#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x6e s SER 2 N 0.00 -0.18 0.18 1.61 0.15 -1.26 -5.19 113.70 109.01 1x6e s SER 2 Ca 0.00 0.13 -0.10 0.00 0.70 0.00 0.00 55.95 56.69 1x6e s SER 2 Cb 0.00 0.16 -0.01 0.00 -1.71 0.00 0.00 66.02 64.46 1x6e s SER 2 CO 0.00 -0.21 0.32 -0.94 1.20 0.00 0.00 173.24 173.61 1x6e s SER 3 N -1.45 0.01 0.00 5.45 1.04 -1.26 -5.18 113.70 112.31 1x6e s SER 3 Ca 0.06 -0.87 0.00 0.00 0.48 0.00 0.00 55.95 55.62 1x6e s SER 3 Cb -0.01 0.46 0.00 0.00 0.10 0.00 0.00 66.02 66.57 1x6e s SER 3 CO -0.04 -0.93 0.00 0.61 0.98 0.00 0.00 173.24 173.86 1x6e n GLY 4 N -0.24 -0.90 3.64 7.32 0.00 -1.26 -5.18 105.19 108.57 1x6e n GLY 4 Ca -0.07 -1.08 -0.05 0.00 0.00 0.00 0.00 46.02 44.83 1x6e n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x6e s SER 5 N 0.00 -0.19 0.20 1.61 0.15 -1.26 -5.19 113.70 109.02 1x6e s SER 5 Ca 0.00 0.37 -0.08 0.00 0.70 0.00 0.00 55.95 56.94 1x6e s SER 5 Cb 0.00 0.37 -0.02 0.00 -1.71 0.00 0.00 66.02 64.67 1x6e s SER 5 CO 0.00 -0.06 0.29 -0.94 1.20 0.00 0.00 173.24 173.73 1x6e s SER 6 N 0.09 0.04 -0.26 5.45 1.04 -1.26 -5.15 113.70 113.65 1x6e s SER 6 Ca 0.06 -1.03 -0.01 0.00 0.48 0.00 0.00 55.95 55.45 1x6e s SER 6 Cb -0.05 0.46 0.14 0.00 0.10 0.00 0.00 66.02 66.67 1x6e s SER 6 CO -0.12 -0.95 0.37 -0.83 0.98 0.00 0.00 173.24 172.69 1x6e s GLY 7 N -3.03 -0.40 -0.20 7.32 0.00 -1.26 -5.03 107.32 104.71 1x6e s GLY 7 Ca 0.24 0.53 -0.16 0.00 0.00 0.00 0.00 44.72 45.33 1x6e s GLY 7 CO 0.06 2.74 -0.16 1.39 0.00 0.00 0.00 173.10 177.13 1x6e n ILE 8 N 5.35 1.49 -3.88 0.90 5.41 -1.26 -4.97 119.36 122.40 1x6e n ILE 8 Ca -0.02 0.00 -0.27 0.00 1.00 0.00 0.00 62.75 63.46 1x6e n ILE 8 Cb 0.49 -2.18 -0.04 0.00 -0.71 0.00 0.00 39.64 37.21 1x6e n ILE 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1x6e n HIS 9 N -4.45 -0.93 -3.68 1.39 1.44 -1.26 -4.87 115.22 102.86 1x6e n HIS 9 Ca -0.26 0.29 -0.36 0.00 -2.01 0.00 0.00 57.72 55.38 1x6e n HIS 9 Cb 0.57 -2.00 -0.08 0.00 0.12 0.00 0.00 29.99 28.60 1x6e n HIS 9 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 1x6e s SER 10 N -3.98 6.22 0.00 4.39 0.15 -1.26 -4.94 113.70 114.28 1x6e s SER 10 Ca 0.13 0.24 0.00 0.00 0.70 0.00 0.00 55.95 57.02 1x6e s SER 10 Cb -0.08 -2.11 0.00 0.00 -1.71 0.00 0.00 66.02 62.13 1x6e s SER 10 CO 0.72 0.13 0.00 0.61 1.20 0.00 0.00 173.24 175.90 1x6e n GLY 11 N 3.73 -0.33 0.08 9.45 0.00 -1.26 -5.08 105.19 111.78 1x6e n GLY 11 Ca -0.15 0.36 -0.17 0.00 0.00 0.00 0.00 46.02 46.06 1x6e n GLY 11 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1x6e h GLU 12 N 0.00 0.02 -3.53 1.61 4.11 -2.03 -3.45 114.58 111.31 1x6e h GLU 12 Ca 0.00 -0.03 -0.36 0.00 0.07 0.00 0.00 59.36 59.04 1x6e h GLU 12 Cb 0.00 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.20 1x6e h GLU 12 CO 0.00 1.02 1.22 1.63 0.07 0.00 0.00 179.01 182.95 1x6e n LYS 13 N -4.51 0.00 0.00 1.06 5.02 -1.26 -4.69 118.16 113.77 1x6e n LYS 13 Ca -0.17 0.00 0.07 0.00 -2.02 0.00 0.00 58.31 56.19 1x6e n LYS 13 Cb 0.57 -1.05 0.37 0.00 -0.02 0.00 0.00 35.03 34.90 1x6e n LYS 13 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1x6e n PRO 14 N 5.93 0.21 -3.78 1.97 -0.04 -1.26 -4.47 135.00 133.56 1x6e n PRO 14 Ca 0.46 0.15 -0.37 0.00 -0.04 0.00 0.00 63.50 63.70 1x6e n PRO 14 Cb 0.02 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 31.86 1x6e n PRO 14 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1x6e s TYR 15 N -2.58 3.32 -0.07 0.54 1.51 -1.26 -5.06 117.35 113.75 1x6e s TYR 15 Ca 0.14 -1.71 0.02 0.00 -1.01 0.00 0.00 57.07 54.51 1x6e s TYR 15 Cb 0.10 -2.44 -0.02 0.00 -0.11 0.00 0.00 41.96 39.49 1x6e s TYR 15 CO 0.23 -0.80 -0.14 0.20 -1.11 0.00 0.00 175.55 173.93 1x6e s GLY 16 N 1.50 1.53 0.60 0.71 0.00 -1.26 -0.29 107.32 110.11 1x6e s GLY 16 Ca -0.01 -0.95 -0.17 0.00 0.00 0.00 0.00 44.72 43.59 1x6e s GLY 16 CO 0.01 -0.59 1.10 0.00 0.00 0.00 0.00 173.10 173.61 1x6e n VAL 18 N -1.91 0.00 0.01 0.00 3.14 -1.26 -2.87 118.33 115.43 1x6e n VAL 18 Ca 0.10 -0.32 -0.19 0.00 -2.96 0.00 0.00 64.34 60.98 1x6e n VAL 18 Cb 0.52 0.24 -0.09 0.00 -1.06 0.00 0.00 33.84 33.45 1x6e n VAL 18 CO 0.00 0.00 0.00 -0.33 -6.46 0.00 0.00 176.83 170.04 1x6e h GLU 19 N 0.00 0.73 0.00 1.45 4.39 -1.97 -3.41 114.58 115.77 1x6e h GLU 19 Ca 0.00 -0.68 0.00 0.00 0.34 0.00 0.00 59.36 59.02 1x6e h GLU 19 Cb 0.64 0.17 0.00 0.00 -0.10 0.00 0.00 28.75 29.46 1x6e h GLU 19 CO 0.00 1.28 -0.43 0.00 -1.16 0.00 0.00 179.01 178.69 1x6e n GLY 21 N 1.97 0.80 2.48 0.00 0.00 -1.14 -5.02 105.19 104.28 1x6e n GLY 21 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1x6e n GLY 21 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1x6e n LYS 22 N 0.00 0.00 -4.01 1.61 4.76 -1.26 -2.81 118.16 116.45 1x6e n LYS 22 Ca 0.00 0.00 -0.34 0.00 -2.87 0.00 0.00 58.31 55.10 1x6e n LYS 22 Cb 0.00 -1.03 -0.06 0.00 -1.84 0.00 0.00 35.03 32.10 1x6e n LYS 22 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1x6e s ALA 23 N 0.81 3.75 -0.15 7.82 0.00 -1.26 -0.38 121.76 132.36 1x6e s ALA 23 Ca 0.66 -0.79 -0.03 0.00 0.00 0.00 0.00 51.96 51.80 1x6e s ALA 23 Cb -0.94 -1.75 0.05 0.00 0.00 0.00 0.00 23.12 20.49 1x6e s ALA 23 CO 0.46 0.70 0.05 -0.06 0.00 0.00 0.00 175.76 176.91 1x6e s PHE 24 N -1.21 0.63 0.62 0.00 0.08 0.60 -4.98 117.98 113.72 1x6e s PHE 24 Ca 0.23 -0.47 0.23 0.00 0.12 0.00 0.00 56.93 57.04 1x6e s PHE 24 Cb -0.12 -0.84 0.97 0.00 -0.57 0.00 0.00 43.02 42.46 1x6e s PHE 24 CO 0.14 -0.49 1.46 0.66 -0.10 0.00 0.00 175.22 176.89 1x6e h SER 25 N 8.33 0.00 -3.57 1.36 4.64 -1.88 -3.36 113.55 119.07 1x6e h SER 25 Ca -0.16 0.00 -0.67 0.00 -0.47 0.00 0.00 61.79 60.49 1x6e h SER 25 Cb 1.13 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 63.02 1x6e h SER 25 CO 0.29 0.00 -0.69 -0.13 -0.87 0.00 0.00 176.83 175.43 1x6e s ARG 26 N -4.36 2.98 0.15 4.77 1.81 -1.26 -4.72 118.95 118.32 1x6e s ARG 26 Ca -0.03 -0.55 -0.11 0.00 -1.72 0.00 0.00 55.73 53.31 1x6e s ARG 26 Cb 0.11 -2.66 0.00 0.00 -0.45 0.00 0.00 34.95 31.96 1x6e s ARG 26 CO 0.38 0.54 1.56 0.66 -0.68 0.00 0.00 175.30 177.76 1x6e h SER 27 N 5.65 0.93 -0.80 0.23 4.64 -1.97 -2.92 113.55 119.32 1x6e h SER 27 Ca -0.43 -0.36 0.03 0.00 -0.47 0.00 0.00 61.79 60.55 1x6e h SER 27 Cb 1.18 -0.25 -0.05 0.00 -0.31 0.00 0.00 62.40 62.97 1x6e h SER 27 CO 0.55 1.08 0.51 -1.28 -0.87 0.00 0.00 176.83 176.82 1x6e h SER 28 N 0.77 0.85 0.20 4.97 0.87 -1.95 -1.11 113.55 118.15 1x6e h SER 28 Ca 0.12 -0.00 -0.04 0.00 -1.23 0.00 0.00 61.79 60.64 1x6e h SER 28 Cb 0.68 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.44 1x6e h SER 28 CO 0.05 0.58 -0.17 0.40 -0.53 0.00 0.00 176.83 177.16 1x6e h ILE 29 N 1.00 1.05 -0.08 2.23 2.04 -1.90 -2.52 117.51 119.33 1x6e h ILE 29 Ca 0.32 -0.61 -0.12 0.00 1.00 0.00 0.00 64.86 65.45 1x6e h ILE 29 Cb 0.01 1.33 0.01 0.00 -0.74 0.00 0.00 36.82 37.43 1x6e h ILE 29 CO -0.11 0.17 -0.41 0.25 0.00 0.00 0.00 178.15 178.05 1x6e h LEU 30 N 0.00 0.50 -0.34 1.44 5.85 -1.05 -2.74 115.31 118.97 1x6e h LEU 30 Ca -0.00 -0.65 0.03 0.00 0.84 0.00 0.00 57.88 58.10 1x6e h LEU 30 Cb 0.32 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.17 1x6e h LEU 30 CO 0.02 1.07 0.15 0.58 -0.34 0.00 0.00 178.44 179.92 1x6e h VAL 31 N -0.04 0.95 -0.36 1.05 2.07 -1.06 -0.39 116.25 118.46 1x6e h VAL 31 Ca -0.03 -0.11 -0.03 0.00 0.82 0.00 0.00 66.70 67.36 1x6e h VAL 31 Cb 1.06 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 31.42 1x6e h VAL 31 CO 0.08 0.06 0.11 0.06 0.02 0.00 0.00 177.57 177.90 1x6e h GLN 32 N 0.31 0.52 0.00 1.57 3.07 -1.53 -0.76 115.11 118.29 1x6e h GLN 32 Ca 0.15 -0.08 0.00 0.00 0.09 0.00 0.00 58.65 58.81 1x6e h GLN 32 Cb 0.09 -0.09 0.00 0.00 0.08 0.00 0.00 27.48 27.55 1x6e h GLN 32 CO -0.13 0.47 0.00 1.58 0.09 0.00 0.00 178.83 180.84 1x6e n HIS 33 N -4.36 0.00 -0.07 0.06 -0.00 -0.74 -3.68 115.22 106.44 1x6e n HIS 33 Ca 0.02 0.00 -0.18 0.00 0.46 0.00 0.00 57.72 58.03 1x6e n HIS 33 Cb 0.17 -0.48 -0.13 0.00 -0.12 0.00 0.00 29.99 29.43 1x6e n HIS 33 CO 0.00 0.00 0.00 1.96 0.46 0.00 0.00 176.34 178.76 1x6e h GLN 34 N 0.00 0.03 -0.48 1.57 4.20 0.42 -3.37 115.11 117.48 1x6e h GLN 34 Ca 0.00 -0.05 0.10 0.00 0.06 0.00 0.00 58.65 58.75 1x6e h GLN 34 Cb 0.47 0.02 -0.09 0.00 0.30 0.00 0.00 27.48 28.18 1x6e h GLN 34 CO 0.00 1.03 -0.14 0.00 -0.67 0.00 0.00 178.83 179.04 1x6e h ARG 35 N -0.92 -0.03 -0.78 1.46 3.08 -1.56 -0.75 114.38 114.87 1x6e h ARG 35 Ca -0.15 0.00 0.32 0.00 0.07 0.00 0.00 59.98 60.22 1x6e h ARG 35 Cb 1.19 0.01 -0.14 0.00 0.08 0.00 0.00 29.97 31.10 1x6e h ARG 35 CO -0.06 -0.02 0.37 1.33 -1.07 0.00 0.00 179.97 180.52 1x6e n VAL 36 N -5.37 -0.33 0.20 2.04 0.24 -1.25 0.83 118.33 114.70 1x6e n VAL 36 Ca 0.04 1.61 -0.15 0.00 -2.04 0.00 0.00 64.34 63.80 1x6e n VAL 36 Cb 0.27 -2.58 -0.07 0.00 -1.47 0.00 0.00 33.84 29.99 1x6e n VAL 36 CO 0.00 0.00 0.00 0.45 -2.14 0.00 0.00 176.83 175.14 1x6e h HIS 37 N 0.00 -0.85 0.00 6.34 3.86 -1.33 -2.26 115.15 120.92 1x6e h HIS 37 Ca 0.64 0.01 -0.05 0.00 -1.16 0.00 0.00 60.37 59.81 1x6e h HIS 37 Cb 1.67 0.33 -0.01 0.00 1.06 0.00 0.00 27.41 30.46 1x6e h HIS 37 CO -0.06 -0.45 -0.26 0.00 0.86 0.00 0.00 177.93 178.02 1x6e h THR 38 N -0.66 1.15 0.00 2.45 1.03 0.33 -3.48 112.91 113.74 1x6e h THR 38 Ca -0.01 -0.90 0.00 0.00 -0.01 0.00 0.00 66.41 65.49 1x6e h THR 38 Cb 0.60 1.49 0.00 0.00 -1.07 0.00 0.00 68.15 69.17 1x6e h THR 38 CO -0.07 0.25 0.00 0.61 -0.01 0.00 0.00 175.52 176.30 1x6e n GLY 39 N -0.75 4.20 1.18 2.99 0.00 -0.12 -5.14 105.19 107.55 1x6e n GLY 39 Ca -0.02 -1.48 -0.08 0.00 0.00 0.00 0.00 46.02 44.43 1x6e n GLY 39 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1x6e n GLU 40 N -1.68 0.59 -3.38 1.61 0.28 -1.26 -4.43 120.64 112.37 1x6e n GLU 40 Ca 0.00 -1.22 -0.32 0.00 -0.16 0.00 0.00 57.16 55.46 1x6e n GLU 40 Cb 0.00 0.77 -0.06 0.00 1.43 0.00 0.00 31.44 33.58 1x6e n GLU 40 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1x6e n LYS 41 N -0.30 2.98 0.01 3.44 4.01 -1.26 -4.17 118.16 122.87 1x6e n LYS 41 Ca -0.01 -4.61 -0.07 0.00 -0.51 0.00 0.00 58.31 53.11 1x6e n LYS 41 Cb 0.22 -2.34 0.12 0.00 -0.51 0.00 0.00 35.03 32.51 1x6e n LYS 41 CO 0.00 0.00 0.00 -1.00 -1.11 0.00 0.00 177.40 175.29 1x6e h PRO 42 N 4.77 0.49 -6.20 1.97 0.13 -1.86 -3.38 132.00 127.93 1x6e h PRO 42 Ca 0.19 -0.26 -0.54 0.00 -0.87 0.00 0.00 66.00 64.52 1x6e h PRO 42 Cb 0.67 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 31.78 1x6e h PRO 42 CO 0.95 0.84 1.26 0.71 -0.23 0.00 0.00 178.00 181.54 1x6e s TYR 43 N -4.16 1.87 0.23 1.56 2.02 -1.23 -4.93 117.35 112.71 1x6e s TYR 43 Ca -0.07 0.68 0.06 0.00 -0.37 0.00 0.00 57.07 57.37 1x6e s TYR 43 Cb 0.12 -4.16 -0.03 0.00 -0.40 0.00 0.00 41.96 37.49 1x6e s TYR 43 CO 0.82 -2.49 0.27 0.21 -1.57 0.00 0.00 175.55 172.79 1x6e s LYS 44 N 6.09 3.20 -0.37 -0.62 2.20 -1.26 -1.14 119.74 127.84 1x6e s LYS 44 Ca 0.70 -0.86 -0.16 0.00 -0.36 0.00 0.00 55.97 55.28 1x6e s LYS 44 Cb -0.16 -2.75 0.00 0.00 -1.51 0.00 0.00 37.83 33.40 1x6e s LYS 44 CO 0.28 0.43 0.41 0.00 -0.36 0.00 0.00 175.35 176.11 1x6e n LEU 46 N 5.52 1.55 -0.11 0.00 4.77 -1.26 -2.14 117.00 125.33 1x6e n LEU 46 Ca -0.08 -0.78 -0.20 0.00 -0.03 0.00 0.00 56.01 54.92 1x6e n LEU 46 Cb 0.49 -0.38 -0.09 0.00 -2.33 0.00 0.00 43.42 41.11 1x6e n LEU 46 CO 0.43 0.28 -1.25 1.21 -1.33 0.00 0.00 177.39 176.73 1x6e n GLU 47 N 0.06 0.51 0.00 3.23 4.07 -1.26 -4.91 120.64 122.34 1x6e n GLU 47 Ca 0.05 0.17 0.00 0.00 -0.06 0.00 0.00 57.16 57.33 1x6e n GLU 47 Cb 0.33 -1.36 0.00 0.00 -0.06 0.00 0.00 31.44 30.35 1x6e n GLU 47 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1x6e n GLY 49 N 2.60 0.66 3.21 0.00 0.00 -0.91 -5.07 105.19 105.68 1x6e n GLY 49 Ca 0.00 -0.37 -0.11 0.00 0.00 0.00 0.00 46.02 45.54 1x6e n GLY 49 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x6e s LYS 50 N 0.00 0.74 0.01 1.61 -0.14 -1.25 -4.90 119.74 115.80 1x6e s LYS 50 Ca 0.00 -0.56 0.07 0.00 -1.36 0.00 0.00 55.97 54.12 1x6e s LYS 50 Cb 0.00 0.31 -0.03 0.00 -1.68 0.00 0.00 37.83 36.44 1x6e s LYS 50 CO 0.00 -0.22 -0.22 0.00 -0.76 0.00 0.00 175.35 174.15 1x6e s ALA 51 N -2.50 2.40 0.00 5.17 0.00 -1.26 0.92 121.76 126.49 1x6e s ALA 51 Ca -0.05 -1.15 0.01 0.00 0.00 0.00 0.00 51.96 50.76 1x6e s ALA 51 Cb -0.01 -0.67 -0.01 0.00 0.00 0.00 0.00 23.12 22.44 1x6e s ALA 51 CO -0.03 0.55 -0.03 -0.06 0.00 0.00 0.00 175.76 176.19 1x6e s PHE 52 N -0.77 0.23 0.25 0.00 0.40 -0.29 -4.99 117.98 112.81 1x6e s PHE 52 Ca 0.12 -0.12 -0.03 0.00 -0.60 0.00 0.00 56.93 56.30 1x6e s PHE 52 Cb -0.10 -0.15 0.31 0.00 0.51 0.00 0.00 43.02 43.59 1x6e s PHE 52 CO 0.02 -0.03 1.76 1.03 0.70 0.00 0.00 175.22 178.70 1x6e h SER 53 N 5.82 0.81 -2.06 1.36 0.87 -1.87 -3.26 113.55 115.22 1x6e h SER 53 Ca -0.27 -0.19 -0.56 0.00 -1.23 0.00 0.00 61.79 59.54 1x6e h SER 53 Cb 1.20 -0.21 -0.09 0.00 -0.44 0.00 0.00 62.40 62.86 1x6e h SER 53 CO 0.49 0.85 -0.62 -1.10 -0.53 0.00 0.00 176.83 175.92 1x6e s GLN 54 N -5.06 2.24 -0.07 2.24 -0.21 -1.26 -4.75 119.66 112.80 1x6e s GLN 54 Ca -0.10 -1.54 -0.15 0.00 0.02 0.00 0.00 55.36 53.59 1x6e s GLN 54 Cb 0.15 -2.10 -0.30 0.00 1.00 0.00 0.00 33.01 31.76 1x6e s GLN 54 CO 0.81 0.25 0.68 -0.97 -2.12 0.00 0.00 175.29 173.95 1x6e h ASN 55 N 1.80 0.51 -0.30 5.90 -0.00 -1.96 -3.24 115.58 118.29 1x6e h ASN 55 Ca -0.44 -0.90 0.09 0.00 -0.00 0.00 0.00 56.30 55.05 1x6e h ASN 55 Cb 1.25 -0.17 -0.01 0.00 -0.00 0.00 0.00 38.32 39.39 1x6e h ASN 55 CO 0.62 1.64 0.52 0.28 -0.00 0.00 0.00 177.43 180.50 1x6e h SER 56 N -0.15 0.00 0.11 1.15 0.02 -1.99 0.13 113.55 112.82 1x6e h SER 56 Ca -0.29 0.00 -0.31 0.00 -0.84 0.00 0.00 61.79 60.35 1x6e h SER 56 Cb 1.88 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 64.41 1x6e h SER 56 CO 0.13 0.00 -1.64 1.23 -1.14 0.00 0.00 176.83 175.41 1x6e h GLY 57 N 0.00 0.27 0.94 -3.77 0.00 -1.99 -3.32 103.07 95.20 1x6e h GLY 57 Ca 0.14 -0.69 -0.01 0.00 0.00 0.00 0.00 47.33 46.77 1x6e h GLY 57 CO -0.00 0.60 0.15 -2.00 0.00 0.00 0.00 176.54 175.30 1x6e h LEU 58 N -0.22 0.41 -0.08 3.11 5.85 -1.05 -2.53 115.31 120.79 1x6e h LEU 58 Ca -0.36 -0.12 0.04 0.00 0.84 0.00 0.00 57.88 58.28 1x6e h LEU 58 Cb 1.83 -0.10 -0.06 0.00 0.37 0.00 0.00 40.66 42.70 1x6e h LEU 58 CO 0.05 0.41 -0.33 0.40 -0.34 0.00 0.00 178.44 178.63 1x6e h ILE 59 N 0.37 0.28 -0.02 4.05 2.04 -1.37 0.17 117.51 123.04 1x6e h ILE 59 Ca 0.11 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.97 1x6e h ILE 59 Cb 0.11 0.28 -0.00 0.00 -0.74 0.00 0.00 36.82 36.47 1x6e h ILE 59 CO -0.01 0.00 0.06 0.78 0.00 0.00 0.00 178.15 178.98 1x6e h ASN 60 N -0.43 0.00 0.26 1.72 2.35 -1.63 0.37 115.58 118.21 1x6e h ASN 60 Ca 0.08 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 1x6e h ASN 60 Cb 0.56 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.93 1x6e h ASN 60 CO -0.32 0.00 -0.28 1.57 -1.65 0.00 0.00 177.43 176.75 1x6e n HIS 61 N -3.27 0.00 -0.09 1.19 -0.00 0.45 -3.86 115.22 109.64 1x6e n HIS 61 Ca -0.02 0.00 -0.09 0.00 0.46 0.00 0.00 57.72 58.06 1x6e n HIS 61 Cb 0.14 -0.13 -0.13 0.00 -0.12 0.00 0.00 29.99 29.75 1x6e n HIS 61 CO 0.00 0.00 0.00 1.04 0.46 0.00 0.00 176.34 177.84 1x6e n GLN 62 N -0.71 1.14 0.23 1.57 6.02 0.12 -4.37 117.38 121.37 1x6e n GLN 62 Ca 0.12 0.01 0.11 0.00 -0.01 0.00 0.00 57.00 57.22 1x6e n GLN 62 Cb 0.35 -1.44 0.51 0.00 1.02 0.00 0.00 30.24 30.68 1x6e n GLN 62 CO 0.00 0.00 0.00 0.07 -1.01 0.00 0.00 177.06 176.12 1x6e h ARG 63 N 0.00 0.00 -0.70 -1.09 0.11 -1.41 -3.02 114.38 108.27 1x6e h ARG 63 Ca -0.47 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 59.59 1x6e h ARG 63 Cb 2.02 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 33.07 1x6e h ARG 63 CO 0.01 0.20 0.35 -0.84 0.10 0.00 0.00 179.97 179.80 1x6e h ILE 64 N 0.00 1.23 0.26 0.08 3.07 -1.76 -2.78 117.51 117.61 1x6e h ILE 64 Ca -0.00 -0.61 -0.01 0.00 1.55 0.00 0.00 64.86 65.78 1x6e h ILE 64 Cb 0.68 0.35 0.00 0.00 -0.27 0.00 0.00 36.82 37.58 1x6e h ILE 64 CO 0.03 0.26 -0.13 0.45 -1.05 0.00 0.00 178.15 177.71 1x6e h HIS 65 N 0.97 -0.33 -0.93 0.16 -0.00 -1.77 -3.23 115.15 110.02 1x6e h HIS 65 Ca 0.24 -0.01 0.21 0.00 -0.00 0.00 0.00 60.37 60.82 1x6e h HIS 65 Cb 0.09 0.11 -0.17 0.00 -0.00 0.00 0.00 27.41 27.44 1x6e h HIS 65 CO 0.00 0.03 -0.11 1.79 -0.00 0.00 0.00 177.93 179.64 1x6e h THR 66 N -0.78 0.09 -0.36 2.45 1.35 -1.51 -3.23 112.91 110.93 1x6e h THR 66 Ca -0.04 -0.01 -0.21 0.00 -0.55 0.00 0.00 66.41 65.61 1x6e h THR 66 Cb 0.51 0.07 -0.03 0.00 -1.73 0.00 0.00 68.15 66.97 1x6e h THR 66 CO 0.06 0.00 0.66 -0.55 -0.25 0.00 0.00 175.52 175.44 1x6e s SER 67 N -5.16 4.44 0.45 5.36 0.15 -1.05 -4.92 113.70 112.96 1x6e s SER 67 Ca -0.14 -1.28 -0.22 0.00 0.70 0.00 0.00 55.95 55.01 1x6e s SER 67 Cb 0.26 -2.59 -0.08 0.00 -1.71 0.00 0.00 66.02 61.90 1x6e s SER 67 CO 0.77 -3.67 1.06 -0.83 1.20 0.00 0.00 173.24 171.77 1x6e s GLY 68 N 7.50 2.65 0.24 9.45 0.00 -1.22 -4.93 107.32 121.01 1x6e s GLY 68 Ca 0.74 0.70 0.23 0.00 0.00 0.00 0.00 44.72 46.39 1x6e s GLY 68 CO 0.14 1.09 1.69 -1.55 0.00 0.00 0.00 173.10 174.47 1x6e n PRO 69 N -0.51 0.18 -2.46 2.90 -0.04 -1.26 -4.77 135.00 129.03 1x6e n PRO 69 Ca 0.07 0.42 -0.37 0.00 -0.04 0.00 0.00 63.50 63.58 1x6e n PRO 69 Cb 0.51 -1.85 -0.03 0.00 -0.04 0.00 0.00 33.50 32.08 1x6e n PRO 69 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1x6e s SER 70 N -4.16 6.57 -0.91 3.54 0.15 -1.26 -3.70 113.70 113.93 1x6e s SER 70 Ca 0.04 2.11 -0.03 0.00 0.70 0.00 0.00 55.95 58.78 1x6e s SER 70 Cb 0.09 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.82 1x6e s SER 70 CO 0.38 -0.62 0.77 -0.24 1.20 0.00 0.00 173.24 174.73 1x6e n SER 71 N -0.22 -3.38 0.00 5.45 2.88 -1.26 -5.17 113.62 111.92 1x6e n SER 71 Ca 0.06 -0.42 0.00 0.00 -1.33 0.00 0.00 58.87 57.18 1x6e n SER 71 Cb 0.49 -3.79 0.00 0.00 -0.75 0.00 0.00 64.21 60.16 1x6e n SER 71 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42