#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e5r s SER 2 N 0.00 -0.12 0.88 1.61 1.04 -1.26 -5.16 113.70 110.69 2e5r s SER 2 Ca 0.00 -0.39 -0.14 0.00 0.48 0.00 0.00 55.95 55.90 2e5r s SER 2 Cb 0.00 0.42 -0.01 0.00 0.10 0.00 0.00 66.02 66.53 2e5r s SER 2 CO 0.00 -0.79 0.32 -1.20 0.98 0.00 0.00 173.24 172.56 2e5r n SER 3 N -0.60 -2.21 -3.54 7.02 7.64 -1.26 -5.02 113.62 115.65 2e5r n SER 3 Ca -0.06 0.40 -0.11 0.00 1.01 0.00 0.00 58.87 60.11 2e5r n SER 3 Cb 0.61 -1.16 -0.03 0.00 -1.01 0.00 0.00 64.21 62.61 2e5r n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2e5r s GLY 4 N -1.74 -0.42 -0.16 0.23 0.00 -1.26 -5.18 107.32 98.79 2e5r s GLY 4 Ca 0.58 0.20 -0.30 0.00 0.00 0.00 0.00 44.72 45.20 2e5r s GLY 4 CO 0.66 -0.06 0.97 -1.35 0.00 0.00 0.00 173.10 173.32 2e5r s SER 5 N -2.79 -0.40 1.01 1.64 1.04 -1.26 -5.17 113.70 107.77 2e5r s SER 5 Ca 0.03 0.46 -0.13 0.00 0.48 0.00 0.00 55.95 56.79 2e5r s SER 5 Cb -0.00 0.36 0.19 0.00 0.10 0.00 0.00 66.02 66.68 2e5r s SER 5 CO -0.11 -0.36 1.11 -0.55 0.98 0.00 0.00 173.24 174.31 2e5r s SER 6 N -1.03 2.54 0.00 7.02 0.15 -1.26 -4.72 113.70 116.40 2e5r s SER 6 Ca -0.02 1.02 0.00 0.00 0.70 0.00 0.00 55.95 57.64 2e5r s SER 6 Cb -0.01 -1.59 0.00 0.00 -1.71 0.00 0.00 66.02 62.72 2e5r s SER 6 CO 0.02 -3.16 0.00 0.61 1.20 0.00 0.00 173.24 171.91 2e5r n GLY 7 N -1.40 1.61 3.42 9.45 0.00 -1.26 -5.09 105.19 111.92 2e5r n GLY 7 Ca 0.07 -0.62 -0.40 0.00 0.00 0.00 0.00 46.02 45.06 2e5r n GLY 7 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2e5r n VAL 8 N 0.00 1.59 -0.81 1.61 0.24 -1.26 -4.88 118.33 114.83 2e5r n VAL 8 Ca 0.00 -0.50 -0.34 0.00 -2.04 0.00 0.00 64.34 61.46 2e5r n VAL 8 Cb 0.00 -0.47 0.12 0.00 -1.47 0.00 0.00 33.84 32.02 2e5r n VAL 8 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 2e5r n PHE 9 N -1.15 -1.79 -1.56 6.34 3.01 -1.26 -4.69 117.46 116.35 2e5r n PHE 9 Ca 0.11 0.26 -0.48 0.00 1.01 0.00 0.00 57.45 58.35 2e5r n PHE 9 Cb 0.42 -1.55 -0.05 0.00 -0.01 0.00 0.00 39.48 38.29 2e5r n PHE 9 CO 0.00 0.00 0.00 0.72 1.01 0.00 0.00 176.76 178.49 2e5r n HIS 10 N -3.86 1.93 -1.47 1.38 8.25 -1.26 -4.93 115.22 115.26 2e5r n HIS 10 Ca 0.01 0.10 -0.32 0.00 -0.26 0.00 0.00 57.72 57.25 2e5r n HIS 10 Cb 0.63 -2.62 0.07 0.00 1.12 0.00 0.00 29.99 29.20 2e5r n HIS 10 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 2e5r s PRO 11 N 5.51 2.49 -1.12 -0.41 0.04 -1.26 -4.96 135.00 135.29 2e5r s PRO 11 Ca 1.02 1.27 -0.16 0.00 0.04 0.00 0.00 61.00 63.17 2e5r s PRO 11 Cb -0.69 -1.92 0.15 0.00 0.04 0.00 0.00 34.50 32.08 2e5r s PRO 11 CO 0.47 -1.48 1.35 0.08 0.04 0.00 0.00 177.00 177.46 2e5r s VAL 12 N -2.66 4.87 -0.12 -0.36 1.01 -1.26 -4.97 120.40 116.92 2e5r s VAL 12 Ca 0.64 -2.23 0.02 0.00 0.00 0.00 0.00 61.98 60.41 2e5r s VAL 12 Cb -0.19 -4.88 0.01 0.00 0.00 0.00 0.00 36.38 31.32 2e5r s VAL 12 CO 0.50 -1.61 -0.19 -1.61 0.00 0.00 0.00 175.10 172.19 2e5r s GLU 13 N 2.11 2.64 1.32 2.72 2.02 -1.26 -4.11 118.70 124.14 2e5r s GLU 13 Ca 0.40 -0.72 -0.22 0.00 0.02 0.00 0.00 54.97 54.46 2e5r s GLU 13 Cb -0.03 -2.15 0.33 0.00 0.10 0.00 0.00 34.13 32.38 2e5r s GLU 13 CO -0.03 -0.01 1.03 0.00 0.02 0.00 0.00 175.26 176.26 2e5r n SER 15 N -5.22 0.76 0.00 0.00 7.64 -1.26 -4.08 113.62 111.46 2e5r n SER 15 Ca 0.14 0.21 0.00 0.00 1.01 0.00 0.00 58.87 60.23 2e5r n SER 15 Cb 0.60 0.21 0.00 0.00 -1.01 0.00 0.00 64.21 64.01 2e5r n SER 15 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2e5r n TYR 16 N -3.00 0.00 0.14 1.43 4.19 -1.26 -4.65 117.16 114.02 2e5r n TYR 16 Ca -0.26 0.00 0.10 0.00 3.31 0.00 0.00 57.90 61.05 2e5r n TYR 16 Cb 1.09 0.00 0.52 0.00 0.49 0.00 0.00 39.34 41.44 2e5r n TYR 16 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 2e5r n HIS 18 N -2.17 -1.22 -1.19 0.00 8.25 -1.26 -4.89 115.22 112.74 2e5r n HIS 18 Ca -0.01 0.56 -0.29 0.00 -0.26 0.00 0.00 57.72 57.72 2e5r n HIS 18 Cb 0.03 -2.70 0.18 0.00 1.12 0.00 0.00 29.99 28.62 2e5r n HIS 18 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2e5r s SER 19 N -4.30 2.63 0.00 0.41 0.15 -1.26 -4.59 113.70 106.74 2e5r s SER 19 Ca 0.03 1.16 0.00 0.00 0.70 0.00 0.00 55.95 57.84 2e5r s SER 19 Cb -0.02 -1.82 0.00 0.00 -1.71 0.00 0.00 66.02 62.48 2e5r s SER 19 CO 0.96 -3.12 0.00 -1.84 1.20 0.00 0.00 173.24 170.44 2e5r n GLU 20 N -4.17 0.00 -1.28 5.44 0.28 -1.26 -3.59 120.64 116.07 2e5r n GLU 20 Ca 0.05 0.00 -0.42 0.00 -0.16 0.00 0.00 57.16 56.63 2e5r n GLU 20 Cb 0.57 -0.49 -0.01 0.00 1.43 0.00 0.00 31.44 32.94 2e5r n GLU 20 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 2e5r n SER 21 N -2.50 -2.03 -1.80 -1.84 2.88 -1.26 -4.74 113.62 102.32 2e5r n SER 21 Ca 0.00 0.91 -0.09 0.00 -1.33 0.00 0.00 58.87 58.36 2e5r n SER 21 Cb 0.29 -0.87 -0.05 0.00 -0.75 0.00 0.00 64.21 62.83 2e5r n SER 21 CO 0.00 0.00 0.00 0.23 -1.23 0.00 0.00 175.04 174.04 2e5r n MET 22 N 1.13 1.56 -2.23 -1.46 2.81 -1.26 -4.28 117.12 113.38 2e5r n MET 22 Ca 0.14 -0.75 -0.26 0.00 -1.81 0.00 0.00 57.70 55.02 2e5r n MET 22 Cb 0.31 -1.51 0.01 0.00 -0.71 0.00 0.00 33.22 31.33 2e5r n MET 22 CO 0.00 0.00 0.00 -1.33 1.51 0.00 0.00 175.97 176.15 2e5r n MET 23 N 1.59 3.51 -3.88 0.03 2.81 -1.26 -5.04 117.12 114.89 2e5r n MET 23 Ca 0.22 -4.32 -0.03 0.00 -1.81 0.00 0.00 57.70 51.76 2e5r n MET 23 Cb 0.65 -2.27 0.02 0.00 -0.71 0.00 0.00 33.22 30.91 2e5r n MET 23 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 2e5r s GLY 24 N -3.53 0.13 0.25 3.03 0.00 -1.26 -4.70 107.32 101.23 2e5r s GLY 24 Ca 0.50 -0.36 0.03 0.00 0.00 0.00 0.00 44.72 44.88 2e5r s GLY 24 CO -0.08 2.28 0.27 0.69 0.00 0.00 0.00 173.10 176.27 2e5r n PHE 25 N -0.69 -0.83 -3.35 1.90 3.72 -1.26 -4.88 117.46 112.07 2e5r n PHE 25 Ca -0.03 -1.94 -0.43 0.00 -0.05 0.00 0.00 57.45 55.00 2e5r n PHE 25 Cb 0.59 0.29 -0.09 0.00 -0.94 0.00 0.00 39.48 39.34 2e5r n PHE 25 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 2e5r s ARG 26 N -2.83 3.06 -0.30 -1.08 6.06 -1.26 -3.96 118.95 118.63 2e5r s ARG 26 Ca 0.26 -0.87 -0.04 0.00 -2.50 0.00 0.00 55.73 52.59 2e5r s ARG 26 Cb 0.01 -3.99 0.04 0.00 0.06 0.00 0.00 34.95 31.06 2e5r s ARG 26 CO 0.19 -0.86 0.03 0.71 -2.50 0.00 0.00 175.30 172.86 2e5r s TYR 27 N 2.02 3.21 -0.25 5.12 2.02 0.23 -0.77 117.35 128.94 2e5r s TYR 27 Ca 0.10 -1.56 -0.10 0.00 -0.37 0.00 0.00 57.07 55.14 2e5r s TYR 27 Cb -0.18 -2.16 -0.05 0.00 -0.40 0.00 0.00 41.96 39.17 2e5r s TYR 27 CO 0.12 -0.74 0.14 0.50 -1.57 0.00 0.00 175.55 174.01 2e5r s ARG 28 N 1.34 3.95 0.99 -0.62 3.00 0.06 -0.57 118.95 127.11 2e5r s ARG 28 Ca -0.02 -0.33 -0.17 0.00 -1.00 0.00 0.00 55.73 54.21 2e5r s ARG 28 Cb -0.19 -3.50 -0.06 0.00 0.00 0.00 0.00 34.95 31.20 2e5r s ARG 28 CO -0.00 -0.02 -0.36 0.00 0.00 0.00 0.00 175.30 174.91 2e5r n GLN 30 N 0.57 0.00 -3.66 0.00 6.02 0.60 -4.57 117.38 116.34 2e5r n GLN 30 Ca 0.01 0.29 -0.39 0.00 -0.01 0.00 0.00 57.00 56.91 2e5r n GLN 30 Cb 0.57 -1.08 -0.11 0.00 1.02 0.00 0.00 30.24 30.65 2e5r n GLN 30 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.06 174.91 2e5r s GLN 31 N -1.48 2.49 -0.04 -1.09 2.00 -1.26 -5.04 119.66 115.24 2e5r s GLN 31 Ca 0.00 -1.50 -0.31 0.00 -2.00 0.00 0.00 55.36 51.55 2e5r s GLN 31 Cb 0.00 -3.69 0.12 0.00 0.80 0.00 0.00 33.01 30.24 2e5r s GLN 31 CO 0.00 -0.94 1.24 0.00 -0.50 0.00 0.00 175.29 175.08 2e5r n HIS 33 N -0.40 0.00 -3.65 0.00 8.25 -1.26 -4.81 115.22 113.36 2e5r n HIS 33 Ca -0.06 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.10 2e5r n HIS 33 Cb 0.62 -0.25 -0.13 0.00 1.12 0.00 0.00 29.99 31.35 2e5r n HIS 33 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2e5r s ASN 34 N -2.00 3.41 -0.28 0.41 2.20 -1.26 -5.06 114.94 112.35 2e5r s ASN 34 Ca 0.00 -2.63 -0.01 0.00 -0.94 0.00 0.00 52.86 49.27 2e5r s ASN 34 Cb 0.00 -0.90 0.09 0.00 -2.00 0.00 0.00 41.25 38.44 2e5r s ASN 34 CO 0.00 -0.26 0.08 -0.47 -2.94 0.00 0.00 177.10 173.51 2e5r s TYR 35 N 0.38 1.47 0.03 1.54 5.04 -1.26 -5.10 117.35 119.45 2e5r s TYR 35 Ca 0.19 -1.48 0.07 0.00 -2.44 0.00 0.00 57.07 53.41 2e5r s TYR 35 Cb -0.21 -1.49 -0.02 0.00 0.35 0.00 0.00 41.96 40.58 2e5r s TYR 35 CO -0.02 -0.82 -0.21 -0.65 -1.34 0.00 0.00 175.55 172.51 2e5r s GLN 36 N 1.70 1.52 0.07 4.97 -0.21 -1.26 -1.37 119.66 125.08 2e5r s GLN 36 Ca 0.07 -0.92 -0.13 0.00 0.02 0.00 0.00 55.36 54.40 2e5r s GLN 36 Cb -0.17 -1.60 0.02 0.00 1.00 0.00 0.00 33.01 32.26 2e5r s GLN 36 CO -0.22 0.42 0.31 -0.51 -2.12 0.00 0.00 175.29 173.16 2e5r s LEU 37 N -1.02 0.85 0.57 2.90 1.43 0.26 -4.41 118.68 119.26 2e5r s LEU 37 Ca 0.08 -0.31 0.08 0.00 -1.03 0.00 0.00 54.13 52.95 2e5r s LEU 37 Cb -0.09 1.43 0.08 0.00 0.03 0.00 0.00 46.19 47.64 2e5r s LEU 37 CO 0.01 -0.70 0.78 0.00 0.23 0.00 0.00 176.35 176.68 2e5r h GLN 39 N 0.15 0.05 0.50 0.00 4.15 -1.84 -0.45 115.11 117.67 2e5r h GLN 39 Ca -0.33 -0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.07 2e5r h GLN 39 Cb 1.28 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.97 2e5r h GLN 39 CO 0.42 0.03 -0.24 -0.44 -1.93 0.00 0.00 178.83 176.67 2e5r h ASP 40 N 0.05 -0.57 -0.94 -0.69 5.19 -1.95 -1.22 116.42 116.30 2e5r h ASP 40 Ca 0.38 0.02 0.18 0.00 -0.62 0.00 0.00 57.03 56.99 2e5r h ASP 40 Cb 0.63 0.15 -0.17 0.00 0.18 0.00 0.00 39.33 40.11 2e5r h ASP 40 CO -0.70 -0.37 -0.26 0.00 -3.12 0.00 0.00 179.24 174.80 2e5r h PHE 42 N 0.00 -1.13 -0.95 0.00 3.57 -1.07 0.90 116.94 118.26 2e5r h PHE 42 Ca 0.43 -0.03 0.30 0.00 3.53 0.00 0.00 57.97 62.20 2e5r h PHE 42 Cb 0.66 0.37 -0.16 0.00 2.79 0.00 0.00 35.95 39.62 2e5r h PHE 42 CO -0.74 -0.70 0.36 -1.49 -2.23 0.00 0.00 178.31 173.51 2e5r h TRP 43 N -1.24 0.56 -0.23 0.41 4.06 0.23 0.61 115.95 120.36 2e5r h TRP 43 Ca -0.12 0.05 -0.18 0.00 2.06 0.00 0.00 58.89 60.69 2e5r h TRP 43 Cb 0.93 -0.09 -0.00 0.00 -1.00 0.00 0.00 29.16 29.00 2e5r h TRP 43 CO 0.02 -0.28 -0.58 0.00 -3.56 0.00 0.00 178.44 174.04 2e5r h ARG 44 N 0.18 0.73 -0.34 0.49 3.08 -0.71 -3.50 114.38 114.31 2e5r h ARG 44 Ca 0.67 -0.48 0.00 0.00 0.07 0.00 0.00 59.98 60.24 2e5r h ARG 44 Cb 1.50 0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.61 2e5r h ARG 44 CO -0.70 1.10 0.00 0.41 -1.07 0.00 0.00 179.97 179.72 2e5r n GLY 45 N 0.37 0.16 3.31 0.04 0.00 0.21 -5.10 105.19 104.18 2e5r n GLY 45 Ca -0.04 -0.96 -0.28 0.00 0.00 0.00 0.00 46.02 44.74 2e5r n GLY 45 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2e5r s HIS 46 N 0.00 2.11 0.02 1.61 3.76 -1.25 -4.99 115.29 116.55 2e5r s HIS 46 Ca 0.00 -0.40 -0.20 0.00 -0.15 0.00 0.00 55.06 54.31 2e5r s HIS 46 Cb 0.00 -1.25 0.07 0.00 1.11 0.00 0.00 32.58 32.51 2e5r s HIS 46 CO 0.00 0.12 0.93 0.00 -0.85 0.00 0.00 174.74 174.94 2e5r n ALA 47 N 1.76 -2.58 -3.97 -1.40 0.00 -1.26 -4.46 120.51 108.60 2e5r n ALA 47 Ca -0.17 -0.66 0.05 0.00 0.00 0.00 0.00 53.44 52.66 2e5r n ALA 47 Cb 0.53 0.20 0.01 0.00 0.00 0.00 0.00 19.45 20.18 2e5r n ALA 47 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2e5r s GLY 48 N -3.45 -0.26 0.51 0.00 0.00 -0.40 -4.91 107.32 98.81 2e5r s GLY 48 Ca 0.22 0.28 0.36 0.00 0.00 0.00 0.00 44.72 45.58 2e5r s GLY 48 CO 0.01 5.96 1.28 0.61 0.00 0.00 0.00 173.10 180.96 2e5r n GLY 49 N -0.91 -0.79 0.00 0.20 0.00 -1.26 -2.22 105.19 100.20 2e5r n GLY 49 Ca 0.04 0.50 0.00 0.00 0.00 0.00 0.00 46.02 46.56 2e5r n GLY 49 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2e5r n SER 50 N -3.42 0.00 -4.77 1.61 2.88 -1.26 -4.98 113.62 103.68 2e5r n SER 50 Ca 0.32 0.08 -0.35 0.00 -1.33 0.00 0.00 58.87 57.60 2e5r n SER 50 Cb 1.62 -0.32 0.02 0.00 -0.75 0.00 0.00 64.21 64.77 2e5r n SER 50 CO 0.00 0.00 0.00 -2.28 -1.23 0.00 0.00 175.04 171.53 2e5r s HIS 51 N -0.65 2.59 -0.11 0.66 5.04 -0.94 -5.04 115.29 116.84 2e5r s HIS 51 Ca 0.00 1.54 0.01 0.00 -1.54 0.00 0.00 55.06 55.07 2e5r s HIS 51 Cb 0.00 -3.31 -0.02 0.00 0.04 0.00 0.00 32.58 29.29 2e5r s HIS 51 CO 0.00 -1.75 -0.15 0.45 -2.34 0.00 0.00 174.74 170.95 2e5r s SER 52 N -1.88 3.88 0.63 9.88 0.15 -1.26 -1.27 113.70 123.83 2e5r s SER 52 Ca 0.73 -0.33 0.24 0.00 0.70 0.00 0.00 55.95 57.29 2e5r s SER 52 Cb -0.25 -1.39 1.24 0.00 -1.71 0.00 0.00 66.02 63.91 2e5r s SER 52 CO 0.31 0.21 1.69 -0.55 1.20 0.00 0.00 173.24 176.10 2e5r h ASN 53 N 6.37 0.00 0.51 5.45 -1.07 -1.93 0.76 115.58 125.68 2e5r h ASN 53 Ca -0.30 0.00 -0.22 0.00 0.07 0.00 0.00 56.30 55.86 2e5r h ASN 53 Cb 1.20 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 37.45 2e5r h ASN 53 CO 0.53 0.00 -0.94 1.56 0.07 0.00 0.00 177.43 178.65 2e5r h GLN 54 N 0.00 0.28 -6.19 4.14 4.20 -1.93 -3.45 115.11 112.14 2e5r h GLN 54 Ca 0.13 -0.32 -0.71 0.00 0.06 0.00 0.00 58.65 57.81 2e5r h GLN 54 Cb 1.32 0.09 0.03 0.00 0.30 0.00 0.00 27.48 29.22 2e5r h GLN 54 CO -0.00 1.04 0.79 0.72 -0.67 0.00 0.00 178.83 180.71 2e5r n HIS 55 N -3.67 1.93 -1.80 2.96 8.25 0.27 -4.93 115.22 118.23 2e5r n HIS 55 Ca -0.05 0.52 -0.31 0.00 -0.26 0.00 0.00 57.72 57.62 2e5r n HIS 55 Cb 0.84 -2.44 0.02 0.00 1.12 0.00 0.00 29.99 29.53 2e5r n HIS 55 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 2e5r s GLN 56 N 2.72 3.37 -0.08 -0.41 2.00 -1.26 -4.86 119.66 121.14 2e5r s GLN 56 Ca 0.94 0.77 0.05 0.00 -2.00 0.00 0.00 55.36 55.12 2e5r s GLN 56 Cb -1.01 -2.05 -0.01 0.00 0.80 0.00 0.00 33.01 30.74 2e5r s GLN 56 CO 0.59 -0.74 -0.23 -1.64 -0.50 0.00 0.00 175.29 172.77 2e5r s MET 57 N -5.16 2.80 0.05 1.67 -1.94 -1.26 -0.29 119.30 115.16 2e5r s MET 57 Ca 0.56 -0.87 -0.10 0.00 -1.71 0.00 0.00 55.69 53.57 2e5r s MET 57 Cb -0.12 -2.26 -0.06 0.00 2.01 0.00 0.00 34.83 34.41 2e5r s MET 57 CO 0.54 0.31 0.37 0.15 -0.01 0.00 0.00 175.02 176.38 2e5r s LYS 58 N 0.03 3.74 0.06 2.03 -0.14 0.66 -4.82 119.74 121.30 2e5r s LYS 58 Ca -0.09 0.15 -0.27 0.00 -1.36 0.00 0.00 55.97 54.40 2e5r s LYS 58 Cb -0.15 -3.05 -0.05 0.00 -1.68 0.00 0.00 37.83 32.90 2e5r s LYS 58 CO 0.06 0.60 0.84 -1.83 -0.76 0.00 0.00 175.35 174.26 2e5r s GLU 59 N -1.75 4.57 -0.21 1.68 -1.05 -1.26 -0.76 118.70 119.92 2e5r s GLU 59 Ca 0.30 1.21 0.02 0.00 -0.15 0.00 0.00 54.97 56.35 2e5r s GLU 59 Cb -0.14 -3.38 0.04 0.00 -0.44 0.00 0.00 34.13 30.21 2e5r s GLU 59 CO 0.17 0.23 -0.16 0.71 0.95 0.00 0.00 175.26 177.16 2e5r s TYR 60 N 0.06 2.87 -0.48 4.83 1.51 0.05 -4.96 117.35 121.24 2e5r s TYR 60 Ca 0.42 -1.85 -0.02 0.00 -1.01 0.00 0.00 57.07 54.61 2e5r s TYR 60 Cb -0.21 -1.87 0.22 0.00 -0.11 0.00 0.00 41.96 39.98 2e5r s TYR 60 CO 0.25 -0.82 2.27 0.25 -1.11 0.00 0.00 175.55 176.39 2e5r n THR 61 N 4.57 3.19 -0.10 -0.71 -2.24 -1.26 -4.24 114.28 113.49 2e5r n THR 61 Ca -0.18 -2.58 -0.19 0.00 -2.27 0.00 0.00 64.05 58.83 2e5r n THR 61 Cb 0.47 -1.38 -0.08 0.00 -2.10 0.00 0.00 70.33 67.24 2e5r n THR 61 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2e5r n SER 62 N 0.20 1.88 -0.09 3.42 2.88 -1.26 -5.18 113.62 115.46 2e5r n SER 62 Ca 0.44 0.11 0.16 0.00 -1.33 0.00 0.00 58.87 58.25 2e5r n SER 62 Cb 0.55 -0.50 0.87 0.00 -0.75 0.00 0.00 64.21 64.38 2e5r n SER 62 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14