#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 2.31 1.20 1.61 1.04 -1.26 -5.14 113.70 113.46 1x4i s SER 2 Ca 0.00 -0.39 -0.18 0.00 0.48 0.00 0.00 55.95 55.87 1x4i s SER 2 Cb 0.00 -0.73 0.28 0.00 0.10 0.00 0.00 66.02 65.67 1x4i s SER 2 CO 0.00 0.15 1.07 -0.55 0.98 0.00 0.00 173.24 174.89 1x4i s SER 3 N 0.12 0.88 0.00 7.02 0.15 -1.26 -5.07 113.70 115.53 1x4i s SER 3 Ca -0.07 0.86 0.00 0.00 0.70 0.00 0.00 55.95 57.44 1x4i s SER 3 Cb -0.13 -1.26 0.00 0.00 -1.71 0.00 0.00 66.02 62.92 1x4i s SER 3 CO 0.03 -4.18 0.00 0.61 1.20 0.00 0.00 173.24 170.91 1x4i n GLY 4 N -0.39 1.45 3.63 9.45 0.00 -1.26 -5.15 105.19 112.91 1x4i n GLY 4 Ca 0.10 -1.85 -0.09 0.00 0.00 0.00 0.00 46.02 44.18 1x4i n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x4i s SER 5 N -1.00 -0.34 0.62 1.61 0.01 -1.26 -5.18 113.70 108.16 1x4i s SER 5 Ca 0.00 -0.41 -0.05 0.00 1.31 0.00 0.00 55.95 56.80 1x4i s SER 5 Cb 0.00 0.64 0.03 0.00 0.21 0.00 0.00 66.02 66.91 1x4i s SER 5 CO 0.00 -1.15 0.91 -0.44 0.41 0.00 0.00 173.24 172.97 1x4i s SER 6 N -2.86 5.25 -0.30 2.44 0.01 -1.26 -5.10 113.70 111.88 1x4i s SER 6 Ca 0.08 0.46 -0.17 0.00 1.31 0.00 0.00 55.95 57.63 1x4i s SER 6 Cb -0.03 -1.32 0.17 0.00 0.21 0.00 0.00 66.02 65.05 1x4i s SER 6 CO -0.01 -1.26 1.21 -0.83 0.41 0.00 0.00 173.24 172.76 1x4i s GLY 7 N -4.40 -0.14 -0.03 3.44 0.00 -1.26 -4.24 107.32 100.68 1x4i s GLY 7 Ca 0.56 3.07 -0.03 0.00 0.00 0.00 0.00 44.72 48.33 1x4i s GLY 7 CO 0.43 3.98 -0.06 -1.72 0.00 0.00 0.00 173.10 175.73 1x4i n TYR 8 N 5.47 0.02 -0.89 1.90 4.02 -0.80 -4.59 117.16 122.29 1x4i n TYR 8 Ca -0.08 0.01 -0.35 0.00 -0.01 0.00 0.00 57.90 57.47 1x4i n TYR 8 Cb 0.55 -0.13 0.08 0.00 -0.02 0.00 0.00 39.34 39.82 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 -1.31 0.55 -0.05 0.00 3.07 -1.94 0.68 117.51 118.51 1x4i h ILE 10 Ca -0.44 0.00 0.00 0.00 1.55 0.00 0.00 64.86 65.97 1x4i h ILE 10 Cb 1.31 0.65 0.00 0.00 -0.27 0.00 0.00 36.82 38.52 1x4i h ILE 10 CO 0.28 0.00 0.00 0.00 -1.05 0.00 0.00 178.15 177.38 1x4i n ASN 12 N -0.31 -1.26 -4.28 0.00 3.02 0.24 -4.97 115.26 107.70 1x4i n ASN 12 Ca 0.02 -1.02 -0.20 0.00 -0.03 0.00 0.00 54.58 53.35 1x4i n ASN 12 Cb 0.08 -3.08 -0.11 0.00 -0.61 0.00 0.00 39.78 36.05 1x4i n ASN 12 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1x4i s GLN 13 N -6.48 1.12 0.57 3.52 -1.52 -1.25 -4.34 119.66 111.28 1x4i s GLN 13 Ca 0.10 -1.27 -0.20 0.00 -1.95 0.00 0.00 55.36 52.04 1x4i s GLN 13 Cb -0.04 -1.14 -0.05 0.00 -0.22 0.00 0.00 33.01 31.56 1x4i s GLN 13 CO 0.89 0.23 1.09 1.33 -0.25 0.00 0.00 175.29 178.58 1x4i n VAL 14 N 0.58 3.65 -2.33 1.09 0.24 -1.26 -1.90 118.33 118.40 1x4i n VAL 14 Ca -0.16 -0.50 -0.43 0.00 -2.04 0.00 0.00 64.34 61.21 1x4i n VAL 14 Cb 0.56 -1.30 -0.02 0.00 -1.47 0.00 0.00 33.84 31.61 1x4i n VAL 14 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1x4i s SER 15 N -1.11 6.49 0.30 -1.34 0.15 -1.26 -4.88 113.70 112.06 1x4i s SER 15 Ca 0.74 1.17 0.05 0.00 0.70 0.00 0.00 55.95 58.60 1x4i s SER 15 Cb -0.43 -2.54 -0.03 0.00 -1.71 0.00 0.00 66.02 61.31 1x4i s SER 15 CO 0.48 -1.24 0.23 -0.72 1.20 0.00 0.00 173.24 173.19 1x4i s TYR 16 N 4.93 1.61 0.00 3.44 -0.85 -1.26 -5.11 117.35 120.11 1x4i s TYR 16 Ca 0.61 -1.55 0.00 0.00 -0.52 0.00 0.00 57.07 55.61 1x4i s TYR 16 Cb -0.17 -0.72 0.00 0.00 0.38 0.00 0.00 41.96 41.45 1x4i s TYR 16 CO 0.27 -0.76 0.00 0.41 -1.52 0.00 0.00 175.55 173.96 1x4i n GLY 17 N -0.56 0.43 3.61 5.49 0.00 -1.26 -4.23 105.19 108.68 1x4i n GLY 17 Ca 0.05 -0.74 -0.43 0.00 0.00 0.00 0.00 46.02 44.90 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 0.00 3.64 0.10 1.61 2.02 -1.26 -5.00 118.70 119.81 1x4i s GLU 18 Ca 0.00 1.34 0.08 0.00 0.02 0.00 0.00 54.97 56.41 1x4i s GLU 18 Cb 0.00 -4.05 -0.04 0.00 0.10 0.00 0.00 34.13 30.15 1x4i s GLU 18 CO 0.00 -1.47 -0.15 -1.64 0.02 0.00 0.00 175.26 172.02 1x4i s MET 19 N 4.90 1.98 -0.36 1.61 -1.94 -1.26 -3.47 119.30 120.76 1x4i s MET 19 Ca 0.68 -1.08 -0.03 0.00 -1.71 0.00 0.00 55.69 53.55 1x4i s MET 19 Cb -0.20 -2.21 0.08 0.00 2.01 0.00 0.00 34.83 34.51 1x4i s MET 19 CO 0.30 0.50 0.12 0.54 -0.01 0.00 0.00 175.02 176.47 1x4i s VAL 20 N -1.13 3.30 0.13 -6.03 0.11 -0.74 -4.94 120.40 111.11 1x4i s VAL 20 Ca 0.19 -1.64 -0.31 0.00 -2.93 0.00 0.00 61.98 57.29 1x4i s VAL 20 Cb -0.11 -3.06 -0.08 0.00 -1.53 0.00 0.00 36.38 31.60 1x4i s VAL 20 CO 0.11 -0.39 1.36 -0.83 -3.33 0.00 0.00 175.10 172.01 1x4i s GLY 21 N 1.57 2.13 0.14 6.54 0.00 -1.26 -3.18 107.32 113.26 1x4i s GLY 21 Ca 0.02 1.10 -0.31 0.00 0.00 0.00 0.00 44.72 45.53 1x4i s GLY 21 CO -0.02 2.26 1.80 0.00 0.00 0.00 0.00 173.10 177.14 1x4i h ASP 23 N 8.14 0.45 -2.35 0.00 1.82 -1.92 -3.34 116.42 119.21 1x4i h ASP 23 Ca -0.45 0.07 -0.54 0.00 -0.39 0.00 0.00 57.03 55.73 1x4i h ASP 23 Cb 1.21 -0.00 -0.07 0.00 0.68 0.00 0.00 39.33 41.15 1x4i h ASP 23 CO 0.95 0.11 1.09 0.21 -1.61 0.00 0.00 179.24 179.99 1x4i s ASN 24 N -5.34 6.07 0.50 2.28 2.47 -1.26 -4.86 114.94 114.80 1x4i s ASN 24 Ca -0.09 -0.33 0.24 0.00 0.42 0.00 0.00 52.86 53.11 1x4i s ASN 24 Cb 0.25 -2.56 1.32 0.00 -1.45 0.00 0.00 41.25 38.81 1x4i s ASN 24 CO 0.80 -1.89 1.93 1.56 -3.72 0.00 0.00 177.10 175.78 1x4i h GLN 25 N 10.59 0.12 -0.07 0.43 4.20 -2.00 0.28 115.11 128.66 1x4i h GLN 25 Ca -0.28 -0.01 0.02 0.00 0.06 0.00 0.00 58.65 58.45 1x4i h GLN 25 Cb 1.06 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.81 1x4i h GLN 25 CO 1.27 0.08 0.11 0.22 -0.67 0.00 0.00 178.83 179.84 1x4i h ASP 26 N 0.13 0.00 -2.02 1.46 1.82 -1.92 -3.43 116.42 112.46 1x4i h ASP 26 Ca 0.35 0.00 -0.64 0.00 -0.39 0.00 0.00 57.03 56.35 1x4i h ASP 26 Cb 1.20 0.00 0.08 0.00 0.68 0.00 0.00 39.33 41.29 1x4i h ASP 26 CO -0.05 0.00 0.34 0.00 -1.61 0.00 0.00 179.24 177.92 1x4i h PRO 28 N 3.61 0.00 0.00 0.00 0.13 -1.88 -3.33 132.00 130.52 1x4i h PRO 28 Ca -0.44 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.47 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 0.05 -1.68 -0.89 -0.23 0.00 0.00 178.00 175.97 1x4i n ILE 29 N -3.18 0.95 -2.25 -3.56 5.41 -1.26 -4.99 119.36 110.48 1x4i n ILE 29 Ca 0.00 -0.15 -0.10 0.00 1.00 0.00 0.00 62.75 63.50 1x4i n ILE 29 Cb 0.32 -1.76 -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 -3.76 -2.15 -3.26 0.38 2.13 -1.25 -4.87 120.64 107.85 1x4i n GLU 30 Ca -0.28 0.52 0.03 0.00 0.66 0.00 0.00 57.16 58.10 1x4i n GLU 30 Cb 0.65 -5.03 -0.02 0.00 0.27 0.00 0.00 31.44 27.31 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 -2.40 -1.19 0.02 4.31 0.52 -1.26 -3.15 118.94 115.79 1x4i s TRP 31 Ca 0.00 1.47 0.02 0.00 0.02 0.00 0.00 56.10 57.61 1x4i s TRP 31 Cb 0.00 0.50 -0.02 0.00 -1.15 0.00 0.00 33.47 32.80 1x4i s TRP 31 CO 0.00 -0.64 -0.07 -0.06 0.02 0.00 0.00 176.95 176.20 1x4i s PHE 32 N 2.84 0.61 0.76 -1.98 0.40 -1.19 -3.01 117.98 116.41 1x4i s PHE 32 Ca 0.08 -0.33 -0.12 0.00 -0.60 0.00 0.00 56.93 55.96 1x4i s PHE 32 Cb -0.12 -0.37 0.06 0.00 0.51 0.00 0.00 43.02 43.09 1x4i s PHE 32 CO -0.18 -0.05 1.12 -1.01 0.70 0.00 0.00 175.22 175.80 1x4i s HIS 33 N -0.87 2.34 0.19 0.36 3.76 -1.26 -1.79 115.29 118.02 1x4i s HIS 33 Ca -0.05 1.61 0.03 0.00 -0.15 0.00 0.00 55.06 56.50 1x4i s HIS 33 Cb -0.07 -3.19 0.07 0.00 1.11 0.00 0.00 32.58 30.50 1x4i s HIS 33 CO 0.00 -2.06 1.43 1.88 -0.85 0.00 0.00 174.74 175.14 1x4i h TYR 34 N -0.86 0.29 0.00 1.40 -1.99 -1.89 -2.84 116.97 111.08 1x4i h TYR 34 Ca -0.45 -0.15 -0.14 0.00 2.00 0.00 0.00 58.73 60.00 1x4i h TYR 34 Cb 1.25 -0.04 -0.02 0.00 2.00 0.00 0.00 36.73 39.92 1x4i h TYR 34 CO 0.54 0.91 -0.83 0.78 -0.00 0.00 0.00 178.16 179.56 1x4i h GLY 35 N 1.75 0.00 1.67 3.88 0.00 -1.90 0.58 103.07 109.05 1x4i h GLY 35 Ca -0.03 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.10 1x4i h GLY 35 CO 0.12 0.00 -0.83 0.00 0.00 0.00 0.00 176.54 175.83 1x4i n VAL 37 N -3.74 0.36 -0.93 0.00 0.24 -1.07 -5.01 118.33 108.17 1x4i n VAL 37 Ca -0.04 -0.59 0.00 0.00 -2.04 0.00 0.00 64.34 61.66 1x4i n VAL 37 Cb 0.77 -0.12 0.00 0.00 -1.47 0.00 0.00 33.84 33.02 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 1.38 -0.00 2.53 7.63 0.00 0.58 -5.08 105.19 112.24 1x4i n GLY 38 Ca -0.11 -0.37 -0.27 0.00 0.00 0.00 0.00 46.02 45.27 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 -0.96 2.24 0.41 0.99 1.43 0.17 -4.97 118.68 117.98 1x4i s LEU 39 Ca 0.00 -3.20 0.26 0.00 -1.03 0.00 0.00 54.13 50.16 1x4i s LEU 39 Cb 0.00 -0.74 1.38 0.00 0.03 0.00 0.00 46.19 46.86 1x4i s LEU 39 CO 0.00 -0.16 1.60 0.71 0.23 0.00 0.00 176.35 178.74 1x4i h THR 40 N 4.61 0.08 -4.52 5.49 1.35 -1.98 -3.42 112.91 114.51 1x4i h THR 40 Ca 0.22 -0.02 -0.39 0.00 -0.55 0.00 0.00 66.41 65.66 1x4i h THR 40 Cb 0.88 0.00 -0.10 0.00 -1.73 0.00 0.00 68.15 67.20 1x4i h THR 40 CO 0.45 0.01 -0.32 -1.84 -0.25 0.00 0.00 175.52 173.57 1x4i n GLU 41 N -4.91 0.56 -2.18 4.72 0.28 -1.26 -5.14 120.64 112.72 1x4i n GLU 41 Ca 0.38 -3.16 -0.41 0.00 -0.16 0.00 0.00 57.16 53.81 1x4i n GLU 41 Cb 1.37 2.79 -0.03 0.00 1.43 0.00 0.00 31.44 37.00 1x4i n GLU 41 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1x4i s ALA 42 N -3.12 3.52 -0.17 -1.84 0.00 -1.26 -4.95 121.76 113.95 1x4i s ALA 42 Ca 0.36 1.17 -0.29 0.00 0.00 0.00 0.00 51.96 53.20 1x4i s ALA 42 Cb 0.01 -3.48 -0.03 0.00 0.00 0.00 0.00 23.12 19.61 1x4i s ALA 42 CO 0.25 -0.57 1.58 -1.25 0.00 0.00 0.00 175.76 175.77 1x4i s PRO 43 N -0.76 3.96 0.05 0.00 0.04 -1.26 -4.92 135.00 132.12 1x4i s PRO 43 Ca 0.54 1.80 -0.26 0.00 0.04 0.00 0.00 61.00 63.12 1x4i s PRO 43 Cb -0.38 -3.98 -0.17 0.00 0.04 0.00 0.00 34.50 30.01 1x4i s PRO 43 CO 0.44 -1.09 1.55 0.87 0.04 0.00 0.00 177.00 178.81 1x4i h LYS 44 N 10.05 -0.26 0.00 4.56 1.57 -2.06 -3.44 116.57 126.99 1x4i h LYS 44 Ca -0.34 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.46 1x4i h LYS 44 Cb 1.15 0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.52 1x4i h LYS 44 CO 0.98 -0.07 0.00 0.41 -0.57 0.00 0.00 179.45 180.21 1x4i n GLY 45 N -0.84 0.88 3.60 3.86 0.00 -1.26 -5.04 105.19 106.39 1x4i n GLY 45 Ca -0.09 -0.33 -0.34 0.00 0.00 0.00 0.00 46.02 45.26 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 0.51 3.68 0.03 1.61 -0.14 -1.26 -5.11 119.74 119.06 1x4i s LYS 46 Ca 0.00 -0.41 0.07 0.00 -1.36 0.00 0.00 55.97 54.26 1x4i s LYS 46 Cb 0.00 -3.03 -0.03 0.00 -1.68 0.00 0.00 37.83 33.09 1x4i s LYS 46 CO 0.00 0.35 -0.17 -0.46 -0.76 0.00 0.00 175.35 174.31 1x4i s TRP 47 N 0.11 2.58 -0.04 3.18 -0.00 -1.26 -5.11 118.94 118.39 1x4i s TRP 47 Ca 0.02 -0.24 -0.01 0.00 -0.00 0.00 0.00 56.10 55.87 1x4i s TRP 47 Cb -0.13 -1.48 0.03 0.00 -0.00 0.00 0.00 33.47 31.89 1x4i s TRP 47 CO 0.02 0.25 0.03 0.71 -0.00 0.00 0.00 176.95 177.95 1x4i s TYR 48 N -0.91 0.26 0.79 5.86 2.02 -1.26 -3.49 117.35 120.63 1x4i s TYR 48 Ca 0.14 0.07 -0.16 0.00 -0.37 0.00 0.00 57.07 56.76 1x4i s TYR 48 Cb -0.11 -0.50 -0.07 0.00 -0.40 0.00 0.00 41.96 40.89 1x4i s TYR 48 CO 0.05 -0.19 0.09 0.00 -1.57 0.00 0.00 175.55 173.93 1x4i n PRO 50 N 0.23 0.03 0.05 0.00 -0.04 -1.26 -2.45 135.00 131.56 1x4i n PRO 50 Ca 0.06 0.28 -0.08 0.00 -0.04 0.00 0.00 63.50 63.73 1x4i n PRO 50 Cb 0.51 -1.56 -0.12 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 0.02 0.00 0.54 4.20 -2.00 -3.25 115.11 114.62 1x4i h GLN 51 Ca 0.00 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.65 1x4i h GLN 51 Cb 0.26 0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.05 1x4i h GLN 51 CO 0.00 0.94 -0.46 0.00 -0.67 0.00 0.00 178.83 178.64 1x4i h THR 53 N -1.00 0.22 -0.08 0.00 2.02 -1.67 1.03 112.91 113.42 1x4i h THR 53 Ca -0.03 -0.02 -0.23 0.00 0.77 0.00 0.00 66.41 66.90 1x4i h THR 53 Cb 0.48 0.15 0.01 0.00 -1.74 0.00 0.00 68.15 67.06 1x4i h THR 53 CO -0.02 0.01 -0.88 0.00 0.37 0.00 0.00 175.52 175.01 1x4i h ALA 54 N 1.35 0.29 -0.05 6.16 0.00 -1.71 -2.71 119.26 122.57 1x4i h ALA 54 Ca 0.75 -0.64 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 1x4i h ALA 54 Cb 2.77 0.00 0.00 0.00 0.00 0.00 0.00 17.79 20.56 1x4i h ALA 54 CO -0.14 0.71 -0.31 0.00 0.00 0.00 0.00 179.25 179.51 1x4i h ALA 55 N 0.56 0.10 -0.79 0.00 0.00 0.87 -2.98 119.26 117.02 1x4i h ALA 55 Ca -0.08 -0.45 0.06 0.00 0.00 0.00 0.00 54.91 54.44 1x4i h ALA 55 Cb 1.51 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 19.25 1x4i h ALA 55 CO 0.17 0.16 0.52 0.52 0.00 0.00 0.00 179.25 180.62 1x4i h MET 56 N -0.24 0.87 -0.25 0.00 2.86 -0.66 -2.28 114.93 115.24 1x4i h MET 56 Ca -0.02 -0.05 -0.02 0.00 -2.06 0.00 0.00 59.70 57.54 1x4i h MET 56 Cb 0.98 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 32.43 1x4i h MET 56 CO 0.06 0.57 0.07 0.87 1.06 0.00 0.00 176.91 179.55 1x4i h LYS 57 N 0.89 0.39 0.00 1.72 1.57 -1.51 -2.22 116.57 117.42 1x4i h LYS 57 Ca 0.34 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 59.03 1x4i h LYS 57 Cb 0.18 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.44 1x4i h LYS 57 CO -0.11 0.48 0.25 0.00 -0.57 0.00 0.00 179.45 179.50 1x4i h ARG 58 N 0.23 0.00 -0.82 3.15 3.08 -1.25 0.38 114.38 119.16 1x4i h ARG 58 Ca 0.08 0.00 -0.23 0.00 0.07 0.00 0.00 59.98 59.90 1x4i h ARG 58 Cb 0.26 0.00 -0.14 0.00 0.08 0.00 0.00 29.97 30.17 1x4i h ARG 58 CO -0.00 0.00 0.29 0.54 -1.07 0.00 0.00 179.97 179.73 1x4i n ARG 59 N -2.70 3.25 -1.47 0.04 1.74 -0.84 -5.00 116.66 111.68 1x4i n ARG 59 Ca -0.02 -2.70 -0.43 0.00 -0.77 0.00 0.00 57.85 53.94 1x4i n ARG 59 Cb 0.30 -2.10 0.00 0.00 -1.02 0.00 0.00 32.46 29.63 1x4i n ARG 59 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1x4i n GLY 60 N -0.21 -1.30 1.78 -0.13 0.00 0.13 -4.79 105.19 100.68 1x4i n GLY 60 Ca 0.39 0.11 -0.08 0.00 0.00 0.00 0.00 46.02 46.44 1x4i n GLY 60 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1x4i n SER 61 N 1.30 5.58 -0.11 1.61 3.41 -1.26 -4.11 113.62 120.04 1x4i n SER 61 Ca 0.12 -2.60 -0.22 0.00 -0.26 0.00 0.00 58.87 55.91 1x4i n SER 61 Cb 0.37 -1.21 -0.09 0.00 -0.26 0.00 0.00 64.21 63.02 1x4i n SER 61 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1x4i n ARG 62 N 1.56 0.56 -2.46 4.33 1.74 -1.26 -4.91 116.66 116.21 1x4i n ARG 62 Ca 0.21 0.40 -0.42 0.00 -0.77 0.00 0.00 57.85 57.27 1x4i n ARG 62 Cb 0.64 -1.60 -0.03 0.00 -1.02 0.00 0.00 32.46 30.45 1x4i n ARG 62 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1x4i s HIS 63 N -2.47 3.42 -0.09 -1.55 2.46 -1.26 -4.95 115.29 110.85 1x4i s HIS 63 Ca -0.32 1.33 -0.29 0.00 0.47 0.00 0.00 55.06 56.25 1x4i s HIS 63 Cb 0.09 -3.38 -0.07 0.00 -0.13 0.00 0.00 32.58 29.09 1x4i s HIS 63 CO 0.49 -1.13 2.08 0.15 -2.47 0.00 0.00 174.74 173.86 1x4i s LYS 64 N 1.27 3.65 -0.07 2.88 1.02 -1.26 -4.83 119.74 122.40 1x4i s LYS 64 Ca 0.57 2.32 -0.08 0.00 0.02 0.00 0.00 55.97 58.81 1x4i s LYS 64 Cb -0.28 -4.26 -0.04 0.00 -0.52 0.00 0.00 37.83 32.73 1x4i s LYS 64 CO 0.28 -1.51 -0.17 0.45 -0.92 0.00 0.00 175.35 173.48 1x4i n SER 65 N 9.54 1.26 0.00 2.83 2.88 -1.26 -5.14 113.62 123.72 1x4i n SER 65 Ca 0.25 0.20 0.00 0.00 -1.33 0.00 0.00 58.87 57.99 1x4i n SER 65 Cb 0.43 -0.47 0.00 0.00 -0.75 0.00 0.00 64.21 63.42 1x4i n SER 65 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x4i n GLY 66 N 2.39 2.19 0.00 0.46 0.00 -1.26 -4.98 105.19 103.99 1x4i n GLY 66 Ca -0.15 -0.16 0.08 0.00 0.00 0.00 0.00 46.02 45.79 1x4i n GLY 66 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x4i n PRO 67 N 0.00 0.41 -1.66 1.61 -0.04 -1.26 -4.82 135.00 129.23 1x4i n PRO 67 Ca 0.00 0.04 -0.47 0.00 -0.04 0.00 0.00 63.50 63.03 1x4i n PRO 67 Cb 0.00 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 31.92 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 -1.08 2.93 -4.91 3.54 2.88 -1.26 -4.98 113.62 110.74 1x4i n SER 68 Ca 0.10 1.08 -0.21 0.00 -1.33 0.00 0.00 58.87 58.51 1x4i n SER 68 Cb 0.07 -1.39 -0.01 0.00 -0.75 0.00 0.00 64.21 62.13 1x4i n SER 68 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1x4i s SER 69 N 1.19 5.02 0.00 -3.46 0.15 -1.26 -5.00 113.70 110.34 1x4i s SER 69 Ca 0.81 -0.83 0.00 0.00 0.70 0.00 0.00 55.95 56.63 1x4i s SER 69 Cb -0.72 -0.27 0.00 0.00 -1.71 0.00 0.00 66.02 63.32 1x4i s SER 69 CO 0.41 -0.84 0.00 0.61 1.20 0.00 0.00 173.24 174.62