#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 3.46 -0.74 2.12 8.01 -1.26 -4.86 118.70 125.43 2k7r s GLU 2 Ca 0.00 2.19 -0.26 0.00 0.01 0.00 0.00 54.97 56.92 2k7r s GLU 2 Cb 0.00 -2.43 -0.04 0.00 -4.31 0.00 0.00 34.13 27.34 2k7r s GLU 2 CO 0.00 -0.92 1.98 -2.14 0.01 0.00 0.00 175.26 174.19 2k7r s PRO 3 N -2.69 2.48 -0.26 0.39 0.02 -1.26 -4.93 135.00 128.75 2k7r s PRO 3 Ca 0.66 0.28 -0.00 0.00 0.02 0.00 0.00 61.00 61.96 2k7r s PRO 3 Cb -0.39 -4.72 0.04 0.00 0.02 0.00 0.00 34.50 29.45 2k7r s PRO 3 CO 0.48 -3.18 -0.07 -1.50 -0.33 0.00 0.00 177.00 172.40 2k7r s ILE 4 N 10.18 2.62 -0.24 2.83 1.10 -1.26 -5.00 121.20 131.43 2k7r s ILE 4 Ca 0.73 -1.31 -0.18 0.00 -0.51 0.00 0.00 60.65 59.38 2k7r s ILE 4 Cb -0.10 -2.43 -0.15 0.00 0.15 0.00 0.00 42.46 39.93 2k7r s ILE 4 CO 0.11 0.07 -0.09 0.61 -2.11 0.00 0.00 174.94 173.53 2k7r n GLY 5 N 4.58 -0.64 3.54 1.50 0.00 -1.26 -4.74 105.19 108.18 2k7r n GLY 5 Ca -0.15 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 2k7r n GLY 5 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k7r s ARG 6 N -2.44 3.63 0.41 1.61 3.00 -1.26 -4.97 118.95 118.92 2k7r s ARG 6 Ca -0.34 -1.30 0.08 0.00 0.00 0.00 0.00 55.73 54.16 2k7r s ARG 6 Cb 0.11 -5.30 -0.01 0.00 0.00 0.00 0.00 34.95 29.75 2k7r s ARG 6 CO 0.53 -2.14 0.46 -1.54 0.00 0.00 0.00 175.30 172.62 2k7r s SER 7 N 4.68 5.39 0.00 0.23 1.04 -1.26 -5.03 113.70 118.75 2k7r s SER 7 Ca 0.44 -0.55 0.16 0.00 0.48 0.00 0.00 55.95 56.48 2k7r s SER 7 Cb -0.01 -0.69 0.38 0.00 0.10 0.00 0.00 66.02 65.80 2k7r s SER 7 CO -0.09 -0.66 1.29 0.18 0.98 0.00 0.00 173.24 174.95 2k7r n LEU 8 N -1.67 3.13 -1.43 2.42 4.77 -1.26 -4.40 117.00 118.56 2k7r n LEU 8 Ca 0.05 -1.76 -0.02 0.00 -0.03 0.00 0.00 56.01 54.25 2k7r n LEU 8 Cb 0.60 -0.26 0.19 0.00 -2.33 0.00 0.00 43.42 41.62 2k7r n LEU 8 CO 0.41 0.74 0.72 0.00 -1.33 0.00 0.00 177.39 177.93 2k7r n GLN 9 N 0.98 2.75 -3.54 3.23 6.02 -1.26 -4.52 117.38 121.05 2k7r n GLN 9 Ca 0.15 -1.78 -0.27 0.00 -0.01 0.00 0.00 57.00 55.09 2k7r n GLN 9 Cb 0.49 -1.86 -0.11 0.00 1.02 0.00 0.00 30.24 29.78 2k7r n GLN 9 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2k7r n GLY 10 N 0.10 2.72 3.60 1.08 0.00 -1.26 -5.08 105.19 106.35 2k7r n GLY 10 Ca 0.22 -1.70 -0.43 0.00 0.00 0.00 0.00 46.02 44.11 2k7r n GLY 10 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2k7r s VAL 11 N -0.44 3.16 0.29 1.61 1.01 -1.26 -4.92 120.40 119.85 2k7r s VAL 11 Ca 0.31 0.17 0.04 0.00 0.00 0.00 0.00 61.98 62.50 2k7r s VAL 11 Cb 0.02 -3.22 -0.03 0.00 0.00 0.00 0.00 36.38 33.15 2k7r s VAL 11 CO -0.19 -0.14 0.25 0.42 0.00 0.00 0.00 175.10 175.44 2k7r s THR 12 N 7.81 0.00 0.98 3.92 -4.23 -1.26 -5.17 115.64 117.70 2k7r s THR 12 Ca 0.94 -1.97 -0.16 0.00 -1.18 0.00 0.00 61.69 59.32 2k7r s THR 12 Cb -0.30 -2.50 0.19 0.00 1.34 0.00 0.00 72.50 71.23 2k7r s THR 12 CO 0.35 0.00 1.24 -0.83 -0.54 0.00 0.00 174.62 174.84 2k7r s GLY 13 N -3.30 1.70 -0.39 3.99 0.00 -1.26 -5.07 107.32 102.99 2k7r s GLY 13 Ca 0.39 -1.01 0.03 0.00 0.00 0.00 0.00 44.72 44.13 2k7r s GLY 13 CO 0.22 -0.28 0.31 0.50 0.00 0.00 0.00 173.10 173.86 2k7r s ARG 14 N -5.69 0.77 0.08 2.90 3.00 -1.26 -5.11 118.95 113.63 2k7r s ARG 14 Ca 0.71 -1.71 -0.31 0.00 0.00 0.00 0.00 55.73 54.42 2k7r s ARG 14 Cb -0.07 -1.27 -0.09 0.00 0.00 0.00 0.00 34.95 33.52 2k7r s ARG 14 CO 0.53 -1.31 1.76 -1.25 0.00 0.00 0.00 175.30 175.02 2k7r s PRO 15 N 0.53 4.17 0.50 3.54 0.04 -1.26 -4.89 135.00 137.62 2k7r s PRO 15 Ca 0.27 2.46 0.16 0.00 0.04 0.00 0.00 61.00 63.93 2k7r s PRO 15 Cb -0.07 -3.68 1.20 0.00 0.04 0.00 0.00 34.50 32.00 2k7r s PRO 15 CO -0.11 -0.81 2.09 -0.44 0.04 0.00 0.00 177.00 177.78 2k7r h ASP 16 N 8.75 0.00 -0.01 6.66 3.32 -1.99 -2.74 116.42 130.41 2k7r h ASP 16 Ca -0.44 0.00 0.02 0.00 0.02 0.00 0.00 57.03 56.63 2k7r h ASP 16 Cb 1.21 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.73 2k7r h ASP 16 CO 0.94 0.07 -0.12 0.15 -1.72 0.00 0.00 179.24 178.56 2k7r h PHE 17 N 0.00 -0.30 -0.04 4.55 3.57 -1.99 0.12 116.94 122.85 2k7r h PHE 17 Ca -0.00 0.01 -0.12 0.00 3.53 0.00 0.00 57.97 61.39 2k7r h PHE 17 Cb 0.13 0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.00 2k7r h PHE 17 CO 0.00 -0.18 -0.53 -0.56 -2.23 0.00 0.00 178.31 174.81 2k7r h GLN 18 N -0.20 0.11 -0.07 1.11 -0.00 -1.90 -0.27 115.11 113.89 2k7r h GLN 18 Ca 0.05 -0.06 -0.01 0.00 -0.00 0.00 0.00 58.65 58.62 2k7r h GLN 18 Cb 0.26 0.01 -0.00 0.00 -0.00 0.00 0.00 27.48 27.74 2k7r h GLN 18 CO -0.13 0.61 -0.01 0.87 -0.00 0.00 0.00 178.83 180.18 2k7r h LYS 19 N 0.09 0.13 -0.08 0.06 1.57 -1.19 -0.86 116.57 116.29 2k7r h LYS 19 Ca -0.00 -0.04 -0.10 0.00 -1.87 0.00 0.00 60.65 58.64 2k7r h LYS 19 Cb 0.96 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.25 2k7r h LYS 19 CO 0.07 0.42 -0.39 0.07 -0.57 0.00 0.00 179.45 179.05 2k7r h ARG 20 N -0.17 0.17 0.02 3.15 0.11 -0.71 -2.26 114.38 114.70 2k7r h ARG 20 Ca 0.02 -0.08 -0.00 0.00 0.10 0.00 0.00 59.98 60.02 2k7r h ARG 20 Cb 0.36 -0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.44 2k7r h ARG 20 CO 0.00 0.54 -0.01 1.25 0.10 0.00 0.00 179.97 181.85 2k7r h LEU 21 N 0.14 -0.03 -0.50 0.08 5.85 -0.81 0.25 115.31 120.30 2k7r h LEU 21 Ca 0.01 -0.14 0.01 0.00 0.84 0.00 0.00 57.88 58.61 2k7r h LEU 21 Cb 0.76 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.77 2k7r h LEU 21 CO 0.06 0.12 0.32 -0.33 -0.34 0.00 0.00 178.44 178.27 2k7r h GLU 22 N -0.18 0.64 0.71 1.25 5.08 -1.11 -0.45 114.58 120.52 2k7r h GLU 22 Ca -0.00 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.29 2k7r h GLU 22 Cb 0.16 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.27 2k7r h GLU 22 CO 0.01 0.42 -0.39 0.37 -1.00 0.00 0.00 179.01 178.42 2k7r h GLN 23 N 0.66 -0.98 -0.48 2.33 4.15 -1.14 0.21 115.11 119.85 2k7r h GLN 23 Ca 0.19 0.07 -0.10 0.00 0.77 0.00 0.00 58.65 59.57 2k7r h GLN 23 Cb -0.05 0.22 -0.02 0.00 0.21 0.00 0.00 27.48 27.84 2k7r h GLN 23 CO -0.05 -0.65 -0.10 0.00 -1.93 0.00 0.00 178.83 176.09 2k7r h MET 24 N -1.02 0.89 -0.60 1.69 -0.00 -0.95 -1.20 114.93 113.74 2k7r h MET 24 Ca -0.09 -0.31 -0.06 0.00 -0.00 0.00 0.00 59.70 59.24 2k7r h MET 24 Cb 0.80 -0.07 -0.02 0.00 -0.00 0.00 0.00 31.60 32.31 2k7r h MET 24 CO 0.13 0.95 0.13 -0.22 -0.00 0.00 0.00 176.91 177.89 2k7r h LYS 25 N 0.80 0.98 0.06 -0.10 1.63 -0.95 -1.45 116.57 117.53 2k7r h LYS 25 Ca 0.13 -0.24 -0.00 0.00 -0.85 0.00 0.00 60.65 59.68 2k7r h LYS 25 Cb 0.62 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 32.13 2k7r h LYS 25 CO 0.04 0.90 -0.03 1.49 -3.45 0.00 0.00 179.45 178.41 2k7r h GLU 26 N 0.88 -0.08 -0.84 1.90 4.81 -0.37 -0.34 114.58 120.55 2k7r h GLU 26 Ca 0.19 0.01 0.11 0.00 -0.13 0.00 0.00 59.36 59.53 2k7r h GLU 26 Cb 0.38 0.02 -0.08 0.00 0.63 0.00 0.00 28.75 29.70 2k7r h GLU 26 CO 0.01 0.04 0.47 0.87 -0.73 0.00 0.00 179.01 179.67 2k7r h LYS 27 N -0.17 0.74 -0.32 1.92 1.57 -1.01 0.11 116.57 119.41 2k7r h LYS 27 Ca -0.01 -0.04 -0.11 0.00 -1.87 0.00 0.00 60.65 58.62 2k7r h LYS 27 Cb 0.15 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 2k7r h LYS 27 CO 0.01 0.49 -0.21 0.28 -0.57 0.00 0.00 179.45 179.46 2k7r h VAL 28 N 0.76 1.29 0.00 0.50 2.07 -1.11 -3.11 116.25 116.66 2k7r h VAL 28 Ca 0.42 -1.34 0.00 0.00 0.82 0.00 0.00 66.70 66.60 2k7r h VAL 28 Cb 0.44 1.46 0.00 0.00 -1.52 0.00 0.00 31.29 31.67 2k7r h VAL 28 CO -0.28 0.44 0.00 0.23 0.02 0.00 0.00 177.57 177.98 2k7r n MET 29 N -4.30 0.29 0.00 1.57 2.81 -0.15 -3.02 117.12 114.31 2k7r n MET 29 Ca -0.03 0.02 0.09 0.00 -1.81 0.00 0.00 57.70 55.98 2k7r n MET 29 Cb 0.42 -1.50 0.01 0.00 -0.71 0.00 0.00 33.22 31.44 2k7r n MET 29 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 2k7r n LYS 30 N -1.35 1.52 -2.91 0.03 4.01 0.28 -4.94 118.16 114.80 2k7r n LYS 30 Ca 0.11 -1.00 -0.40 0.00 -0.51 0.00 0.00 58.31 56.51 2k7r n LYS 30 Cb 0.25 -1.37 -0.05 0.00 -0.51 0.00 0.00 35.03 33.36 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 -2.08 7.28 0.16 4.39 2.15 -1.17 -4.96 116.67 122.43 2k7r s ASP 31 Ca 0.17 1.53 -0.11 0.00 0.43 0.00 0.00 52.55 54.56 2k7r s ASP 31 Cb 0.15 -2.50 0.03 0.00 -0.30 0.00 0.00 42.92 40.31 2k7r s ASP 31 CO 0.45 -0.03 1.61 0.06 -0.17 0.00 0.00 175.17 177.09 2k7r h GLN 32 N 5.78 0.94 -0.06 4.34 3.07 -1.92 -2.71 115.11 124.56 2k7r h GLN 32 Ca -0.43 -0.30 -0.20 0.00 0.09 0.00 0.00 58.65 57.81 2k7r h GLN 32 Cb 1.21 -0.08 -0.00 0.00 0.08 0.00 0.00 27.48 28.68 2k7r h GLN 32 CO 0.72 0.96 -0.80 -0.44 0.09 0.00 0.00 178.83 179.35 2k7r h ASP 33 N 0.81 0.52 -0.40 0.06 3.32 -1.97 -2.07 116.42 116.69 2k7r h ASP 33 Ca 0.15 -0.37 0.06 0.00 0.02 0.00 0.00 57.03 56.89 2k7r h ASP 33 Cb 0.54 -0.16 -0.05 0.00 0.22 0.00 0.00 39.33 39.88 2k7r h ASP 33 CO 0.03 1.13 0.11 0.58 -1.72 0.00 0.00 179.24 179.37 2k7r h VAL 34 N 0.27 0.83 -0.12 -1.35 2.07 -1.86 -1.64 116.25 114.45 2k7r h VAL 34 Ca -0.05 -0.09 -0.06 0.00 0.82 0.00 0.00 66.70 67.33 2k7r h VAL 34 Cb 1.40 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 2k7r h VAL 34 CO 0.14 0.05 -0.19 1.56 0.02 0.00 0.00 177.57 179.15 2k7r h GLN 35 N 0.25 0.20 -0.30 1.57 4.20 -1.23 0.73 115.11 120.53 2k7r h GLN 35 Ca 0.19 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.84 2k7r h GLN 35 Cb 0.21 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 2k7r h GLN 35 CO -0.22 0.39 0.15 0.00 -0.67 0.00 0.00 178.83 178.47 2k7r h ALA 36 N 1.63 0.39 -0.50 3.87 0.00 -0.78 -0.22 119.26 123.65 2k7r h ALA 36 Ca 0.03 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 2k7r h ALA 36 Cb 0.44 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2k7r h ALA 36 CO 0.03 -0.05 0.06 0.35 0.00 0.00 0.00 179.25 179.63 2k7r h PHE 37 N 0.35 0.91 -0.62 0.00 3.57 -0.71 -2.22 116.94 118.23 2k7r h PHE 37 Ca 0.10 -0.14 0.05 0.00 3.53 0.00 0.00 57.97 61.51 2k7r h PHE 37 Cb 0.12 -0.25 -0.05 0.00 2.79 0.00 0.00 35.95 38.56 2k7r h PHE 37 CO -0.02 0.84 0.35 -0.07 -2.23 0.00 0.00 178.31 177.18 2k7r h LEU 38 N 0.73 0.53 -0.68 0.59 -0.00 -0.61 -1.32 115.31 114.55 2k7r h LEU 38 Ca 0.15 0.02 -0.12 0.00 -0.00 0.00 0.00 57.88 57.93 2k7r h LEU 38 Cb 0.44 -0.08 -0.02 0.00 -0.00 0.00 0.00 40.66 41.00 2k7r h LEU 38 CO 0.01 0.35 -0.56 0.07 -0.00 0.00 0.00 178.44 178.32 2k7r h LYS 39 N 0.66 0.00 0.39 1.13 2.10 -0.95 -0.91 116.57 118.99 2k7r h LYS 39 Ca 0.27 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.90 2k7r h LYS 39 Cb 0.13 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.46 2k7r h LYS 39 CO -0.16 0.56 -0.19 1.49 -2.00 0.00 0.00 179.45 179.16 2k7r h GLU 40 N 0.00 -0.51 -0.88 0.07 4.81 -0.75 -3.30 114.58 114.02 2k7r h GLU 40 Ca -0.01 0.03 -0.46 0.00 -0.13 0.00 0.00 59.36 58.80 2k7r h GLU 40 Cb 1.12 0.12 -0.27 0.00 0.63 0.00 0.00 28.75 30.34 2k7r h GLU 40 CO 0.07 -0.20 0.52 0.09 -0.73 0.00 0.00 179.01 178.76 2k7r n ASN 41 N -5.19 3.59 0.28 1.04 3.02 -0.56 -4.60 115.26 112.83 2k7r n ASN 41 Ca -0.10 -3.65 0.12 0.00 -0.03 0.00 0.00 54.58 50.92 2k7r n ASN 41 Cb 0.28 -0.80 0.78 0.00 -0.61 0.00 0.00 39.78 39.43 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 1.02 0.00 0.00 3.52 4.11 -1.24 0.30 114.58 122.30 2k7r h GLU 42 Ca 0.56 0.00 -0.11 0.00 0.07 0.00 0.00 59.36 59.89 2k7r h GLU 42 Cb 2.61 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 31.84 2k7r h GLU 42 CO 0.99 0.01 -0.92 1.49 0.07 0.00 0.00 179.01 180.65 2k7r h GLU 43 N 0.00 0.00 0.04 1.06 4.57 -1.86 -3.37 114.58 115.02 2k7r h GLU 43 Ca -0.00 0.00 -0.35 0.00 -1.18 0.00 0.00 59.36 57.83 2k7r h GLU 43 Cb 0.03 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.58 2k7r h GLU 43 CO 0.00 0.29 -2.05 0.28 -1.18 0.00 0.00 179.01 176.36 2k7r n VAL 44 N -2.99 1.62 -3.22 0.32 0.31 -0.42 -4.91 118.33 109.03 2k7r n VAL 44 Ca -0.03 -0.72 -0.32 0.00 -0.01 0.00 0.00 64.34 63.26 2k7r n VAL 44 Cb 0.73 -1.25 -0.05 0.00 -0.91 0.00 0.00 33.84 32.35 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 -2.55 4.82 0.32 2.52 1.01 -0.04 -5.09 121.20 122.18 2k7r s ILE 45 Ca -0.17 0.65 0.10 0.00 0.00 0.00 0.00 60.65 61.24 2k7r s ILE 45 Cb 0.07 -3.64 -0.06 0.00 0.01 0.00 0.00 42.46 38.85 2k7r s ILE 45 CO 0.77 -0.20 -0.11 -0.62 0.00 0.00 0.00 174.94 174.78 2k7r s ASP 46 N -2.49 3.76 0.28 3.58 2.15 -1.26 -4.87 116.67 117.82 2k7r s ASP 46 Ca 0.50 -1.10 -0.03 0.00 0.43 0.00 0.00 52.55 52.35 2k7r s ASP 46 Cb -0.11 -0.37 0.38 0.00 -0.30 0.00 0.00 42.92 42.52 2k7r s ASP 46 CO 0.22 -0.12 1.94 1.56 -0.17 0.00 0.00 175.17 178.60 2k7r h GLN 47 N 2.07 1.18 -0.58 4.34 1.08 -1.98 -0.60 115.11 120.62 2k7r h GLN 47 Ca -0.42 -0.07 -0.06 0.00 -1.45 0.00 0.00 58.65 56.65 2k7r h GLN 47 Cb 1.25 -0.27 -0.03 0.00 -0.05 0.00 0.00 27.48 28.39 2k7r h GLN 47 CO 0.66 0.78 0.10 0.87 -0.95 0.00 0.00 178.83 180.30 2k7r h LYS 48 N 1.22 0.93 -0.10 1.46 1.57 -1.99 -1.25 116.57 118.40 2k7r h LYS 48 Ca 0.35 -0.22 -0.09 0.00 -1.87 0.00 0.00 60.65 58.82 2k7r h LYS 48 Cb -0.09 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.08 2k7r h LYS 48 CO -0.08 0.86 -0.33 1.98 -0.57 0.00 0.00 179.45 181.31 2k7r h MET 49 N 0.88 0.20 -0.28 3.15 4.05 -1.70 0.35 114.93 121.58 2k7r h MET 49 Ca 0.18 -0.08 -0.02 0.00 -0.28 0.00 0.00 59.70 59.51 2k7r h MET 49 Cb 0.37 -0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 31.15 2k7r h MET 49 CO 0.01 0.51 0.10 0.82 0.23 0.00 0.00 176.91 178.57 2k7r h ILE 50 N 0.18 1.19 -0.52 1.77 1.08 -0.39 0.20 117.51 121.02 2k7r h ILE 50 Ca 0.02 -0.59 -0.11 0.00 -0.39 0.00 0.00 64.86 63.78 2k7r h ILE 50 Cb 0.67 1.06 -0.02 0.00 -3.07 0.00 0.00 36.82 35.46 2k7r h ILE 50 CO 0.05 0.20 -0.12 -0.33 -0.69 0.00 0.00 178.15 177.26 2k7r h GLU 51 N 0.29 0.99 -0.38 2.37 4.39 -0.87 0.12 114.58 121.50 2k7r h GLU 51 Ca 0.09 -0.38 -0.07 0.00 0.34 0.00 0.00 59.36 59.34 2k7r h GLU 51 Cb 0.22 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.80 2k7r h GLU 51 CO -0.00 1.06 -0.03 -0.22 -1.16 0.00 0.00 179.01 178.65 2k7r h LYS 52 N 0.86 0.69 -0.61 2.33 1.63 -0.86 -2.97 116.57 117.65 2k7r h LYS 52 Ca 0.13 -0.24 0.00 0.00 -0.85 0.00 0.00 60.65 59.69 2k7r h LYS 52 Cb 0.69 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 32.26 2k7r h LYS 52 CO 0.05 0.81 0.00 0.43 -3.45 0.00 0.00 179.45 177.29 2k7r n SER 53 N -4.43 5.42 0.22 4.20 7.64 0.05 -4.28 113.62 122.45 2k7r n SER 53 Ca -0.01 -2.83 0.06 0.00 1.01 0.00 0.00 58.87 57.09 2k7r n SER 53 Cb 0.31 -0.67 0.52 0.00 -1.01 0.00 0.00 64.21 63.36 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 3.85 0.01 -1.07 -3.43 5.85 -0.58 0.77 115.31 120.71 2k7r h LEU 54 Ca 0.00 -0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 2k7r h LEU 54 Cb 1.86 -0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.85 2k7r h LEU 54 CO 0.44 0.16 0.36 -0.55 -0.34 0.00 0.00 178.44 178.52 2k7r h ASN 55 N 0.01 0.92 -0.06 1.25 -1.07 -1.80 0.12 115.58 114.96 2k7r h ASN 55 Ca 0.00 -0.09 -0.24 0.00 0.07 0.00 0.00 56.30 56.05 2k7r h ASN 55 Cb 0.27 -0.23 0.02 0.00 -2.07 0.00 0.00 38.32 36.30 2k7r h ASN 55 CO 0.02 0.76 -0.88 0.11 0.07 0.00 0.00 177.43 177.51 2k7r h LYS 56 N 1.02 0.70 -0.78 4.14 1.79 -1.25 0.17 116.57 122.35 2k7r h LYS 56 Ca 0.25 -0.68 -0.02 0.00 -2.18 0.00 0.00 60.65 58.02 2k7r h LYS 56 Cb 0.07 0.17 -0.04 0.00 -1.58 0.00 0.00 32.23 30.86 2k7r h LYS 56 CO -0.04 1.27 0.40 -0.07 -1.08 0.00 0.00 179.45 179.93 2k7r h LEU 57 N 0.38 1.01 -0.22 2.94 -0.00 -0.79 0.38 115.31 119.01 2k7r h LEU 57 Ca -0.09 -0.12 -0.09 0.00 -0.00 0.00 0.00 57.88 57.58 2k7r h LEU 57 Cb 1.54 -0.26 -0.00 0.00 -0.00 0.00 0.00 40.66 41.93 2k7r h LEU 57 CO 0.18 0.84 -0.20 0.22 -0.00 0.00 0.00 178.44 179.48 2k7r h TYR 58 N 1.10 0.63 -0.40 1.13 3.20 -0.72 -2.77 116.97 119.14 2k7r h TYR 58 Ca 0.27 -0.19 -0.05 0.00 3.14 0.00 0.00 58.73 61.90 2k7r h TYR 58 Cb 0.09 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.20 2k7r h TYR 58 CO 0.01 0.86 0.03 1.49 -1.64 0.00 0.00 178.16 178.91 2k7r h GLU 59 N 0.22 0.63 0.31 1.82 4.81 -0.48 -2.44 114.58 119.45 2k7r h GLU 59 Ca 0.04 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 59.13 2k7r h GLU 59 Cb 0.75 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.02 2k7r h GLU 59 CO 0.05 0.63 -0.33 -0.92 -0.73 0.00 0.00 179.01 177.72 2k7r h TYR 60 N 0.60 -0.89 -0.04 0.92 3.20 -0.10 -2.34 116.97 118.32 2k7r h TYR 60 Ca 0.13 0.01 -0.10 0.00 3.14 0.00 0.00 58.73 61.90 2k7r h TYR 60 Cb 0.34 0.35 -0.01 0.00 1.54 0.00 0.00 36.73 38.95 2k7r h TYR 60 CO 0.01 -0.46 -0.45 -0.84 -1.64 0.00 0.00 178.16 174.78 2k7r h ILE 61 N -0.67 1.33 0.00 1.81 3.07 -1.36 -3.11 117.51 118.57 2k7r h ILE 61 Ca -0.01 -1.59 -0.11 0.00 1.55 0.00 0.00 64.86 64.70 2k7r h ILE 61 Cb 0.62 1.81 -0.02 0.00 -0.27 0.00 0.00 36.82 38.96 2k7r h ILE 61 CO -0.07 0.46 -0.54 1.05 -1.05 0.00 0.00 178.15 178.00 2k7r h GLU 62 N 0.08 0.00 0.03 0.16 4.11 -1.34 -3.30 114.58 114.31 2k7r h GLU 62 Ca 0.00 0.00 -0.21 0.00 0.07 0.00 0.00 59.36 59.22 2k7r h GLU 62 Cb 0.83 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.07 2k7r h GLU 62 CO 0.06 0.48 -0.97 1.96 0.07 0.00 0.00 179.01 180.61 2k7r h GLN 63 N 0.00 0.15 -0.11 1.06 4.20 -1.35 -3.46 115.11 115.61 2k7r h GLN 63 Ca -0.01 -0.20 0.27 0.00 0.06 0.00 0.00 58.65 58.76 2k7r h GLN 63 Cb 1.39 0.07 -0.26 0.00 0.30 0.00 0.00 27.48 28.97 2k7r h GLN 63 CO 0.06 1.01 0.50 -1.12 -0.67 0.00 0.00 178.83 178.61 2k7r s SER 64 N -6.91 -0.07 -0.17 1.46 0.01 -1.23 -4.79 113.70 102.00 2k7r s SER 64 Ca -0.02 0.09 -0.21 0.00 1.31 0.00 0.00 55.95 57.11 2k7r s SER 64 Cb 0.10 1.07 -0.18 0.00 0.21 0.00 0.00 66.02 67.22 2k7r s SER 64 CO 0.83 -0.01 0.35 0.11 0.41 0.00 0.00 173.24 174.93 2k7r h LYS 65 N 7.21 0.00 0.00 12.44 6.56 -1.84 -3.43 116.57 137.51 2k7r h LYS 65 Ca -0.13 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.46 2k7r h LYS 65 Cb 1.14 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.80 2k7r h LYS 65 CO 0.01 0.82 0.00 0.27 -2.06 0.00 0.00 179.45 178.49 2k7r n ASN 66 N -4.54 1.23 -3.78 0.86 0.23 -1.26 -4.95 115.26 103.05 2k7r n ASN 66 Ca -0.19 0.00 -0.10 0.00 -0.53 0.00 0.00 54.58 53.76 2k7r n ASN 66 Cb 0.52 0.00 -0.05 0.00 -2.08 0.00 0.00 39.78 38.17 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 2.36 0.11 0.00 0.00 0.87 -1.87 0.18 113.55 115.19 2k7r h SER 68 Ca -0.31 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.26 2k7r h SER 68 Cb 1.25 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 63.19 2k7r h SER 68 CO 0.43 0.06 0.00 0.00 -0.53 0.00 0.00 176.83 176.79 2k7r n TYR 69 N -4.41 0.00 -1.97 2.24 4.19 -1.26 -2.66 117.16 113.29 2k7r n TYR 69 Ca 0.10 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.31 2k7r n TYR 69 Cb 0.56 0.00 0.00 0.00 0.49 0.00 0.00 39.34 40.39 2k7r n TYR 69 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 2k7r s SER 71 N -0.39 1.92 0.26 0.00 0.15 -0.32 -4.78 113.70 110.55 2k7r s SER 71 Ca 0.00 -0.76 0.13 0.00 0.70 0.00 0.00 55.95 56.02 2k7r s SER 71 Cb 0.00 -0.06 0.16 0.00 -1.71 0.00 0.00 66.02 64.41 2k7r s SER 71 CO 0.00 -0.12 1.48 -0.08 1.20 0.00 0.00 173.24 175.72 2k7r h GLU 72 N 3.72 0.00 -6.12 5.44 4.57 -1.89 -3.44 114.58 116.86 2k7r h GLU 72 Ca -0.40 0.00 -0.56 0.00 -1.18 0.00 0.00 59.36 57.22 2k7r h GLU 72 Cb 1.19 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 29.74 2k7r h GLU 72 CO 0.48 0.62 0.20 -0.51 -1.18 0.00 0.00 179.01 178.61 2k7r s ASP 73 N -6.56 7.08 0.00 1.04 1.11 -1.26 -4.88 116.67 113.21 2k7r s ASP 73 Ca 0.02 1.31 0.00 0.00 0.18 0.00 0.00 52.55 54.06 2k7r s ASP 73 Cb 0.09 -2.46 0.00 0.00 1.07 0.00 0.00 42.92 41.63 2k7r s ASP 73 CO 0.75 -0.19 0.14 -1.84 1.18 0.00 0.00 175.17 175.22 2k7r n GLU 74 N 3.98 1.59 0.03 8.23 -0.00 -1.26 -4.49 120.64 128.72 2k7r n GLU 74 Ca 0.01 -0.14 -0.19 0.00 -0.00 0.00 0.00 57.16 56.84 2k7r n GLU 74 Cb 0.51 -0.53 -0.10 0.00 -0.00 0.00 0.00 31.44 31.32 2k7r n GLU 74 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.13 176.16 2k7r h ASN 75 N 0.00 0.88 0.00 -1.84 -0.73 -1.98 -3.40 115.58 108.51 2k7r h ASN 75 Ca 0.00 -0.72 -0.09 0.00 1.87 0.00 0.00 56.30 57.35 2k7r h ASN 75 Cb 0.12 -0.27 -0.14 0.00 0.27 0.00 0.00 38.32 38.29 2k7r h ASN 75 CO 0.00 1.48 -0.44 0.00 -0.37 0.00 0.00 177.43 178.10 2k7r h ASN 77 N 0.24 -0.62 -4.94 0.00 -1.24 -1.78 -3.48 115.58 103.77 2k7r h ASN 77 Ca -0.27 0.02 -0.02 0.00 0.71 0.00 0.00 56.30 56.75 2k7r h ASN 77 Cb 1.43 0.16 -0.15 0.00 0.73 0.00 0.00 38.32 40.50 2k7r h ASN 77 CO -0.08 -0.23 0.24 0.54 -1.29 0.00 0.00 177.43 176.61 2k7r s ASN 78 N -4.59 -0.57 -0.06 1.15 4.22 -1.26 -4.97 114.94 108.87 2k7r s ASN 78 Ca -0.11 0.21 -0.16 0.00 -2.14 0.00 0.00 52.86 50.66 2k7r s ASN 78 Cb 0.01 0.55 -0.12 0.00 1.28 0.00 0.00 41.25 42.98 2k7r s ASN 78 CO 0.32 -0.82 0.66 0.25 -2.04 0.00 0.00 177.10 175.46 2k7r h LEU 79 N 2.29 -0.23 -7.86 3.54 7.12 -1.93 -3.39 115.31 114.85 2k7r h LEU 79 Ca -0.30 -0.22 -0.68 0.00 0.13 0.00 0.00 57.88 56.80 2k7r h LEU 79 Cb 1.25 0.06 -0.10 0.00 -0.53 0.00 0.00 40.66 41.34 2k7r h LEU 79 CO 0.37 0.30 1.93 -0.76 -0.13 0.00 0.00 178.44 180.14 2k7r s LEU 80 N -8.92 4.09 0.15 2.25 1.43 -1.26 -4.96 118.68 111.46 2k7r s LEU 80 Ca -0.10 -2.46 -0.31 0.00 -1.03 0.00 0.00 54.13 50.23 2k7r s LEU 80 Cb 0.00 -2.54 -0.10 0.00 0.03 0.00 0.00 46.19 43.59 2k7r s LEU 80 CO 0.34 -1.11 1.57 -1.83 0.23 0.00 0.00 176.35 175.55 2k7r s GLU 81 N 3.70 4.22 0.00 1.70 -1.05 -1.26 -2.16 118.70 123.84 2k7r s GLU 81 Ca 0.50 2.34 0.00 0.00 -0.15 0.00 0.00 54.97 57.67 2k7r s GLU 81 Cb 0.02 -3.22 0.00 0.00 -0.44 0.00 0.00 34.13 30.49 2k7r s GLU 81 CO 0.04 -0.62 0.00 0.41 0.95 0.00 0.00 175.26 176.05 2k7r n GLY 82 N 3.78 0.39 3.36 -3.83 0.00 -1.26 -4.93 105.19 102.69 2k7r n GLY 82 Ca 0.14 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.14 1.84 0.13 1.61 1.51 -0.92 0.35 117.35 119.73 2k7r s TYR 83 Ca 0.00 -0.49 0.06 0.00 -1.01 0.00 0.00 57.07 55.62 2k7r s TYR 83 Cb 0.00 -0.87 -0.04 0.00 -0.11 0.00 0.00 41.96 40.94 2k7r s TYR 83 CO 0.00 0.40 -0.14 -1.01 -1.11 0.00 0.00 175.55 173.69 2k7r s HIS 84 N -2.51 1.39 0.49 2.71 3.76 0.89 -4.63 115.29 117.38 2k7r s HIS 84 Ca 0.21 -0.58 -0.19 0.00 -0.15 0.00 0.00 55.06 54.35 2k7r s HIS 84 Cb -0.03 -0.72 -0.09 0.00 1.11 0.00 0.00 32.58 32.85 2k7r s HIS 84 CO 0.08 0.14 1.00 -1.25 -0.85 0.00 0.00 174.74 173.86 2k7r s PRO 85 N -2.80 3.93 -0.06 8.40 0.04 -1.26 -0.69 135.00 142.57 2k7r s PRO 85 Ca 0.10 1.16 -0.06 0.00 0.04 0.00 0.00 61.00 62.24 2k7r s PRO 85 Cb -0.04 -2.13 0.01 0.00 0.04 0.00 0.00 34.50 32.39 2k7r s PRO 85 CO 0.03 -0.30 0.17 0.21 0.04 0.00 0.00 177.00 177.15 2k7r s LYS 86 N -3.51 0.24 0.25 4.56 2.20 0.46 -4.85 119.74 119.09 2k7r s LYS 86 Ca 0.63 0.15 -0.30 0.00 -0.36 0.00 0.00 55.97 56.10 2k7r s LYS 86 Cb -0.12 0.11 -0.09 0.00 -1.51 0.00 0.00 37.83 36.22 2k7r s LYS 86 CO 0.22 -0.04 0.98 -0.51 -0.36 0.00 0.00 175.35 175.64 2k7r s LEU 87 N -0.11 4.63 0.05 5.43 2.01 -1.26 -0.31 118.68 129.12 2k7r s LEU 87 Ca -0.02 2.02 0.04 0.00 0.01 0.00 0.00 54.13 56.18 2k7r s LEU 87 Cb -0.02 -3.62 -0.02 0.00 0.01 0.00 0.00 46.19 42.54 2k7r s LEU 87 CO 0.00 0.09 -0.12 0.68 1.01 0.00 0.00 176.35 178.02 2k7r s VAL 88 N -1.18 0.91 -0.35 -1.59 -7.23 0.45 -4.90 120.40 106.51 2k7r s VAL 88 Ca 0.42 -1.06 -0.15 0.00 -1.81 0.00 0.00 61.98 59.38 2k7r s VAL 88 Cb -0.27 -0.88 -0.01 0.00 0.56 0.00 0.00 36.38 35.78 2k7r s VAL 88 CO 0.34 -0.16 0.33 0.54 -0.31 0.00 0.00 175.10 175.83 2k7r s VAL 89 N -1.07 5.20 -0.44 1.32 0.11 -1.26 -0.06 120.40 124.20 2k7r s VAL 89 Ca -0.03 -0.12 0.02 0.00 -2.93 0.00 0.00 61.98 58.92 2k7r s VAL 89 Cb -0.09 -3.82 0.12 0.00 -1.53 0.00 0.00 36.38 31.06 2k7r s VAL 89 CO 0.01 -0.12 0.19 0.20 -3.33 0.00 0.00 175.10 172.05 2k7r s ASN 90 N 1.73 4.83 1.30 3.54 0.01 0.54 -4.99 114.94 121.90 2k7r s ASN 90 Ca 0.10 -2.43 0.00 0.00 -0.71 0.00 0.00 52.86 49.81 2k7r s ASN 90 Cb -0.17 -1.71 0.00 0.00 0.41 0.00 0.00 41.25 39.78 2k7r s ASN 90 CO 0.11 -0.38 0.00 0.61 -1.51 0.00 0.00 177.10 175.93 2k7r n GLY 91 N 3.95 1.37 0.34 0.66 0.00 -1.26 -1.68 105.19 108.56 2k7r n GLY 91 Ca 0.03 0.16 0.09 0.00 0.00 0.00 0.00 46.02 46.30 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 1.93 -4.18 1.61 5.12 -1.26 -4.99 116.66 114.89 2k7r n ARG 92 Ca 0.00 -2.59 -0.16 0.00 -1.93 0.00 0.00 57.85 53.17 2k7r n ARG 92 Cb 0.00 -1.57 -0.14 0.00 -1.16 0.00 0.00 32.46 29.59 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 -2.43 0.74 -0.15 0.55 1.04 -0.68 -4.97 113.70 107.81 2k7r s SER 93 Ca 0.33 -0.19 -0.13 0.00 0.48 0.00 0.00 55.95 56.44 2k7r s SER 93 Cb 0.28 -0.06 -0.05 0.00 0.10 0.00 0.00 66.02 66.29 2k7r s SER 93 CO 0.05 0.03 0.28 -0.63 0.98 0.00 0.00 173.24 173.94 2k7r s ILE 94 N -0.36 5.31 0.50 -1.02 1.01 -1.26 -0.34 121.20 125.04 2k7r s ILE 94 Ca 0.00 0.52 0.01 0.00 0.00 0.00 0.00 60.65 61.18 2k7r s ILE 94 Cb -0.04 -3.61 -0.02 0.00 0.01 0.00 0.00 42.46 38.81 2k7r s ILE 94 CO -0.00 0.43 0.01 -0.62 0.00 0.00 0.00 174.94 174.76 2k7r s ASP 95 N 0.19 4.06 -0.15 3.58 -1.08 0.92 -4.92 116.67 119.27 2k7r s ASP 95 Ca 0.16 -1.65 -0.02 0.00 -0.52 0.00 0.00 52.55 50.53 2k7r s ASP 95 Cb -0.13 0.50 0.04 0.00 -1.46 0.00 0.00 42.92 41.87 2k7r s ASP 95 CO 0.04 -0.84 -0.00 -0.63 0.52 0.00 0.00 175.17 174.25 2k7r s ILE 96 N -2.89 0.69 0.42 4.11 1.01 -1.26 -0.41 121.20 122.86 2k7r s ILE 96 Ca 0.07 -0.40 0.06 0.00 0.00 0.00 0.00 60.65 60.38 2k7r s ILE 96 Cb 0.02 -0.98 0.06 0.00 0.01 0.00 0.00 42.46 41.56 2k7r s ILE 96 CO 0.04 0.03 0.49 -1.84 0.00 0.00 0.00 174.94 173.67 2k7r n GLU 97 N 5.02 0.77 -4.10 2.79 0.28 0.58 -4.84 120.64 121.13 2k7r n GLU 97 Ca -0.09 -2.35 -0.25 0.00 -0.16 0.00 0.00 57.16 54.31 2k7r n GLU 97 Cb 0.48 -0.04 -0.17 0.00 1.43 0.00 0.00 31.44 33.15 2k7r n GLU 97 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 177.13 177.68 2k7r s TYR 98 N -1.74 1.34 0.13 -1.84 1.51 -1.26 -0.40 117.35 115.10 2k7r s TYR 98 Ca 0.37 -0.59 0.07 0.00 -1.01 0.00 0.00 57.07 55.92 2k7r s TYR 98 Cb -0.03 -1.10 -0.04 0.00 -0.11 0.00 0.00 41.96 40.68 2k7r s TYR 98 CO 0.24 -0.41 -0.08 1.52 -1.11 0.00 0.00 175.55 175.72 2k7r s TYR 99 N 1.37 2.74 0.02 2.71 -0.85 0.14 -4.89 117.35 118.59 2k7r s TYR 99 Ca -0.02 -0.16 -0.25 0.00 -0.52 0.00 0.00 57.07 56.11 2k7r s TYR 99 Cb -0.14 -1.39 -0.05 0.00 0.38 0.00 0.00 41.96 40.76 2k7r s TYR 99 CO -0.04 0.47 0.78 -1.83 -1.52 0.00 0.00 175.55 173.41 2k7r s GLU 100 N -2.50 4.50 -0.18 -3.49 -1.05 -1.26 -0.08 118.70 114.65 2k7r s GLU 100 Ca 0.23 1.08 -0.40 0.00 -0.15 0.00 0.00 54.97 55.74 2k7r s GLU 100 Cb -0.10 -3.39 -0.17 0.00 -0.44 0.00 0.00 34.13 30.03 2k7r s GLU 100 CO 0.15 0.21 1.58 0.00 0.95 0.00 0.00 175.26 178.15 2k7r n PRO 102 N 4.21 0.03 0.28 0.00 -0.04 -1.26 -2.19 135.00 136.04 2k7r n PRO 102 Ca 0.24 0.35 0.17 0.00 -0.04 0.00 0.00 63.50 64.23 2k7r n PRO 102 Cb 0.12 -1.57 0.73 0.00 -0.04 0.00 0.00 33.50 32.75 2k7r n PRO 102 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2k7r h VAL 103 N 0.00 0.06 0.00 0.52 2.07 -1.88 -2.57 116.25 114.44 2k7r h VAL 103 Ca 0.00 -0.50 -0.03 0.00 0.82 0.00 0.00 66.70 66.99 2k7r h VAL 103 Cb 0.19 1.47 -0.00 0.00 -1.52 0.00 0.00 31.29 31.42 2k7r h VAL 103 CO 0.00 0.02 -0.14 0.07 0.02 0.00 0.00 177.57 177.54 2k7r h LYS 104 N 0.00 0.00 -4.93 1.57 2.10 -1.71 -3.39 116.57 110.22 2k7r h LYS 104 Ca -0.00 0.00 -0.65 0.00 -2.00 0.00 0.00 60.65 58.00 2k7r h LYS 104 Cb 0.47 0.00 -0.22 0.00 -0.90 0.00 0.00 32.23 31.58 2k7r h LYS 104 CO 0.00 0.14 -0.60 -0.98 -2.00 0.00 0.00 179.45 176.01 2k7r s ARG 105 N -3.91 3.66 0.00 0.07 1.70 -0.97 -5.19 118.95 114.31 2k7r s ARG 105 Ca -0.01 -0.48 0.00 0.00 -0.47 0.00 0.00 55.73 54.77 2k7r s ARG 105 Cb 0.11 -3.39 0.00 0.00 -0.57 0.00 0.00 34.95 31.10 2k7r s ARG 105 CO 0.59 -0.21 0.04 0.36 -1.08 0.00 0.00 175.30 175.00