#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x4i s SER 2 N 0.00 -0.13 0.17 1.61 0.01 -1.26 -5.06 113.70 109.04 1x4i s SER 2 Ca 0.00 -0.40 -0.14 0.00 1.31 0.00 0.00 55.95 56.72 1x4i s SER 2 Cb 0.00 0.43 0.05 0.00 0.21 0.00 0.00 66.02 66.71 1x4i s SER 2 CO 0.00 -0.81 1.80 0.77 0.41 0.00 0.00 173.24 175.41 1x4i h SER 3 N 2.51 0.61 -1.59 2.44 4.64 -2.06 -3.48 113.55 116.63 1x4i h SER 3 Ca -0.34 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 1x4i h SER 3 Cb 1.24 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 63.17 1x4i h SER 3 CO 0.49 0.49 0.00 0.61 -0.87 0.00 0.00 176.83 177.55 1x4i n GLY 4 N -1.12 0.31 3.60 -0.77 0.00 -1.26 -5.13 105.19 100.82 1x4i n GLY 4 Ca 0.02 -0.46 -0.15 0.00 0.00 0.00 0.00 46.02 45.43 1x4i n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x4i s SER 5 N -2.07 -0.71 -0.02 1.61 0.15 -1.26 -5.13 113.70 106.27 1x4i s SER 5 Ca 0.00 1.20 -0.40 0.00 0.70 0.00 0.00 55.95 57.45 1x4i s SER 5 Cb 0.00 1.16 -0.19 0.00 -1.71 0.00 0.00 66.02 65.28 1x4i s SER 5 CO 0.00 -0.36 1.22 -1.54 1.20 0.00 0.00 173.24 173.77 1x4i n SER 6 N 2.11 0.70 -3.15 5.45 3.41 -1.26 -4.94 113.62 115.95 1x4i n SER 6 Ca -0.15 1.15 0.05 0.00 -0.26 0.00 0.00 58.87 59.65 1x4i n SER 6 Cb 0.56 -1.01 -0.02 0.00 -0.26 0.00 0.00 64.21 63.48 1x4i n SER 6 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1x4i s GLY 7 N 0.54 -0.45 -0.03 5.00 0.00 -1.26 -4.09 107.32 107.03 1x4i s GLY 7 Ca 0.90 2.63 -0.03 0.00 0.00 0.00 0.00 44.72 48.22 1x4i s GLY 7 CO 0.56 3.78 -0.07 -1.72 0.00 0.00 0.00 173.10 175.65 1x4i n TYR 8 N 5.45 0.00 -0.84 1.90 4.01 -0.23 -4.66 117.16 122.80 1x4i n TYR 8 Ca -0.06 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.34 1x4i n TYR 8 Cb 0.54 -0.09 0.10 0.00 -0.31 0.00 0.00 39.34 39.58 1x4i n TYR 8 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1x4i h ILE 10 N -1.48 0.51 0.00 0.00 3.07 -1.94 0.63 117.51 118.31 1x4i h ILE 10 Ca -0.45 0.00 0.00 0.00 1.55 0.00 0.00 64.86 65.96 1x4i h ILE 10 Cb 1.31 0.67 0.00 0.00 -0.27 0.00 0.00 36.82 38.53 1x4i h ILE 10 CO 0.31 0.00 0.00 0.00 -1.05 0.00 0.00 178.15 177.41 1x4i n ASN 12 N -0.52 -0.89 -4.36 0.00 4.13 0.22 -4.98 115.26 108.86 1x4i n ASN 12 Ca 0.01 -0.95 -0.19 0.00 1.68 0.00 0.00 54.58 55.13 1x4i n ASN 12 Cb 0.00 -3.39 -0.10 0.00 -1.54 0.00 0.00 39.78 34.76 1x4i n ASN 12 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 1x4i s GLN 13 N -6.33 1.38 0.88 3.52 -1.52 -1.25 -4.41 119.66 111.92 1x4i s GLN 13 Ca 0.03 -1.62 -0.13 0.00 -1.95 0.00 0.00 55.36 51.70 1x4i s GLN 13 Cb -0.01 -1.21 0.07 0.00 -0.22 0.00 0.00 33.01 31.64 1x4i s GLN 13 CO 0.86 0.20 0.81 1.33 -0.25 0.00 0.00 175.29 178.24 1x4i n VAL 14 N -0.42 0.76 -2.73 1.09 0.24 -1.26 -1.07 118.33 114.94 1x4i n VAL 14 Ca -0.08 -0.18 -0.42 0.00 -2.04 0.00 0.00 64.34 61.63 1x4i n VAL 14 Cb 0.60 -0.87 -0.03 0.00 -1.47 0.00 0.00 33.84 32.07 1x4i n VAL 14 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1x4i s SER 15 N -2.12 6.33 0.40 -1.34 0.01 -1.26 -4.79 113.70 110.93 1x4i s SER 15 Ca 0.65 -1.18 0.04 0.00 1.31 0.00 0.00 55.95 56.76 1x4i s SER 15 Cb -0.25 -2.48 -0.03 0.00 0.21 0.00 0.00 66.02 63.47 1x4i s SER 15 CO 0.60 -1.47 0.11 -0.72 0.41 0.00 0.00 173.24 172.16 1x4i s TYR 16 N 4.37 1.81 0.08 2.43 1.13 -1.26 -5.09 117.35 120.82 1x4i s TYR 16 Ca 0.32 -1.22 0.00 0.00 -1.41 0.00 0.00 57.07 54.77 1x4i s TYR 16 Cb -0.09 -1.20 0.00 0.00 -1.10 0.00 0.00 41.96 39.57 1x4i s TYR 16 CO 0.03 -0.22 0.00 0.41 -2.51 0.00 0.00 175.55 173.26 1x4i n GLY 17 N -0.90 -0.66 3.62 5.49 0.00 -1.26 -4.39 105.19 107.10 1x4i n GLY 17 Ca -0.06 -0.50 -0.43 0.00 0.00 0.00 0.00 46.02 45.03 1x4i n GLY 17 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1x4i s GLU 18 N -0.77 3.56 0.01 1.61 0.41 -1.26 -4.97 118.70 117.28 1x4i s GLU 18 Ca 0.00 2.11 0.07 0.00 -0.41 0.00 0.00 54.97 56.74 1x4i s GLU 18 Cb 0.00 -4.24 -0.03 0.00 -1.78 0.00 0.00 34.13 28.08 1x4i s GLU 18 CO 0.00 -1.61 -0.21 -1.64 -0.49 0.00 0.00 175.26 171.31 1x4i s MET 19 N 5.46 2.10 -0.40 1.61 -1.94 -1.26 -3.49 119.30 121.38 1x4i s MET 19 Ca 0.91 -0.95 -0.08 0.00 -1.71 0.00 0.00 55.69 53.86 1x4i s MET 19 Cb -0.34 -2.13 0.07 0.00 2.01 0.00 0.00 34.83 34.44 1x4i s MET 19 CO 0.36 0.55 0.22 0.54 -0.01 0.00 0.00 175.02 176.68 1x4i s VAL 20 N -0.78 4.00 0.11 -6.03 0.11 -0.57 -4.91 120.40 112.33 1x4i s VAL 20 Ca 0.12 -1.42 -0.31 0.00 -2.93 0.00 0.00 61.98 57.44 1x4i s VAL 20 Cb -0.10 -3.44 -0.08 0.00 -1.53 0.00 0.00 36.38 31.23 1x4i s VAL 20 CO 0.02 -0.45 1.49 -0.83 -3.33 0.00 0.00 175.10 172.00 1x4i s GLY 21 N 1.92 1.76 0.09 6.54 0.00 -1.26 -3.22 107.32 113.15 1x4i s GLY 21 Ca 0.02 1.18 -0.32 0.00 0.00 0.00 0.00 44.72 45.60 1x4i s GLY 21 CO 0.01 2.55 1.79 0.00 0.00 0.00 0.00 173.10 177.46 1x4i h ASP 23 N 8.14 0.15 -2.97 0.00 3.58 -1.91 -3.34 116.42 120.07 1x4i h ASP 23 Ca -0.46 0.03 -0.58 0.00 0.42 0.00 0.00 57.03 56.44 1x4i h ASP 23 Cb 1.24 0.01 -0.10 0.00 1.72 0.00 0.00 39.33 42.20 1x4i h ASP 23 CO 0.94 0.01 0.80 0.21 -2.88 0.00 0.00 179.24 178.32 1x4i s ASN 24 N -5.11 6.32 0.52 2.28 2.47 -1.26 -4.88 114.94 115.29 1x4i s ASN 24 Ca -0.06 -0.29 0.21 0.00 0.42 0.00 0.00 52.86 53.14 1x4i s ASN 24 Cb 0.24 -2.50 1.32 0.00 -1.45 0.00 0.00 41.25 38.87 1x4i s ASN 24 CO 0.81 -1.46 2.06 1.56 -3.72 0.00 0.00 177.10 176.35 1x4i h GLN 25 N 9.56 0.02 0.00 0.43 4.20 -1.99 0.70 115.11 128.03 1x4i h GLN 25 Ca -0.26 -0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.44 1x4i h GLN 25 Cb 1.06 -0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.84 1x4i h GLN 25 CO 1.17 0.01 -0.01 -0.44 -0.67 0.00 0.00 178.83 178.89 1x4i h ASP 26 N 0.02 0.00 -2.02 1.46 5.19 -1.91 -3.44 116.42 115.72 1x4i h ASP 26 Ca 0.14 0.00 -0.64 0.00 -0.62 0.00 0.00 57.03 55.91 1x4i h ASP 26 Cb 0.55 0.00 0.08 0.00 0.18 0.00 0.00 39.33 40.14 1x4i h ASP 26 CO -0.00 0.01 0.34 0.00 -3.12 0.00 0.00 179.24 176.47 1x4i h PRO 28 N 3.61 0.00 0.00 0.00 0.13 -1.89 -3.33 132.00 130.53 1x4i h PRO 28 Ca -0.44 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.48 1x4i h PRO 28 Cb 1.33 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.43 1x4i h PRO 28 CO 0.72 0.00 -1.63 -0.89 -0.23 0.00 0.00 178.00 175.97 1x4i n ILE 29 N -2.88 0.85 -2.12 -3.56 5.41 -1.26 -4.98 119.36 110.81 1x4i n ILE 29 Ca 0.01 -0.14 -0.09 0.00 1.00 0.00 0.00 62.75 63.53 1x4i n ILE 29 Cb 0.28 -1.73 -0.01 0.00 -0.71 0.00 0.00 39.64 37.47 1x4i n ILE 29 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 1x4i n GLU 30 N -3.68 -2.10 -3.15 0.38 2.13 -1.25 -4.85 120.64 108.12 1x4i n GLU 30 Ca -0.25 0.45 0.04 0.00 0.66 0.00 0.00 57.16 58.06 1x4i n GLU 30 Cb 0.64 -4.91 -0.01 0.00 0.27 0.00 0.00 31.44 27.43 1x4i n GLU 30 CO 0.00 0.00 0.00 -1.58 -0.41 0.00 0.00 177.13 175.14 1x4i s TRP 31 N -2.25 -1.30 0.09 4.31 0.52 -1.26 -3.25 118.94 115.81 1x4i s TRP 31 Ca 0.00 1.27 0.05 0.00 0.02 0.00 0.00 56.10 57.44 1x4i s TRP 31 Cb 0.00 0.42 -0.03 0.00 -1.15 0.00 0.00 33.47 32.70 1x4i s TRP 31 CO 0.00 -0.72 -0.13 -0.06 0.02 0.00 0.00 176.95 176.07 1x4i s PHE 32 N 2.89 1.20 0.51 -1.98 0.40 -1.20 -3.11 117.98 116.68 1x4i s PHE 32 Ca 0.14 -0.54 -0.18 0.00 -0.60 0.00 0.00 56.93 55.75 1x4i s PHE 32 Cb -0.13 -0.66 -0.08 0.00 0.51 0.00 0.00 43.02 42.67 1x4i s PHE 32 CO -0.19 0.06 1.00 -1.01 0.70 0.00 0.00 175.22 175.78 1x4i s HIS 33 N -1.81 3.24 0.27 0.36 3.76 -1.26 -1.51 115.29 118.34 1x4i s HIS 33 Ca 0.02 1.53 0.05 0.00 -0.15 0.00 0.00 55.06 56.51 1x4i s HIS 33 Cb -0.07 -2.90 0.36 0.00 1.11 0.00 0.00 32.58 31.09 1x4i s HIS 33 CO 0.02 -0.54 1.64 1.88 -0.85 0.00 0.00 174.74 176.89 1x4i h TYR 34 N 1.16 0.34 0.00 1.40 -1.99 -1.87 -2.16 116.97 113.85 1x4i h TYR 34 Ca -0.48 -0.10 -0.21 0.00 2.00 0.00 0.00 58.73 59.94 1x4i h TYR 34 Cb 1.20 -0.07 -0.03 0.00 2.00 0.00 0.00 36.73 39.83 1x4i h TYR 34 CO 0.61 0.70 -0.98 0.78 -0.00 0.00 0.00 178.16 179.27 1x4i h GLY 35 N 1.27 0.00 1.73 3.88 0.00 -1.90 0.71 103.07 108.77 1x4i h GLY 35 Ca 0.01 -0.01 -0.19 0.00 0.00 0.00 0.00 47.33 47.14 1x4i h GLY 35 CO 0.07 0.01 -0.83 0.00 0.00 0.00 0.00 176.54 175.79 1x4i n VAL 37 N -3.72 0.95 -0.59 0.00 0.24 -0.82 -5.01 118.33 109.38 1x4i n VAL 37 Ca -0.04 -0.69 0.00 0.00 -2.04 0.00 0.00 64.34 61.57 1x4i n VAL 37 Cb 0.77 -0.48 0.00 0.00 -1.47 0.00 0.00 33.84 32.67 1x4i n VAL 37 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1x4i n GLY 38 N 1.46 0.29 2.67 7.63 0.00 0.94 -5.07 105.19 113.11 1x4i n GLY 38 Ca -0.15 -0.49 -0.23 0.00 0.00 0.00 0.00 46.02 45.16 1x4i n GLY 38 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1x4i s LEU 39 N -0.63 0.16 0.25 0.99 1.43 0.21 -5.00 118.68 116.08 1x4i s LEU 39 Ca 0.00 -0.39 0.01 0.00 -1.03 0.00 0.00 54.13 52.72 1x4i s LEU 39 Cb 0.00 0.00 0.32 0.00 0.03 0.00 0.00 46.19 46.54 1x4i s LEU 39 CO 0.00 -0.33 1.65 0.71 0.23 0.00 0.00 176.35 178.61 1x4i h THR 40 N 6.38 1.29 -4.71 5.49 1.35 -2.00 -3.43 112.91 117.29 1x4i h THR 40 Ca -0.15 -1.45 -0.39 0.00 -0.55 0.00 0.00 66.41 63.86 1x4i h THR 40 Cb 1.15 1.50 -0.13 0.00 -1.73 0.00 0.00 68.15 68.94 1x4i h THR 40 CO 0.27 0.46 -0.46 -1.83 -0.25 0.00 0.00 175.52 173.71 1x4i s GLU 41 N -4.32 1.68 0.13 4.72 1.03 -1.26 -5.13 118.70 115.55 1x4i s GLU 41 Ca -0.07 -1.90 -0.31 0.00 0.03 0.00 0.00 54.97 52.72 1x4i s GLU 41 Cb 0.13 0.34 -0.09 0.00 -0.80 0.00 0.00 34.13 33.71 1x4i s GLU 41 CO 0.80 -0.63 1.43 0.00 -1.33 0.00 0.00 175.26 175.54 1x4i s ALA 42 N -3.51 3.64 -0.57 -0.84 0.00 -1.26 -4.93 121.76 114.29 1x4i s ALA 42 Ca 0.39 1.19 -0.27 0.00 0.00 0.00 0.00 51.96 53.26 1x4i s ALA 42 Cb 0.03 -3.56 -0.02 0.00 0.00 0.00 0.00 23.12 19.57 1x4i s ALA 42 CO 0.24 -0.65 1.84 -1.25 0.00 0.00 0.00 175.76 175.93 1x4i s PRO 43 N 1.04 2.75 0.22 0.00 0.04 -1.26 -4.87 135.00 132.92 1x4i s PRO 43 Ca 0.66 0.73 -0.08 0.00 0.04 0.00 0.00 61.00 62.34 1x4i s PRO 43 Cb -0.39 -4.35 0.35 0.00 0.04 0.00 0.00 34.50 30.15 1x4i s PRO 43 CO 0.31 -2.59 1.70 0.87 0.04 0.00 0.00 177.00 177.34 1x4i h LYS 44 N 14.57 0.28 0.00 4.56 6.56 -2.06 -3.42 116.57 137.06 1x4i h LYS 44 Ca -0.27 -0.02 0.00 0.00 -1.06 0.00 0.00 60.65 59.30 1x4i h LYS 44 Cb 1.16 -0.06 0.00 0.00 -0.57 0.00 0.00 32.23 32.76 1x4i h LYS 44 CO 1.19 0.19 0.00 0.41 -2.06 0.00 0.00 179.45 179.18 1x4i n GLY 45 N -1.33 0.82 3.69 3.86 0.00 -1.26 -5.02 105.19 105.96 1x4i n GLY 45 Ca 0.11 -1.52 -0.38 0.00 0.00 0.00 0.00 46.02 44.23 1x4i n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x4i s LYS 46 N 0.16 4.23 -0.10 1.61 -0.14 -1.26 -5.07 119.74 119.17 1x4i s LYS 46 Ca 0.00 0.26 0.01 0.00 -1.36 0.00 0.00 55.97 54.89 1x4i s LYS 46 Cb 0.00 -3.49 -0.02 0.00 -1.68 0.00 0.00 37.83 32.64 1x4i s LYS 46 CO 0.00 0.05 -0.13 -0.46 -0.76 0.00 0.00 175.35 174.05 1x4i s TRP 47 N 1.01 2.78 -0.15 3.18 -0.00 -1.26 -5.11 118.94 119.39 1x4i s TRP 47 Ca 0.21 -0.48 0.00 0.00 -0.00 0.00 0.00 56.10 55.83 1x4i s TRP 47 Cb -0.15 -1.77 0.02 0.00 -0.00 0.00 0.00 33.47 31.57 1x4i s TRP 47 CO 0.08 -0.08 -0.15 0.71 -0.00 0.00 0.00 176.95 177.51 1x4i s TYR 48 N -0.01 2.21 0.80 5.86 2.02 -1.26 -3.28 117.35 123.68 1x4i s TYR 48 Ca -0.04 -1.24 -0.17 0.00 -0.37 0.00 0.00 57.07 55.26 1x4i s TYR 48 Cb -0.14 -1.61 -0.10 0.00 -0.40 0.00 0.00 41.96 39.70 1x4i s TYR 48 CO 0.04 -0.67 -0.18 0.00 -1.57 0.00 0.00 175.55 173.16 1x4i n PRO 50 N 1.02 0.04 0.05 0.00 -0.04 -1.26 -2.42 135.00 132.39 1x4i n PRO 50 Ca 0.04 0.29 -0.06 0.00 -0.04 0.00 0.00 63.50 63.73 1x4i n PRO 50 Cb 0.52 -1.57 -0.11 0.00 -0.04 0.00 0.00 33.50 32.29 1x4i n PRO 50 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 1x4i h GLN 51 N 0.00 0.00 0.00 0.54 4.20 -2.01 -3.26 115.11 114.58 1x4i h GLN 51 Ca 0.00 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.65 1x4i h GLN 51 Cb 0.27 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.04 1x4i h GLN 51 CO 0.00 0.86 -0.60 0.00 -0.67 0.00 0.00 178.83 178.42 1x4i h THR 53 N -1.00 0.25 -0.33 0.00 2.02 -1.67 0.85 112.91 113.04 1x4i h THR 53 Ca -0.09 -0.03 -0.15 0.00 0.77 0.00 0.00 66.41 66.90 1x4i h THR 53 Cb 0.67 0.14 -0.00 0.00 -1.74 0.00 0.00 68.15 67.21 1x4i h THR 53 CO -0.06 0.02 -0.39 0.00 0.37 0.00 0.00 175.52 175.46 1x4i h ALA 54 N 1.43 0.49 -0.04 6.16 0.00 -1.71 -1.45 119.26 124.13 1x4i h ALA 54 Ca 0.74 -0.45 -0.12 0.00 0.00 0.00 0.00 54.91 55.08 1x4i h ALA 54 Cb 2.55 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 20.25 1x4i h ALA 54 CO -0.20 0.59 -0.43 0.00 0.00 0.00 0.00 179.25 179.20 1x4i h ALA 55 N 0.72 0.11 -0.65 0.00 0.00 0.46 -2.98 119.26 116.92 1x4i h ALA 55 Ca 0.04 -0.50 -0.02 0.00 0.00 0.00 0.00 54.91 54.43 1x4i h ALA 55 Cb 0.98 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.75 1x4i h ALA 55 CO 0.09 0.26 0.32 0.52 0.00 0.00 0.00 179.25 180.44 1x4i h MET 56 N -0.14 0.91 -0.61 0.00 2.86 -0.64 -2.56 114.93 114.75 1x4i h MET 56 Ca -0.04 -0.11 -0.04 0.00 -2.06 0.00 0.00 59.70 57.45 1x4i h MET 56 Cb 1.12 -0.18 -0.03 0.00 0.06 0.00 0.00 31.60 32.58 1x4i h MET 56 CO 0.09 0.69 0.23 0.87 1.06 0.00 0.00 176.91 179.85 1x4i h LYS 57 N 0.91 0.92 -0.67 1.72 1.57 -1.30 -2.92 116.57 116.80 1x4i h LYS 57 Ca 0.23 -0.18 0.14 0.00 -1.87 0.00 0.00 60.65 58.97 1x4i h LYS 57 Cb 0.08 -0.14 -0.11 0.00 0.08 0.00 0.00 32.23 32.13 1x4i h LYS 57 CO -0.03 0.80 0.05 0.00 -0.57 0.00 0.00 179.45 179.70 1x4i h ARG 58 N 0.85 0.15 -0.13 3.15 3.08 -1.29 0.40 114.38 120.59 1x4i h ARG 58 Ca 0.20 -0.01 0.01 0.00 0.07 0.00 0.00 59.98 60.25 1x4i h ARG 58 Cb 0.23 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 1x4i h ARG 58 CO -0.01 0.10 0.09 0.00 -1.07 0.00 0.00 179.97 179.07 1x4i h ARG 59 N 0.16 0.13 -7.32 0.04 3.08 -1.51 -3.42 114.38 105.54 1x4i h ARG 59 Ca 0.36 -0.01 -0.41 0.00 0.07 0.00 0.00 59.98 60.00 1x4i h ARG 59 Cb 0.61 -0.03 0.20 0.00 0.08 0.00 0.00 29.97 30.83 1x4i h ARG 59 CO -0.55 0.09 0.09 0.20 -1.07 0.00 0.00 179.97 178.73 1x4i s GLY 60 N -3.97 1.55 -0.83 0.04 0.00 0.14 -4.85 107.32 99.40 1x4i s GLY 60 Ca -0.06 -0.86 -0.25 0.00 0.00 0.00 0.00 44.72 43.55 1x4i s GLY 60 CO 0.69 0.02 1.97 -0.56 0.00 0.00 0.00 173.10 175.22 1x4i s SER 61 N -3.69 5.06 0.25 1.64 0.01 -1.26 -4.89 113.70 110.83 1x4i s SER 61 Ca 0.70 -0.40 0.01 0.00 1.31 0.00 0.00 55.95 57.57 1x4i s SER 61 Cb -0.11 -2.55 -0.03 0.00 0.21 0.00 0.00 66.02 63.53 1x4i s SER 61 CO 0.57 -2.76 0.20 -0.13 0.41 0.00 0.00 173.24 171.53 1x4i s ARG 62 N 7.17 1.42 -0.44 12.44 0.52 -1.26 -5.07 118.95 133.73 1x4i s ARG 62 Ca 0.72 -1.75 0.04 0.00 -0.52 0.00 0.00 55.73 54.22 1x4i s ARG 62 Cb -0.08 0.30 0.45 0.00 0.52 0.00 0.00 34.95 36.14 1x4i s ARG 62 CO 0.04 -0.50 1.49 1.58 0.02 0.00 0.00 175.30 177.93 1x4i n HIS 63 N -0.40 2.96 -2.03 -0.53 -0.00 -1.26 -5.04 115.22 108.91 1x4i n HIS 63 Ca 0.04 -2.54 -0.32 0.00 -0.00 0.00 0.00 57.72 54.90 1x4i n HIS 63 Cb 0.64 -0.71 0.00 0.00 -0.00 0.00 0.00 29.99 29.93 1x4i n HIS 63 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.34 176.49 1x4i s LYS 64 N -3.69 3.48 0.54 1.57 -0.14 -1.26 -5.08 119.74 115.17 1x4i s LYS 64 Ca 0.55 1.01 0.07 0.00 -1.36 0.00 0.00 55.97 56.24 1x4i s LYS 64 Cb 0.44 -2.06 0.09 0.00 -1.68 0.00 0.00 37.83 34.62 1x4i s LYS 64 CO -0.01 -0.66 0.74 -1.13 -0.76 0.00 0.00 175.35 173.53 1x4i n SER 65 N -2.22 1.71 -4.84 2.83 3.41 -1.26 -5.10 113.62 108.15 1x4i n SER 65 Ca 0.07 -2.27 -0.37 0.00 -0.26 0.00 0.00 58.87 56.04 1x4i n SER 65 Cb 0.54 -0.41 -0.06 0.00 -0.26 0.00 0.00 64.21 64.01 1x4i n SER 65 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1x4i s GLY 66 N -4.40 2.50 0.00 5.00 0.00 -1.26 -4.96 107.32 104.20 1x4i s GLY 66 Ca 0.54 -0.17 0.14 0.00 0.00 0.00 0.00 44.72 45.24 1x4i s GLY 66 CO 0.35 0.18 1.44 -1.55 0.00 0.00 0.00 173.10 173.51 1x4i n PRO 67 N 1.52 0.07 -1.12 2.90 -0.04 -1.26 -4.83 135.00 132.25 1x4i n PRO 67 Ca -0.11 0.22 -0.41 0.00 -0.04 0.00 0.00 63.50 63.15 1x4i n PRO 67 Cb 0.52 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.37 1x4i n PRO 67 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1x4i n SER 68 N -1.43 0.43 -4.74 3.54 2.88 -1.26 -4.87 113.62 108.17 1x4i n SER 68 Ca 0.05 0.36 -0.35 0.00 -1.33 0.00 0.00 58.87 57.59 1x4i n SER 68 Cb 0.15 -0.74 -0.08 0.00 -0.75 0.00 0.00 64.21 62.78 1x4i n SER 68 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1x4i s SER 69 N 6.11 5.81 0.00 -3.46 0.01 -1.26 -5.26 113.70 115.64 1x4i s SER 69 Ca 1.05 0.24 0.00 0.00 1.31 0.00 0.00 55.95 58.55 1x4i s SER 69 Cb -1.13 -1.87 0.00 0.00 0.21 0.00 0.00 66.02 63.23 1x4i s SER 69 CO 0.47 0.31 0.48 0.61 0.41 0.00 0.00 173.24 175.52