#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1afi s THR 2 N 0.00 -0.04 0.32 0.00 -1.32 -1.25 -2.48 115.64 110.88 1afi s THR 2 Ca 0.00 -1.33 0.08 0.00 -1.21 0.00 0.00 61.69 59.22 1afi s THR 2 Cb 0.00 -0.98 -0.03 0.00 -1.51 0.00 0.00 72.50 69.98 1afi s THR 2 CO 0.00 -0.83 0.23 -1.10 -2.21 0.00 0.00 174.62 170.71 1afi s GLN 3 N 1.37 2.64 -0.06 7.08 1.11 -0.93 -4.86 119.66 126.01 1afi s GLN 3 Ca 0.16 -1.33 0.01 0.00 0.01 0.00 0.00 55.36 54.21 1afi s GLN 3 Cb -0.20 -2.40 0.02 0.00 -1.01 0.00 0.00 33.01 29.43 1afi s GLN 3 CO -0.07 0.15 -0.08 -0.08 0.01 0.00 0.00 175.29 175.23 1afi s THR 4 N -2.31 0.83 0.18 -0.19 -1.32 -1.26 -2.01 115.64 109.55 1afi s THR 4 Ca 0.39 -0.27 -0.01 0.00 -1.21 0.00 0.00 61.69 60.59 1afi s THR 4 Cb -0.05 -0.81 -0.04 0.00 -1.51 0.00 0.00 72.50 70.09 1afi s THR 4 CO 0.25 0.30 0.10 -0.69 -2.21 0.00 0.00 174.62 172.36 1afi s VAL 5 N 0.96 0.11 0.44 5.08 1.01 -0.85 -4.98 120.40 122.17 1afi s VAL 5 Ca -0.10 -1.97 0.07 0.00 0.00 0.00 0.00 61.98 59.99 1afi s VAL 5 Cb -0.15 -2.33 -0.02 0.00 0.00 0.00 0.00 36.38 33.89 1afi s VAL 5 CO 0.00 -0.19 0.35 0.28 0.00 0.00 0.00 175.10 175.54 1afi s THR 6 N -4.07 2.40 0.11 3.92 -1.32 -1.26 -1.08 115.64 114.36 1afi s THR 6 Ca 0.33 -1.44 0.03 0.00 -1.21 0.00 0.00 61.69 59.40 1afi s THR 6 Cb 0.07 -2.84 -0.04 0.00 -1.51 0.00 0.00 72.50 68.18 1afi s THR 6 CO 0.08 0.00 -0.08 -0.76 -2.21 0.00 0.00 174.62 171.65 1afi s LEU 7 N -4.12 2.50 -0.43 9.08 1.02 0.29 -2.17 118.68 124.85 1afi s LEU 7 Ca 0.45 -0.98 -0.03 0.00 0.02 0.00 0.00 54.13 53.59 1afi s LEU 7 Cb -0.01 -0.18 0.11 0.00 0.02 0.00 0.00 46.19 46.13 1afi s LEU 7 CO 0.26 -0.40 0.22 0.00 0.02 0.00 0.00 176.35 176.45 1afi s ALA 8 N -3.38 3.19 -0.40 4.21 0.00 -0.61 -1.78 121.76 123.00 1afi s ALA 8 Ca 0.12 -2.60 -0.03 0.00 0.00 0.00 0.00 51.96 49.45 1afi s ALA 8 Cb 0.03 -2.44 0.10 0.00 0.00 0.00 0.00 23.12 20.81 1afi s ALA 8 CO -0.03 -1.83 0.18 0.54 0.00 0.00 0.00 175.76 174.63 1afi s VAL 9 N 1.05 3.34 0.00 0.00 0.11 -0.94 -1.73 120.40 122.23 1afi s VAL 9 Ca 0.09 -1.91 0.00 0.00 -2.93 0.00 0.00 61.98 57.23 1afi s VAL 9 Cb -0.23 -3.22 0.00 0.00 -1.53 0.00 0.00 36.38 31.40 1afi s VAL 9 CO -0.04 -0.60 1.75 -0.81 -3.33 0.00 0.00 175.10 172.07 1afi n PRO 10 N 4.63 0.88 -0.08 1.54 -0.04 -1.26 -4.22 135.00 136.45 1afi n PRO 10 Ca -0.04 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.27 1afi n PRO 10 Cb 0.42 -1.06 -0.11 0.00 -0.04 0.00 0.00 33.50 32.71 1afi n PRO 10 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1afi h GLY 11 N 3.13 0.00 -6.79 0.55 0.00 -1.92 -3.48 103.07 94.56 1afi h GLY 11 Ca 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 46.77 1afi h GLY 11 CO 0.00 0.00 -0.98 -0.13 0.00 0.00 0.00 176.54 175.43 1afi n MET 12 N -4.58 -0.85 -0.26 4.80 1.56 -1.26 -4.78 117.12 111.75 1afi n MET 12 Ca -0.14 0.18 0.04 0.00 -0.27 0.00 0.00 57.70 57.50 1afi n MET 12 Cb 0.48 -3.21 0.15 0.00 2.15 0.00 0.00 33.22 32.79 1afi n MET 12 CO 0.00 0.00 0.00 0.25 -0.73 0.00 0.00 175.97 175.49 1afi n THR 13 N -4.75 0.76 -2.41 1.12 -2.24 -1.26 -4.91 114.28 100.59 1afi n THR 13 Ca -0.16 -0.48 -0.02 0.00 -2.27 0.00 0.00 64.05 61.12 1afi n THR 13 Cb 0.60 -0.11 0.00 0.00 -2.10 0.00 0.00 70.33 68.72 1afi n THR 13 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1afi n ALA 15 N 0.29 -0.36 0.00 0.00 0.00 -1.26 -4.82 120.51 114.35 1afi n ALA 15 Ca 0.02 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.57 1afi n ALA 15 Cb 0.09 -1.50 0.00 0.00 0.00 0.00 0.00 19.45 18.04 1afi n ALA 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1afi n ALA 16 N -1.52 2.82 -0.13 0.00 0.00 -1.26 -4.77 120.51 115.64 1afi n ALA 16 Ca -0.15 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.25 1afi n ALA 16 Cb 0.61 0.04 0.04 0.00 0.00 0.00 0.00 19.45 20.13 1afi n ALA 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1afi n PRO 18 N -5.05 0.03 -0.04 0.00 -0.04 -1.26 -1.89 135.00 126.75 1afi n PRO 18 Ca 0.04 0.19 -0.18 0.00 -0.04 0.00 0.00 63.50 63.51 1afi n PRO 18 Cb 0.18 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.01 1afi n PRO 18 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1afi n ILE 19 N -1.47 1.67 0.06 0.52 5.41 -0.50 -3.29 119.36 121.75 1afi n ILE 19 Ca 0.05 -0.67 -0.21 0.00 1.00 0.00 0.00 62.75 62.92 1afi n ILE 19 Cb 0.19 -1.48 -0.12 0.00 -0.71 0.00 0.00 39.64 37.53 1afi n ILE 19 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 176.55 177.29 1afi h THR 20 N 0.04 1.31 -0.38 1.39 2.02 -1.36 -2.87 112.91 113.06 1afi h THR 20 Ca -0.45 -2.34 -0.02 0.00 0.77 0.00 0.00 66.41 64.38 1afi h THR 20 Cb 2.02 2.60 -0.02 0.00 -1.74 0.00 0.00 68.15 71.01 1afi h THR 20 CO 0.04 0.71 0.16 0.58 0.37 0.00 0.00 175.52 177.39 1afi h VAL 21 N 0.24 1.18 0.10 3.16 2.07 -1.56 0.21 116.25 121.65 1afi h VAL 21 Ca -0.15 -0.54 0.02 0.00 0.82 0.00 0.00 66.70 66.84 1afi h VAL 21 Cb 1.75 0.84 -0.04 0.00 -1.52 0.00 0.00 31.29 32.33 1afi h VAL 21 CO 0.21 0.20 -0.32 0.50 0.02 0.00 0.00 177.57 178.17 1afi h LYS 22 N 0.46 -0.52 0.00 1.57 3.64 -1.59 -0.08 116.57 120.06 1afi h LYS 22 Ca 0.13 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 1afi h LYS 22 Cb 0.16 0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.10 1afi h LYS 22 CO -0.01 -0.34 0.00 0.36 -2.27 0.00 0.00 179.45 177.18 1afi n LYS 23 N -5.42 0.72 -0.03 1.90 -0.00 -1.08 -2.14 118.16 112.11 1afi n LYS 23 Ca -0.06 0.01 -0.00 0.00 -0.00 0.00 0.00 58.31 58.25 1afi n LYS 23 Cb 0.33 -1.50 -0.00 0.00 -0.00 0.00 0.00 35.03 33.86 1afi n LYS 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1afi h ALA 24 N 3.52 0.00 0.00 0.58 0.00 0.14 -2.00 119.26 121.50 1afi h ALA 24 Ca 0.00 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1afi h ALA 24 Cb 0.04 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1afi h ALA 24 CO 0.00 0.03 -0.16 1.37 0.00 0.00 0.00 179.25 180.48 1afi h LEU 25 N -0.56 0.00 -0.86 0.00 -0.00 -1.59 -0.08 115.31 112.23 1afi h LEU 25 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 57.88 57.79 1afi h LEU 25 Cb 0.03 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.67 1afi h LEU 25 CO 0.00 0.16 -0.42 -1.28 -0.00 0.00 0.00 178.44 176.90 1afi h SER 26 N 0.00 0.00 0.05 0.17 0.87 -1.54 -2.83 113.55 110.28 1afi h SER 26 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1afi h SER 26 Cb 0.48 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.44 1afi h SER 26 CO 0.02 0.42 -0.46 0.29 -0.53 0.00 0.00 176.83 176.58 1afi n LYS 27 N -3.55 1.03 -0.13 2.24 4.01 -0.29 -4.46 118.16 117.00 1afi n LYS 27 Ca -0.00 -0.80 -0.14 0.00 -0.51 0.00 0.00 58.31 56.86 1afi n LYS 27 Cb 0.54 -1.48 -0.10 0.00 -0.51 0.00 0.00 35.03 33.48 1afi n LYS 27 CO 0.00 0.00 0.00 0.28 -1.11 0.00 0.00 177.40 176.57 1afi h VAL 28 N 1.96 0.00 0.00 -0.18 2.07 -0.81 -3.47 116.25 115.81 1afi h VAL 28 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1afi h VAL 28 Cb 0.68 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.45 1afi h VAL 28 CO 0.00 0.00 0.00 -0.62 0.02 0.00 0.00 177.57 176.97 1afi n GLU 29 N -5.38 0.00 0.20 1.57 1.02 -1.26 -4.93 120.64 111.86 1afi n GLU 29 Ca -0.04 0.00 0.06 0.00 -0.02 0.00 0.00 57.16 57.16 1afi n GLU 29 Cb 0.35 0.00 0.41 0.00 -0.02 0.00 0.00 31.44 32.18 1afi n GLU 29 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1afi h GLY 30 N 0.00 0.00 -4.99 0.62 0.00 -1.87 -3.45 103.07 93.38 1afi h GLY 30 Ca 0.00 0.00 -0.67 0.00 0.00 0.00 0.00 47.33 46.66 1afi h GLY 30 CO 0.00 0.00 -0.48 1.55 0.00 0.00 0.00 176.54 177.61 1afi n VAL 31 N -3.74 1.83 0.02 4.60 3.14 -1.26 -3.05 118.33 119.87 1afi n VAL 31 Ca -0.01 -0.46 0.00 0.00 -2.96 0.00 0.00 64.34 60.92 1afi n VAL 31 Cb 0.43 0.00 -0.00 0.00 -1.06 0.00 0.00 33.84 33.20 1afi n VAL 31 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 1afi n SER 32 N 1.93 2.28 -3.62 6.55 2.88 -0.56 -4.84 113.62 118.24 1afi n SER 32 Ca 0.18 -0.28 -0.08 0.00 -1.33 0.00 0.00 58.87 57.36 1afi n SER 32 Cb 0.23 1.02 -0.02 0.00 -0.75 0.00 0.00 64.21 64.69 1afi n SER 32 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 1afi s LYS 33 N -1.53 1.30 -0.04 -1.46 2.20 -0.98 -4.97 119.74 114.26 1afi s LYS 33 Ca 0.00 -0.61 -0.30 0.00 -0.36 0.00 0.00 55.97 54.70 1afi s LYS 33 Cb 0.00 0.51 0.07 0.00 -1.51 0.00 0.00 37.83 36.90 1afi s LYS 33 CO 0.03 -0.58 0.66 0.08 -0.36 0.00 0.00 175.35 175.18 1afi s VAL 34 N -3.56 0.00 0.20 4.02 1.01 -1.26 -1.54 120.40 119.27 1afi s VAL 34 Ca 0.07 -0.02 -0.03 0.00 0.00 0.00 0.00 61.98 61.99 1afi s VAL 34 Cb -0.02 -0.98 -0.03 0.00 0.00 0.00 0.00 36.38 35.34 1afi s VAL 34 CO -0.04 -0.01 0.19 -1.81 0.00 0.00 0.00 175.10 173.43 1afi s ASP 35 N -1.30 0.12 0.12 3.32 1.11 0.58 -4.96 116.67 115.66 1afi s ASP 35 Ca -0.10 -1.27 0.05 0.00 0.18 0.00 0.00 52.55 51.41 1afi s ASP 35 Cb -0.00 0.41 -0.04 0.00 1.07 0.00 0.00 42.92 44.36 1afi s ASP 35 CO 0.08 -0.88 0.01 -0.69 1.18 0.00 0.00 175.17 174.87 1afi s VAL 36 N -4.11 3.99 -0.40 -1.27 1.01 -1.26 -2.24 120.40 116.11 1afi s VAL 36 Ca 0.33 -1.10 0.10 0.00 0.00 0.00 0.00 61.98 61.32 1afi s VAL 36 Cb 0.06 -2.94 0.34 0.00 0.00 0.00 0.00 36.38 33.84 1afi s VAL 36 CO 0.10 0.05 0.84 0.61 0.00 0.00 0.00 175.10 176.69 1afi n GLY 37 N 0.33 2.75 0.30 4.51 0.00 -0.34 -4.77 105.19 107.97 1afi n GLY 37 Ca -0.10 -1.20 0.17 0.00 0.00 0.00 0.00 46.02 44.88 1afi n GLY 37 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1afi h PHE 38 N 3.00 0.00 -0.17 1.61 3.57 -1.95 -1.58 116.94 121.42 1afi h PHE 38 Ca 0.04 0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.59 1afi h PHE 38 Cb 1.01 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.74 1afi h PHE 38 CO 0.42 0.02 0.49 1.49 -2.23 0.00 0.00 178.31 178.50 1afi h GLU 39 N 0.00 0.00 -0.34 1.11 4.81 -1.92 -1.76 114.58 116.48 1afi h GLU 39 Ca -0.00 0.00 -0.23 0.00 -0.13 0.00 0.00 59.36 59.00 1afi h GLU 39 Cb 0.06 0.00 -0.36 0.00 0.63 0.00 0.00 28.75 29.08 1afi h GLU 39 CO 0.00 0.00 -0.99 1.63 -0.73 0.00 0.00 179.01 178.93 1afi n LYS 40 N -3.09 1.58 -4.02 1.92 5.02 -0.65 -5.01 118.16 113.91 1afi n LYS 40 Ca 0.02 -3.09 -0.39 0.00 -2.02 0.00 0.00 58.31 52.84 1afi n LYS 40 Cb 0.58 -1.22 0.02 0.00 -0.02 0.00 0.00 35.03 34.38 1afi n LYS 40 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1afi n ARG 41 N -0.68 -0.37 -3.94 1.97 0.63 -0.66 -4.89 116.66 108.71 1afi n ARG 41 Ca 0.03 -0.05 -0.09 0.00 -0.92 0.00 0.00 57.85 56.82 1afi n ARG 41 Cb 0.83 -1.79 -0.05 0.00 0.45 0.00 0.00 32.46 31.90 1afi n ARG 41 CO 0.00 0.00 0.00 -1.83 -2.51 0.00 0.00 177.63 173.29 1afi s GLU 42 N -7.00 1.48 -0.01 -0.14 -1.05 -0.88 -2.22 118.70 108.87 1afi s GLU 42 Ca 0.40 -1.16 0.03 0.00 -0.15 0.00 0.00 54.97 54.09 1afi s GLU 42 Cb -0.22 0.47 -0.01 0.00 -0.44 0.00 0.00 34.13 33.93 1afi s GLU 42 CO 0.79 -0.61 -0.11 0.00 0.95 0.00 0.00 175.26 176.28 1afi s ALA 43 N -3.98 0.96 -0.36 -0.84 0.00 -0.73 -1.20 121.76 115.60 1afi s ALA 43 Ca 0.19 -0.47 -0.08 0.00 0.00 0.00 0.00 51.96 51.60 1afi s ALA 43 Cb -0.00 -0.27 0.04 0.00 0.00 0.00 0.00 23.12 22.89 1afi s ALA 43 CO 0.06 0.22 0.15 0.54 0.00 0.00 0.00 175.76 176.73 1afi s VAL 44 N -0.18 4.06 0.25 0.00 0.11 -0.95 0.10 120.40 123.79 1afi s VAL 44 Ca 0.03 -1.09 0.09 0.00 -2.93 0.00 0.00 61.98 58.08 1afi s VAL 44 Cb -0.05 -3.31 -0.04 0.00 -1.53 0.00 0.00 36.38 31.44 1afi s VAL 44 CO -0.00 -0.23 0.04 -0.69 -3.33 0.00 0.00 175.10 170.88 1afi s VAL 45 N 1.45 3.70 0.12 2.04 1.01 -0.24 -0.31 120.40 128.17 1afi s VAL 45 Ca -0.00 -1.73 0.09 0.00 0.00 0.00 0.00 61.98 60.34 1afi s VAL 45 Cb -0.20 -2.96 -0.04 0.00 0.00 0.00 0.00 36.38 33.18 1afi s VAL 45 CO 0.04 -0.33 -0.22 -0.89 0.00 0.00 0.00 175.10 173.70 1afi s THR 46 N -2.19 1.89 0.07 3.92 2.01 -0.59 -2.01 115.64 118.75 1afi s THR 46 Ca 0.31 -1.66 -0.15 0.00 0.31 0.00 0.00 61.69 60.50 1afi s THR 46 Cb -0.07 -1.72 0.05 0.00 0.01 0.00 0.00 72.50 70.77 1afi s THR 46 CO 0.21 -0.05 0.72 2.22 -0.69 0.00 0.00 174.62 177.02 1afi n PHE 47 N 0.92 -0.78 -3.67 4.92 1.16 -0.85 -1.50 117.46 117.66 1afi n PHE 47 Ca -0.18 -0.68 -0.39 0.00 -1.87 0.00 0.00 57.45 54.33 1afi n PHE 47 Cb 0.54 0.32 -0.12 0.00 -1.61 0.00 0.00 39.48 38.62 1afi n PHE 47 CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 1afi s ASP 48 N -2.65 5.49 0.00 5.98 2.15 -1.17 -2.18 116.67 124.29 1afi s ASP 48 Ca 0.16 -0.68 0.04 0.00 0.43 0.00 0.00 52.55 52.50 1afi s ASP 48 Cb -0.01 -1.98 0.19 0.00 -0.30 0.00 0.00 42.92 40.83 1afi s ASP 48 CO 0.02 -0.24 1.00 -0.67 -0.17 0.00 0.00 175.17 175.11 1afi n ASP 49 N 4.95 0.00 0.10 -0.34 2.03 -1.03 -1.74 116.55 120.51 1afi n ASP 49 Ca -0.13 0.29 0.01 0.00 0.52 0.00 0.00 54.79 55.48 1afi n ASP 49 Cb 0.48 -0.34 -0.02 0.00 -0.72 0.00 0.00 41.12 40.52 1afi n ASP 49 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 1afi h THR 50 N 0.00 0.77 -0.00 5.18 1.35 -1.92 -3.36 112.91 114.93 1afi h THR 50 Ca 0.00 -2.19 0.00 0.00 -0.55 0.00 0.00 66.41 63.67 1afi h THR 50 Cb 0.05 2.30 0.00 0.00 -1.73 0.00 0.00 68.15 68.76 1afi h THR 50 CO 0.00 0.44 -0.12 0.29 -0.25 0.00 0.00 175.52 175.88 1afi n LYS 51 N -3.11 4.02 -3.03 4.72 4.76 -0.71 -5.08 118.16 119.73 1afi n LYS 51 Ca -0.02 -0.21 0.00 0.00 -2.87 0.00 0.00 58.31 55.20 1afi n LYS 51 Cb 0.78 -0.79 0.00 0.00 -1.84 0.00 0.00 35.03 33.18 1afi n LYS 51 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1afi n ALA 52 N -0.71 0.00 0.00 7.82 0.00 -0.72 -3.69 120.51 123.21 1afi n ALA 52 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1afi n ALA 52 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.52 1afi n ALA 52 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1afi n SER 53 N 0.09 0.00 -0.33 0.00 3.41 -1.26 -3.39 113.62 112.14 1afi n SER 53 Ca 0.00 0.00 0.30 0.00 -0.26 0.00 0.00 58.87 58.91 1afi n SER 53 Cb 0.00 0.00 0.52 0.00 -0.26 0.00 0.00 64.21 64.47 1afi n SER 53 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1afi n VAL 54 N 2.40 -0.28 0.03 -3.33 0.31 -1.26 0.52 118.33 116.73 1afi n VAL 54 Ca 0.00 1.60 -0.10 0.00 -0.01 0.00 0.00 64.34 65.82 1afi n VAL 54 Cb 0.00 -2.60 -0.04 0.00 -0.91 0.00 0.00 33.84 30.28 1afi n VAL 54 CO 0.00 0.00 0.00 -0.61 -1.32 0.00 0.00 176.83 174.90 1afi h GLN 55 N 0.00 -0.20 0.00 5.55 5.75 -2.00 -1.78 115.11 122.43 1afi h GLN 55 Ca 0.72 0.01 0.00 0.00 -0.15 0.00 0.00 58.65 59.23 1afi h GLN 55 Cb 2.10 0.05 0.00 0.00 1.07 0.00 0.00 27.48 30.70 1afi h GLN 55 CO -0.52 -0.13 -0.26 0.87 -2.65 0.00 0.00 178.83 176.14 1afi h LYS 56 N -0.21 0.00 0.11 1.69 1.79 -0.30 -2.96 116.57 116.69 1afi h LYS 56 Ca 0.06 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.53 1afi h LYS 56 Cb 0.29 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.94 1afi h LYS 56 CO -0.17 0.00 -0.05 -0.07 -1.08 0.00 0.00 179.45 178.08 1afi h LEU 57 N 0.00 -0.12 -1.44 2.94 3.38 -0.84 0.61 115.31 119.83 1afi h LEU 57 Ca 0.00 -0.44 0.01 0.00 0.09 0.00 0.00 57.88 57.54 1afi h LEU 57 Cb 0.88 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.64 1afi h LEU 57 CO 0.00 0.49 0.38 0.74 0.09 0.00 0.00 178.44 180.14 1afi h THR 58 N -0.87 1.14 0.00 0.22 2.02 -1.46 -0.86 112.91 113.10 1afi h THR 58 Ca -0.01 -0.26 -0.13 0.00 0.77 0.00 0.00 66.41 66.78 1afi h THR 58 Cb 0.56 0.31 -0.02 0.00 -1.74 0.00 0.00 68.15 67.26 1afi h THR 58 CO 0.02 0.14 -0.60 0.50 0.37 0.00 0.00 175.52 175.96 1afi h LYS 59 N 0.77 0.00 -0.22 6.66 3.64 -1.51 -0.46 116.57 125.45 1afi h LYS 59 Ca 0.21 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.48 1afi h LYS 59 Cb -0.07 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.75 1afi h LYS 59 CO -0.05 0.60 -0.29 0.00 -2.27 0.00 0.00 179.45 177.44 1afi h ALA 60 N 1.40 0.33 0.00 5.00 0.00 0.52 0.71 119.26 127.23 1afi h ALA 60 Ca -0.01 -0.40 -0.12 0.00 0.00 0.00 0.00 54.91 54.38 1afi h ALA 60 Cb 1.12 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 1afi h ALA 60 CO 0.08 0.34 -0.59 0.00 0.00 0.00 0.00 179.25 179.08 1afi h THR 61 N 0.27 1.34 -0.03 0.00 1.03 -1.36 -0.12 112.91 114.04 1afi h THR 61 Ca 0.03 -2.10 -0.10 0.00 -0.01 0.00 0.00 66.41 64.22 1afi h THR 61 Cb 0.87 2.16 -0.01 0.00 -1.07 0.00 0.00 68.15 70.09 1afi h THR 61 CO 0.07 0.58 -0.47 0.00 -0.01 0.00 0.00 175.52 175.69 1afi h ALA 62 N 1.41 1.17 0.00 0.00 0.00 -0.88 -1.50 119.26 119.45 1afi h ALA 62 Ca -0.01 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1afi h ALA 62 Cb 1.11 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1afi h ALA 62 CO 0.08 0.60 -0.57 -0.25 0.00 0.00 0.00 179.25 179.11 1afi n ASP 63 N -3.98 0.55 0.06 0.00 9.92 0.23 -3.72 116.55 119.60 1afi n ASP 63 Ca -0.02 -0.24 -0.06 0.00 -0.53 0.00 0.00 54.79 53.94 1afi n ASP 63 Cb 0.50 0.31 -0.11 0.00 -0.64 0.00 0.00 41.12 41.18 1afi n ASP 63 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1afi h ALA 64 N 2.92 0.44 0.00 2.24 0.00 -0.43 -3.47 119.26 120.96 1afi h ALA 64 Ca 0.00 -0.94 0.00 0.00 0.00 0.00 0.00 54.91 53.97 1afi h ALA 64 Cb 0.54 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1afi h ALA 64 CO 0.00 1.23 0.00 0.41 0.00 0.00 0.00 179.25 180.89 1afi n GLY 65 N 1.37 0.00 2.86 0.00 0.00 -0.96 -5.08 105.19 103.38 1afi n GLY 65 Ca -0.02 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.84 1afi n GLY 65 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1afi s TYR 66 N 0.00 -0.41 -0.78 1.61 2.02 -0.62 -4.90 117.35 114.27 1afi s TYR 66 Ca 0.00 0.58 -0.24 0.00 -0.37 0.00 0.00 57.07 57.03 1afi s TYR 66 Cb 0.00 -0.19 -0.15 0.00 -0.40 0.00 0.00 41.96 41.21 1afi s TYR 66 CO 0.00 -0.53 2.40 -2.30 -1.57 0.00 0.00 175.55 173.55 1afi n PRO 67 N 5.34 0.54 -1.49 -1.71 -0.02 -1.26 -3.22 135.00 133.17 1afi n PRO 67 Ca -0.05 -0.68 -0.01 0.00 -2.02 0.00 0.00 63.50 60.74 1afi n PRO 67 Cb 0.50 -3.39 0.00 0.00 -0.02 0.00 0.00 33.50 30.59 1afi n PRO 67 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1afi n SER 68 N 17.11 0.92 0.00 2.55 7.64 -1.25 -4.30 113.62 136.29 1afi n SER 68 Ca 0.48 -1.04 0.00 0.00 1.01 0.00 0.00 58.87 59.32 1afi n SER 68 Cb 0.41 -0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.61 1afi n SER 68 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1afi n SER 69 N -2.12 0.00 -4.12 6.43 7.64 -0.71 -4.92 113.62 115.83 1afi n SER 69 Ca -0.00 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 59.80 1afi n SER 69 Cb 0.01 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.11 1afi n SER 69 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1afi s VAL 70 N -2.98 0.26 -0.14 0.44 0.11 -1.26 -1.57 120.40 115.24 1afi s VAL 70 Ca 0.00 -1.86 0.15 0.00 -2.93 0.00 0.00 61.98 57.35 1afi s VAL 70 Cb 0.00 -1.69 0.32 0.00 -1.53 0.00 0.00 36.38 33.48 1afi s VAL 70 CO 0.00 -0.83 1.17 0.29 -3.33 0.00 0.00 175.10 172.39 1afi n LYS 71 N 0.03 1.24 0.00 1.54 5.02 -0.92 -4.84 118.16 120.23 1afi n LYS 71 Ca -0.11 -2.70 0.00 0.00 -2.02 0.00 0.00 58.31 53.47 1afi n LYS 71 Cb 0.62 -1.40 0.00 0.00 -0.02 0.00 0.00 35.03 34.22 1afi n LYS 71 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82