#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x4i n SER 2 N 0.00 -1.25 -2.21 1.61 3.41 -1.26 -4.96 113.62 108.96 1x4i n SER 2 Ca 0.00 0.08 -0.21 0.00 -0.26 0.00 0.00 58.87 58.48 1x4i n SER 2 Cb 0.00 -1.28 0.02 0.00 -0.26 0.00 0.00 64.21 62.70 1x4i n SER 2 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1x4i n SER 3 N -3.82 4.38 -3.09 4.04 7.64 -1.26 -4.82 113.62 116.68 1x4i n SER 3 Ca 0.06 -3.50 -0.18 0.00 1.01 0.00 0.00 58.87 56.26 1x4i n SER 3 Cb 0.54 -0.38 -0.02 0.00 -1.01 0.00 0.00 64.21 63.34 1x4i n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x4i n GLY 4 N -0.65 3.54 0.23 0.23 0.00 -1.26 -4.95 105.19 102.33 1x4i n GLY 4 Ca 0.38 -1.75 -0.12 0.00 0.00 0.00 0.00 46.02 44.53 1x4i n GLY 4 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1x4i h SER 5 N 2.99 -0.53 -4.19 1.61 0.02 -1.96 -3.43 113.55 108.06 1x4i h SER 5 Ca 0.08 0.06 -0.47 0.00 -0.84 0.00 0.00 61.79 60.63 1x4i h SER 5 Cb 0.96 0.20 0.09 0.00 0.14 0.00 0.00 62.40 63.79 1x4i h SER 5 CO 0.53 -0.27 0.32 -0.44 -1.14 0.00 0.00 176.83 175.83 1x4i s SER 6 N -4.90 4.73 -0.30 3.07 0.01 -1.26 -5.10 113.70 109.96 1x4i s SER 6 Ca -0.15 0.65 -0.19 0.00 1.31 0.00 0.00 55.95 57.57 1x4i s SER 6 Cb 0.08 -1.24 0.19 0.00 0.21 0.00 0.00 66.02 65.25 1x4i s SER 6 CO 0.66 -1.71 1.24 -0.83 0.41 0.00 0.00 173.24 173.01 1x4i s GLY 7 N -4.53 0.20 0.00 3.44 0.00 -1.26 -4.34 107.32 100.83 1x4i s GLY 7 Ca 0.61 3.55 0.00 0.00 0.00 0.00 0.00 44.72 48.88 1x4i s GLY 7 CO 0.47 3.39 0.00 -1.72 0.00 0.00 0.00 173.10 175.24 1x4i n TYR 8 N 4.66 0.00 -0.97 1.90 4.02 0.10 -4.74 117.16 122.12 1x4i n TYR 8 Ca -0.07 0.00 -0.36 0.00 -0.01 0.00 0.00 57.90 57.46 1x4i n TYR 8 Cb 0.55 0.00 0.05 0.00 -0.02 0.00 0.00 39.34 39.92 1x4i n TYR 8 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1x4i h ILE 10 N -1.09 0.49 -0.03 0.00 3.07 -1.94 0.44 117.51 118.46 1x4i h ILE 10 Ca -0.43 0.00 0.00 0.00 1.55 0.00 0.00 64.86 65.98 1x4i h ILE 10 Cb 1.33 0.75 0.00 0.00 -0.27 0.00 0.00 36.82 38.63 1x4i h ILE 10 CO 0.24 0.00 0.00 0.00 -1.05 0.00 0.00 178.15 177.34 1x4i n ASN 12 N -0.36 -1.10 -4.36 0.00 2.85 0.16 -4.98 115.26 107.46 1x4i n ASN 12 Ca 0.01 -0.95 -0.19 0.00 -0.11 0.00 0.00 54.58 53.34 1x4i n ASN 12 Cb 0.05 -3.40 -0.10 0.00 1.24 0.00 0.00 39.78 37.57 1x4i n ASN 12 CO 0.00 0.00 0.00 -1.10 -2.11 0.00 0.00 177.26 174.05 1x4i s GLN 13 N -6.31 1.37 1.01 1.20 -1.52 -1.25 -4.55 119.66 109.61 1x4i s GLN 13 Ca 0.05 -1.62 -0.13 0.00 -1.95 0.00 0.00 55.36 51.71 1x4i s GLN 13 Cb -0.02 -1.13 0.13 0.00 -0.22 0.00 0.00 33.01 31.77 1x4i s GLN 13 CO 0.86 0.16 0.69 1.33 -0.25 0.00 0.00 175.29 178.08 1x4i n VAL 14 N -0.41 0.00 -2.88 1.09 0.24 -1.26 -0.72 118.33 114.39 1x4i n VAL 14 Ca -0.07 -0.19 -0.43 0.00 -2.04 0.00 0.00 64.34 61.60 1x4i n VAL 14 Cb 0.61 -0.80 -0.03 0.00 -1.47 0.00 0.00 33.84 32.15 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 -2.26 6.61 0.45 -1.34 0.01 -1.26 -4.75 113.70 111.17 1x4i s SER 15 Ca 0.62 -1.97 0.03 0.00 1.31 0.00 0.00 55.95 55.94 1x4i s SER 15 Cb -0.21 -2.42 -0.03 0.00 0.21 0.00 0.00 66.02 63.56 1x4i s SER 15 CO 0.64 -1.12 0.03 -0.72 0.41 0.00 0.00 173.24 172.48 1x4i s TYR 16 N 2.98 2.00 0.11 2.43 -0.85 -1.26 -5.07 117.35 117.69 1x4i s TYR 16 Ca 0.34 -0.96 0.00 0.00 -0.52 0.00 0.00 57.07 55.93 1x4i s TYR 16 Cb -0.04 -1.52 0.00 0.00 0.38 0.00 0.00 41.96 40.77 1x4i s TYR 16 CO -0.10 0.15 0.00 0.41 -1.52 0.00 0.00 175.55 174.49 1x4i n GLY 17 N -1.07 -0.80 3.63 5.49 0.00 -1.26 -4.41 105.19 106.76 1x4i n GLY 17 Ca -0.12 -0.57 -0.43 0.00 0.00 0.00 0.00 46.02 44.91 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 -1.05 3.68 0.11 1.61 2.02 -1.26 -4.98 118.70 118.83 1x4i s GLU 18 Ca 0.00 2.06 0.09 0.00 0.02 0.00 0.00 54.97 57.14 1x4i s GLU 18 Cb 0.00 -4.18 -0.04 0.00 0.10 0.00 0.00 34.13 30.01 1x4i s GLU 18 CO 0.00 -1.46 -0.18 -1.64 0.02 0.00 0.00 175.26 171.99 1x4i s MET 19 N 5.16 1.81 -0.30 1.61 -1.94 -1.26 -3.38 119.30 121.01 1x4i s MET 19 Ca 0.86 -1.16 0.01 0.00 -1.71 0.00 0.00 55.69 53.69 1x4i s MET 19 Cb -0.33 -2.12 0.06 0.00 2.01 0.00 0.00 34.83 34.46 1x4i s MET 19 CO 0.35 0.49 -0.02 0.54 -0.01 0.00 0.00 175.02 176.36 1x4i s VAL 20 N -1.12 2.63 -0.03 -6.03 0.11 -0.56 -4.92 120.40 110.48 1x4i s VAL 20 Ca 0.17 -1.62 -0.30 0.00 -2.93 0.00 0.00 61.98 57.30 1x4i s VAL 20 Cb -0.11 -2.59 -0.06 0.00 -1.53 0.00 0.00 36.38 32.10 1x4i s VAL 20 CO 0.09 -0.17 1.64 -0.83 -3.33 0.00 0.00 175.10 172.50 1x4i s GLY 21 N 1.20 1.56 0.21 6.54 0.00 -1.26 -2.91 107.32 112.66 1x4i s GLY 21 Ca -0.04 0.98 -0.31 0.00 0.00 0.00 0.00 44.72 45.35 1x4i s GLY 21 CO -0.03 2.98 0.97 0.00 0.00 0.00 0.00 173.10 177.01 1x4i h ASP 23 N 2.37 0.00 -3.36 0.00 3.58 -1.87 -3.40 116.42 113.74 1x4i h ASP 23 Ca -0.39 0.00 -0.58 0.00 0.42 0.00 0.00 57.03 56.48 1x4i h ASP 23 Cb 1.37 0.00 -0.08 0.00 1.72 0.00 0.00 39.33 42.34 1x4i h ASP 23 CO 0.64 0.00 0.70 0.21 -2.88 0.00 0.00 179.24 177.91 1x4i s ASN 24 N -6.75 6.83 0.09 2.28 2.47 -1.26 -4.89 114.94 113.71 1x4i s ASN 24 Ca -0.05 0.89 0.19 0.00 0.42 0.00 0.00 52.86 54.31 1x4i s ASN 24 Cb 0.17 -2.50 0.78 0.00 -1.45 0.00 0.00 41.25 38.25 1x4i s ASN 24 CO 0.65 -0.81 1.58 1.67 -3.72 0.00 0.00 177.10 176.47 1x4i n GLN 25 N 6.69 0.07 -0.03 0.43 7.27 -1.26 -1.95 117.38 128.60 1x4i n GLN 25 Ca 0.09 0.29 0.12 0.00 0.07 0.00 0.00 57.00 57.58 1x4i n GLN 25 Cb 0.47 -1.63 0.52 0.00 2.41 0.00 0.00 30.24 32.01 1x4i n GLN 25 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 1x4i n ASP 26 N -1.77 1.25 -4.74 1.69 8.00 -1.26 -4.90 116.55 114.82 1x4i n ASP 26 Ca 0.03 -1.52 -0.41 0.00 0.71 0.00 0.00 54.79 53.60 1x4i n ASP 26 Cb 0.21 -0.04 -0.03 0.00 -0.02 0.00 0.00 41.12 41.24 1x4i n ASP 26 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1x4i n PRO 28 N 2.29 0.12 -0.01 0.00 -0.04 -1.26 -3.93 135.00 132.17 1x4i n PRO 28 Ca 0.05 0.36 -0.04 0.00 -0.04 0.00 0.00 63.50 63.83 1x4i n PRO 28 Cb 0.42 -1.74 -0.01 0.00 -0.04 0.00 0.00 33.50 32.13 1x4i n PRO 28 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1x4i n ILE 29 N -1.97 0.84 -1.93 0.52 5.41 -1.26 -5.01 119.36 115.96 1x4i n ILE 29 Ca 0.03 0.14 -0.18 0.00 1.00 0.00 0.00 62.75 63.74 1x4i n ILE 29 Cb 0.20 -1.68 -0.04 0.00 -0.71 0.00 0.00 39.64 37.42 1x4i n ILE 29 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1x4i n GLU 30 N -3.51 -1.32 -3.60 0.38 1.02 -1.25 -4.95 120.64 107.41 1x4i n GLU 30 Ca -0.08 0.99 -0.03 0.00 -0.02 0.00 0.00 57.16 58.03 1x4i n GLU 30 Cb 0.34 -5.36 -0.05 0.00 -0.02 0.00 0.00 31.44 26.35 1x4i n GLU 30 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1x4i s TRP 31 N -2.77 -0.97 -0.04 -0.32 0.52 -1.26 -3.63 118.94 110.48 1x4i s TRP 31 Ca 0.00 1.79 -0.04 0.00 0.02 0.00 0.00 56.10 57.87 1x4i s TRP 31 Cb 0.00 0.58 0.01 0.00 -1.15 0.00 0.00 33.47 32.91 1x4i s TRP 31 CO 0.00 -0.48 0.11 -0.06 0.02 0.00 0.00 176.95 176.54 1x4i s PHE 32 N 2.11 -0.12 0.58 -1.98 0.40 -1.15 -3.61 117.98 114.22 1x4i s PHE 32 Ca -0.07 0.30 -0.18 0.00 -0.60 0.00 0.00 56.93 56.37 1x4i s PHE 32 Cb -0.07 0.04 -0.04 0.00 0.51 0.00 0.00 43.02 43.46 1x4i s PHE 32 CO -0.18 -0.06 1.14 -1.01 0.70 0.00 0.00 175.22 175.81 1x4i s HIS 33 N 0.08 2.60 0.24 0.36 3.76 -1.26 -1.50 115.29 119.56 1x4i s HIS 33 Ca -0.00 1.54 -0.01 0.00 -0.15 0.00 0.00 55.06 56.44 1x4i s HIS 33 Cb -0.01 -3.30 0.26 0.00 1.11 0.00 0.00 32.58 30.64 1x4i s HIS 33 CO 0.00 -1.73 1.63 1.88 -0.85 0.00 0.00 174.74 175.67 1x4i h TYR 34 N 0.86 0.65 0.00 1.40 -1.99 -1.88 -2.12 116.97 113.89 1x4i h TYR 34 Ca -0.49 -0.17 -0.11 0.00 2.00 0.00 0.00 58.73 59.96 1x4i h TYR 34 Cb 1.26 -0.15 -0.02 0.00 2.00 0.00 0.00 36.73 39.83 1x4i h TYR 34 CO 0.51 0.84 -0.51 0.78 -0.00 0.00 0.00 178.16 179.78 1x4i h GLY 35 N 1.04 0.00 1.32 3.88 0.00 -1.89 0.67 103.07 108.09 1x4i h GLY 35 Ca 0.05 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 47.10 1x4i h GLY 35 CO 0.07 0.00 -1.16 0.00 0.00 0.00 0.00 176.54 175.45 1x4i n VAL 37 N -3.77 0.32 -1.21 0.00 0.24 -0.81 -5.02 118.33 108.07 1x4i n VAL 37 Ca -0.12 -0.52 0.00 0.00 -2.04 0.00 0.00 64.34 61.66 1x4i n VAL 37 Cb 0.95 -0.17 0.00 0.00 -1.47 0.00 0.00 33.84 33.15 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 1.22 -0.16 2.57 7.63 0.00 0.19 -5.07 105.19 111.56 1x4i n GLY 38 Ca -0.02 -0.28 -0.28 0.00 0.00 0.00 0.00 46.02 45.44 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 -1.43 2.44 0.56 0.99 1.43 0.14 -4.96 118.68 117.85 1x4i s LEU 39 Ca 0.00 -3.18 0.43 0.00 -1.03 0.00 0.00 54.13 50.35 1x4i s LEU 39 Cb 0.00 -0.82 1.59 0.00 0.03 0.00 0.00 46.19 46.99 1x4i s LEU 39 CO 0.00 -0.17 1.63 0.71 0.23 0.00 0.00 176.35 178.75 1x4i h THR 40 N 4.66 0.15 -3.41 5.49 1.35 -1.98 -3.43 112.91 115.74 1x4i h THR 40 Ca 0.19 0.00 -0.13 0.00 -0.55 0.00 0.00 66.41 65.93 1x4i h THR 40 Cb 0.87 0.16 -0.02 0.00 -1.73 0.00 0.00 68.15 67.43 1x4i h THR 40 CO 0.47 0.00 0.12 -1.83 -0.25 0.00 0.00 175.52 174.03 1x4i s GLU 41 N -4.83 2.19 0.28 4.72 -1.05 -1.26 -5.14 118.70 113.61 1x4i s GLU 41 Ca -0.05 -1.61 -0.30 0.00 -0.15 0.00 0.00 54.97 52.86 1x4i s GLU 41 Cb 0.24 0.57 -0.11 0.00 -0.44 0.00 0.00 34.13 34.38 1x4i s GLU 41 CO 0.81 -0.99 1.60 0.00 0.95 0.00 0.00 175.26 177.62 1x4i s ALA 42 N -2.37 3.76 -0.61 -0.84 0.00 -1.26 -4.89 121.76 115.55 1x4i s ALA 42 Ca 0.21 1.55 -0.27 0.00 0.00 0.00 0.00 51.96 53.46 1x4i s ALA 42 Cb -0.04 -3.65 -0.02 0.00 0.00 0.00 0.00 23.12 19.42 1x4i s ALA 42 CO 0.16 -0.96 1.86 -1.25 0.00 0.00 0.00 175.76 175.57 1x4i s PRO 43 N -0.26 2.63 0.10 0.00 0.04 -1.26 -4.89 135.00 131.37 1x4i s PRO 43 Ca 0.64 0.62 -0.19 0.00 0.04 0.00 0.00 61.00 62.11 1x4i s PRO 43 Cb -0.47 -4.39 -0.04 0.00 0.04 0.00 0.00 34.50 29.63 1x4i s PRO 43 CO 0.45 -2.73 1.05 1.17 0.04 0.00 0.00 177.00 176.98 1x4i n LYS 44 N 9.18 -0.27 0.00 4.56 4.81 -1.26 -4.46 118.16 130.72 1x4i n LYS 44 Ca 0.20 1.03 0.00 0.00 -0.87 0.00 0.00 58.31 58.68 1x4i n LYS 44 Cb 0.52 -1.52 0.00 0.00 0.02 0.00 0.00 35.03 34.05 1x4i n LYS 44 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1x4i n GLY 45 N -1.16 1.16 3.82 3.14 0.00 -1.26 -5.04 105.19 105.85 1x4i n GLY 45 Ca 0.01 -1.49 -0.38 0.00 0.00 0.00 0.00 46.02 44.16 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 1.25 4.13 -0.06 1.61 -0.14 -1.26 -5.08 119.74 120.18 1x4i s LYS 46 Ca 0.00 0.66 0.05 0.00 -1.36 0.00 0.00 55.97 55.32 1x4i s LYS 46 Cb 0.00 -3.22 -0.01 0.00 -1.68 0.00 0.00 37.83 32.92 1x4i s LYS 46 CO 0.00 0.65 -0.23 -0.46 -0.76 0.00 0.00 175.35 174.55 1x4i s TRP 47 N -1.11 2.29 -0.16 3.18 -0.00 -1.26 -5.07 118.94 116.80 1x4i s TRP 47 Ca 0.28 -0.73 0.00 0.00 -0.00 0.00 0.00 56.10 55.65 1x4i s TRP 47 Cb -0.19 -1.52 0.03 0.00 -0.00 0.00 0.00 33.47 31.80 1x4i s TRP 47 CO 0.18 -0.24 -0.10 0.71 -0.00 0.00 0.00 176.95 177.49 1x4i s TYR 48 N -0.02 2.02 0.80 5.86 1.51 -1.26 -2.76 117.35 123.51 1x4i s TYR 48 Ca -0.07 -1.20 -0.17 0.00 -1.01 0.00 0.00 57.07 54.62 1x4i s TYR 48 Cb -0.14 -1.49 -0.12 0.00 -0.11 0.00 0.00 41.96 40.10 1x4i s TYR 48 CO 0.04 -0.65 -0.34 0.00 -1.11 0.00 0.00 175.55 173.50 1x4i n PRO 50 N 1.48 0.03 0.06 0.00 -0.04 -1.26 -2.38 135.00 132.89 1x4i n PRO 50 Ca 0.03 0.28 -0.04 0.00 -0.04 0.00 0.00 63.50 63.73 1x4i n PRO 50 Cb 0.52 -1.55 -0.08 0.00 -0.04 0.00 0.00 33.50 32.35 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 -2.00 -3.26 115.11 114.59 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 0.26 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 1x4i h GLN 51 CO 0.00 0.70 -0.64 0.00 -0.67 0.00 0.00 178.83 178.22 1x4i h THR 53 N -1.00 0.29 0.22 0.00 2.02 -1.67 0.67 112.91 113.44 1x4i h THR 53 Ca -0.09 0.00 -0.32 0.00 0.77 0.00 0.00 66.41 66.76 1x4i h THR 53 Cb 0.68 0.34 0.03 0.00 -1.74 0.00 0.00 68.15 67.46 1x4i h THR 53 CO -0.06 0.00 -1.41 0.00 0.37 0.00 0.00 175.52 174.42 1x4i h ALA 54 N 1.25 -0.10 -0.04 6.16 0.00 -1.71 -3.00 119.26 121.81 1x4i h ALA 54 Ca 0.54 -0.85 -0.04 0.00 0.00 0.00 0.00 54.91 54.57 1x4i h ALA 54 Cb 2.37 0.14 0.00 0.00 0.00 0.00 0.00 17.79 20.30 1x4i h ALA 54 CO -0.01 0.73 -0.12 0.00 0.00 0.00 0.00 179.25 179.86 1x4i h ALA 55 N 0.24 0.06 -0.95 0.00 0.00 0.14 -2.72 119.26 116.03 1x4i h ALA 55 Ca -0.23 -0.36 0.08 0.00 0.00 0.00 0.00 54.91 54.40 1x4i h ALA 55 Cb 2.10 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 19.82 1x4i h ALA 55 CO 0.26 -0.04 0.61 0.52 0.00 0.00 0.00 179.25 180.61 1x4i h MET 56 N -0.42 1.02 0.03 0.00 2.86 -0.67 -2.41 114.93 115.35 1x4i h MET 56 Ca -0.00 -0.06 -0.00 0.00 -2.06 0.00 0.00 59.70 57.57 1x4i h MET 56 Cb 0.75 -0.23 0.00 0.00 0.06 0.00 0.00 31.60 32.18 1x4i h MET 56 CO 0.03 0.68 -0.02 0.87 1.06 0.00 0.00 176.91 179.52 1x4i h LYS 57 N 1.05 -0.04 -0.65 1.72 1.57 -1.55 -2.90 116.57 115.77 1x4i h LYS 57 Ca 0.42 0.00 0.14 0.00 -1.87 0.00 0.00 60.65 59.34 1x4i h LYS 57 Cb 0.25 0.01 -0.11 0.00 0.08 0.00 0.00 32.23 32.46 1x4i h LYS 57 CO -0.17 0.17 -0.00 0.00 -0.57 0.00 0.00 179.45 178.88 1x4i h ARG 58 N -0.26 0.11 -0.38 3.15 3.08 -1.11 0.35 114.38 119.31 1x4i h ARG 58 Ca -0.00 -0.01 0.05 0.00 0.07 0.00 0.00 59.98 60.09 1x4i h ARG 58 Cb 0.24 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.24 1x4i h ARG 58 CO 0.01 0.07 0.26 0.00 -1.07 0.00 0.00 179.97 179.24 1x4i h ARG 59 N 0.11 0.29 -5.25 0.04 3.08 -1.38 -3.24 114.38 108.03 1x4i h ARG 59 Ca 0.34 -0.02 -0.34 0.00 0.07 0.00 0.00 59.98 60.03 1x4i h ARG 59 Cb 0.56 -0.07 -0.05 0.00 0.08 0.00 0.00 29.97 30.50 1x4i h ARG 59 CO -0.56 0.19 1.38 0.41 -1.07 0.00 0.00 179.97 180.32 1x4i n GLY 60 N -1.53 -0.22 2.34 0.04 0.00 0.12 -0.26 105.19 105.69 1x4i n GLY 60 Ca 0.05 0.56 -0.18 0.00 0.00 0.00 0.00 46.02 46.45 1x4i n GLY 60 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1x4i n SER 61 N 12.88 -5.19 -4.16 1.61 7.64 -1.26 -4.94 113.62 120.20 1x4i n SER 61 Ca 0.54 -0.00 -0.35 0.00 1.01 0.00 0.00 58.87 60.07 1x4i n SER 61 Cb 0.29 -4.27 0.07 0.00 -1.01 0.00 0.00 64.21 59.30 1x4i n SER 61 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1x4i n ARG 62 N -2.70 -0.18 -3.91 1.43 -4.01 0.64 -5.02 116.66 102.92 1x4i n ARG 62 Ca -0.21 -0.04 -0.09 0.00 -1.04 0.00 0.00 57.85 56.47 1x4i n ARG 62 Cb 0.66 -1.33 -0.08 0.00 -3.04 0.00 0.00 32.46 28.67 1x4i n ARG 62 CO 0.00 0.00 0.00 -1.58 -3.04 0.00 0.00 177.63 173.01 1x4i s HIS 63 N -2.15 0.21 -0.11 2.89 2.46 -1.26 -5.08 115.29 112.25 1x4i s HIS 63 Ca 0.46 -0.59 -0.15 0.00 0.47 0.00 0.00 55.06 55.25 1x4i s HIS 63 Cb -0.17 -0.13 -0.05 0.00 -0.13 0.00 0.00 32.58 32.11 1x4i s HIS 63 CO 0.76 -0.46 0.35 -1.59 -2.47 0.00 0.00 174.74 171.33 1x4i s LYS 64 N -3.37 4.15 0.07 2.88 -2.85 -1.26 -5.08 119.74 114.27 1x4i s LYS 64 Ca 0.01 0.24 0.04 0.00 -1.00 0.00 0.00 55.97 55.26 1x4i s LYS 64 Cb 0.03 -3.37 -0.03 0.00 -2.06 0.00 0.00 37.83 32.40 1x4i s LYS 64 CO -0.08 0.36 -0.10 0.45 0.10 0.00 0.00 175.35 176.07 1x4i s SER 65 N 0.06 1.32 0.20 0.03 0.15 -1.26 -5.11 113.70 109.09 1x4i s SER 65 Ca 0.20 -0.70 -0.19 0.00 0.70 0.00 0.00 55.95 55.96 1x4i s SER 65 Cb -0.14 0.01 -0.12 0.00 -1.71 0.00 0.00 66.02 64.05 1x4i s SER 65 CO 0.08 -0.21 0.28 0.61 1.20 0.00 0.00 173.24 175.20 1x4i n GLY 66 N 0.97 -1.56 3.68 9.45 0.00 -1.26 -4.90 105.19 111.57 1x4i n GLY 66 Ca -0.19 0.17 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 1x4i n GLY 66 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x4i s PRO 67 N -0.75 0.47 0.01 1.61 0.04 -1.26 -5.06 135.00 130.06 1x4i s PRO 67 Ca 0.47 0.54 0.04 0.00 0.04 0.00 0.00 61.00 62.09 1x4i s PRO 67 Cb -0.63 -1.74 -0.03 0.00 0.04 0.00 0.00 34.50 32.14 1x4i s PRO 67 CO 0.44 -2.71 -0.07 -1.12 0.04 0.00 0.00 177.00 173.58 1x4i s SER 68 N -3.45 4.59 -0.33 6.66 0.01 -1.26 -5.08 113.70 114.85 1x4i s SER 68 Ca 0.65 -0.17 -0.29 0.00 1.31 0.00 0.00 55.95 57.45 1x4i s SER 68 Cb -0.19 -1.05 0.00 0.00 0.21 0.00 0.00 66.02 65.00 1x4i s SER 68 CO 0.58 0.27 1.32 -0.55 0.41 0.00 0.00 173.24 175.26 1x4i s SER 69 N -1.50 6.61 0.00 2.44 0.15 -1.26 -5.33 113.70 114.81 1x4i s SER 69 Ca 0.18 1.11 0.00 0.00 0.70 0.00 0.00 55.95 57.93 1x4i s SER 69 Cb -0.11 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.66 1x4i s SER 69 CO 0.08 -1.15 0.44 0.61 1.20 0.00 0.00 173.24 174.42