#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 5.87 -0.09 -1.84 1.04 -1.26 -4.85 113.70 112.56 2row s SER 2 Ca 0.00 -2.04 0.21 0.00 0.48 0.00 0.00 55.95 54.59 2row s SER 2 Cb 0.00 -2.06 0.43 0.00 0.10 0.00 0.00 66.02 64.50 2row s SER 2 CO 0.00 -0.69 1.18 0.29 0.98 0.00 0.00 173.24 175.00 2row n LYS 3 N 4.77 0.74 -3.52 4.02 4.01 -1.26 -4.99 118.16 121.93 2row n LYS 3 Ca -0.06 -2.59 -0.28 0.00 -0.51 0.00 0.00 58.31 54.88 2row n LYS 3 Cb 0.41 -0.69 -0.14 0.00 -0.51 0.00 0.00 35.03 34.10 2row n LYS 3 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 2row s LYS 4 N -1.39 0.21 0.17 1.97 1.02 -1.26 -5.13 119.74 115.34 2row s LYS 4 Ca 0.35 -0.50 -0.30 0.00 0.02 0.00 0.00 55.97 55.54 2row s LYS 4 Cb 0.38 -1.10 -0.08 0.00 -0.52 0.00 0.00 37.83 36.51 2row s LYS 4 CO -0.12 -1.03 1.30 -1.83 -0.92 0.00 0.00 175.35 172.75 2row s GLU 5 N 2.11 4.39 0.00 1.68 -1.05 -1.26 -5.03 118.70 119.54 2row s GLU 5 Ca 0.09 2.01 0.00 0.00 -0.15 0.00 0.00 54.97 56.92 2row s GLU 5 Cb -0.16 -3.22 0.00 0.00 -0.44 0.00 0.00 34.13 30.31 2row s GLU 5 CO -0.36 -0.26 0.00 -0.35 0.95 0.00 0.00 175.26 175.24 2row n PRO 6 N 2.97 -0.13 -2.48 -4.83 -0.04 -1.26 -5.01 135.00 124.23 2row n PRO 6 Ca 0.07 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.28 2row n PRO 6 Cb 0.43 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.90 2row n PRO 6 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2row n GLU 7 N -0.94 3.25 -3.01 0.54 4.71 -1.26 -4.96 120.64 118.97 2row n GLU 7 Ca 0.00 -4.40 -0.01 0.00 -0.01 0.00 0.00 57.16 52.75 2row n GLU 7 Cb 0.00 -2.17 0.00 0.00 -1.01 0.00 0.00 31.44 28.26 2row n GLU 7 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 2row n PHE 8 N -0.45 -2.97 -1.70 -0.32 7.35 -1.26 -5.02 117.46 113.08 2row n PHE 8 Ca 0.37 1.14 -0.30 0.00 -0.76 0.00 0.00 57.45 57.90 2row n PHE 8 Cb 0.68 -4.07 0.19 0.00 0.35 0.00 0.00 39.48 36.63 2row n PHE 8 CO 0.00 0.00 0.00 -1.25 -0.76 0.00 0.00 176.76 174.75 2row s PRO 9 N -2.97 0.36 -0.14 -7.13 0.04 -1.26 -5.09 135.00 118.80 2row s PRO 9 Ca 0.02 -0.23 -0.04 0.00 0.04 0.00 0.00 61.00 60.79 2row s PRO 9 Cb -0.01 -1.80 0.07 0.00 0.04 0.00 0.00 34.50 32.81 2row s PRO 9 CO 0.74 -2.63 0.20 0.08 0.04 0.00 0.00 177.00 175.42 2row s VAL 10 N -3.61 -0.31 -0.58 -0.36 1.01 -1.26 -5.11 120.40 110.18 2row s VAL 10 Ca 0.71 0.14 -0.18 0.00 0.00 0.00 0.00 61.98 62.65 2row s VAL 10 Cb -0.07 -0.48 0.11 0.00 0.00 0.00 0.00 36.38 35.94 2row s VAL 10 CO 0.53 -0.01 0.65 -1.83 0.00 0.00 0.00 175.10 174.44 2row s GLU 11 N 2.32 3.03 0.00 2.72 -1.05 -1.26 -5.06 118.70 119.40 2row s GLU 11 Ca 0.04 -1.42 0.00 0.00 -0.15 0.00 0.00 54.97 53.44 2row s GLU 11 Cb -0.14 -4.27 0.00 0.00 -0.44 0.00 0.00 34.13 29.28 2row s GLU 11 CO -0.09 -1.48 0.00 -0.35 0.95 0.00 0.00 175.26 174.29 2row n PRO 12 N 6.03 -0.51 -1.82 -4.83 -0.04 -1.26 -4.87 135.00 127.69 2row n PRO 12 Ca -0.11 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 62.93 2row n PRO 12 Cb 0.42 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.85 2row n PRO 12 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2row s VAL 13 N -0.70 3.28 -0.29 0.52 0.11 -1.26 -4.86 120.40 117.21 2row s VAL 13 Ca 0.00 0.32 0.23 0.00 -2.93 0.00 0.00 61.98 59.60 2row s VAL 13 Cb 0.00 -3.27 0.00 0.00 -1.53 0.00 0.00 36.38 31.58 2row s VAL 13 CO 0.00 -0.10 1.07 1.23 -3.33 0.00 0.00 175.10 173.97 2row h GLY 14 N 12.11 0.00 0.48 6.54 0.00 -2.00 -3.34 103.07 116.86 2row h GLY 14 Ca -0.41 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.92 2row h GLY 14 CO 0.97 0.00 -0.43 0.83 0.00 0.00 0.00 176.54 177.91 2row h GLU 15 N 0.00 -0.77 -2.20 4.80 5.08 -2.03 -3.39 114.58 116.07 2row h GLU 15 Ca 0.00 0.05 -0.47 0.00 -1.00 0.00 0.00 59.36 57.94 2row h GLU 15 Cb 0.97 0.18 -0.34 0.00 0.50 0.00 0.00 28.75 30.05 2row h GLU 15 CO 0.00 -0.52 -0.78 0.15 -1.00 0.00 0.00 179.01 176.86 2row s LYS 16 N -5.93 0.67 -0.75 2.33 -0.14 -1.26 -5.08 119.74 109.58 2row s LYS 16 Ca -0.17 -1.25 -0.17 0.00 -1.36 0.00 0.00 55.97 53.02 2row s LYS 16 Cb 0.06 -1.01 0.15 0.00 -1.68 0.00 0.00 37.83 35.35 2row s LYS 16 CO 0.62 -1.24 0.80 -1.54 -0.76 0.00 0.00 175.35 173.23 2row s SER 17 N 1.04 6.49 0.93 2.83 1.04 -1.25 -5.00 113.70 119.77 2row s SER 17 Ca 0.21 -2.05 -0.15 0.00 0.48 0.00 0.00 55.95 54.44 2row s SER 17 Cb -0.14 -2.28 0.16 0.00 0.10 0.00 0.00 66.02 63.86 2row s SER 17 CO -0.04 -0.89 1.24 0.20 0.98 0.00 0.00 173.24 174.73 2row s ASN 18 N 3.11 3.43 -0.07 7.02 0.01 -1.26 -5.03 114.94 122.15 2row s ASN 18 Ca 0.18 0.52 -0.01 0.00 -0.71 0.00 0.00 52.86 52.84 2row s ASN 18 Cb -0.15 -0.78 0.03 0.00 0.41 0.00 0.00 41.25 40.76 2row s ASN 18 CO -0.03 -2.56 0.00 -0.31 -1.51 0.00 0.00 177.10 172.69 2row s TYR 19 N -3.67 0.67 -0.54 2.20 2.02 -1.26 -4.15 117.35 112.63 2row s TYR 19 Ca 0.69 -0.18 -0.28 0.00 -0.37 0.00 0.00 57.07 56.93 2row s TYR 19 Cb -0.08 -0.81 0.01 0.00 -0.40 0.00 0.00 41.96 40.69 2row s TYR 19 CO 0.52 -0.34 1.43 0.42 -1.57 0.00 0.00 175.55 176.02 2row s ILE 20 N 1.97 3.79 0.18 2.71 1.09 0.30 -4.86 121.20 126.38 2row s ILE 20 Ca 0.05 0.70 -0.30 0.00 -1.10 0.00 0.00 60.65 60.00 2row s ILE 20 Cb -0.12 -4.38 -0.08 0.00 -1.06 0.00 0.00 42.46 36.82 2row s ILE 20 CO -0.05 -1.09 1.10 0.00 -0.10 0.00 0.00 174.94 174.81 2row n HIS 22 N 2.40 -1.48 -1.53 0.00 -0.00 0.24 -4.98 115.22 109.87 2row n HIS 22 Ca 0.03 -1.24 -0.19 0.00 -0.00 0.00 0.00 57.72 56.32 2row n HIS 22 Cb 0.46 0.46 -0.14 0.00 -0.00 0.00 0.00 29.99 30.77 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 -0.33 0.32 -1.20 1.57 2.85 -1.26 -1.46 118.16 118.65 2row n LYS 23 Ca -0.03 -0.41 -0.07 0.00 -1.05 0.00 0.00 58.31 56.75 2row n LYS 23 Cb 0.35 -2.45 -0.03 0.00 -0.65 0.00 0.00 35.03 32.26 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 6.20 0.66 3.14 2.58 0.00 -1.26 -3.62 105.19 112.90 2row n GLY 24 Ca 0.56 -0.01 -0.26 0.00 0.00 0.00 0.00 46.02 46.31 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 -1.60 1.70 -0.65 1.61 4.02 -0.53 -2.90 115.29 116.94 2row s HIS 25 Ca 0.00 -0.47 0.05 0.00 1.02 0.00 0.00 55.06 55.66 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 -0.15 0.51 0.39 1.02 0.00 0.00 174.74 176.51 2row n GLU 26 N 3.09 1.66 -1.12 1.40 1.02 -1.25 0.82 120.64 126.26 2row n GLU 26 Ca -0.18 -4.29 -0.31 0.00 -0.02 0.00 0.00 57.16 52.36 2row n GLU 26 Cb 0.53 -2.16 0.11 0.00 -0.02 0.00 0.00 31.44 29.90 2row n GLU 26 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 2row s PHE 27 N -1.38 2.33 -0.04 -0.32 0.08 -0.24 -3.12 117.98 115.28 2row s PHE 27 Ca 0.28 1.59 0.02 0.00 0.12 0.00 0.00 56.93 58.95 2row s PHE 27 Cb 0.00 -3.12 0.01 0.00 -0.57 0.00 0.00 43.02 39.34 2row s PHE 27 CO -0.15 -2.09 -0.10 0.42 -0.10 0.00 0.00 175.22 173.19 2row s ILE 28 N -2.84 0.93 -0.22 0.64 -1.09 0.48 0.11 121.20 119.21 2row s ILE 28 Ca 0.63 -0.40 -0.29 0.00 -2.23 0.00 0.00 60.65 58.35 2row s ILE 28 Cb -0.19 -0.85 -0.03 0.00 -1.58 0.00 0.00 42.46 39.82 2row s ILE 28 CO 0.57 0.30 1.65 -2.16 -1.23 0.00 0.00 174.94 174.07 2row s PRO 29 N 0.44 3.75 0.20 2.79 0.04 -1.26 -0.21 135.00 140.76 2row s PRO 29 Ca -0.08 1.67 -0.20 0.00 0.04 0.00 0.00 61.00 62.43 2row s PRO 29 Cb -0.12 -4.06 0.04 0.00 0.04 0.00 0.00 34.50 30.40 2row s PRO 29 CO 0.02 -1.35 0.59 -0.08 0.04 0.00 0.00 177.00 176.22 2row s THR 30 N 5.39 0.01 0.23 1.26 -1.32 0.93 -4.77 115.64 117.37 2row s THR 30 Ca 0.73 -0.57 0.08 0.00 -1.21 0.00 0.00 61.69 60.72 2row s THR 30 Cb -0.25 -1.48 -0.04 0.00 -1.51 0.00 0.00 72.50 69.21 2row s THR 30 CO 0.30 -0.05 0.02 -0.76 -2.21 0.00 0.00 174.62 171.91 2row s LEU 31 N -2.84 3.31 -0.33 9.08 1.43 -1.26 -0.60 118.68 127.47 2row s LEU 31 Ca 0.07 -0.50 -0.02 0.00 -1.03 0.00 0.00 54.13 52.65 2row s LEU 31 Cb -0.02 -1.89 0.11 0.00 0.03 0.00 0.00 46.19 44.43 2row s LEU 31 CO -0.04 0.03 0.16 -0.31 0.23 0.00 0.00 176.35 176.42 2row s TYR 32 N -2.05 0.92 -0.33 0.29 2.02 -1.26 -4.97 117.35 111.97 2row s TYR 32 Ca 0.30 -1.44 0.24 0.00 -0.37 0.00 0.00 57.07 55.81 2row s TYR 32 Cb -0.08 -1.19 1.10 0.00 -0.40 0.00 0.00 41.96 41.39 2row s TYR 32 CO 0.20 -0.84 1.74 0.45 -1.57 0.00 0.00 175.55 175.53 2row h HIS 33 N 7.79 0.00 -1.69 2.71 3.86 -1.95 -3.21 115.15 122.65 2row h HIS 33 Ca -0.10 0.00 -0.43 0.00 -1.16 0.00 0.00 60.37 58.68 2row h HIS 33 Cb 0.99 0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.47 2row h HIS 33 CO 0.37 0.00 -0.30 -0.06 0.86 0.00 0.00 177.93 178.80 2row s PHE 34 N -3.43 2.99 -0.54 2.45 0.08 -1.26 -4.48 117.98 113.79 2row s PHE 34 Ca 0.02 -0.28 -0.26 0.00 0.12 0.00 0.00 56.93 56.53 2row s PHE 34 Cb 0.09 -2.17 -0.06 0.00 -0.57 0.00 0.00 43.02 40.30 2row s PHE 34 CO 0.35 -0.20 2.29 -2.14 -0.10 0.00 0.00 175.22 175.42 2row s PRO 35 N -4.27 2.19 -0.08 0.24 0.02 -1.26 -4.62 135.00 127.23 2row s PRO 35 Ca 0.49 1.17 0.02 0.00 0.02 0.00 0.00 61.00 62.70 2row s PRO 35 Cb -0.10 -4.56 -0.02 0.00 0.02 0.00 0.00 34.50 29.84 2row s PRO 35 CO 0.32 -3.23 -0.12 0.99 -0.33 0.00 0.00 177.00 174.64 2row s THR 36 N 11.66 3.24 -0.16 0.99 2.01 -0.36 -5.01 115.64 128.01 2row s THR 36 Ca 0.90 -0.64 -0.08 0.00 0.31 0.00 0.00 61.69 62.18 2row s THR 36 Cb -0.16 -2.31 -0.04 0.00 0.01 0.00 0.00 72.50 70.00 2row s THR 36 CO 0.24 0.57 0.12 0.20 -0.69 0.00 0.00 174.62 175.06 2row s ASN 37 N -0.43 6.19 0.42 3.53 0.02 -1.26 0.13 114.94 123.53 2row s ASN 37 Ca 0.05 0.31 -0.23 0.00 -1.02 0.00 0.00 52.86 51.97 2row s ASN 37 Cb -0.12 -2.04 -0.09 0.00 0.02 0.00 0.00 41.25 39.01 2row s ASN 37 CO 0.02 0.28 1.03 0.00 0.02 0.00 0.00 177.10 178.45 2row h GLU 39 N 2.28 0.18 0.00 0.00 4.39 -1.05 -3.43 114.58 116.95 2row h GLU 39 Ca -0.48 -0.31 0.00 0.00 0.34 0.00 0.00 59.36 58.90 2row h GLU 39 Cb 1.21 0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.98 2row h GLU 39 CO 0.62 0.99 0.00 0.00 -1.16 0.00 0.00 179.01 179.46 2row n ALA 40 N -2.66 0.00 -1.00 3.43 0.00 -1.26 -4.91 120.51 114.10 2row n ALA 40 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.27 2row n ALA 40 Cb 1.04 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.49 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 -0.83 3.65 -4.27 0.00 0.00 -1.26 -4.75 117.12 109.66 2row n MET 42 Ca 0.00 -4.74 -0.16 0.00 0.00 0.00 0.00 57.70 52.80 2row n MET 42 Cb 0.00 -2.28 -0.10 0.00 0.00 0.00 0.00 33.22 30.83 2row n MET 42 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 175.97 176.12 2row s LYS 43 N -3.66 1.11 0.23 0.03 3.01 -1.26 -5.09 119.74 114.11 2row s LYS 43 Ca 0.47 -1.44 -0.30 0.00 -1.01 0.00 0.00 55.97 53.69 2row s LYS 43 Cb 0.28 -0.78 -0.09 0.00 -1.01 0.00 0.00 37.83 36.24 2row s LYS 43 CO -0.15 0.12 1.22 -1.25 0.51 0.00 0.00 175.35 175.80 2row s PRO 44 N -3.53 4.47 -0.33 -1.68 0.04 -1.26 -3.48 135.00 129.24 2row s PRO 44 Ca 0.16 1.96 0.02 0.00 0.04 0.00 0.00 61.00 63.18 2row s PRO 44 Cb 0.00 -3.19 0.08 0.00 0.04 0.00 0.00 34.50 31.44 2row s PRO 44 CO 0.02 -0.08 0.03 -1.17 0.04 0.00 0.00 177.00 175.84 2row s LEU 45 N -0.72 4.42 0.00 -3.56 2.96 0.34 -4.87 118.68 117.24 2row s LEU 45 Ca 0.51 -1.82 0.00 0.00 -0.22 0.00 0.00 54.13 52.60 2row s LEU 45 Cb -0.35 -1.66 0.00 0.00 0.50 0.00 0.00 46.19 44.68 2row s LEU 45 CO 0.41 -0.35 0.00 -2.67 -1.32 0.00 0.00 176.35 172.42 2row n TRP 46 N 4.41 0.00 0.00 5.38 4.27 -1.26 -1.23 117.44 129.02 2row n TRP 46 Ca -0.04 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.57 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 0.43 0.00 0.10 -2.67 -0.00 -1.21 -4.69 115.22 107.18 2row n HIS 47 Ca 0.00 0.00 -0.23 0.00 0.46 0.00 0.00 57.72 57.95 2row n HIS 47 Cb 0.00 0.00 -0.15 0.00 -0.12 0.00 0.00 29.99 29.72 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 0.44 0.00 1.57 2.86 -1.90 -3.36 114.93 114.53 2row h MET 48 Ca 0.00 -0.75 0.00 0.00 -2.06 0.00 0.00 59.70 56.89 2row h MET 48 Cb 0.00 0.28 0.00 0.00 0.06 0.00 0.00 31.60 31.94 2row h MET 48 CO 0.00 1.36 0.00 1.19 1.06 0.00 0.00 176.91 180.52 2row n PHE 49 N -3.76 0.00 -3.81 -0.22 3.01 -1.26 -4.80 117.46 106.62 2row n PHE 49 Ca -0.20 0.00 -0.35 0.00 1.01 0.00 0.00 57.45 57.92 2row n PHE 49 Cb 1.04 -0.24 -0.12 0.00 -0.01 0.00 0.00 39.48 40.16 2row n PHE 49 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 2row s LYS 50 N -0.52 2.14 0.00 -1.08 -0.14 -1.26 -5.08 119.74 113.80 2row s LYS 50 Ca 0.00 -2.21 -0.30 0.00 -1.36 0.00 0.00 55.97 52.09 2row s LYS 50 Cb 0.00 -3.55 -0.07 0.00 -1.68 0.00 0.00 37.83 32.53 2row s LYS 50 CO 0.00 -1.10 1.63 -1.25 -0.76 0.00 0.00 175.35 173.87 2row s PRO 51 N 0.45 4.20 0.56 -1.68 0.04 -1.26 -4.77 135.00 132.53 2row s PRO 51 Ca 0.13 2.23 -0.19 0.00 0.04 0.00 0.00 61.00 63.21 2row s PRO 51 Cb -0.22 -3.80 -0.05 0.00 0.04 0.00 0.00 34.50 30.47 2row s PRO 51 CO -0.04 -0.77 1.11 -1.25 0.04 0.00 0.00 177.00 176.09 2row s PRO 52 N 3.32 3.33 -0.73 0.56 0.04 -1.26 -4.89 135.00 135.37 2row s PRO 52 Ca 0.73 1.52 -0.26 0.00 0.04 0.00 0.00 61.00 63.03 2row s PRO 52 Cb -0.36 -2.01 -0.11 0.00 0.04 0.00 0.00 34.50 32.06 2row s PRO 52 CO 0.31 -0.85 2.37 -1.25 0.04 0.00 0.00 177.00 177.61 2row s PRO 53 N -3.45 1.79 0.11 0.56 0.04 -1.26 -4.64 135.00 128.14 2row s PRO 53 Ca 0.71 0.64 -0.15 0.00 0.04 0.00 0.00 61.00 62.24 2row s PRO 53 Cb -0.22 -4.75 -0.07 0.00 0.04 0.00 0.00 34.50 29.50 2row s PRO 53 CO 0.29 -4.10 0.53 0.00 0.04 0.00 0.00 177.00 173.76 2row s ALA 54 N 13.83 3.61 -0.34 8.56 0.00 0.23 0.15 121.76 147.79 2row s ALA 54 Ca 0.92 -0.12 -0.09 0.00 0.00 0.00 0.00 51.96 52.66 2row s ALA 54 Cb -0.13 -2.51 0.02 0.00 0.00 0.00 0.00 23.12 20.49 2row s ALA 54 CO 0.12 0.45 0.16 -0.51 0.00 0.00 0.00 175.76 175.98 2row s LEU 55 N -1.68 4.36 -0.08 0.00 1.43 0.15 -0.05 118.68 122.81 2row s LEU 55 Ca 0.34 -0.84 -0.09 0.00 -1.03 0.00 0.00 54.13 52.50 2row s LEU 55 Cb -0.16 -1.97 -0.05 0.00 0.03 0.00 0.00 46.19 44.04 2row s LEU 55 CO 0.18 -0.29 0.22 -0.70 0.23 0.00 0.00 176.35 175.99 2row s GLU 56 N 1.54 3.60 0.11 1.70 2.12 0.71 0.53 118.70 129.01 2row s GLU 56 Ca 0.02 0.04 -0.29 0.00 0.36 0.00 0.00 54.97 55.10 2row s GLU 56 Cb -0.18 -3.20 -0.06 0.00 0.26 0.00 0.00 34.13 30.94 2row s GLU 56 CO 0.05 0.74 0.94 0.00 -0.54 0.00 0.00 175.26 176.45 2row n ARG 58 N 2.75 1.92 0.00 0.00 1.85 -1.18 -3.26 116.66 118.74 2row n ARG 58 Ca 0.02 -2.17 0.00 0.00 -1.00 0.00 0.00 57.85 54.70 2row n ARG 58 Cb 0.49 -1.85 0.00 0.00 -1.05 0.00 0.00 32.46 30.05 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 -0.64 0.00 0.00 2.89 1.74 -1.26 -4.90 116.66 114.49 2row n ARG 59 Ca 0.43 0.00 0.13 0.00 -0.77 0.00 0.00 57.85 57.65 2row n ARG 59 Cb 1.28 0.00 0.50 0.00 -1.02 0.00 0.00 32.46 33.22 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 -1.20 -2.12 -4.16 0.00 8.25 -1.20 -5.06 115.22 109.73 2row n HIS 61 Ca 0.10 0.87 -0.10 0.00 -0.26 0.00 0.00 57.72 58.32 2row n HIS 61 Cb 0.31 -3.04 -0.04 0.00 1.12 0.00 0.00 29.99 28.35 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 -0.28 0.00 -3.76 1.59 -5.35 -1.25 -4.90 119.36 105.42 2row n ILE 62 Ca 0.06 -1.21 -0.13 0.00 -0.27 0.00 0.00 62.75 61.19 2row n ILE 62 Cb 0.24 0.57 -0.09 0.00 -1.74 0.00 0.00 39.64 38.62 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 -2.70 0.62 -0.27 6.28 3.01 -1.25 -1.00 119.74 124.43 2row s LYS 63 Ca 0.18 -0.05 -0.10 0.00 -1.01 0.00 0.00 55.97 54.99 2row s LYS 63 Cb 0.01 0.28 0.11 0.00 -1.01 0.00 0.00 37.83 37.22 2row s LYS 63 CO 0.13 -0.16 0.60 0.00 0.51 0.00 0.00 175.35 176.43 2row n HIS 65 N 5.28 0.56 -0.18 0.00 -0.00 -1.26 0.30 115.22 119.92 2row n HIS 65 Ca -0.12 0.92 0.27 0.00 -0.00 0.00 0.00 57.72 58.79 2row n HIS 65 Cb 0.50 -2.12 0.70 0.00 -0.00 0.00 0.00 29.99 29.08 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 2.67 0.04 -0.64 -0.41 1.63 0.10 -0.21 116.57 119.76 2row h LYS 66 Ca -0.43 -0.00 0.13 0.00 -0.85 0.00 0.00 60.65 59.49 2row h LYS 66 Cb 1.41 -0.01 -0.09 0.00 -0.60 0.00 0.00 32.23 32.93 2row h LYS 66 CO 0.65 0.03 0.12 -0.44 -3.45 0.00 0.00 179.45 176.36 2row h ASP 67 N 0.04 -0.04 -0.36 4.20 3.32 -1.86 -1.17 116.42 120.56 2row h ASP 67 Ca 0.42 0.13 0.08 0.00 0.02 0.00 0.00 57.03 57.68 2row h ASP 67 Cb 1.63 0.18 -0.08 0.00 0.22 0.00 0.00 39.33 41.28 2row h ASP 67 CO -0.02 -0.02 -0.16 0.45 -1.72 0.00 0.00 179.24 177.76 2row h HIS 68 N 0.24 -0.40 -0.28 4.55 3.86 -1.35 0.30 115.15 122.07 2row h HIS 68 Ca 0.34 0.04 -0.01 0.00 -1.16 0.00 0.00 60.37 59.58 2row h HIS 68 Cb 0.53 0.23 -0.01 0.00 1.06 0.00 0.00 27.41 29.22 2row h HIS 68 CO -0.27 -0.24 0.13 1.98 0.86 0.00 0.00 177.93 180.39 2row h MET 69 N -0.10 0.40 0.00 2.45 1.85 -1.50 0.94 114.93 118.97 2row h MET 69 Ca 0.18 -0.06 -0.01 0.00 -0.61 0.00 0.00 59.70 59.20 2row h MET 69 Cb 0.38 -0.07 -0.00 0.00 0.43 0.00 0.00 31.60 32.33 2row h MET 69 CO -0.42 0.40 -0.05 0.22 -0.40 0.00 0.00 176.91 176.65 2row h ASP 70 N 0.31 0.00 0.56 1.39 1.82 -0.54 -1.97 116.42 117.99 2row h ASP 70 Ca 0.09 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.73 2row h ASP 70 Cb 0.13 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.14 2row h ASP 70 CO -0.01 0.05 -1.39 0.29 -1.61 0.00 0.00 179.24 176.57 2row n LYS 71 N -4.44 0.60 -2.68 0.28 4.76 1.00 -5.03 118.16 112.65 2row n LYS 71 Ca -0.03 -0.01 -0.03 0.00 -2.87 0.00 0.00 58.31 55.37 2row n LYS 71 Cb 0.13 -1.69 0.00 0.00 -1.84 0.00 0.00 35.03 31.64 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 -2.46 -1.47 -3.79 1.97 4.76 0.32 -5.01 118.16 112.49 2row n LYS 72 Ca -0.01 1.55 -0.35 0.00 -2.87 0.00 0.00 58.31 56.62 2row n LYS 72 Cb 0.55 -4.91 -0.09 0.00 -1.84 0.00 0.00 35.03 28.73 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 -2.67 4.05 0.63 1.97 2.02 -1.08 -4.96 118.70 118.66 2row s GLU 73 Ca 0.10 -0.29 0.35 0.00 0.02 0.00 0.00 54.97 55.15 2row s GLU 73 Cb -0.03 -3.40 1.98 0.00 0.10 0.00 0.00 34.13 32.78 2row s GLU 73 CO 0.61 0.17 2.20 1.05 0.02 0.00 0.00 175.26 179.31 2row h GLU 74 N 7.08 0.00 -1.08 1.61 4.11 -1.94 -2.26 114.58 122.10 2row h GLU 74 Ca -0.39 0.00 0.29 0.00 0.07 0.00 0.00 59.36 59.34 2row h GLU 74 Cb 1.16 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.33 2row h GLU 74 CO 0.69 0.00 0.72 -0.84 0.07 0.00 0.00 179.01 179.65 2row h ILE 75 N 0.00 0.48 -3.52 -1.06 3.07 -1.95 -3.40 117.51 111.13 2row h ILE 75 Ca 0.02 -0.09 -0.53 0.00 1.55 0.00 0.00 64.86 65.82 2row h ILE 75 Cb 0.26 0.19 0.06 0.00 -0.27 0.00 0.00 36.82 37.06 2row h ILE 75 CO -0.00 0.05 0.73 -0.63 -1.05 0.00 0.00 178.15 177.25 2row s ILE 76 N -5.32 2.67 0.34 0.16 1.01 -0.85 -4.77 121.20 114.44 2row s ILE 76 Ca -0.08 0.59 0.09 0.00 0.00 0.00 0.00 60.65 61.26 2row s ILE 76 Cb 0.25 -3.38 -0.06 0.00 0.01 0.00 0.00 42.46 39.28 2row s ILE 76 CO 0.80 0.11 -0.07 0.00 0.00 0.00 0.00 174.94 175.78 2row s ALA 77 N -0.30 3.02 0.73 9.38 0.00 -1.26 -5.07 121.76 128.25 2row s ALA 77 Ca 0.57 -2.05 -0.13 0.00 0.00 0.00 0.00 51.96 50.35 2row s ALA 77 Cb -0.41 -0.15 0.04 0.00 0.00 0.00 0.00 23.12 22.60 2row s ALA 77 CO 0.46 0.08 1.11 -1.25 0.00 0.00 0.00 175.76 176.16 2row s PRO 78 N -3.64 2.42 0.53 0.00 0.04 -1.25 -4.89 135.00 128.22 2row s PRO 78 Ca 0.33 1.31 -0.22 0.00 0.04 0.00 0.00 61.00 62.46 2row s PRO 78 Cb 0.01 -1.91 -0.05 0.00 0.04 0.00 0.00 34.50 32.59 2row s PRO 78 CO 0.17 -1.53 1.33 0.00 0.04 0.00 0.00 177.00 177.00 2row n LYS 80 N -0.92 0.69 0.31 0.00 2.85 -1.26 -4.26 118.16 115.57 2row n LYS 80 Ca 0.10 0.21 0.19 0.00 -1.05 0.00 0.00 58.31 57.75 2row n LYS 80 Cb 0.45 -1.60 0.99 0.00 -0.65 0.00 0.00 35.03 34.23 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 -0.02 0.20 -0.76 0.58 -1.51 -1.93 -3.04 116.25 109.77 2row h VAL 81 Ca -0.52 -0.18 -0.52 0.00 -1.23 0.00 0.00 66.70 64.25 2row h VAL 81 Cb 1.93 1.15 -0.12 0.00 -2.13 0.00 0.00 31.29 32.12 2row h VAL 81 CO -0.03 0.02 1.14 0.00 -1.23 0.00 0.00 177.57 177.47 2row n TYR 82 N -3.32 1.62 0.00 5.19 9.36 -1.26 -4.01 117.16 124.74 2row n TYR 82 Ca -0.02 -2.21 0.00 0.00 3.32 0.00 0.00 57.90 58.99 2row n TYR 82 Cb 0.14 -1.67 0.00 0.00 -0.63 0.00 0.00 39.34 37.19 2row n TYR 82 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 2row n TYR 83 N 1.72 -0.08 0.03 2.98 4.01 -1.18 -5.00 117.16 119.64 2row n TYR 83 Ca 0.55 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 58.29 2row n TYR 83 Cb 0.51 0.02 0.01 0.00 -0.31 0.00 0.00 39.34 39.57 2row n TYR 83 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93