#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2row s SER 2 N 0.00 7.21 -0.03 -1.84 1.04 -1.26 -5.07 113.70 113.76 2row s SER 2 Ca 0.00 1.84 0.00 0.00 0.48 0.00 0.00 55.95 58.27 2row s SER 2 Cb 0.00 -2.57 0.03 0.00 0.10 0.00 0.00 66.02 63.57 2row s SER 2 CO 0.00 -0.16 0.02 -0.75 0.98 0.00 0.00 173.24 173.33 2row s LYS 3 N -2.26 0.14 -0.22 4.02 2.20 -1.26 -5.14 119.74 117.22 2row s LYS 3 Ca 0.53 0.14 -0.28 0.00 -0.36 0.00 0.00 55.97 55.99 2row s LYS 3 Cb -0.18 -0.38 0.15 0.00 -1.51 0.00 0.00 37.83 35.91 2row s LYS 3 CO 0.23 -0.16 1.12 0.21 -0.36 0.00 0.00 175.35 176.39 2row s LYS 4 N 1.10 0.41 0.07 4.03 2.20 -1.26 -5.14 119.74 121.14 2row s LYS 4 Ca -0.09 0.19 -0.31 0.00 -0.36 0.00 0.00 55.97 55.41 2row s LYS 4 Cb -0.13 0.20 -0.07 0.00 -1.51 0.00 0.00 37.83 36.31 2row s LYS 4 CO -0.02 -0.11 1.50 -1.83 -0.36 0.00 0.00 175.35 174.53 2row s GLU 5 N -0.73 4.26 0.24 4.03 -1.05 -1.26 -4.99 118.70 119.21 2row s GLU 5 Ca 0.02 2.15 -0.30 0.00 -0.15 0.00 0.00 54.97 56.70 2row s GLU 5 Cb -0.02 -3.46 -0.09 0.00 -0.44 0.00 0.00 34.13 30.12 2row s GLU 5 CO -0.04 -0.60 0.99 -1.25 0.95 0.00 0.00 175.26 175.32 2row s PRO 6 N 2.06 4.78 0.32 -4.83 0.04 -1.26 -4.78 135.00 131.32 2row s PRO 6 Ca 0.68 1.59 0.00 0.00 0.04 0.00 0.00 61.00 63.31 2row s PRO 6 Cb -0.37 -3.26 0.00 0.00 0.04 0.00 0.00 34.50 30.92 2row s PRO 6 CO 0.30 0.40 0.00 0.39 0.04 0.00 0.00 177.00 178.13 2row n GLU 7 N 1.49 -3.74 -3.19 4.56 4.71 -1.26 -4.81 120.64 118.39 2row n GLU 7 Ca -0.01 2.73 -0.46 0.00 -0.01 0.00 0.00 57.16 59.41 2row n GLU 7 Cb 0.46 -3.03 -0.02 0.00 -1.01 0.00 0.00 31.44 27.85 2row n GLU 7 CO 0.00 0.00 0.00 -0.06 0.09 0.00 0.00 177.13 177.16 2row s PHE 8 N -2.19 3.62 0.00 -0.32 0.08 -1.26 -5.05 117.98 112.86 2row s PHE 8 Ca 0.00 -1.90 0.00 0.00 0.12 0.00 0.00 56.93 55.15 2row s PHE 8 Cb 0.00 -3.98 0.00 0.00 -0.57 0.00 0.00 43.02 38.47 2row s PHE 8 CO 0.00 -1.15 0.00 -0.35 -0.10 0.00 0.00 175.22 173.62 2row n PRO 9 N 4.67 -0.93 -3.77 0.24 -0.04 -1.26 -4.99 135.00 128.92 2row n PRO 9 Ca 0.19 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.37 2row n PRO 9 Cb 0.47 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.81 2row n PRO 9 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 2row n VAL 10 N -2.28 1.27 -2.10 0.52 3.14 -1.26 -5.02 118.33 112.60 2row n VAL 10 Ca 0.00 -4.69 -0.43 0.00 -2.96 0.00 0.00 64.34 56.27 2row n VAL 10 Cb 0.00 -2.10 -0.03 0.00 -1.06 0.00 0.00 33.84 30.65 2row n VAL 10 CO 0.00 0.00 0.00 -1.83 -6.46 0.00 0.00 176.83 168.54 2row s GLU 11 N -1.35 3.72 0.00 1.45 1.03 -1.26 -4.86 118.70 117.43 2row s GLU 11 Ca 0.28 1.61 0.00 0.00 0.03 0.00 0.00 54.97 56.89 2row s GLU 11 Cb -0.01 -4.06 0.00 0.00 -0.80 0.00 0.00 34.13 29.26 2row s GLU 11 CO -0.16 -1.38 0.00 -0.35 -1.33 0.00 0.00 175.26 172.04 2row n PRO 12 N 7.79 -0.93 -2.69 -4.83 -0.04 -1.26 -4.93 135.00 128.10 2row n PRO 12 Ca 0.19 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.22 2row n PRO 12 Cb 0.45 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.89 2row n PRO 12 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2row s VAL 13 N -0.88 4.30 -0.10 0.52 -7.23 -1.26 -4.87 120.40 110.88 2row s VAL 13 Ca 0.00 0.98 0.14 0.00 -1.81 0.00 0.00 61.98 61.30 2row s VAL 13 Cb 0.00 -4.54 -0.24 0.00 0.56 0.00 0.00 36.38 32.16 2row s VAL 13 CO 0.00 -0.97 0.47 0.61 -0.31 0.00 0.00 175.10 174.90 2row n GLY 14 N 4.91 -1.00 0.29 2.32 0.00 -1.26 -3.98 105.19 106.47 2row n GLY 14 Ca 0.09 -0.14 0.04 0.00 0.00 0.00 0.00 46.02 46.01 2row n GLY 14 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2row h GLU 15 N 0.00 0.42 -0.87 1.61 4.11 -2.03 -3.41 114.58 114.41 2row h GLU 15 Ca -0.37 -0.04 0.15 0.00 0.07 0.00 0.00 59.36 59.17 2row h GLU 15 Cb 2.08 -0.09 -0.21 0.00 0.50 0.00 0.00 28.75 31.03 2row h GLU 15 CO 0.06 0.31 -0.07 0.15 0.07 0.00 0.00 179.01 179.54 2row s LYS 16 N -5.31 0.41 -0.04 1.06 1.02 -1.26 -5.16 119.74 110.47 2row s LYS 16 Ca -0.07 0.80 0.01 0.00 0.02 0.00 0.00 55.97 56.72 2row s LYS 16 Cb 0.17 0.45 0.02 0.00 -0.52 0.00 0.00 37.83 37.95 2row s LYS 16 CO 0.72 -0.39 -0.03 -1.54 -0.92 0.00 0.00 175.35 173.20 2row s SER 17 N 2.85 0.69 0.80 2.83 1.04 -1.26 -4.83 113.70 115.82 2row s SER 17 Ca 0.09 -0.08 -0.09 0.00 0.48 0.00 0.00 55.95 56.34 2row s SER 17 Cb -0.12 -0.34 0.12 0.00 0.10 0.00 0.00 66.02 65.78 2row s SER 17 CO -0.17 -0.07 1.13 0.20 0.98 0.00 0.00 173.24 175.31 2row s ASN 18 N 0.91 4.11 -0.11 7.02 0.01 -1.26 -5.06 114.94 120.57 2row s ASN 18 Ca -0.11 0.24 -0.02 0.00 -0.71 0.00 0.00 52.86 52.26 2row s ASN 18 Cb -0.14 -0.61 0.04 0.00 0.41 0.00 0.00 41.25 40.95 2row s ASN 18 CO -0.01 -2.06 0.01 -0.31 -1.51 0.00 0.00 177.10 173.22 2row s TYR 19 N -3.47 0.74 -0.41 2.20 1.51 -1.26 -4.21 117.35 112.45 2row s TYR 19 Ca 0.66 -0.35 -0.29 0.00 -1.01 0.00 0.00 57.07 56.09 2row s TYR 19 Cb -0.07 -0.86 0.01 0.00 -0.11 0.00 0.00 41.96 40.93 2row s TYR 19 CO 0.48 -0.41 1.36 0.42 -1.11 0.00 0.00 175.55 176.29 2row s ILE 20 N 1.95 3.97 0.20 2.71 1.09 0.32 -4.82 121.20 126.62 2row s ILE 20 Ca 0.03 1.00 -0.30 0.00 -1.10 0.00 0.00 60.65 60.28 2row s ILE 20 Cb -0.14 -4.27 -0.08 0.00 -1.06 0.00 0.00 42.46 36.92 2row s ILE 20 CO -0.06 -0.78 1.02 0.00 -0.10 0.00 0.00 174.94 175.02 2row s HIS 22 N -0.67 -1.12 -0.24 0.00 5.04 0.42 -4.96 115.29 113.77 2row s HIS 22 Ca 0.45 0.93 -0.19 0.00 -1.54 0.00 0.00 55.06 54.71 2row s HIS 22 Cb -0.27 0.29 0.03 0.00 0.04 0.00 0.00 32.58 32.67 2row s HIS 22 CO 0.34 -0.63 0.33 0.36 -2.34 0.00 0.00 174.74 172.80 2row n LYS 23 N 5.37 -0.96 -0.90 2.88 2.85 -1.26 0.10 118.16 126.24 2row n LYS 23 Ca 0.01 0.70 0.00 0.00 -1.05 0.00 0.00 58.31 57.97 2row n LYS 23 Cb 0.54 -1.01 0.00 0.00 -0.65 0.00 0.00 35.03 33.91 2row n LYS 23 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2row n GLY 24 N -0.14 0.26 3.21 2.58 0.00 -1.26 -3.66 105.19 106.19 2row n GLY 24 Ca -0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.66 2row n GLY 24 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2row s HIS 25 N -1.66 2.35 -0.62 1.61 4.02 0.28 -3.35 115.29 117.93 2row s HIS 25 Ca 0.00 -0.84 0.06 0.00 1.02 0.00 0.00 55.06 55.30 2row s HIS 25 Cb 0.00 -1.57 0.25 0.00 -1.02 0.00 0.00 32.58 30.24 2row s HIS 25 CO 0.00 -0.31 0.74 0.39 1.02 0.00 0.00 174.74 176.58 2row n GLU 26 N 3.30 2.42 -0.70 1.40 4.71 -1.24 0.16 120.64 130.68 2row n GLU 26 Ca -0.19 -4.57 -0.32 0.00 -0.01 0.00 0.00 57.16 52.08 2row n GLU 26 Cb 0.53 -2.17 0.16 0.00 -1.01 0.00 0.00 31.44 28.94 2row n GLU 26 CO 0.00 0.00 0.00 1.19 0.09 0.00 0.00 177.13 178.41 2row n PHE 27 N 0.84 -0.02 -4.51 -0.32 3.72 0.35 -3.71 117.46 113.81 2row n PHE 27 Ca 0.29 0.32 -0.23 0.00 -0.05 0.00 0.00 57.45 57.79 2row n PHE 27 Cb 0.42 -1.91 -0.16 0.00 -0.94 0.00 0.00 39.48 36.89 2row n PHE 27 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2row s ILE 28 N -2.54 0.99 -0.25 4.37 -1.09 0.48 0.12 121.20 123.27 2row s ILE 28 Ca 0.63 -0.44 -0.29 0.00 -2.23 0.00 0.00 60.65 58.33 2row s ILE 28 Cb -0.22 -0.89 -0.03 0.00 -1.58 0.00 0.00 42.46 39.74 2row s ILE 28 CO 0.62 0.31 1.77 -2.16 -1.23 0.00 0.00 174.94 174.24 2row s PRO 29 N 0.41 3.58 0.19 2.79 0.04 -1.26 -0.19 135.00 140.56 2row s PRO 29 Ca -0.08 1.67 -0.15 0.00 0.04 0.00 0.00 61.00 62.47 2row s PRO 29 Cb -0.12 -4.14 0.02 0.00 0.04 0.00 0.00 34.50 30.30 2row s PRO 29 CO 0.02 -1.57 0.47 -0.08 0.04 0.00 0.00 177.00 175.88 2row s THR 30 N 6.10 0.03 0.23 1.26 -1.32 0.85 -4.77 115.64 118.03 2row s THR 30 Ca 0.79 -0.98 0.08 0.00 -1.21 0.00 0.00 61.69 60.38 2row s THR 30 Cb -0.26 -1.70 -0.04 0.00 -1.51 0.00 0.00 72.50 68.99 2row s THR 30 CO 0.32 -0.15 0.03 -0.76 -2.21 0.00 0.00 174.62 171.85 2row s LEU 31 N -2.91 3.32 -0.09 9.08 1.43 -1.26 -0.68 118.68 127.58 2row s LEU 31 Ca 0.12 -0.50 -0.01 0.00 -1.03 0.00 0.00 54.13 52.71 2row s LEU 31 Cb -0.00 -1.89 0.03 0.00 0.03 0.00 0.00 46.19 44.35 2row s LEU 31 CO -0.01 0.02 -0.04 -0.31 0.23 0.00 0.00 176.35 176.24 2row s TYR 32 N -2.10 1.08 -0.39 0.29 2.02 -1.26 -4.91 117.35 112.09 2row s TYR 32 Ca 0.30 -0.45 0.23 0.00 -0.37 0.00 0.00 57.07 56.78 2row s TYR 32 Cb -0.08 -1.00 0.07 0.00 -0.40 0.00 0.00 41.96 40.56 2row s TYR 32 CO 0.20 -0.40 1.07 1.58 -1.57 0.00 0.00 175.55 176.44 2row n HIS 33 N 4.90 0.70 -3.44 2.71 -0.00 -1.26 -2.98 115.22 115.85 2row n HIS 33 Ca -0.12 0.20 -0.20 0.00 0.46 0.00 0.00 57.72 58.06 2row n HIS 33 Cb 0.50 -0.77 -0.01 0.00 -0.12 0.00 0.00 29.99 29.59 2row n HIS 33 CO 0.00 0.00 0.00 -0.06 0.46 0.00 0.00 176.34 176.74 2row s PHE 34 N -3.30 2.52 -0.49 1.57 0.40 -1.26 -4.47 117.98 112.95 2row s PHE 34 Ca 0.01 -0.53 -0.27 0.00 -0.60 0.00 0.00 56.93 55.55 2row s PHE 34 Cb 0.12 -2.19 -0.04 0.00 0.51 0.00 0.00 43.02 41.41 2row s PHE 34 CO 0.78 -0.30 2.12 -2.14 0.70 0.00 0.00 175.22 176.38 2row s PRO 35 N -4.23 2.53 -0.18 0.24 0.02 -1.26 -4.58 135.00 127.54 2row s PRO 35 Ca 0.49 1.19 -0.02 0.00 0.02 0.00 0.00 61.00 62.68 2row s PRO 35 Cb -0.05 -4.45 -0.01 0.00 0.02 0.00 0.00 34.50 30.02 2row s PRO 35 CO 0.29 -2.80 -0.10 0.99 -0.33 0.00 0.00 177.00 175.05 2row s THR 36 N 10.08 3.07 -0.32 0.99 2.01 -0.46 -5.01 115.64 126.00 2row s THR 36 Ca 0.85 -0.62 -0.21 0.00 0.31 0.00 0.00 61.69 62.02 2row s THR 36 Cb -0.18 -2.34 -0.01 0.00 0.01 0.00 0.00 72.50 69.99 2row s THR 36 CO 0.26 0.48 0.65 0.20 -0.69 0.00 0.00 174.62 175.52 2row s ASN 37 N 1.01 6.50 0.80 3.53 0.02 -1.26 0.21 114.94 125.75 2row s ASN 37 Ca -0.01 0.39 -0.13 0.00 -1.02 0.00 0.00 52.86 52.09 2row s ASN 37 Cb -0.15 -2.34 0.08 0.00 0.02 0.00 0.00 41.25 38.86 2row s ASN 37 CO -0.01 -0.52 1.18 0.00 0.02 0.00 0.00 177.10 177.77 2row h GLU 39 N -0.90 0.19 0.00 0.00 4.22 -1.45 -3.43 114.58 113.22 2row h GLU 39 Ca -0.46 -0.33 0.00 0.00 0.08 0.00 0.00 59.36 58.65 2row h GLU 39 Cb 1.28 0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.66 2row h GLU 39 CO 0.47 1.00 0.00 0.00 -2.18 0.00 0.00 179.01 178.30 2row n ALA 40 N -2.81 0.00 -1.08 2.92 0.00 -1.26 -4.90 120.51 113.38 2row n ALA 40 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.19 2row n ALA 40 Cb 1.05 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.50 2row n ALA 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2row n MET 42 N -0.38 0.93 -1.08 0.00 2.81 -1.26 -4.74 117.12 113.42 2row n MET 42 Ca 0.00 -0.09 -0.36 0.00 -1.81 0.00 0.00 57.70 55.45 2row n MET 42 Cb 0.00 -1.41 0.07 0.00 -0.71 0.00 0.00 33.22 31.17 2row n MET 42 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 2row n LYS 43 N -2.33 0.04 -2.05 0.03 5.02 -1.26 -4.83 118.16 112.79 2row n LYS 43 Ca -0.14 0.04 -0.33 0.00 -2.02 0.00 0.00 58.31 55.87 2row n LYS 43 Cb 0.72 -1.55 0.01 0.00 -0.02 0.00 0.00 35.03 34.19 2row n LYS 43 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2row s PRO 44 N -2.61 3.35 -0.34 1.97 0.04 -1.26 -4.13 135.00 132.02 2row s PRO 44 Ca 0.56 1.17 0.01 0.00 0.04 0.00 0.00 61.00 62.78 2row s PRO 44 Cb -0.29 -2.04 0.11 0.00 0.04 0.00 0.00 34.50 32.32 2row s PRO 44 CO 0.67 -0.79 0.11 -1.17 0.04 0.00 0.00 177.00 175.87 2row s LEU 45 N -4.53 2.91 0.00 -3.56 0.20 0.13 -4.84 118.68 109.00 2row s LEU 45 Ca 0.63 -1.93 0.00 0.00 0.69 0.00 0.00 54.13 53.52 2row s LEU 45 Cb -0.15 -1.08 0.00 0.00 -0.43 0.00 0.00 46.19 44.53 2row s LEU 45 CO 0.38 -0.38 0.00 -2.67 -0.29 0.00 0.00 176.35 173.38 2row n TRP 46 N 4.49 0.00 0.00 5.38 4.27 -1.26 -1.35 117.44 128.97 2row n TRP 46 Ca 0.01 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.62 2row n TRP 46 Cb 0.41 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 30.36 2row n TRP 46 CO 0.00 0.00 0.00 1.58 -2.29 0.00 0.00 177.69 176.98 2row n HIS 47 N 0.09 0.00 -0.07 -2.67 -0.00 -1.16 -4.68 115.22 106.73 2row n HIS 47 Ca 0.00 0.00 -0.17 0.00 0.46 0.00 0.00 57.72 58.01 2row n HIS 47 Cb 0.00 0.00 -0.13 0.00 -0.12 0.00 0.00 29.99 29.74 2row n HIS 47 CO 0.00 0.00 0.00 0.52 0.46 0.00 0.00 176.34 177.32 2row h MET 48 N 0.00 0.02 0.00 1.57 2.86 -1.87 -3.35 114.93 114.16 2row h MET 48 Ca 0.00 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 2row h MET 48 Cb 0.00 0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.67 2row h MET 48 CO 0.00 1.02 0.00 1.19 1.06 0.00 0.00 176.91 180.18 2row n PHE 49 N -4.51 0.00 -3.91 -0.22 3.72 -1.26 -4.69 117.46 106.59 2row n PHE 49 Ca -0.18 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 56.90 2row n PHE 49 Cb 0.57 -0.21 -0.13 0.00 -0.94 0.00 0.00 39.48 38.77 2row n PHE 49 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 2row s LYS 50 N -1.17 1.91 0.07 -1.08 -0.14 -1.26 -5.09 119.74 112.98 2row s LYS 50 Ca 0.00 -2.24 -0.31 0.00 -1.36 0.00 0.00 55.97 52.07 2row s LYS 50 Cb 0.00 -3.39 -0.08 0.00 -1.68 0.00 0.00 37.83 32.68 2row s LYS 50 CO 0.00 -1.06 1.62 -1.25 -0.76 0.00 0.00 175.35 173.90 2row s PRO 51 N 0.37 4.21 0.68 -1.68 0.04 -1.26 -4.81 135.00 132.54 2row s PRO 51 Ca 0.14 2.29 -0.13 0.00 0.04 0.00 0.00 61.00 63.33 2row s PRO 51 Cb -0.22 -3.57 0.01 0.00 0.04 0.00 0.00 34.50 30.76 2row s PRO 51 CO -0.04 -0.71 1.09 -1.25 0.04 0.00 0.00 177.00 176.13 2row s PRO 52 N 2.51 2.78 -0.81 0.56 0.04 -1.26 -4.88 135.00 133.95 2row s PRO 52 Ca 0.72 1.23 -0.25 0.00 0.04 0.00 0.00 61.00 62.75 2row s PRO 52 Cb -0.39 -1.96 -0.06 0.00 0.04 0.00 0.00 34.50 32.13 2row s PRO 52 CO 0.32 -1.24 2.04 -1.25 0.04 0.00 0.00 177.00 176.90 2row s PRO 53 N -4.43 2.37 0.12 0.56 0.04 -1.26 -4.53 135.00 127.87 2row s PRO 53 Ca 0.63 0.11 -0.09 0.00 0.04 0.00 0.00 61.00 61.69 2row s PRO 53 Cb -0.18 -4.86 -0.06 0.00 0.04 0.00 0.00 34.50 29.44 2row s PRO 53 CO 0.46 -3.44 0.43 0.00 0.04 0.00 0.00 177.00 174.49 2row s ALA 54 N 10.84 3.70 -0.26 8.56 0.00 0.14 0.13 121.76 144.88 2row s ALA 54 Ca 0.75 -0.38 -0.07 0.00 0.00 0.00 0.00 51.96 52.26 2row s ALA 54 Cb -0.09 -2.29 -0.02 0.00 0.00 0.00 0.00 23.12 20.72 2row s ALA 54 CO 0.06 0.57 0.08 -0.51 0.00 0.00 0.00 175.76 175.96 2row s LEU 55 N -2.19 3.55 -0.09 0.00 1.43 0.11 -0.10 118.68 121.38 2row s LEU 55 Ca 0.37 -0.32 -0.05 0.00 -1.03 0.00 0.00 54.13 53.10 2row s LEU 55 Cb -0.13 -1.92 -0.04 0.00 0.03 0.00 0.00 46.19 44.13 2row s LEU 55 CO 0.20 -0.07 0.12 -0.70 0.23 0.00 0.00 176.35 176.12 2row s GLU 56 N 1.59 3.34 0.08 1.70 2.12 0.73 0.61 118.70 128.87 2row s GLU 56 Ca 0.06 -0.22 -0.29 0.00 0.36 0.00 0.00 54.97 54.87 2row s GLU 56 Cb -0.16 -3.09 -0.05 0.00 0.26 0.00 0.00 34.13 31.09 2row s GLU 56 CO 0.03 0.75 0.94 0.00 -0.54 0.00 0.00 175.26 176.44 2row n ARG 58 N 3.02 2.08 0.00 0.00 1.85 -1.24 -3.30 116.66 119.07 2row n ARG 58 Ca 0.02 -2.09 0.00 0.00 -1.00 0.00 0.00 57.85 54.78 2row n ARG 58 Cb 0.50 -1.84 0.00 0.00 -1.05 0.00 0.00 32.46 30.06 2row n ARG 58 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 2row n ARG 59 N -0.51 0.00 0.00 2.89 3.00 -1.26 -4.89 116.66 115.88 2row n ARG 59 Ca 0.39 0.00 0.14 0.00 -0.01 0.00 0.00 57.85 58.37 2row n ARG 59 Cb 1.27 0.00 0.62 0.00 0.00 0.00 0.00 32.46 34.35 2row n ARG 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2row n HIS 61 N -1.38 -2.27 -4.12 0.00 8.25 -1.21 -5.05 115.22 109.44 2row n HIS 61 Ca 0.10 0.99 -0.14 0.00 -0.26 0.00 0.00 57.72 58.41 2row n HIS 61 Cb 0.30 -2.98 -0.05 0.00 1.12 0.00 0.00 29.99 28.39 2row n HIS 61 CO 0.00 0.00 0.00 0.44 0.64 0.00 0.00 176.34 177.42 2row n ILE 62 N 0.25 0.00 -3.79 1.59 -5.35 -1.25 -4.89 119.36 105.91 2row n ILE 62 Ca 0.01 -1.72 -0.13 0.00 -0.27 0.00 0.00 62.75 60.65 2row n ILE 62 Cb 0.06 0.92 -0.10 0.00 -1.74 0.00 0.00 39.64 38.77 2row n ILE 62 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 2row s LYS 63 N -2.90 0.44 -0.28 6.28 3.01 -1.26 -0.90 119.74 124.13 2row s LYS 63 Ca 0.28 0.10 -0.09 0.00 -1.01 0.00 0.00 55.97 55.26 2row s LYS 63 Cb 0.01 0.20 0.13 0.00 -1.01 0.00 0.00 37.83 37.16 2row s LYS 63 CO 0.20 -0.09 0.61 0.00 0.51 0.00 0.00 175.35 176.58 2row n HIS 65 N 5.44 0.01 -0.17 0.00 -0.00 -1.26 0.07 115.22 119.30 2row n HIS 65 Ca -0.11 0.99 0.26 0.00 -0.00 0.00 0.00 57.72 58.86 2row n HIS 65 Cb 0.49 -1.97 0.69 0.00 -0.00 0.00 0.00 29.99 29.20 2row n HIS 65 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.34 176.12 2row h LYS 66 N 1.84 0.05 -0.69 -0.41 3.64 0.82 -0.20 116.57 121.62 2row h LYS 66 Ca -0.37 -0.00 0.13 0.00 -1.27 0.00 0.00 60.65 59.14 2row h LYS 66 Cb 1.40 -0.01 -0.09 0.00 -0.41 0.00 0.00 32.23 33.12 2row h LYS 66 CO 0.59 0.04 0.21 -0.44 -2.27 0.00 0.00 179.45 177.57 2row h ASP 67 N 0.06 0.12 -0.60 4.20 5.19 -1.86 -1.15 116.42 122.37 2row h ASP 67 Ca 0.41 0.12 0.10 0.00 -0.62 0.00 0.00 57.03 57.04 2row h ASP 67 Cb 1.56 0.13 -0.08 0.00 0.18 0.00 0.00 39.33 41.13 2row h ASP 67 CO -0.03 0.04 0.20 0.45 -3.12 0.00 0.00 179.24 176.78 2row h HIS 68 N 0.34 0.35 0.27 4.55 3.86 -1.34 0.18 115.15 123.35 2row h HIS 68 Ca 0.37 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.60 2row h HIS 68 Cb 0.58 -0.06 0.00 0.00 1.06 0.00 0.00 27.41 28.99 2row h HIS 68 CO -0.22 0.07 -0.13 1.98 0.86 0.00 0.00 177.93 180.49 2row h MET 69 N 0.37 -0.35 -0.40 2.45 1.85 -1.38 0.57 114.93 118.04 2row h MET 69 Ca 0.31 0.02 0.11 0.00 -0.61 0.00 0.00 59.70 59.54 2row h MET 69 Cb 0.40 0.08 -0.02 0.00 0.43 0.00 0.00 31.60 32.49 2row h MET 69 CO -0.33 -0.07 0.29 0.22 -0.40 0.00 0.00 176.91 176.62 2row h ASP 70 N -0.61 0.01 0.86 1.39 1.82 -0.87 0.10 116.42 119.11 2row h ASP 70 Ca -0.04 0.00 -0.06 0.00 -0.39 0.00 0.00 57.03 56.55 2row h ASP 70 Cb 0.44 -0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.44 2row h ASP 70 CO 0.06 0.01 -1.18 0.29 -1.61 0.00 0.00 179.24 176.80 2row n LYS 71 N -4.42 0.61 -2.84 0.28 4.76 0.60 -5.02 118.16 112.13 2row n LYS 71 Ca 0.07 0.14 -0.02 0.00 -2.87 0.00 0.00 58.31 55.63 2row n LYS 71 Cb 0.47 -1.81 0.00 0.00 -1.84 0.00 0.00 35.03 31.85 2row n LYS 71 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2row n LYS 72 N -2.73 -1.41 -3.65 1.97 4.76 0.20 -4.99 118.16 112.29 2row n LYS 72 Ca -0.04 1.53 -0.36 0.00 -2.87 0.00 0.00 58.31 56.57 2row n LYS 72 Cb 0.65 -5.27 -0.09 0.00 -1.84 0.00 0.00 35.03 28.48 2row n LYS 72 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2row s GLU 73 N -2.86 4.12 0.62 1.97 2.02 -1.07 -4.96 118.70 118.54 2row s GLU 73 Ca 0.06 -0.21 0.31 0.00 0.02 0.00 0.00 54.97 55.15 2row s GLU 73 Cb -0.02 -3.50 1.75 0.00 0.10 0.00 0.00 34.13 32.46 2row s GLU 73 CO 0.67 0.12 2.08 1.05 0.02 0.00 0.00 175.26 179.21 2row h GLU 74 N 7.25 0.00 -0.77 1.61 4.11 -1.94 -1.59 114.58 123.26 2row h GLU 74 Ca -0.39 0.00 0.22 0.00 0.07 0.00 0.00 59.36 59.27 2row h GLU 74 Cb 1.16 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.38 2row h GLU 74 CO 0.69 0.00 0.68 -0.84 0.07 0.00 0.00 179.01 179.61 2row h ILE 75 N 0.00 0.37 -3.25 -1.06 3.07 -1.95 -3.39 117.51 111.30 2row h ILE 75 Ca 0.07 0.00 -0.54 0.00 1.55 0.00 0.00 64.86 65.93 2row h ILE 75 Cb 0.52 0.49 -0.01 0.00 -0.27 0.00 0.00 36.82 37.55 2row h ILE 75 CO -0.00 0.00 0.53 -0.63 -1.05 0.00 0.00 178.15 177.00 2row s ILE 76 N -4.74 4.43 0.33 0.16 1.01 -0.60 -4.74 121.20 117.05 2row s ILE 76 Ca -0.04 1.74 0.08 0.00 0.00 0.00 0.00 60.65 62.43 2row s ILE 76 Cb 0.18 -4.12 -0.04 0.00 0.01 0.00 0.00 42.46 38.49 2row s ILE 76 CO 0.64 0.09 0.13 0.00 0.00 0.00 0.00 174.94 175.80 2row s ALA 77 N 1.40 3.47 1.06 9.38 0.00 -1.26 -5.05 121.76 130.76 2row s ALA 77 Ca 0.55 -1.79 -0.12 0.00 0.00 0.00 0.00 51.96 50.60 2row s ALA 77 Cb -0.24 -0.77 0.22 0.00 0.00 0.00 0.00 23.12 22.33 2row s ALA 77 CO 0.26 0.07 1.07 -1.25 0.00 0.00 0.00 175.76 175.90 2row s PRO 78 N -3.83 -0.06 0.46 0.00 0.04 -1.25 -4.90 135.00 125.46 2row s PRO 78 Ca 0.37 0.75 -0.23 0.00 0.04 0.00 0.00 61.00 61.93 2row s PRO 78 Cb -0.03 -1.66 -0.08 0.00 0.04 0.00 0.00 34.50 32.77 2row s PRO 78 CO 0.22 -3.12 1.15 0.00 0.04 0.00 0.00 177.00 175.29 2row n LYS 80 N -0.48 0.64 0.27 0.00 2.85 -1.26 -4.23 118.16 115.94 2row n LYS 80 Ca 0.07 0.40 0.12 0.00 -1.05 0.00 0.00 58.31 57.85 2row n LYS 80 Cb 0.48 -1.69 0.74 0.00 -0.65 0.00 0.00 35.03 33.91 2row n LYS 80 CO 0.00 0.00 0.00 -0.39 -0.05 0.00 0.00 177.40 176.96 2row h VAL 81 N -0.57 0.70 -0.62 0.58 -1.51 -1.94 -2.41 116.25 110.49 2row h VAL 81 Ca -0.43 -0.35 0.18 0.00 -1.23 0.00 0.00 66.70 64.87 2row h VAL 81 Cb 1.63 1.21 -0.02 0.00 -2.13 0.00 0.00 31.29 31.98 2row h VAL 81 CO -0.13 0.09 0.53 0.22 -1.23 0.00 0.00 177.57 177.05 2row h TYR 82 N 0.00 0.00 0.24 5.19 3.20 -1.90 -2.20 116.97 121.49 2row h TYR 82 Ca -0.00 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 2row h TYR 82 Cb 0.20 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.48 2row h TYR 82 CO 0.00 0.00 -0.11 1.88 -1.64 0.00 0.00 178.16 178.29 2row h TYR 83 N 0.00 -0.30 0.00 -3.82 0.05 -1.67 -3.53 116.97 107.70 2row h TYR 83 Ca 0.29 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 59.07 2row h TYR 83 Cb 1.35 0.10 0.00 0.00 1.01 0.00 0.00 36.73 39.19 2row h TYR 83 CO 0.00 -0.10 0.00 -3.47 -1.05 0.00 0.00 178.16 173.54