#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 3.88 -0.65 1.62 0.01 -1.26 -5.08 113.70 112.22 2row s SER 2 Ca 0.00 -0.27 -0.20 0.00 1.31 0.00 0.00 55.95 56.80 2row s SER 2 Cb 0.00 -0.96 0.10 0.00 0.21 0.00 0.00 66.02 65.37 2row s SER 2 CO 0.00 0.30 0.80 -0.54 0.41 0.00 0.00 173.24 174.21 2row s LYS 3 N -0.46 3.13 -0.30 12.44 -0.14 -1.26 -4.94 119.74 128.21 2row s LYS 3 Ca 0.06 -1.29 -0.03 0.00 -1.36 0.00 0.00 55.97 53.35 2row s LYS 3 Cb -0.12 -4.32 0.19 0.00 -1.68 0.00 0.00 37.83 31.90 2row s LYS 3 CO 0.02 -1.62 0.73 0.15 -0.76 0.00 0.00 175.35 173.87 2row s LYS 4 N 2.92 0.45 0.38 1.68 1.02 -1.26 -5.16 119.74 119.77 2row s LYS 4 Ca 0.16 0.69 -0.20 0.00 0.02 0.00 0.00 55.97 56.64 2row s LYS 4 Cb -0.20 0.37 -0.10 0.00 -0.52 0.00 0.00 37.83 37.37 2row s LYS 4 CO 0.05 -0.60 0.88 -1.21 -0.92 0.00 0.00 175.35 173.56 2row s GLU 5 N 2.88 4.22 0.19 1.68 8.01 -1.26 -5.04 118.70 129.39 2row s GLU 5 Ca 0.14 1.02 -0.30 0.00 0.01 0.00 0.00 54.97 55.85 2row s GLU 5 Cb -0.12 -2.36 -0.08 0.00 -4.31 0.00 0.00 34.13 27.27 2row s GLU 5 CO -0.20 0.08 0.99 -1.25 0.01 0.00 0.00 175.26 174.89 2row s PRO 6 N -2.92 4.74 -0.28 0.39 0.04 -1.26 -5.04 135.00 130.66 2row s PRO 6 Ca 0.58 1.56 -0.02 0.00 0.04 0.00 0.00 61.00 63.15 2row s PRO 6 Cb -0.11 -3.30 0.12 0.00 0.04 0.00 0.00 34.50 31.25 2row s PRO 6 CO 0.16 0.31 0.23 -1.21 0.04 0.00 0.00 177.00 176.53 2row s GLU 7 N -0.71 0.26 -0.30 4.56 2.02 -1.26 -5.01 118.70 118.27 2row s GLU 7 Ca 0.45 -0.25 -0.01 0.00 0.02 0.00 0.00 54.97 55.18 2row s GLU 7 Cb -0.27 -0.88 0.00 0.00 0.10 0.00 0.00 34.13 33.08 2row s GLU 7 CO 0.33 -1.00 0.03 1.19 0.02 0.00 0.00 175.26 175.83 2row n PHE 8 N 5.29 -3.84 -0.93 1.61 3.72 -1.26 -5.00 117.46 117.04 2row n PHE 8 Ca -0.04 1.70 -0.31 0.00 -0.05 0.00 0.00 57.45 58.75 2row n PHE 8 Cb 0.45 -3.91 0.26 0.00 -0.94 0.00 0.00 39.48 35.34 2row n PHE 8 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 2row s PRO 9 N -1.66 -1.95 -0.13 -1.08 0.04 -1.26 -5.04 135.00 123.91 2row s PRO 9 Ca 0.01 -0.17 -0.05 0.00 0.04 0.00 0.00 61.00 60.83 2row s PRO 9 Cb -0.00 -1.52 -0.04 0.00 0.04 0.00 0.00 34.50 32.98 2row s PRO 9 CO 0.76 -4.17 0.04 0.54 0.04 0.00 0.00 177.00 174.21 2row s VAL 10 N -2.87 4.65 -0.47 -0.36 0.11 -1.26 -5.08 120.40 115.12 2row s VAL 10 Ca 0.72 -0.10 -0.18 0.00 -2.93 0.00 0.00 61.98 59.48 2row s VAL 10 Cb -0.08 -3.02 0.05 0.00 -1.53 0.00 0.00 36.38 31.79 2row s VAL 10 CO 0.56 0.55 0.52 -1.83 -3.33 0.00 0.00 175.10 171.57 2row s GLU 11 N -0.39 3.10 1.18 1.54 1.03 -1.26 -5.07 118.70 118.82 2row s GLU 11 Ca 0.09 -0.90 -0.20 0.00 0.03 0.00 0.00 54.97 53.99 2row s GLU 11 Cb -0.12 -4.05 0.30 0.00 -0.80 0.00 0.00 34.13 29.46 2row s GLU 11 CO 0.02 -1.05 0.95 -0.35 -1.33 0.00 0.00 175.26 173.50 2row n PRO 12 N 5.80 -3.39 -2.49 -4.83 -0.04 -1.26 -4.95 135.00 123.83 2row n PRO 12 Ca -0.08 -1.53 -0.42 0.00 -0.04 0.00 0.00 63.50 61.43 2row n PRO 12 Cb 0.46 -1.55 -0.03 0.00 -0.04 0.00 0.00 33.50 32.34 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 -2.60 4.34 0.00 0.52 -7.23 -1.26 -4.78 120.40 109.38 2row s VAL 13 Ca 0.64 1.65 0.00 0.00 -1.81 0.00 0.00 61.98 62.46 2row s VAL 13 Cb -0.07 -4.06 0.00 0.00 0.56 0.00 0.00 36.38 32.80 2row s VAL 13 CO 0.50 -0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.90 2row n GLY 14 N 3.32 1.92 0.10 2.32 0.00 -1.26 -4.93 105.19 106.67 2row n GLY 14 Ca 0.11 -1.25 -0.13 0.00 0.00 0.00 0.00 46.02 44.75 2row n GLY 14 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2row h GLU 15 N 0.00 -0.14 -3.78 1.61 4.39 -2.02 -3.38 114.58 111.26 2row h GLU 15 Ca 0.00 0.01 -0.74 0.00 0.34 0.00 0.00 59.36 58.97 2row h GLU 15 Cb 0.00 0.03 -0.31 0.00 -0.10 0.00 0.00 28.75 28.37 2row h GLU 15 CO 0.00 0.27 -0.18 0.21 -1.16 0.00 0.00 179.01 178.14 2row s LYS 16 N -4.35 2.97 -0.15 2.33 2.20 -1.26 -5.06 119.74 116.42 2row s LYS 16 Ca -0.15 -2.40 -0.09 0.00 -0.36 0.00 0.00 55.97 52.98 2row s LYS 16 Cb 0.02 -4.04 -0.04 0.00 -1.51 0.00 0.00 37.83 32.25 2row s LYS 16 CO 0.61 -1.23 0.14 -1.12 -0.36 0.00 0.00 175.35 173.40 2row s SER 17 N 1.57 6.32 1.32 1.43 0.01 -1.26 -5.09 113.70 118.00 2row s SER 17 Ca 0.16 0.38 -0.18 0.00 1.31 0.00 0.00 55.95 57.61 2row s SER 17 Cb -0.17 -2.08 0.33 0.00 0.21 0.00 0.00 66.02 64.30 2row s SER 17 CO -0.05 0.30 0.88 0.59 0.41 0.00 0.00 173.24 175.37 2row n ASN 18 N 2.68 -3.01 -3.71 2.44 5.03 -1.26 -4.96 115.26 112.48 2row n ASN 18 Ca -0.18 -0.52 -0.22 0.00 0.87 0.00 0.00 54.58 54.53 2row n ASN 18 Cb 0.54 -1.11 -0.18 0.00 -1.02 0.00 0.00 39.78 38.01 2row n ASN 18 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 2row s TYR 19 N -2.24 0.36 -0.43 3.10 1.51 -1.26 -4.16 117.35 114.22 2row s TYR 19 Ca 0.67 -0.02 -0.29 0.00 -1.01 0.00 0.00 57.07 56.42 2row s TYR 19 Cb -0.18 -0.65 0.01 0.00 -0.11 0.00 0.00 41.96 41.02 2row s TYR 19 CO 0.61 -0.30 1.37 0.42 -1.11 0.00 0.00 175.55 176.54 2row s ILE 20 N 2.08 3.94 0.27 2.71 1.09 0.29 -4.86 121.20 126.72 2row s ILE 20 Ca 0.04 0.95 -0.29 0.00 -1.10 0.00 0.00 60.65 60.25 2row s ILE 20 Cb -0.13 -4.28 -0.09 0.00 -1.06 0.00 0.00 42.46 36.90 2row s ILE 20 CO -0.05 -0.82 1.00 0.00 -0.10 0.00 0.00 174.94 174.97 2row n HIS 22 N 1.24 -1.50 -1.54 0.00 -0.00 0.16 -4.97 115.22 108.61 2row n HIS 22 Ca -0.01 -0.72 -0.18 0.00 -0.00 0.00 0.00 57.72 56.81 2row n HIS 22 Cb 0.47 0.35 -0.13 0.00 -0.00 0.00 0.00 29.99 30.68 2row n HIS 22 CO 0.00 0.00 0.00 0.36 -0.00 0.00 0.00 176.34 176.70 2row n LYS 23 N -0.21 0.37 -1.25 1.57 2.85 -1.26 -1.73 118.16 118.51 2row n LYS 23 Ca -0.03 -0.49 -0.09 0.00 -1.05 0.00 0.00 58.31 56.65 2row n LYS 23 Cb 0.23 -2.69 -0.04 0.00 -0.65 0.00 0.00 35.03 31.88 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 6.31 0.84 3.18 2.58 0.00 -1.26 -3.58 105.19 113.26 2row n GLY 24 Ca 0.54 -0.01 -0.26 0.00 0.00 0.00 0.00 46.02 46.29 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 -1.76 1.74 -0.61 1.61 4.02 -0.70 -2.96 115.29 116.63 2row s HIS 25 Ca 0.00 -0.38 0.05 0.00 1.02 0.00 0.00 55.06 55.74 2row s HIS 25 Cb 0.00 -1.14 0.18 0.00 -1.02 0.00 0.00 32.58 30.60 2row s HIS 25 CO 0.00 -0.07 0.47 0.39 1.02 0.00 0.00 174.74 176.54 2row n GLU 26 N 2.77 1.38 -1.29 1.40 4.71 -1.25 0.35 120.64 128.70 2row n GLU 26 Ca -0.16 -4.09 -0.31 0.00 -0.01 0.00 0.00 57.16 52.59 2row n GLU 26 Cb 0.53 -2.08 0.09 0.00 -1.01 0.00 0.00 31.44 28.97 2row n GLU 26 CO 0.00 0.00 0.00 -0.06 0.09 0.00 0.00 177.13 177.16 2row s PHE 27 N -1.09 2.63 -0.05 -0.32 0.08 -0.23 -3.06 117.98 115.94 2row s PHE 27 Ca 0.28 1.53 0.03 0.00 0.12 0.00 0.00 56.93 58.89 2row s PHE 27 Cb -0.00 -3.03 0.01 0.00 -0.57 0.00 0.00 43.02 39.42 2row s PHE 27 CO -0.17 -1.76 -0.13 0.42 -0.10 0.00 0.00 175.22 173.48 2row s ILE 28 N -2.92 1.13 -0.23 0.64 -1.09 0.38 0.11 121.20 119.21 2row s ILE 28 Ca 0.61 -0.52 -0.29 0.00 -2.23 0.00 0.00 60.65 58.22 2row s ILE 28 Cb -0.17 -1.01 -0.03 0.00 -1.58 0.00 0.00 42.46 39.68 2row s ILE 28 CO 0.56 0.34 1.70 -2.16 -1.23 0.00 0.00 174.94 174.15 2row s PRO 29 N 0.36 3.68 0.20 2.79 0.04 -1.26 0.07 135.00 140.88 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 -0.13 -4.09 0.02 0.00 0.04 0.00 0.00 34.50 30.34 2row s PRO 29 CO 0.02 -1.44 0.48 -0.08 0.04 0.00 0.00 177.00 176.02 2row s THR 30 N 5.68 0.03 0.22 1.26 -1.32 0.41 -4.92 115.64 117.00 2row s THR 30 Ca 0.75 -1.01 0.08 0.00 -1.21 0.00 0.00 61.69 60.31 2row s THR 30 Cb -0.25 -1.74 -0.04 0.00 -1.51 0.00 0.00 72.50 68.95 2row s THR 30 CO 0.31 -0.13 0.02 -0.76 -2.21 0.00 0.00 174.62 171.84 2row s LEU 31 N -2.92 3.31 -0.08 9.08 1.43 -1.26 -0.66 118.68 127.57 2row s LEU 31 Ca 0.13 -0.48 -0.02 0.00 -1.03 0.00 0.00 54.13 52.73 2row s LEU 31 Cb -0.00 -1.90 0.03 0.00 0.03 0.00 0.00 46.19 44.35 2row s LEU 31 CO -0.00 0.04 0.03 -0.31 0.23 0.00 0.00 176.35 176.34 2row s TYR 32 N -2.00 0.51 -0.30 0.29 2.02 -1.26 -4.98 117.35 111.63 2row s TYR 32 Ca 0.29 -0.14 0.23 0.00 -0.37 0.00 0.00 57.07 57.08 2row s TYR 32 Cb -0.08 -0.73 0.09 0.00 -0.40 0.00 0.00 41.96 40.83 2row s TYR 32 CO 0.20 -0.34 1.17 0.45 -1.57 0.00 0.00 175.55 175.46 2row h HIS 33 N 8.36 0.00 -1.72 2.71 3.86 -1.95 -3.14 115.15 123.27 2row h HIS 33 Ca -0.17 0.00 -0.43 0.00 -1.16 0.00 0.00 60.37 58.61 2row h HIS 33 Cb 1.12 0.00 0.02 0.00 1.06 0.00 0.00 27.41 29.62 2row h HIS 33 CO 0.43 0.00 -0.22 -0.06 0.86 0.00 0.00 177.93 178.94 2row s PHE 34 N -3.32 2.86 -0.48 2.45 0.08 -1.26 -4.41 117.98 113.89 2row s PHE 34 Ca 0.01 -0.29 -0.27 0.00 0.12 0.00 0.00 56.93 56.51 2row s PHE 34 Cb 0.09 -2.42 -0.04 0.00 -0.57 0.00 0.00 43.02 40.08 2row s PHE 34 CO 0.76 -0.47 2.07 -2.14 -0.10 0.00 0.00 175.22 175.34 2row s PRO 35 N -4.42 2.62 -0.19 0.24 0.02 -1.26 -4.59 135.00 127.42 2row s PRO 35 Ca 0.54 1.17 -0.03 0.00 0.02 0.00 0.00 61.00 62.71 2row s PRO 35 Cb -0.10 -4.42 -0.01 0.00 0.02 0.00 0.00 34.50 29.99 2row s PRO 35 CO 0.34 -2.70 -0.06 0.99 -0.33 0.00 0.00 177.00 175.24 2row s THR 36 N 9.68 3.35 -0.35 0.99 2.01 -0.46 -5.00 115.64 125.86 2row s THR 36 Ca 0.83 -0.52 -0.25 0.00 0.31 0.00 0.00 61.69 62.07 2row s THR 36 Cb -0.18 -2.49 0.01 0.00 0.01 0.00 0.00 72.50 69.85 2row s THR 36 CO 0.26 0.45 0.86 0.20 -0.69 0.00 0.00 174.62 175.71 2row s ASN 37 N 1.11 6.64 0.60 3.53 0.02 -1.26 0.59 114.94 126.17 2row s ASN 37 Ca 0.01 0.54 -0.18 0.00 -1.02 0.00 0.00 52.86 52.21 2row s ASN 37 Cb -0.15 -2.43 -0.03 0.00 0.02 0.00 0.00 41.25 38.66 2row s ASN 37 CO -0.01 -0.77 1.17 0.00 0.02 0.00 0.00 177.10 177.50 2row h GLU 39 N 0.77 0.02 0.00 0.00 4.39 -1.83 -3.43 114.58 114.51 2row h GLU 39 Ca -0.50 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.16 2row h GLU 39 Cb 1.28 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.94 2row h GLU 39 CO 0.55 0.83 0.00 0.00 -1.16 0.00 0.00 179.01 179.23 2row n ALA 40 N -2.45 0.00 -1.69 3.43 0.00 -1.26 -4.93 120.51 113.61 2row n ALA 40 Ca -0.07 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.17 2row n ALA 40 Cb 0.99 0.00 0.20 0.00 0.00 0.00 0.00 19.45 20.64 2row n ALA 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2row h MET 42 N 0.00 0.00 -6.65 0.00 0.00 -1.92 -3.43 114.93 102.94 2row h MET 42 Ca -0.40 0.00 -0.58 0.00 0.00 0.00 0.00 59.70 58.72 2row h MET 42 Cb 1.12 0.00 0.14 0.00 0.00 0.00 0.00 31.60 32.86 2row h MET 42 CO 0.28 0.32 0.05 1.63 0.00 0.00 0.00 176.91 179.19 2row n LYS 43 N -2.93 1.10 -2.29 1.72 4.01 -1.26 -4.87 118.16 113.65 2row n LYS 43 Ca -0.09 0.40 -0.36 0.00 -0.51 0.00 0.00 58.31 57.76 2row n LYS 43 Cb 0.84 -1.99 -0.01 0.00 -0.51 0.00 0.00 35.03 33.36 2row n LYS 43 CO 0.00 0.00 0.00 -1.25 -1.11 0.00 0.00 177.40 175.04 2row s PRO 44 N -2.15 3.58 -0.34 1.97 0.04 -1.26 -4.26 135.00 132.57 2row s PRO 44 Ca 0.67 1.66 -0.01 0.00 0.04 0.00 0.00 61.00 63.36 2row s PRO 44 Cb -0.52 -2.20 0.08 0.00 0.04 0.00 0.00 34.50 31.91 2row s PRO 44 CO 0.54 -0.68 0.07 -1.17 0.04 0.00 0.00 177.00 175.81 2row s LEU 45 N -3.42 4.53 0.00 -3.56 0.20 0.20 -4.89 118.68 111.75 2row s LEU 45 Ca 0.68 -1.75 0.00 0.00 0.69 0.00 0.00 54.13 53.75 2row s LEU 45 Cb -0.25 -1.72 0.00 0.00 -0.43 0.00 0.00 46.19 43.78 2row s LEU 45 CO 0.30 -0.38 0.00 -2.67 -0.29 0.00 0.00 176.35 173.31 2row n TRP 46 N 4.51 0.00 0.00 5.38 4.27 -1.26 -1.36 117.44 128.98 2row n TRP 46 Ca -0.06 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.55 2row n TRP 46 Cb 0.42 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 30.37 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 -0.27 0.00 0.04 -2.67 -0.00 -1.19 -4.75 115.22 106.38 2row n HIS 47 Ca 0.00 0.00 -0.20 0.00 0.46 0.00 0.00 57.72 57.98 2row n HIS 47 Cb 0.00 0.00 -0.14 0.00 -0.12 0.00 0.00 29.99 29.73 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 0.28 0.00 1.57 2.86 -1.88 -3.32 114.93 114.44 2row h MET 48 Ca 0.00 -0.48 0.00 0.00 -2.06 0.00 0.00 59.70 57.16 2row h MET 48 Cb 0.00 0.18 0.00 0.00 0.06 0.00 0.00 31.60 31.84 2row h MET 48 CO 0.00 1.23 0.00 1.19 1.06 0.00 0.00 176.91 180.39 2row n PHE 49 N -4.13 0.00 -3.93 -0.22 3.72 -1.26 -4.72 117.46 106.93 2row n PHE 49 Ca -0.15 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 56.95 2row n PHE 49 Cb 0.81 -0.34 -0.14 0.00 -0.94 0.00 0.00 39.48 38.87 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 -1.45 1.59 -0.04 -1.08 -0.14 -1.26 -5.09 119.74 112.26 2row s LYS 50 Ca 0.00 -2.12 -0.30 0.00 -1.36 0.00 0.00 55.97 52.19 2row s LYS 50 Cb 0.00 -3.03 -0.07 0.00 -1.68 0.00 0.00 37.83 33.05 2row s LYS 50 CO 0.00 -1.04 1.86 -1.25 -0.76 0.00 0.00 175.35 174.16 2row s PRO 51 N 0.41 4.02 0.67 -1.68 0.04 -1.25 -4.80 135.00 132.41 2row s PRO 51 Ca 0.14 2.34 -0.16 0.00 0.04 0.00 0.00 61.00 63.36 2row s PRO 51 Cb -0.22 -4.12 0.01 0.00 0.04 0.00 0.00 34.50 30.21 2row s PRO 51 CO -0.05 -1.07 1.15 -1.25 0.04 0.00 0.00 177.00 175.83 2row s PRO 52 N 4.53 2.61 -0.68 0.56 0.04 -1.26 -4.85 135.00 135.95 2row s PRO 52 Ca 0.83 1.58 -0.26 0.00 0.04 0.00 0.00 61.00 63.19 2row s PRO 52 Cb -0.37 -1.91 -0.09 0.00 0.04 0.00 0.00 34.50 32.17 2row s PRO 52 CO 0.36 -1.43 2.28 -1.25 0.04 0.00 0.00 177.00 177.00 2row s PRO 53 N -3.90 2.02 0.49 0.56 0.04 -1.26 -4.59 135.00 128.36 2row s PRO 53 Ca 0.71 0.72 -0.02 0.00 0.04 0.00 0.00 61.00 62.45 2row s PRO 53 Cb -0.25 -4.71 -0.00 0.00 0.04 0.00 0.00 34.50 29.59 2row s PRO 53 CO 0.41 -3.70 0.75 0.00 0.04 0.00 0.00 177.00 174.50 2row s ALA 54 N 12.61 3.58 -0.20 8.56 0.00 0.16 0.13 121.76 146.62 2row s ALA 54 Ca 0.88 -0.90 0.01 0.00 0.00 0.00 0.00 51.96 51.95 2row s ALA 54 Cb -0.13 -2.32 0.04 0.00 0.00 0.00 0.00 23.12 20.71 2row s ALA 54 CO 0.15 -0.50 -0.10 -0.51 0.00 0.00 0.00 175.76 174.79 2row s LEU 55 N -4.70 2.25 -0.16 0.00 1.43 0.29 -0.44 118.68 117.34 2row s LEU 55 Ca 0.50 -0.87 -0.09 0.00 -1.03 0.00 0.00 54.13 52.64 2row s LEU 55 Cb -0.10 -1.22 -0.05 0.00 0.03 0.00 0.00 46.19 44.85 2row s LEU 55 CO 0.41 -0.15 0.13 -0.70 0.23 0.00 0.00 176.35 176.27 2row s GLU 56 N 1.41 3.84 0.15 1.70 2.12 0.11 0.32 118.70 128.34 2row s GLU 56 Ca -0.01 -0.18 -0.30 0.00 0.36 0.00 0.00 54.97 54.84 2row s GLU 56 Cb -0.16 -3.31 -0.07 0.00 0.26 0.00 0.00 34.13 30.85 2row s GLU 56 CO -0.08 0.52 1.07 0.00 -0.54 0.00 0.00 175.26 176.23 2row n ARG 58 N 2.61 2.01 0.00 0.00 1.85 -1.17 -3.37 116.66 118.60 2row n ARG 58 Ca 0.03 -2.39 0.00 0.00 -1.00 0.00 0.00 57.85 54.49 2row n ARG 58 Cb 0.47 -1.94 0.00 0.00 -1.05 0.00 0.00 32.46 29.94 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 -0.77 0.00 0.00 2.89 1.74 -1.26 -4.91 116.66 114.35 2row n ARG 59 Ca 0.47 0.00 0.13 0.00 -0.77 0.00 0.00 57.85 57.68 2row n ARG 59 Cb 1.37 0.00 0.40 0.00 -1.02 0.00 0.00 32.46 33.20 2row n ARG 59 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2row n HIS 61 N -1.47 -1.82 -3.69 0.00 8.25 -1.22 -5.04 115.22 110.24 2row n HIS 61 Ca 0.06 0.87 -0.12 0.00 -0.26 0.00 0.00 57.72 58.28 2row n HIS 61 Cb 0.33 -2.60 -0.09 0.00 1.12 0.00 0.00 29.99 28.75 2row n HIS 61 CO 0.00 0.00 0.00 0.96 0.64 0.00 0.00 176.34 177.94 2row s ILE 62 N -0.62 -0.01 0.03 1.59 -4.36 -1.26 -4.88 121.20 111.70 2row s ILE 62 Ca -0.03 0.02 -0.00 0.00 -0.26 0.00 0.00 60.65 60.38 2row s ILE 62 Cb 0.00 -0.73 -0.04 0.00 1.25 0.00 0.00 42.46 42.94 2row s ILE 62 CO 0.35 0.01 0.15 -0.54 0.24 0.00 0.00 174.94 175.15 2row s LYS 63 N 0.74 3.26 -0.27 0.37 3.01 -1.25 0.56 119.74 126.16 2row s LYS 63 Ca -0.04 -0.46 -0.11 0.00 -1.01 0.00 0.00 55.97 54.35 2row s LYS 63 Cb -0.05 -2.96 0.11 0.00 -1.01 0.00 0.00 37.83 33.92 2row s LYS 63 CO -0.05 0.63 0.61 0.00 0.51 0.00 0.00 175.35 177.04 2row n HIS 65 N 5.09 0.85 -0.16 0.00 -0.00 -1.26 0.10 115.22 119.84 2row n HIS 65 Ca -0.14 0.78 0.26 0.00 -0.00 0.00 0.00 57.72 58.62 2row n HIS 65 Cb 0.52 -2.19 0.69 0.00 -0.00 0.00 0.00 29.99 29.01 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 2.46 0.06 -0.66 -0.41 3.64 0.85 -0.08 116.57 122.43 2row h LYS 66 Ca -0.40 -0.00 0.13 0.00 -1.27 0.00 0.00 60.65 59.11 2row h LYS 66 Cb 1.37 -0.01 -0.10 0.00 -0.41 0.00 0.00 32.23 33.08 2row h LYS 66 CO 0.64 0.04 0.14 -0.44 -2.27 0.00 0.00 179.45 177.56 2row h ASP 67 N 0.06 -0.02 -0.79 4.20 5.19 -1.87 0.19 116.42 123.39 2row h ASP 67 Ca 0.41 0.13 0.08 0.00 -0.62 0.00 0.00 57.03 57.03 2row h ASP 67 Cb 1.53 0.18 -0.07 0.00 0.18 0.00 0.00 39.33 41.15 2row h ASP 67 CO -0.03 -0.02 0.45 0.45 -3.12 0.00 0.00 179.24 176.97 2row h HIS 68 N 0.25 0.82 0.18 4.55 3.86 -1.33 0.28 115.15 123.75 2row h HIS 68 Ca 0.35 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.58 2row h HIS 68 Cb 0.56 -0.25 0.00 0.00 1.06 0.00 0.00 27.41 28.78 2row h HIS 68 CO -0.26 0.35 -0.08 1.98 0.86 0.00 0.00 177.93 180.77 2row h MET 69 N 0.77 -0.23 -0.43 2.45 1.85 -1.24 0.26 114.93 118.37 2row h MET 69 Ca 0.37 0.02 0.11 0.00 -0.61 0.00 0.00 59.70 59.59 2row h MET 69 Cb 0.31 0.05 -0.02 0.00 0.43 0.00 0.00 31.60 32.37 2row h MET 69 CO -0.23 0.18 0.30 0.22 -0.40 0.00 0.00 176.91 176.99 2row h ASP 70 N -0.77 0.06 0.89 1.39 1.82 -0.45 0.19 116.42 119.54 2row h ASP 70 Ca -0.02 0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 56.61 2row h ASP 70 Cb 0.52 -0.01 -0.00 0.00 0.68 0.00 0.00 39.33 40.52 2row h ASP 70 CO 0.04 0.03 -1.12 0.29 -1.61 0.00 0.00 179.24 176.88 2row n LYS 71 N -4.43 0.61 -2.82 0.28 4.76 0.95 -5.02 118.16 112.49 2row n LYS 71 Ca 0.07 0.10 -0.01 0.00 -2.87 0.00 0.00 58.31 55.60 2row n LYS 71 Cb 0.46 -1.80 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 -2.65 -1.34 -3.59 1.97 4.76 0.85 -4.99 118.16 113.17 2row n LYS 72 Ca -0.01 1.48 -0.37 0.00 -2.87 0.00 0.00 58.31 56.55 2row n LYS 72 Cb 0.57 -5.20 -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 -2.87 4.13 0.63 1.97 2.02 -0.86 -4.95 118.70 118.76 2row s GLU 73 Ca 0.05 -0.12 0.33 0.00 0.02 0.00 0.00 54.97 55.25 2row s GLU 73 Cb -0.01 -3.52 1.84 0.00 0.10 0.00 0.00 34.13 32.54 2row s GLU 73 CO 0.66 0.08 2.11 1.05 0.02 0.00 0.00 175.26 179.18 2row h GLU 74 N 7.31 0.00 -0.72 1.61 4.11 -1.94 -1.80 114.58 123.16 2row h GLU 74 Ca -0.38 0.00 0.21 0.00 0.07 0.00 0.00 59.36 59.26 2row h GLU 74 Cb 1.16 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.39 2row h GLU 74 CO 0.69 0.00 0.66 -0.84 0.07 0.00 0.00 179.01 179.60 2row h ILE 75 N 0.00 0.35 -3.43 -1.06 3.07 -1.95 -3.40 117.51 111.10 2row h ILE 75 Ca 0.05 0.00 -0.52 0.00 1.55 0.00 0.00 64.86 65.93 2row h ILE 75 Cb 0.44 0.49 0.00 0.00 -0.27 0.00 0.00 36.82 37.48 2row h ILE 75 CO -0.00 0.00 0.50 -0.63 -1.05 0.00 0.00 178.15 176.97 2row s ILE 76 N -4.70 3.99 0.33 0.16 1.01 -0.68 -4.73 121.20 116.59 2row s ILE 76 Ca -0.04 1.59 0.09 0.00 0.00 0.00 0.00 60.65 62.28 2row s ILE 76 Cb 0.17 -4.02 -0.04 0.00 0.01 0.00 0.00 42.46 38.59 2row s ILE 76 CO 0.61 0.21 0.10 0.00 0.00 0.00 0.00 174.94 175.87 2row s ALA 77 N 0.30 3.41 0.74 9.38 0.00 -1.26 -5.06 121.76 129.25 2row s ALA 77 Ca 0.53 -1.81 -0.13 0.00 0.00 0.00 0.00 51.96 50.55 2row s ALA 77 Cb -0.29 -0.70 0.04 0.00 0.00 0.00 0.00 23.12 22.17 2row s ALA 77 CO 0.33 0.08 1.14 -1.25 0.00 0.00 0.00 175.76 176.05 2row s PRO 78 N -3.80 2.27 0.53 0.00 0.04 -1.26 -4.90 135.00 127.88 2row s PRO 78 Ca 0.36 1.46 -0.22 0.00 0.04 0.00 0.00 61.00 62.65 2row s PRO 78 Cb -0.03 -1.88 -0.06 0.00 0.04 0.00 0.00 34.50 32.57 2row s PRO 78 CO 0.22 -1.67 1.24 0.00 0.04 0.00 0.00 177.00 176.82 2row h LYS 80 N 1.32 0.21 0.00 0.00 2.10 -1.93 -3.36 116.57 114.92 2row h LYS 80 Ca -0.49 -0.37 0.00 0.00 -2.00 0.00 0.00 60.65 57.79 2row h LYS 80 Cb 1.32 0.14 0.00 0.00 -0.90 0.00 0.00 32.23 32.78 2row h LYS 80 CO 0.56 1.18 0.00 -0.39 -2.00 0.00 0.00 179.45 178.80 2row h VAL 81 N -0.17 0.00 -0.16 0.07 -1.51 -1.93 -2.53 116.25 110.02 2row h VAL 81 Ca -0.40 -0.19 0.03 0.00 -1.23 0.00 0.00 66.70 64.90 2row h VAL 81 Cb 1.87 0.89 -0.01 0.00 -2.13 0.00 0.00 31.29 31.91 2row h VAL 81 CO 0.03 0.00 0.11 0.22 -1.23 0.00 0.00 177.57 176.70 2row h TYR 82 N 0.00 0.10 0.00 5.19 3.20 -1.89 -3.22 116.97 120.35 2row h TYR 82 Ca 0.00 0.00 -0.31 0.00 3.14 0.00 0.00 58.73 61.57 2row h TYR 82 Cb 0.28 -0.03 -0.05 0.00 1.54 0.00 0.00 36.73 38.46 2row h TYR 82 CO 0.00 0.06 -2.07 0.66 -1.64 0.00 0.00 178.16 175.17 2row n TYR 83 N -4.51 0.00 0.02 -3.82 4.01 -1.05 -5.15 117.16 106.66 2row n TYR 83 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 2row n TYR 83 Cb 0.17 -0.70 0.01 0.00 -0.31 0.00 0.00 39.34 38.50 2row n TYR 83 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93