#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 1.36 0.53 2.12 2.02 -1.26 -5.12 118.70 118.34 2k7r s GLU 2 Ca 0.00 -1.16 -0.22 0.00 0.02 0.00 0.00 54.97 53.61 2k7r s GLU 2 Cb 0.00 -1.64 -0.06 0.00 0.10 0.00 0.00 34.13 32.52 2k7r s GLU 2 CO 0.00 0.40 1.18 -0.35 0.02 0.00 0.00 175.26 176.51 2k7r n PRO 3 N 1.31 1.44 -2.00 0.39 -0.04 -1.26 -4.99 135.00 129.84 2k7r n PRO 3 Ca -0.18 0.53 -0.29 0.00 -0.04 0.00 0.00 63.50 63.51 2k7r n PRO 3 Cb 0.53 -2.34 0.05 0.00 -0.04 0.00 0.00 33.50 31.69 2k7r n PRO 3 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 2k7r s ILE 4 N -1.34 3.36 -0.02 0.52 -5.25 -1.26 -5.04 121.20 112.17 2k7r s ILE 4 Ca 0.70 0.33 -0.20 0.00 -0.99 0.00 0.00 60.65 60.49 2k7r s ILE 4 Cb -0.45 -3.42 -0.05 0.00 2.95 0.00 0.00 42.46 41.49 2k7r s ILE 4 CO 0.51 -0.53 0.58 -0.83 -1.79 0.00 0.00 174.94 172.88 2k7r s GLY 5 N -4.37 2.59 -0.17 6.27 0.00 -1.26 -5.06 107.32 105.31 2k7r s GLY 5 Ca 0.58 0.01 -0.18 0.00 0.00 0.00 0.00 44.72 45.12 2k7r s GLY 5 CO 0.50 0.75 0.50 -1.60 0.00 0.00 0.00 173.10 173.25 2k7r s ARG 6 N -0.10 0.62 -0.77 2.90 3.52 -1.26 -5.11 118.95 118.75 2k7r s ARG 6 Ca 0.31 0.60 -0.25 0.00 -0.13 0.00 0.00 55.73 56.26 2k7r s ARG 6 Cb -0.18 0.30 0.04 0.00 -1.56 0.00 0.00 34.95 33.55 2k7r s ARG 6 CO 0.16 -0.09 1.24 -1.12 -0.81 0.00 0.00 175.30 174.68 2k7r s SER 7 N 0.06 6.22 -1.22 -2.12 0.01 -1.26 -4.93 113.70 110.47 2k7r s SER 7 Ca -0.02 -0.74 -0.11 0.00 1.31 0.00 0.00 55.95 56.39 2k7r s SER 7 Cb -0.03 -2.53 0.19 0.00 0.21 0.00 0.00 66.02 63.85 2k7r s SER 7 CO 0.01 -1.70 1.54 0.18 0.41 0.00 0.00 173.24 173.69 2k7r n LEU 8 N 8.92 5.76 -0.07 2.44 7.99 -1.26 -4.57 117.00 136.21 2k7r n LEU 8 Ca 0.06 -4.62 -0.04 0.00 -0.01 0.00 0.00 56.01 51.40 2k7r n LEU 8 Cb 0.49 -1.54 -0.15 0.00 -0.11 0.00 0.00 43.42 42.11 2k7r n LEU 8 CO 0.68 1.05 -1.01 0.00 -1.51 0.00 0.00 177.39 176.60 2k7r n GLN 9 N 4.54 0.88 0.00 3.23 1.13 -1.26 -5.11 117.38 120.78 2k7r n GLN 9 Ca 0.36 -0.05 0.00 0.00 -1.94 0.00 0.00 57.00 55.37 2k7r n GLN 9 Cb 0.40 -1.48 0.00 0.00 0.11 0.00 0.00 30.24 29.27 2k7r n GLN 9 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2k7r n GLY 10 N 1.73 1.95 3.56 1.08 0.00 -1.26 -4.84 105.19 107.41 2k7r n GLY 10 Ca -0.24 -1.77 -0.36 0.00 0.00 0.00 0.00 46.02 43.66 2k7r n GLY 10 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2k7r s VAL 11 N -2.38 3.61 -0.91 1.61 -7.23 -1.26 -4.91 120.40 108.92 2k7r s VAL 11 Ca 0.00 -0.23 -0.24 0.00 -1.81 0.00 0.00 61.98 59.70 2k7r s VAL 11 Cb 0.00 -4.46 0.01 0.00 0.56 0.00 0.00 36.38 32.49 2k7r s VAL 11 CO 0.00 -1.39 1.59 0.42 -0.31 0.00 0.00 175.10 175.41 2k7r s THR 12 N 7.61 3.71 0.00 5.32 -4.23 -1.26 -4.36 115.64 122.43 2k7r s THR 12 Ca 0.56 -0.40 0.00 0.00 -1.18 0.00 0.00 61.69 60.67 2k7r s THR 12 Cb -0.06 -4.66 0.00 0.00 1.34 0.00 0.00 72.50 69.12 2k7r s THR 12 CO 0.04 -1.57 0.00 0.61 -0.54 0.00 0.00 174.62 173.16 2k7r n GLY 13 N 6.56 0.68 2.40 3.99 0.00 -1.26 -5.11 105.19 112.44 2k7r n GLY 13 Ca 0.29 -0.18 -0.21 0.00 0.00 0.00 0.00 46.02 45.92 2k7r n GLY 13 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2k7r n ARG 14 N 0.00 0.46 -2.08 1.61 0.00 -1.26 -5.13 116.66 110.26 2k7r n ARG 14 Ca 0.00 -2.91 -0.38 0.00 -0.00 0.00 0.00 57.85 54.55 2k7r n ARG 14 Cb 0.00 -1.47 0.00 0.00 -0.00 0.00 0.00 32.46 31.00 2k7r n ARG 14 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 2k7r s PRO 15 N -0.21 3.73 0.33 2.89 0.04 -1.26 -4.93 135.00 135.59 2k7r s PRO 15 Ca 0.33 2.03 0.02 0.00 0.04 0.00 0.00 61.00 63.42 2k7r s PRO 15 Cb 0.10 -2.53 0.59 0.00 0.04 0.00 0.00 34.50 32.70 2k7r s PRO 15 CO -0.16 -0.65 1.96 -0.44 0.04 0.00 0.00 177.00 177.76 2k7r h ASP 16 N 2.21 0.81 -0.18 6.66 5.19 -2.00 -2.93 116.42 126.18 2k7r h ASP 16 Ca -0.50 -0.01 0.05 0.00 -0.62 0.00 0.00 57.03 55.95 2k7r h ASP 16 Cb 1.26 -0.18 -0.07 0.00 0.18 0.00 0.00 39.33 40.51 2k7r h ASP 16 CO 0.61 0.55 -0.42 0.15 -3.12 0.00 0.00 179.24 177.01 2k7r h PHE 17 N 0.94 -1.22 0.00 4.55 3.57 -2.00 -1.68 116.94 121.10 2k7r h PHE 17 Ca 0.31 0.05 -0.08 0.00 3.53 0.00 0.00 57.97 61.79 2k7r h PHE 17 Cb 0.07 0.56 -0.01 0.00 2.79 0.00 0.00 35.95 39.36 2k7r h PHE 17 CO -0.00 -0.47 -0.37 -0.56 -2.23 0.00 0.00 178.31 174.68 2k7r h GLN 18 N -0.46 0.00 -0.39 1.11 3.07 -1.92 -1.70 115.11 114.82 2k7r h GLN 18 Ca 0.09 0.00 -0.12 0.00 0.09 0.00 0.00 58.65 58.71 2k7r h GLN 18 Cb 0.62 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.16 2k7r h GLN 18 CO -0.43 0.37 -0.24 0.87 0.09 0.00 0.00 178.83 179.48 2k7r h LYS 19 N 0.00 0.78 -0.33 0.06 1.79 -1.21 0.48 116.57 118.15 2k7r h LYS 19 Ca -0.00 -0.33 -0.16 0.00 -2.18 0.00 0.00 60.65 57.98 2k7r h LYS 19 Cb 0.66 -0.03 -0.00 0.00 -1.58 0.00 0.00 32.23 31.28 2k7r h LYS 19 CO 0.05 0.95 -0.42 0.00 -1.08 0.00 0.00 179.45 178.95 2k7r h ARG 20 N 0.68 0.86 -0.20 3.15 3.08 -1.12 -0.69 114.38 120.14 2k7r h ARG 20 Ca 0.09 -0.49 0.03 0.00 0.07 0.00 0.00 59.98 59.68 2k7r h ARG 20 Cb 0.77 0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.82 2k7r h ARG 20 CO 0.06 1.13 0.01 1.25 -1.07 0.00 0.00 179.97 181.35 2k7r h LEU 21 N 0.65 -0.05 -1.34 3.04 5.85 -0.89 0.13 115.31 122.70 2k7r h LEU 21 Ca 0.04 0.04 -0.07 0.00 0.84 0.00 0.00 57.88 58.74 2k7r h LEU 21 Cb 1.01 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 42.10 2k7r h LEU 21 CO 0.10 0.00 -0.29 -0.33 -0.34 0.00 0.00 178.44 177.58 2k7r h GLU 22 N 0.08 0.06 0.16 1.25 4.39 -0.02 -0.87 114.58 119.64 2k7r h GLU 22 Ca 0.10 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.77 2k7r h GLU 22 Cb 0.11 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.76 2k7r h GLU 22 CO -0.15 0.35 -0.08 0.37 -1.16 0.00 0.00 179.01 178.34 2k7r h GLN 23 N 0.06 -0.21 -0.32 2.33 4.15 -0.24 -0.10 115.11 120.77 2k7r h GLN 23 Ca 0.01 0.01 -0.11 0.00 0.77 0.00 0.00 58.65 59.33 2k7r h GLN 23 Cb 0.54 0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.27 2k7r h GLN 23 CO 0.04 0.20 -0.25 0.00 -1.93 0.00 0.00 178.83 176.89 2k7r h MET 24 N -0.72 0.65 -0.79 1.69 -0.00 -0.77 -1.53 114.93 113.46 2k7r h MET 24 Ca -0.02 -0.26 0.04 0.00 -0.00 0.00 0.00 59.70 59.46 2k7r h MET 24 Cb 0.51 -0.03 -0.05 0.00 -0.00 0.00 0.00 31.60 32.03 2k7r h MET 24 CO 0.04 0.84 0.50 -0.22 -0.00 0.00 0.00 176.91 178.06 2k7r h LYS 25 N 0.56 0.92 -0.06 -0.10 1.63 -1.16 -0.95 116.57 117.41 2k7r h LYS 25 Ca 0.08 -0.06 -0.00 0.00 -0.85 0.00 0.00 60.65 59.82 2k7r h LYS 25 Cb 0.73 -0.21 -0.00 0.00 -0.60 0.00 0.00 32.23 32.15 2k7r h LYS 25 CO 0.06 0.61 0.03 1.49 -3.45 0.00 0.00 179.45 178.18 2k7r h GLU 26 N 0.95 0.08 -0.36 1.90 4.57 -0.55 -1.89 114.58 119.28 2k7r h GLU 26 Ca 0.33 -0.01 0.06 0.00 -1.18 0.00 0.00 59.36 58.56 2k7r h GLU 26 Cb 0.07 -0.01 -0.06 0.00 -0.16 0.00 0.00 28.75 28.58 2k7r h GLU 26 CO -0.13 0.19 0.02 0.87 -1.18 0.00 0.00 179.01 178.77 2k7r h LYS 27 N -0.04 0.12 -0.45 1.92 1.79 -0.89 -0.73 116.57 118.29 2k7r h LYS 27 Ca 0.02 -0.01 -0.00 0.00 -2.18 0.00 0.00 60.65 58.48 2k7r h LYS 27 Cb 0.13 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 30.73 2k7r h LYS 27 CO -0.00 0.08 0.26 0.28 -1.08 0.00 0.00 179.45 178.99 2k7r h VAL 28 N 0.12 1.15 -0.04 0.50 2.07 -1.06 -2.15 116.25 116.85 2k7r h VAL 28 Ca 0.18 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 67.34 2k7r h VAL 28 Cb 0.24 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 30.57 2k7r h VAL 28 CO -0.28 0.15 0.00 1.15 0.02 0.00 0.00 177.57 178.61 2k7r n MET 29 N -4.72 1.19 0.00 1.57 0.00 -0.72 -2.69 117.12 111.75 2k7r n MET 29 Ca 0.01 -0.29 0.07 0.00 0.00 0.00 0.00 57.70 57.50 2k7r n MET 29 Cb 0.06 -1.35 -0.02 0.00 0.00 0.00 0.00 33.22 31.91 2k7r n MET 29 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 175.97 177.60 2k7r n LYS 30 N -0.53 1.82 -2.99 3.17 4.01 -0.32 -4.95 118.16 118.38 2k7r n LYS 30 Ca 0.16 -0.58 -0.40 0.00 -0.51 0.00 0.00 58.31 56.98 2k7r n LYS 30 Cb 0.14 -1.24 -0.04 0.00 -0.51 0.00 0.00 35.03 33.38 2k7r n LYS 30 CO 0.00 0.00 0.00 0.34 -1.11 0.00 0.00 177.40 176.63 2k7r s ASP 31 N -2.00 7.03 0.27 4.39 -1.08 -1.05 -4.96 116.67 119.27 2k7r s ASP 31 Ca 0.11 1.24 -0.01 0.00 -0.52 0.00 0.00 52.55 53.37 2k7r s ASP 31 Cb 0.12 -2.43 0.36 0.00 -1.46 0.00 0.00 42.92 39.51 2k7r s ASP 31 CO 0.45 -0.15 1.77 0.06 0.52 0.00 0.00 175.17 177.81 2k7r h GLN 32 N 6.81 0.76 -0.20 4.34 3.07 -1.92 -2.44 115.11 125.53 2k7r h GLN 32 Ca -0.40 -0.20 -0.20 0.00 0.09 0.00 0.00 58.65 57.94 2k7r h GLN 32 Cb 1.19 -0.09 0.00 0.00 0.08 0.00 0.00 27.48 28.67 2k7r h GLN 32 CO 0.76 0.77 -0.67 -0.44 0.09 0.00 0.00 178.83 179.35 2k7r h ASP 33 N 0.71 0.87 -0.21 0.06 5.19 -1.95 -1.50 116.42 119.58 2k7r h ASP 33 Ca 0.14 -0.52 0.04 0.00 -0.62 0.00 0.00 57.03 56.07 2k7r h ASP 33 Cb 0.44 -0.25 -0.04 0.00 0.18 0.00 0.00 39.33 39.66 2k7r h ASP 33 CO 0.02 1.31 -0.05 0.58 -3.12 0.00 0.00 179.24 177.97 2k7r h VAL 34 N 0.55 0.79 -0.81 -1.35 2.07 -1.81 -1.39 116.25 114.30 2k7r h VAL 34 Ca -0.02 -0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.48 2k7r h VAL 34 Cb 1.27 0.78 -0.04 0.00 -1.52 0.00 0.00 31.29 31.79 2k7r h VAL 34 CO 0.14 0.00 0.44 1.56 0.02 0.00 0.00 177.57 179.73 2k7r h GLN 35 N 0.00 1.14 -0.82 1.57 4.20 -1.27 0.10 115.11 120.02 2k7r h GLN 35 Ca 0.10 -0.14 0.06 0.00 0.06 0.00 0.00 58.65 58.73 2k7r h GLN 35 Cb 0.16 -0.22 -0.06 0.00 0.30 0.00 0.00 27.48 27.66 2k7r h GLN 35 CO -0.22 0.84 0.51 0.00 -0.67 0.00 0.00 178.83 179.29 2k7r h ALA 36 N 1.23 1.12 -0.40 3.87 0.00 -0.95 -1.58 119.26 122.57 2k7r h ALA 36 Ca 0.29 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 55.03 2k7r h ALA 36 Cb 0.04 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2k7r h ALA 36 CO -0.04 0.26 -0.37 0.35 0.00 0.00 0.00 179.25 179.44 2k7r h PHE 37 N 0.94 1.13 -0.72 0.00 3.57 -0.29 -1.23 116.94 120.33 2k7r h PHE 37 Ca 0.35 -0.33 0.05 0.00 3.53 0.00 0.00 57.97 61.58 2k7r h PHE 37 Cb 0.14 -0.24 -0.05 0.00 2.79 0.00 0.00 35.95 38.59 2k7r h PHE 37 CO -0.04 1.16 0.43 -0.07 -2.23 0.00 0.00 178.31 177.56 2k7r h LEU 38 N 0.78 0.66 0.00 0.59 -0.00 -0.19 -0.17 115.31 116.98 2k7r h LEU 38 Ca 0.07 0.02 0.00 0.00 -0.00 0.00 0.00 57.88 57.97 2k7r h LEU 38 Cb 0.96 -0.12 0.00 0.00 -0.00 0.00 0.00 40.66 41.51 2k7r h LEU 38 CO 0.09 0.43 -0.35 0.07 -0.00 0.00 0.00 178.44 178.69 2k7r h LYS 39 N 0.80 0.00 0.20 1.13 2.10 -1.29 -0.84 116.57 118.66 2k7r h LYS 39 Ca 0.31 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.95 2k7r h LYS 39 Cb 0.14 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.48 2k7r h LYS 39 CO -0.16 0.00 -0.10 1.49 -2.00 0.00 0.00 179.45 178.68 2k7r h GLU 40 N 0.00 -0.26 -0.56 0.07 4.81 -0.28 -3.32 114.58 115.04 2k7r h GLU 40 Ca 0.00 0.02 -0.34 0.00 -0.13 0.00 0.00 59.36 58.91 2k7r h GLU 40 Cb 0.89 0.06 -0.21 0.00 0.63 0.00 0.00 28.75 30.12 2k7r h GLU 40 CO 0.00 0.07 -0.02 0.09 -0.73 0.00 0.00 179.01 178.41 2k7r n ASN 41 N -5.06 3.68 -0.08 1.04 3.02 -0.17 -4.75 115.26 112.93 2k7r n ASN 41 Ca -0.09 -3.78 0.14 0.00 -0.03 0.00 0.00 54.58 50.82 2k7r n ASN 41 Cb 0.24 -0.65 0.53 0.00 -0.61 0.00 0.00 39.78 39.29 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 1.34 0.33 0.00 3.52 4.11 -1.25 0.24 114.58 122.86 2k7r h GLU 42 Ca 0.34 -0.02 -0.08 0.00 0.07 0.00 0.00 59.36 59.67 2k7r h GLU 42 Cb 1.63 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.80 2k7r h GLU 42 CO 0.68 0.22 -0.55 1.49 0.07 0.00 0.00 179.01 180.91 2k7r h GLU 43 N 0.34 0.00 0.09 1.06 4.81 -1.85 -3.35 114.58 115.67 2k7r h GLU 43 Ca 0.29 0.00 -0.35 0.00 -0.13 0.00 0.00 59.36 59.17 2k7r h GLU 43 Cb 0.68 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.03 2k7r h GLU 43 CO -0.07 0.33 -1.97 0.28 -0.73 0.00 0.00 179.01 176.84 2k7r n VAL 44 N -3.11 1.70 -2.44 0.32 0.31 0.04 -4.91 118.33 110.24 2k7r n VAL 44 Ca 0.01 -0.54 -0.36 0.00 -0.01 0.00 0.00 64.34 63.43 2k7r n VAL 44 Cb 0.69 -1.75 -0.03 0.00 -0.91 0.00 0.00 33.84 31.84 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 -2.52 3.50 0.29 2.52 1.01 0.62 -5.06 121.20 121.55 2k7r s ILE 45 Ca -0.26 1.11 0.11 0.00 0.00 0.00 0.00 60.65 61.61 2k7r s ILE 45 Cb 0.07 -3.55 -0.05 0.00 0.01 0.00 0.00 42.46 38.93 2k7r s ILE 45 CO 0.71 -0.03 -0.17 -0.62 0.00 0.00 0.00 174.94 174.83 2k7r s ASP 46 N -1.54 3.51 0.30 3.58 2.15 -1.26 -4.88 116.67 118.53 2k7r s ASP 46 Ca 0.61 -1.07 -0.02 0.00 0.43 0.00 0.00 52.55 52.50 2k7r s ASP 46 Cb -0.24 -0.29 0.45 0.00 -0.30 0.00 0.00 42.92 42.54 2k7r s ASP 46 CO 0.29 -0.05 1.95 1.56 -0.17 0.00 0.00 175.17 178.76 2k7r h GLN 47 N 2.24 1.03 -0.59 4.34 4.20 -1.98 -1.07 115.11 123.27 2k7r h GLN 47 Ca -0.40 -0.08 -0.05 0.00 0.06 0.00 0.00 58.65 58.17 2k7r h GLN 47 Cb 1.25 -0.22 -0.03 0.00 0.30 0.00 0.00 27.48 28.79 2k7r h GLN 47 CO 0.63 0.71 0.16 0.87 -0.67 0.00 0.00 178.83 180.53 2k7r h LYS 48 N 1.05 0.90 -0.18 1.46 1.79 -2.00 -1.81 116.57 117.78 2k7r h LYS 48 Ca 0.28 -0.18 -0.05 0.00 -2.18 0.00 0.00 60.65 58.52 2k7r h LYS 48 Cb -0.06 -0.14 -0.01 0.00 -1.58 0.00 0.00 32.23 30.44 2k7r h LYS 48 CO -0.05 0.79 -0.10 1.98 -1.08 0.00 0.00 179.45 180.99 2k7r h MET 49 N 0.86 0.28 0.40 3.15 4.05 -1.53 -2.47 114.93 119.68 2k7r h MET 49 Ca 0.19 -0.06 -0.02 0.00 -0.28 0.00 0.00 59.70 59.53 2k7r h MET 49 Cb 0.28 -0.04 0.00 0.00 -0.80 0.00 0.00 31.60 31.04 2k7r h MET 49 CO -0.01 0.39 -0.19 0.82 0.23 0.00 0.00 176.91 178.15 2k7r h ILE 50 N 0.27 0.61 -0.28 1.77 1.08 -0.38 0.13 117.51 120.70 2k7r h ILE 50 Ca 0.06 -0.20 -0.00 0.00 -0.39 0.00 0.00 64.86 64.32 2k7r h ILE 50 Cb 0.34 0.71 -0.01 0.00 -3.07 0.00 0.00 36.82 34.79 2k7r h ILE 50 CO 0.02 0.04 0.17 1.05 -0.69 0.00 0.00 178.15 178.74 2k7r h GLU 51 N -0.65 0.38 -0.36 2.37 4.11 -1.43 0.15 114.58 119.15 2k7r h GLU 51 Ca -0.06 -0.03 0.05 0.00 0.07 0.00 0.00 59.36 59.39 2k7r h GLU 51 Cb 0.48 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.60 2k7r h GLU 51 CO 0.09 0.29 0.08 0.87 0.07 0.00 0.00 179.01 180.41 2k7r h LYS 52 N 0.35 0.20 -0.60 1.06 1.79 -1.42 -2.47 116.57 115.49 2k7r h LYS 52 Ca 0.10 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.56 2k7r h LYS 52 Cb 0.01 -0.05 0.00 0.00 -1.58 0.00 0.00 32.23 30.61 2k7r h LYS 52 CO -0.02 0.13 0.00 0.43 -1.08 0.00 0.00 179.45 178.92 2k7r n SER 53 N -5.08 3.44 -0.13 0.86 7.64 0.03 -4.29 113.62 116.09 2k7r n SER 53 Ca 0.02 -2.24 -0.04 0.00 1.01 0.00 0.00 58.87 57.61 2k7r n SER 53 Cb 0.16 -0.46 0.04 0.00 -1.01 0.00 0.00 64.21 62.94 2k7r n SER 53 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 2k7r h LEU 54 N 3.05 -0.00 -0.94 -3.43 6.46 -0.20 0.31 115.31 120.55 2k7r h LEU 54 Ca 0.00 0.08 0.08 0.00 -0.12 0.00 0.00 57.88 57.92 2k7r h LEU 54 Cb 1.03 0.11 -0.07 0.00 -0.73 0.00 0.00 40.66 40.99 2k7r h LEU 54 CO 0.13 0.03 0.59 0.78 -0.62 0.00 0.00 178.44 179.35 2k7r h ASN 55 N 0.21 0.90 -0.22 1.25 2.35 -1.79 0.73 115.58 119.02 2k7r h ASN 55 Ca 0.21 0.03 -0.10 0.00 -0.55 0.00 0.00 56.30 55.89 2k7r h ASN 55 Cb 0.27 -0.16 -0.00 0.00 0.05 0.00 0.00 38.32 38.48 2k7r h ASN 55 CO -0.28 0.54 -0.26 0.11 -1.65 0.00 0.00 177.43 175.89 2k7r h LYS 56 N 1.02 0.56 -0.74 0.81 1.79 -1.36 0.88 116.57 119.52 2k7r h LYS 56 Ca 0.43 -0.31 -0.04 0.00 -2.18 0.00 0.00 60.65 58.55 2k7r h LYS 56 Cb 0.28 0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 30.92 2k7r h LYS 56 CO -0.21 0.90 0.32 -0.07 -1.08 0.00 0.00 179.45 179.31 2k7r h LEU 57 N 0.24 0.99 -0.34 2.94 3.38 -0.03 0.15 115.31 122.65 2k7r h LEU 57 Ca 0.03 -0.13 -0.14 0.00 0.09 0.00 0.00 57.88 57.73 2k7r h LEU 57 Cb 0.82 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 2k7r h LEU 57 CO 0.06 0.87 -0.33 0.22 0.09 0.00 0.00 178.44 179.35 2k7r h TYR 58 N 1.07 0.98 -0.78 1.13 3.20 -0.78 -2.72 116.97 119.06 2k7r h TYR 58 Ca 0.25 -0.29 0.01 0.00 3.14 0.00 0.00 58.73 61.84 2k7r h TYR 58 Cb 0.17 -0.21 -0.04 0.00 1.54 0.00 0.00 36.73 38.20 2k7r h TYR 58 CO 0.02 1.08 0.52 1.49 -1.64 0.00 0.00 178.16 179.62 2k7r h GLU 59 N 0.60 1.03 -0.14 1.82 4.81 -0.29 0.76 114.58 123.17 2k7r h GLU 59 Ca 0.05 -0.06 0.03 0.00 -0.13 0.00 0.00 59.36 59.25 2k7r h GLU 59 Cb 0.91 -0.23 -0.03 0.00 0.63 0.00 0.00 28.75 30.02 2k7r h GLU 59 CO 0.08 0.69 -0.07 -0.92 -0.73 0.00 0.00 179.01 178.06 2k7r h TYR 60 N 1.06 -0.16 0.00 0.92 3.20 -0.52 -0.18 116.97 121.28 2k7r h TYR 60 Ca 0.29 0.02 -0.16 0.00 3.14 0.00 0.00 58.73 62.01 2k7r h TYR 60 Cb -0.12 0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.22 2k7r h TYR 60 CO 0.00 -0.11 -0.75 -0.84 -1.64 0.00 0.00 178.16 174.82 2k7r h ILE 61 N -0.06 1.51 -0.20 1.81 3.07 -1.16 -3.24 117.51 119.25 2k7r h ILE 61 Ca 0.08 -2.60 -0.03 0.00 1.55 0.00 0.00 64.86 63.85 2k7r h ILE 61 Cb 0.17 2.41 -0.01 0.00 -0.27 0.00 0.00 36.82 39.13 2k7r h ILE 61 CO -0.18 0.74 -0.01 -0.33 -1.05 0.00 0.00 178.15 177.32 2k7r h GLU 62 N 0.00 0.35 0.00 0.16 4.39 -0.58 -3.44 114.58 115.46 2k7r h GLU 62 Ca -0.01 -0.12 -0.20 0.00 0.34 0.00 0.00 59.36 59.38 2k7r h GLU 62 Cb 1.35 -0.03 0.11 0.00 -0.10 0.00 0.00 28.75 30.08 2k7r h GLU 62 CO 0.10 0.56 -0.00 1.04 -1.16 0.00 0.00 179.01 179.55 2k7r n GLN 63 N -4.69 -2.71 -1.56 2.33 6.02 -0.10 -4.81 117.38 111.85 2k7r n GLN 63 Ca -0.05 -0.86 -0.38 0.00 -0.01 0.00 0.00 57.00 55.71 2k7r n GLN 63 Cb 0.24 -0.92 -0.03 0.00 1.02 0.00 0.00 30.24 30.55 2k7r n GLN 63 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 2k7r n SER 64 N -4.19 2.56 0.07 1.08 3.41 -1.23 -4.80 113.62 110.51 2k7r n SER 64 Ca 0.08 -0.33 -0.03 0.00 -0.26 0.00 0.00 58.87 58.33 2k7r n SER 64 Cb 0.31 -1.58 0.21 0.00 -0.26 0.00 0.00 64.21 62.89 2k7r n SER 64 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 2k7r h LYS 65 N 18.50 0.30 0.00 4.33 3.64 -1.84 -3.40 116.57 138.11 2k7r h LYS 65 Ca -0.28 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 58.95 2k7r h LYS 65 Cb 1.26 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.08 2k7r h LYS 65 CO 1.11 0.66 0.00 0.27 -2.27 0.00 0.00 179.45 179.22 2k7r n ASN 66 N -4.03 0.93 -3.79 4.20 0.23 -1.26 -4.80 115.26 106.74 2k7r n ASN 66 Ca -0.01 0.00 -0.12 0.00 -0.53 0.00 0.00 54.58 53.92 2k7r n ASN 66 Cb 0.48 0.00 -0.08 0.00 -2.08 0.00 0.00 39.78 38.09 2k7r n ASN 66 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2k7r h SER 68 N 3.68 0.00 -0.01 0.00 0.02 -1.92 0.95 113.55 116.26 2k7r h SER 68 Ca -0.31 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.65 2k7r h SER 68 Cb 1.19 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.73 2k7r h SER 68 CO 0.43 0.24 0.09 0.22 -1.14 0.00 0.00 176.83 176.68 2k7r h TYR 69 N 0.00 0.00 0.00 3.45 3.20 -1.96 -3.24 116.97 118.42 2k7r h TYR 69 Ca -0.00 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.83 2k7r h TYR 69 Cb 0.92 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.19 2k7r h TYR 69 CO 0.00 0.00 -1.13 0.00 -1.64 0.00 0.00 178.16 175.39 2k7r s SER 71 N -4.92 5.92 -1.05 0.00 0.01 0.26 -4.98 113.70 108.94 2k7r s SER 71 Ca -0.03 -0.18 -0.07 0.00 1.31 0.00 0.00 55.95 56.97 2k7r s SER 71 Cb 0.01 -2.10 -0.07 0.00 0.21 0.00 0.00 66.02 64.07 2k7r s SER 71 CO 0.05 -0.11 2.97 1.21 0.41 0.00 0.00 173.24 177.77 2k7r n GLU 72 N 5.06 3.37 -2.93 12.44 2.13 -1.26 -3.75 120.64 135.69 2k7r n GLU 72 Ca -0.14 -2.22 -0.41 0.00 0.66 0.00 0.00 57.16 55.05 2k7r n GLU 72 Cb 0.51 -2.50 -0.04 0.00 0.27 0.00 0.00 31.44 29.67 2k7r n GLU 72 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 2k7r s ASP 73 N 1.53 6.87 0.27 4.31 -1.08 -1.26 -4.94 116.67 122.37 2k7r s ASP 73 Ca 0.65 1.07 0.25 0.00 -0.52 0.00 0.00 52.55 54.00 2k7r s ASP 73 Cb 0.24 -2.43 0.87 0.00 -1.46 0.00 0.00 42.92 40.14 2k7r s ASP 73 CO -0.07 -0.41 1.75 -0.33 0.52 0.00 0.00 175.17 176.63 2k7r h GLU 74 N 7.46 0.00 -0.00 4.34 4.39 -2.01 -3.23 114.58 125.53 2k7r h GLU 74 Ca -0.28 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.42 2k7r h GLU 74 Cb 1.12 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.77 2k7r h GLU 74 CO 0.83 0.00 -0.01 0.09 -1.16 0.00 0.00 179.01 178.76 2k7r n ASN 75 N -2.37 0.80 -4.62 1.42 4.13 -1.26 -4.99 115.26 108.37 2k7r n ASN 75 Ca 0.04 -0.90 -0.43 0.00 1.68 0.00 0.00 54.58 54.97 2k7r n ASN 75 Cb 0.36 0.27 -0.02 0.00 -1.54 0.00 0.00 39.78 38.85 2k7r n ASN 75 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2k7r s ASN 77 N 3.59 6.77 -0.12 0.00 2.47 -1.26 -4.93 114.94 121.46 2k7r s ASN 77 Ca 0.63 1.16 -0.01 0.00 0.42 0.00 0.00 52.86 55.06 2k7r s ASN 77 Cb -0.19 -2.54 -0.02 0.00 -1.45 0.00 0.00 41.25 37.04 2k7r s ASN 77 CO 0.27 -1.00 -0.08 0.20 -3.72 0.00 0.00 177.10 172.77 2k7r s ASN 78 N 2.36 4.46 0.00 -4.21 0.01 -1.26 -3.55 114.94 112.74 2k7r s ASN 78 Ca 0.52 -0.18 0.00 0.00 -0.71 0.00 0.00 52.86 52.49 2k7r s ASN 78 Cb -0.15 -1.55 0.00 0.00 0.41 0.00 0.00 41.25 39.96 2k7r s ASN 78 CO 0.20 0.22 0.00 0.18 -1.51 0.00 0.00 177.10 176.19 2k7r n LEU 79 N 3.21 1.44 -4.48 0.60 7.99 -1.26 -4.71 117.00 119.79 2k7r n LEU 79 Ca -0.18 0.02 -0.43 0.00 -0.01 0.00 0.00 56.01 55.41 2k7r n LEU 79 Cb 0.53 -0.04 -0.02 0.00 -0.11 0.00 0.00 43.42 43.78 2k7r n LEU 79 CO 0.31 -0.04 1.17 -0.76 -1.51 0.00 0.00 177.39 176.55 2k7r s LEU 80 N -2.15 4.71 0.46 2.23 1.02 -1.26 -5.01 118.68 118.68 2k7r s LEU 80 Ca 0.00 -2.07 -0.24 0.00 0.02 0.00 0.00 54.13 51.84 2k7r s LEU 80 Cb 0.00 -2.44 -0.07 0.00 0.02 0.00 0.00 46.19 43.70 2k7r s LEU 80 CO 0.00 -1.11 1.31 -0.70 0.02 0.00 0.00 176.35 175.87 2k7r s GLU 81 N 3.04 3.66 0.00 1.70 2.56 -1.26 -2.13 118.70 126.27 2k7r s GLU 81 Ca 0.37 2.15 0.00 0.00 0.00 0.00 0.00 54.97 57.49 2k7r s GLU 81 Cb -0.03 -2.54 0.00 0.00 2.00 0.00 0.00 34.13 33.56 2k7r s GLU 81 CO -0.08 -0.75 0.00 0.41 -0.56 0.00 0.00 175.26 174.28 2k7r n GLY 82 N 0.63 1.96 3.55 -1.50 0.00 -1.26 -5.01 105.19 103.55 2k7r n GLY 82 Ca 0.06 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.88 2.34 0.03 1.61 2.02 -0.90 0.07 117.35 119.64 2k7r s TYR 83 Ca 0.00 -0.64 0.04 0.00 -0.37 0.00 0.00 57.07 56.10 2k7r s TYR 83 Cb 0.00 -1.49 -0.02 0.00 -0.40 0.00 0.00 41.96 40.05 2k7r s TYR 83 CO 0.00 0.44 -0.12 -1.01 -1.57 0.00 0.00 175.55 173.29 2k7r s HIS 84 N -2.77 1.03 0.13 2.71 3.76 0.34 -4.59 115.29 115.90 2k7r s HIS 84 Ca 0.33 -0.34 -0.30 0.00 -0.15 0.00 0.00 55.06 54.60 2k7r s HIS 84 Cb 0.06 -0.62 -0.06 0.00 1.11 0.00 0.00 32.58 33.07 2k7r s HIS 84 CO 0.16 0.01 0.97 -1.25 -0.85 0.00 0.00 174.74 173.78 2k7r s PRO 85 N -1.08 4.71 -0.02 8.40 0.04 -1.26 -1.12 135.00 144.67 2k7r s PRO 85 Ca -0.00 1.48 0.06 0.00 0.04 0.00 0.00 61.00 62.57 2k7r s PRO 85 Cb -0.07 -3.36 -0.01 0.00 0.04 0.00 0.00 34.50 31.09 2k7r s PRO 85 CO 0.01 0.24 -0.19 -1.59 0.04 0.00 0.00 177.00 175.51 2k7r s LYS 86 N -0.16 1.53 0.06 4.56 -2.85 0.99 -4.95 119.74 118.93 2k7r s LYS 86 Ca 0.46 -0.66 -0.30 0.00 -1.00 0.00 0.00 55.97 54.47 2k7r s LYS 86 Cb -0.24 -1.47 -0.05 0.00 -2.06 0.00 0.00 37.83 34.01 2k7r s LYS 86 CO 0.30 0.39 1.07 -1.17 0.10 0.00 0.00 175.35 176.04 2k7r s LEU 87 N -0.41 4.41 0.24 2.77 2.96 -1.26 -2.03 118.68 125.35 2k7r s LEU 87 Ca 0.06 1.86 0.00 0.00 -0.22 0.00 0.00 54.13 55.84 2k7r s LEU 87 Cb -0.07 -3.58 -0.05 0.00 0.50 0.00 0.00 46.19 42.99 2k7r s LEU 87 CO -0.01 -0.30 0.11 0.68 -1.32 0.00 0.00 176.35 175.52 2k7r s VAL 88 N 0.70 0.37 -0.27 1.68 -7.23 -0.21 -4.98 120.40 110.47 2k7r s VAL 88 Ca 0.53 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.67 2k7r s VAL 88 Cb -0.25 -2.59 0.02 0.00 0.56 0.00 0.00 36.38 34.12 2k7r s VAL 88 CO 0.30 0.00 -0.01 0.54 -0.31 0.00 0.00 175.10 175.62 2k7r s VAL 89 N -3.89 3.24 -0.27 1.32 0.11 -1.26 0.14 120.40 119.78 2k7r s VAL 89 Ca 0.38 -0.96 0.03 0.00 -2.93 0.00 0.00 61.98 58.50 2k7r s VAL 89 Cb 0.08 -2.68 0.07 0.00 -1.53 0.00 0.00 36.38 32.32 2k7r s VAL 89 CO 0.13 0.13 -0.07 0.20 -3.33 0.00 0.00 175.10 172.16 2k7r s ASN 90 N 1.37 4.41 1.24 3.54 0.01 0.43 -4.93 114.94 121.01 2k7r s ASN 90 Ca 0.00 -1.51 0.00 0.00 -0.71 0.00 0.00 52.86 50.64 2k7r s ASN 90 Cb -0.17 -1.49 0.00 0.00 0.41 0.00 0.00 41.25 40.00 2k7r s ASN 90 CO -0.02 -0.24 0.00 0.61 -1.51 0.00 0.00 177.10 175.94 2k7r n GLY 91 N 4.44 1.88 0.17 0.66 0.00 -1.26 -2.21 105.19 108.87 2k7r n GLY 91 Ca -0.10 -0.17 0.03 0.00 0.00 0.00 0.00 46.02 45.78 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 3.08 2.71 -4.23 1.61 5.12 -1.26 -5.02 116.66 118.67 2k7r n ARG 92 Ca 0.00 -1.83 -0.20 0.00 -1.93 0.00 0.00 57.85 53.89 2k7r n ARG 92 Cb 0.00 -1.16 -0.12 0.00 -1.16 0.00 0.00 32.46 30.02 2k7r n ARG 92 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 2k7r s SER 93 N -1.33 2.05 -0.03 0.55 1.04 -0.94 -4.71 113.70 110.33 2k7r s SER 93 Ca 0.11 -0.67 -0.23 0.00 0.48 0.00 0.00 55.95 55.63 2k7r s SER 93 Cb 0.08 -0.09 -0.04 0.00 0.10 0.00 0.00 66.02 66.07 2k7r s SER 93 CO 0.04 -0.04 0.70 -0.63 0.98 0.00 0.00 173.24 174.29 2k7r s ILE 94 N -1.38 4.94 0.40 -1.02 1.01 -1.26 -0.43 121.20 123.47 2k7r s ILE 94 Ca 0.03 1.47 0.07 0.00 0.00 0.00 0.00 60.65 62.22 2k7r s ILE 94 Cb -0.09 -4.05 -0.08 0.00 0.01 0.00 0.00 42.46 38.26 2k7r s ILE 94 CO 0.03 0.30 0.01 -0.62 0.00 0.00 0.00 174.94 174.66 2k7r s ASP 95 N 0.43 3.90 -0.19 3.58 2.15 0.12 -4.85 116.67 121.81 2k7r s ASP 95 Ca 0.37 -1.32 0.00 0.00 0.43 0.00 0.00 52.55 52.03 2k7r s ASP 95 Cb -0.19 -0.40 0.05 0.00 -0.30 0.00 0.00 42.92 42.08 2k7r s ASP 95 CO 0.19 -0.42 -0.07 -0.63 -0.17 0.00 0.00 175.17 174.07 2k7r s ILE 96 N -2.69 1.36 0.28 4.11 1.01 -1.26 -1.04 121.20 122.97 2k7r s ILE 96 Ca 0.35 -0.87 0.11 0.00 0.00 0.00 0.00 60.65 60.24 2k7r s ILE 96 Cb 0.08 -1.53 -0.05 0.00 0.01 0.00 0.00 42.46 40.98 2k7r s ILE 96 CO 0.18 0.09 -0.15 -1.83 0.00 0.00 0.00 174.94 173.24 2k7r s GLU 97 N 1.51 1.84 -0.16 2.79 -1.05 -0.86 -4.92 118.70 117.84 2k7r s GLU 97 Ca -0.01 -1.67 -0.04 0.00 -0.15 0.00 0.00 54.97 53.09 2k7r s GLU 97 Cb -0.16 -1.88 -0.03 0.00 -0.44 0.00 0.00 34.13 31.62 2k7r s GLU 97 CO -0.08 0.34 -0.03 0.71 0.95 0.00 0.00 175.26 177.16 2k7r s TYR 98 N -2.45 3.03 0.15 4.83 1.51 -1.26 -0.00 117.35 123.16 2k7r s TYR 98 Ca 0.30 -0.32 0.06 0.00 -1.01 0.00 0.00 57.07 56.10 2k7r s TYR 98 Cb -0.05 -1.98 -0.04 0.00 -0.11 0.00 0.00 41.96 39.77 2k7r s TYR 98 CO 0.16 -0.07 0.05 1.52 -1.11 0.00 0.00 175.55 176.10 2k7r s TYR 99 N 0.47 2.98 0.19 2.71 -0.85 -0.27 -4.90 117.35 117.67 2k7r s TYR 99 Ca -0.03 -0.07 -0.30 0.00 -0.52 0.00 0.00 57.07 56.15 2k7r s TYR 99 Cb -0.14 -1.45 -0.08 0.00 0.38 0.00 0.00 41.96 40.66 2k7r s TYR 99 CO 0.03 0.51 1.17 -2.00 -1.52 0.00 0.00 175.55 173.74 2k7r s GLU 100 N -2.88 4.52 -0.10 -3.49 2.12 -1.26 -0.50 118.70 117.12 2k7r s GLU 100 Ca 0.28 1.84 -0.40 0.00 0.36 0.00 0.00 54.97 57.05 2k7r s GLU 100 Cb -0.10 -3.24 -0.18 0.00 0.26 0.00 0.00 34.13 30.87 2k7r s GLU 100 CO 0.20 -0.04 1.41 0.00 -0.54 0.00 0.00 175.26 176.30 2k7r n PRO 102 N 3.19 0.10 0.27 0.00 -0.04 -1.26 -1.29 135.00 135.97 2k7r n PRO 102 Ca 0.22 0.60 0.14 0.00 -0.04 0.00 0.00 63.50 64.42 2k7r n PRO 102 Cb 0.12 -1.86 0.71 0.00 -0.04 0.00 0.00 33.50 32.43 2k7r n PRO 102 CO 0.00 0.00 0.00 -0.24 -0.04 0.00 0.00 175.50 175.22 2k7r h VAL 103 N 0.00 0.38 0.00 0.52 3.04 -1.88 0.07 116.25 118.39 2k7r h VAL 103 Ca 0.00 -0.60 -0.05 0.00 -1.01 0.00 0.00 66.70 65.03 2k7r h VAL 103 Cb 0.03 1.44 -0.01 0.00 -2.01 0.00 0.00 31.29 30.74 2k7r h VAL 103 CO 0.00 0.10 -0.26 0.11 -1.01 0.00 0.00 177.57 176.51 2k7r h LYS 104 N 0.00 0.00 -0.52 4.17 1.79 -1.54 -1.21 116.57 119.26 2k7r h LYS 104 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2k7r h LYS 104 Cb 0.43 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.08 2k7r h LYS 104 CO 0.01 0.26 0.00 0.54 -1.08 0.00 0.00 179.45 179.18 2k7r n ARG 105 N -4.08 3.39 -0.05 3.15 5.12 -0.13 -5.16 116.66 118.90 2k7r n ARG 105 Ca -0.02 -2.70 0.00 0.00 -1.93 0.00 0.00 57.85 53.20 2k7r n ARG 105 Cb 0.32 -1.75 0.00 0.00 -1.16 0.00 0.00 32.46 29.88 2k7r n ARG 105 CO 0.00 0.00 0.00 0.36 -1.93 0.00 0.00 177.63 176.06