119.65 2k7r h ILE 50 Ca 0.35 -0.50 -0.13 0.00 -0.39 0.00 0.00 64.86 64.20 2k7r h ILE 50 Cb 0.45 1.40 -0.01 0.00 -3.07 0.00 0.00 36.82 35.58 2k7r h ILE 50 CO -0.13 0.14 -0.30 -0.33 -0.69 0.00 0.00 178.15 176.84 2k7r h GLU 51 N -0.10 0.78 -0.20 2.37 5.08 -1.07 0.01 114.58 121.45 2k7r h GLU 51 Ca 0.02 -0.35 0.01 0.00 -1.00 0.00 0.00 59.36 58.04 2k7r h GLU 51 Cb 0.20 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 2k7r h GLU 51 CO -0.00 0.98 0.09 -0.22 -1.00 0.00 0.00 179.01 178.86 2k7r h LYS 52 N 0.66 0.19 -0.63 2.33 1.63 -0.42 -3.00 116.57 117.33 2k7r h LYS 52 Ca 0.08 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.86 2k7r h LYS 52 Cb 0.83 -0.04 0.00 0.00 -0.60 0.00 0.00 32.23 32.42 2k7r h LYS 52 CO 0.07 0.13 0.00 0.45 -3.45 0.00 0.00 179.45 176.65 2k7r n SER 53 N -5.01 4.99 -0.26 4.20 2.88 -0.43 -4.41 113.62 115.58 2k7r n SER 53 Ca -0.03 -2.62 -0.00 0.00 -1.33 0.00 0.00 58.87 54.89 2k7r n SER 53 Cb 0.06 -0.62 0.21 0.00 -0.75 0.00 0.00 64.21 63.11 2k7r n SER 53 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 2k7r h LEU 54 N 3.88 0.94 -0.31 2.46 5.85 -0.84 0.28 115.31 127.58 2k7r h LEU 54 Ca 0.00 -0.03 -0.20 0.00 0.84 0.00 0.00 57.88 58.49 2k7r h LEU 54 Cb 1.62 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 42.41 2k7r h LEU 54 CO 0.33 0.69 -0.79 -0.55 -0.34 0.00 0.00 178.44 177.78 2k7r h ASN 55 N 1.11 0.54 -0.18 1.25 7.08 -1.81 -1.77 115.58 121.80 2k7r h ASN 55 Ca 0.30 -0.38 -0.03 0.00 -3.08 0.00 0.00 56.30 53.11 2k7r h ASN 55 Cb -0.11 -0.16 -0.01 0.00 -2.08 0.00 0.00 38.32 35.96 2k7r h ASN 55 CO -0.06 1.14 -0.01 0.11 -2.08 0.00 0.00 177.43 176.52 2k7r h LYS 56 N 0.29 0.32 -0.56 4.14 1.79 -1.63 0.42 116.57 121.34 2k7r h LYS 56 Ca -0.05 -0.11 -0.10 0.00 -2.18 0.00 0.00 60.65 58.22 2k7r h LYS 56 Cb 1.39 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 32.00 2k7r h LYS 56 CO 0.14 0.55 -0.03 -0.07 -1.08 0.00 0.00 179.45 178.96 2k7r h LEU 57 N 0.06 0.97 -0.39 2.94 3.38 -0.50 0.65 115.31 122.40 2k7r h LEU 57 Ca 0.05 -0.28 -0.18 0.00 0.09 0.00 0.00 57.88 57.56 2k7r h LEU 57 Cb 0.42 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 2k7r h LEU 57 CO 0.01 1.04 -0.58 0.22 0.09 0.00 0.00 178.44 179.22 2k7r h TYR 58 N 0.90 0.88 -0.50 1.13 3.20 -1.29 -2.58 116.97 118.70 2k7r h TYR 58 Ca 0.16 -0.32 -0.06 0.00 3.14 0.00 0.00 58.73 61.65 2k7r h TYR 58 Cb 0.56 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.65 2k7r h TYR 58 CO 0.04 1.11 0.07 1.49 -1.64 0.00 0.00 178.16 179.22 2k7r h GLU 59 N 0.52 0.79 -0.08 1.82 4.81 -0.64 -1.02 114.58 120.78 2k7r h GLU 59 Ca 0.00 -0.18 0.03 0.00 -0.13 0.00 0.00 59.36 59.08 2k7r h GLU 59 Cb 1.16 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 30.40 2k7r h GLU 59 CO 0.12 0.75 -0.10 -0.92 -0.73 0.00 0.00 179.01 178.13 2k7r h TYR 60 N 0.75 -0.24 0.00 0.92 3.20 -0.64 -1.81 116.97 119.15 2k7r h TYR 60 Ca 0.16 0.01 -0.15 0.00 3.14 0.00 0.00 58.73 61.89 2k7r h TYR 60 Cb 0.35 0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.72 2k7r h TYR 60 CO 0.02 -0.15 -0.72 -0.84 -1.64 0.00 0.00 178.16 174.83 2k7r h ILE 61 N -0.13 1.49 0.00 1.81 3.07 -1.18 -2.94 117.51 119.63 2k7r h ILE 61 Ca 0.07 -2.50 0.00 0.00 1.55 0.00 0.00 64.86 63.98 2k7r h ILE 61 Cb 0.22 2.36 0.00 0.00 -0.27 0.00 0.00 36.82 39.13 2k7r h ILE 61 CO -0.16 0.71 -0.01 -1.84 -1.05 0.00 0.00 178.15 175.80 2k7r n GLU 62 N -3.64 0.17 -1.77 0.16 0.28 -0.41 -4.80 120.64 110.63 2k7r n GLU 62 Ca -0.01 0.14 -0.21 0.00 -0.16 0.00 0.00 57.16 56.92 2k7r n GLU 62 Cb 0.71 -1.70 0.13 0.00 1.43 0.00 0.00 31.44 32.02 2k7r n GLU 62 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 2k7r n GLN 63 N -1.99 -0.53 -2.88 3.44 6.02 -0.69 -5.02 117.38 115.73 2k7r n GLN 63 Ca 0.06 -1.83 -0.43 0.00 -0.01 0.00 0.00 57.00 54.79 2k7r n GLN 63 Cb 0.40 -0.82 -0.04 0.00 1.02 0.00 0.00 30.24 30.80 2k7r n GLN 63 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2k7r s SER 64 N -4.50 6.31 0.42 1.08 0.15 -1.26 -4.86 113.70 111.03 2k7r s SER 64 Ca 0.55 -0.49 0.20 0.00 0.70 0.00 0.00 55.95 56.92 2k7r s SER 64 Cb -0.02 -2.42 0.90 0.00 -1.71 0.00 0.00 66.02 62.77 2k7r s SER 64 CO 0.38 -1.21 1.84 0.07 1.20 0.00 0.00 173.24 175.52 2k7r h LYS 65 N 9.30 0.00 0.00 5.44 2.10 -1.89 -3.42 116.57 128.09 2k7r h LYS 65 Ca -0.27 0.00 -0.37 0.00 -2.00 0.00 0.00 60.65 58.01 2k7r h LYS 65 Cb 1.08 0.00 0.13 0.00 -0.90 0.00 0.00 32.23 32.54 2k7r h LYS 65 CO 1.08 0.30 0.29 0.09 -2.00 0.00 0.00 179.45 179.21 2k7r n ASN 66 N -3.65 0.34 -3.82 7.07 3.02 -1.26 -4.31 115.26 112.64 2k7r n ASN 66 Ca -0.01 -1.54 -0.11 0.00 -0.03 0.00 0.00 54.58 52.89 2k7r n ASN 66 Cb 0.42 -0.79 -0.08 0.00 -0.61 0.00 0.00 39.78 38.72 2k7r n ASN 66 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2k7r h SER 68 N 3.42 0.33 0.13 0.00 4.64 -1.86 0.86 113.55 121.07 2k7r h SER 68 Ca -0.32 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 2k7r h SER 68 Cb 1.19 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 2k7r h SER 68 CO 0.47 0.19 0.00 0.00 -0.87 0.00 0.00 176.83 176.62 2k7r n TYR 69 N -4.46 0.00 -0.93 4.77 9.36 -1.26 -2.44 117.16 122.19 2k7r n TYR 69 Ca 0.12 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.34 2k7r n TYR 69 Cb 0.47 -0.49 0.00 0.00 -0.63 0.00 0.00 39.34 38.69 2k7r n TYR 69 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2k7r s SER 71 N 0.00 5.67 -1.36 0.00 1.04 -0.27 -4.94 113.70 113.84 2k7r s SER 71 Ca 0.00 -1.28 -0.10 0.00 0.48 0.00 0.00 55.95 55.05 2k7r s SER 71 Cb 0.00 -2.00 0.11 0.00 0.10 0.00 0.00 66.02 64.23 2k7r s SER 71 CO 0.00 -0.47 2.13 -1.84 0.98 0.00 0.00 173.24 174.04 2k7r n GLU 72 N 4.95 3.56 -3.64 4.02 0.28 -1.26 -4.79 120.64 123.76 2k7r n GLU 72 Ca -0.11 -3.16 -0.12 0.00 -0.16 0.00 0.00 57.16 53.61 2k7r n GLU 72 Cb 0.44 -2.97 -0.05 0.00 1.43 0.00 0.00 31.44 30.29 2k7r n GLU 72 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 2k7r s ASP 73 N 1.50 -0.28 0.62 -1.84 -1.08 -1.26 -5.03 116.67 109.30 2k7r s ASP 73 Ca 0.46 -0.11 0.40 0.00 -0.52 0.00 0.00 52.55 52.78 2k7r s ASP 73 Cb 0.13 0.45 2.03 0.00 -1.46 0.00 0.00 42.92 44.07 2k7r s ASP 73 CO -0.04 -0.75 2.23 -0.08 0.52 0.00 0.00 175.17 177.05 2k7r h GLU 74 N 2.71 0.00 -5.47 4.34 4.81 -2.04 -3.37 114.58 115.56 2k7r h GLU 74 Ca -0.32 0.00 -0.33 0.00 -0.13 0.00 0.00 59.36 58.58 2k7r h GLU 74 Cb 1.23 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.57 2k7r h GLU 74 CO 0.45 0.01 1.05 -0.80 -0.73 0.00 0.00 179.01 178.98 2k7r s ASN 75 N -5.40 5.01 -0.25 1.04 -0.87 -1.26 -4.57 114.94 108.63 2k7r s ASN 75 Ca -0.03 -1.62 0.13 0.00 -1.57 0.00 0.00 52.86 49.77 2k7r s ASN 75 Cb 0.12 -2.59 0.60 0.00 -0.02 0.00 0.00 41.25 39.35 2k7r s ASN 75 CO 0.47 -3.09 1.56 0.00 -2.57 0.00 0.00 177.10 173.46 2k7r n ASN 77 N -0.54 2.48 -4.75 0.00 6.94 -1.26 -4.84 115.26 113.29 2k7r n ASN 77 Ca 0.30 -2.22 -0.40 0.00 -0.02 0.00 0.00 54.58 52.24 2k7r n ASN 77 Cb 1.08 -0.55 -0.06 0.00 -2.36 0.00 0.00 39.78 37.90 2k7r n ASN 77 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 2k7r s ASN 78 N 0.24 7.62 -0.01 0.53 4.22 -1.26 -4.94 114.94 121.34 2k7r s ASN 78 Ca 0.10 1.92 -0.09 0.00 -2.14 0.00 0.00 52.86 52.64 2k7r s ASN 78 Cb 0.08 -2.60 -0.05 0.00 1.28 0.00 0.00 41.25 39.95 2k7r s ASN 78 CO 0.02 0.13 0.66 0.25 -2.04 0.00 0.00 177.10 176.12 2k7r h LEU 79 N 4.33 -0.29 -9.10 3.54 6.46 -1.94 -3.42 115.31 114.88 2k7r h LEU 79 Ca -0.45 0.01 -0.59 0.00 -0.12 0.00 0.00 57.88 56.73 2k7r h LEU 79 Cb 1.20 0.07 -0.08 0.00 -0.73 0.00 0.00 40.66 41.12 2k7r h LEU 79 CO 0.68 -0.09 0.36 -0.76 -0.62 0.00 0.00 178.44 178.02 2k7r s LEU 80 N -6.54 4.13 -0.03 2.25 1.02 -1.26 -5.04 118.68 113.21 2k7r s LEU 80 Ca -0.05 1.05 -0.13 0.00 0.02 0.00 0.00 54.13 55.02 2k7r s LEU 80 Cb 0.00 -3.14 -0.05 0.00 0.02 0.00 0.00 46.19 43.02 2k7r s LEU 80 CO 0.15 -0.42 0.35 -0.70 0.02 0.00 0.00 176.35 175.75 2k7r s GLU 81 N 2.37 3.82 0.00 1.70 2.12 -1.26 -3.96 118.70 123.49 2k7r s GLU 81 Ca 0.35 0.29 0.00 0.00 0.36 0.00 0.00 54.97 55.97 2k7r s GLU 81 Cb -0.16 -3.22 0.00 0.00 0.26 0.00 0.00 34.13 31.01 2k7r s GLU 81 CO 0.10 0.70 0.00 0.41 -0.54 0.00 0.00 175.26 175.93 2k7r n GLY 82 N 1.90 1.41 3.51 -1.50 0.00 -1.26 -5.02 105.19 104.23 2k7r n GLY 82 Ca -0.15 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.62 2k7r n GLY 82 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2k7r s TYR 83 N -2.65 2.29 0.04 1.61 2.02 -1.25 0.19 117.35 119.59 2k7r s TYR 83 Ca 0.00 -0.52 0.05 0.00 -0.37 0.00 0.00 57.07 56.24 2k7r s TYR 83 Cb 0.00 -1.27 -0.02 0.00 -0.40 0.00 0.00 41.96 40.27 2k7r s TYR 83 CO 0.00 0.54 -0.16 -1.01 -1.57 0.00 0.00 175.55 173.35 2k7r s HIS 84 N -2.68 1.39 0.27 2.71 3.76 0.52 -4.57 115.29 116.69 2k7r s HIS 84 Ca 0.31 -0.35 -0.30 0.00 -0.15 0.00 0.00 55.06 54.57 2k7r s HIS 84 Cb 0.02 -0.83 -0.10 0.00 1.11 0.00 0.00 32.58 32.77 2k7r s HIS 84 CO 0.15 0.05 1.47 -2.14 -0.85 0.00 0.00 174.74 173.42 2k7r s PRO 85 N -1.10 4.23 0.03 8.40 0.02 -1.26 -0.95 135.00 144.37 2k7r s PRO 85 Ca 0.03 2.38 0.03 0.00 0.02 0.00 0.00 61.00 63.46 2k7r s PRO 85 Cb -0.08 -3.08 -0.02 0.00 0.02 0.00 0.00 34.50 31.34 2k7r s PRO 85 CO 0.01 -0.47 -0.09 -1.59 -0.33 0.00 0.00 177.00 174.54 2k7r s LYS 86 N -0.56 0.62 0.03 5.54 -2.85 0.80 -4.88 119.74 118.44 2k7r s LYS 86 Ca 0.59 -0.64 -0.23 0.00 -1.00 0.00 0.00 55.97 54.70 2k7r s LYS 86 Cb -0.43 -0.51 -0.06 0.00 -2.06 0.00 0.00 37.83 34.77 2k7r s LYS 86 CO 0.46 0.12 0.67 -0.51 0.10 0.00 0.00 175.35 176.19 2k7r s LEU 87 N -1.16 4.45 -0.01 2.77 1.43 -1.26 0.30 118.68 125.20 2k7r s LEU 87 Ca -0.04 1.31 0.02 0.00 -1.03 0.00 0.00 54.13 54.40 2k7r s LEU 87 Cb -0.08 -3.07 -0.01 0.00 0.03 0.00 0.00 46.19 43.07 2k7r s LEU 87 CO 0.01 0.08 -0.07 0.68 0.23 0.00 0.00 176.35 177.28 2k7r s VAL 88 N -0.25 0.58 -0.15 -1.59 -7.23 0.11 -4.88 120.40 107.00 2k7r s VAL 88 Ca 0.34 -0.31 -0.29 0.00 -1.81 0.00 0.00 61.98 59.91 2k7r s VAL 88 Cb -0.19 -0.49 -0.01 0.00 0.56 0.00 0.00 36.38 36.25 2k7r s VAL 88 CO 0.20 0.17 1.12 0.54 -0.31 0.00 0.00 175.10 176.81 2k7r s VAL 89 N -0.15 4.52 -0.41 1.32 0.11 -1.26 -0.16 120.40 124.38 2k7r s VAL 89 Ca 0.02 1.83 0.03 0.00 -2.93 0.00 0.00 61.98 60.93 2k7r s VAL 89 Cb -0.03 -4.18 0.11 0.00 -1.53 0.00 0.00 36.38 30.76 2k7r s VAL 89 CO -0.00 -0.09 0.15 0.21 -3.33 0.00 0.00 175.10 172.04 2k7r s ASN 90 N 1.41 4.36 1.62 3.54 3.84 0.13 -4.90 114.94 124.94 2k7r s ASN 90 Ca 0.50 -2.42 0.00 0.00 0.21 0.00 0.00 52.86 51.15 2k7r s ASN 90 Cb -0.19 -1.44 0.00 0.00 -0.55 0.00 0.00 41.25 39.07 2k7r s ASN 90 CO 0.14 -0.32 0.00 0.61 -2.79 0.00 0.00 177.10 174.74 2k7r n GLY 91 N 3.88 1.06 0.81 1.21 0.00 -1.26 -1.01 105.19 109.88 2k7r n GLY 91 Ca 0.04 0.43 0.09 0.00 0.00 0.00 0.00 46.02 46.57 2k7r n GLY 91 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k7r n ARG 92 N 0.00 2.78 -4.15 1.61 3.00 -1.26 -4.99 116.66 113.65 2k7r n ARG 92 Ca 0.00 -2.79 -0.16 0.00 -0.01 0.00 0.00 57.85 54.89 2k7r n ARG 92 Cb 0.00 -1.80 -0.05 0.00 0.00 0.00 0.00 32.46 30.61 2k7r n ARG 92 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 2k7r s SER 93 N -1.99 1.15 -0.06 0.55 0.15 -0.18 -4.93 113.70 108.40 2k7r s SER 93 Ca 0.41 -1.58 0.04 0.00 0.70 0.00 0.00 55.95 55.52 2k7r s SER 93 Cb 0.33 0.63 -0.02 0.00 -1.71 0.00 0.00 66.02 65.25 2k7r s SER 93 CO 0.08 -1.22 -0.18 -0.63 1.20 0.00 0.00 173.24 172.49 2k7r s ILE 94 N -3.18 2.68 0.39 6.45 1.01 -1.26 0.23 121.20 127.52 2k7r s ILE 94 Ca 0.34 -0.85 0.04 0.00 0.00 0.00 0.00 60.65 60.18 2k7r s ILE 94 Cb 0.01 -2.03 -0.03 0.00 0.01 0.00 0.00 42.46 40.41 2k7r s ILE 94 CO 0.23 0.57 0.13 -1.81 0.00 0.00 0.00 174.94 174.06 2k7r s ASP 95 N -0.41 2.63 -0.17 3.58 1.01 0.78 -4.87 116.67 119.23 2k7r s ASP 95 Ca 0.04 -1.64 0.01 0.00 0.71 0.00 0.00 52.55 51.67 2k7r s ASP 95 Cb -0.12 0.45 0.01 0.00 1.01 0.00 0.00 42.92 44.27 2k7r s ASP 95 CO 0.02 -0.91 -0.19 -0.63 0.21 0.00 0.00 175.17 173.68 2k7r s ILE 96 N -3.25 2.26 0.39 0.77 1.01 -1.26 -0.71 121.20 120.40 2k7r s ILE 96 Ca 0.26 -0.89 0.04 0.00 0.00 0.00 0.00 60.65 60.06 2k7r s ILE 96 Cb 0.03 -1.94 0.04 0.00 0.01 0.00 0.00 42.46 40.60 2k7r s ILE 96 CO 0.15 0.53 0.34 1.21 0.00 0.00 0.00 174.94 177.18 2k7r n GLU 97 N 4.35 0.88 -4.00 2.79 2.13 0.15 -4.90 120.64 122.04 2k7r n GLU 97 Ca -0.20 -2.35 -0.16 0.00 0.66 0.00 0.00 57.16 55.11 2k7r n GLU 97 Cb 0.51 0.17 -0.15 0.00 0.27 0.00 0.00 31.44 32.23 2k7r n GLU 97 CO 0.00 0.00 0.00 0.71 -0.41 0.00 0.00 177.13 177.43 2k7r s TYR 98 N -1.81 0.33 0.29 4.31 1.51 -1.26 -0.14 117.35 120.57 2k7r s TYR 98 Ca 0.26 -0.04 0.11 0.00 -1.01 0.00 0.00 57.07 56.39 2k7r s TYR 98 Cb -0.02 -0.32 -0.05 0.00 -0.11 0.00 0.00 41.96 41.46 2k7r s TYR 98 CO 0.17 -0.07 -0.12 1.52 -1.11 0.00 0.00 175.55 175.94 2k7r s TYR 99 N 0.48 2.44 -0.00 2.71 -0.85 -0.13 -4.87 117.35 117.13 2k7r s TYR 99 Ca -0.05 -0.32 -0.30 0.00 -0.52 0.00 0.00 57.07 55.88 2k7r s TYR 99 Cb -0.08 -1.12 -0.05 0.00 0.38 0.00 0.00 41.96 41.09 2k7r s TYR 99 CO -0.01 0.66 1.31 -1.21 -1.52 0.00 0.00 175.55 174.78 2k7r s GLU 100 N -3.58 4.32 -0.11 -3.49 2.02 -1.26 -0.35 118.70 116.25 2k7r s GLU 100 Ca 0.31 1.85 -0.37 0.00 0.02 0.00 0.00 54.97 56.78 2k7r s GLU 100 Cb -0.04 -3.52 -0.14 0.00 0.10 0.00 0.00 34.13 30.52 2k7r s GLU 100 CO 0.17 -0.49 1.69 0.00 0.02 0.00 0.00 175.26 176.66 2k7r h PRO 102 N 7.19 0.00 0.00 0.00 0.13 -1.92 0.05 132.00 137.45 2k7r h PRO 102 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2k7r h PRO 102 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 2k7r h PRO 102 CO 0.92 0.00 0.00 0.28 -0.23 0.00 0.00 178.00 178.97 2k7r n VAL 103 N -2.79 0.64 0.03 1.56 0.31 -1.26 -2.86 118.33 113.96 2k7r n VAL 103 Ca -0.02 0.03 -0.10 0.00 -0.01 0.00 0.00 64.34 64.24 2k7r n VAL 103 Cb 0.19 -0.84 -0.04 0.00 -0.91 0.00 0.00 33.84 32.24 2k7r n VAL 103 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 2k7r h LYS 104 N 0.00 -0.13 -4.07 5.55 1.79 -1.34 -3.45 116.57 114.92 2k7r h LYS 104 Ca 0.00 0.01 -0.12 0.00 -2.18 0.00 0.00 60.65 58.36 2k7r h LYS 104 Cb 0.48 0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 31.15 2k7r h LYS 104 CO 0.00 -0.09 -0.15 2.89 -1.08 0.00 0.00 179.45 181.02 2k7r n ARG 105 N -5.23 -2.42 0.00 3.15 1.85 -1.14 -5.17 116.66 107.71 2k7r n ARG 105 Ca -0.05 0.31 0.00 0.00 -1.00 0.00 0.00 57.85 57.11 2k7r n ARG 105 Cb 0.15 -4.80 0.00 0.00 -1.05 0.00 0.00 32.46 26.76 2k7r n ARG 105 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25