#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 1.55 -0.15 1.61 1.04 -1.26 -5.09 113.70 111.41 1x6e s SER 2 Ca 0.00 -1.21 -0.10 0.00 0.48 0.00 0.00 55.95 55.12 1x6e s SER 2 Cb 0.00 0.06 -0.06 0.00 0.10 0.00 0.00 66.02 66.12 1x6e s SER 2 CO 0.00 -0.54 -0.23 -1.20 0.98 0.00 0.00 173.24 172.25 1x6e n SER 3 N -0.35 1.40 0.00 7.02 7.64 -1.26 -5.14 113.62 122.93 1x6e n SER 3 Ca -0.05 0.23 0.00 0.00 1.01 0.00 0.00 58.87 60.06 1x6e n SER 3 Cb 0.64 -0.55 0.00 0.00 -1.01 0.00 0.00 64.21 63.28 1x6e n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x6e n GLY 4 N 1.98 0.26 3.62 0.23 0.00 -1.26 -5.07 105.19 104.95 1x6e n GLY 4 Ca -0.26 -2.09 -0.13 0.00 0.00 0.00 0.00 46.02 43.53 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 -4.00 -0.67 -0.30 1.61 0.15 -1.26 -5.15 113.70 104.08 1x6e s SER 5 Ca 0.00 1.24 -0.12 0.00 0.70 0.00 0.00 55.95 57.76 1x6e s SER 5 Cb 0.00 1.24 0.18 0.00 -1.71 0.00 0.00 66.02 65.72 1x6e s SER 5 CO 0.00 -0.26 1.03 -0.55 1.20 0.00 0.00 173.24 174.66 1x6e s SER 6 N 0.18 -0.50 -0.33 5.45 0.15 -1.26 -5.13 113.70 112.26 1x6e s SER 6 Ca -0.00 0.30 0.01 0.00 0.70 0.00 0.00 55.95 56.95 1x6e s SER 6 Cb -0.04 1.41 0.08 0.00 -1.71 0.00 0.00 66.02 65.76 1x6e s SER 6 CO 0.00 -0.09 0.04 -0.83 1.20 0.00 0.00 173.24 173.56 1x6e s GLY 7 N 2.95 1.84 -0.55 9.45 0.00 -1.26 -5.05 107.32 114.70 1x6e s GLY 7 Ca 0.01 -2.15 -0.05 0.00 0.00 0.00 0.00 44.72 42.53 1x6e s GLY 7 CO -0.12 0.82 0.37 -0.42 0.00 0.00 0.00 173.10 173.75 1x6e s ILE 8 N 1.10 3.80 -0.69 0.90 1.01 -1.26 -4.94 121.20 121.12 1x6e s ILE 8 Ca 0.01 -2.45 -0.01 0.00 0.00 0.00 0.00 60.65 58.20 1x6e s ILE 8 Cb -0.20 -3.50 0.42 0.00 0.01 0.00 0.00 42.46 39.18 1x6e s ILE 8 CO -0.04 -0.81 1.93 0.00 0.00 0.00 0.00 174.94 176.01 1x6e n HIS 9 N 4.10 3.12 -3.16 3.97 1.44 -1.26 -4.98 115.22 118.45 1x6e n HIS 9 Ca 0.02 -2.74 -0.39 0.00 -2.01 0.00 0.00 57.72 52.60 1x6e n HIS 9 Cb 0.40 -1.22 -0.05 0.00 0.12 0.00 0.00 29.99 29.23 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 -1.79 6.95 0.00 4.39 0.15 -1.26 -4.98 113.70 117.16 1x6e s SER 10 Ca 0.59 1.14 0.00 0.00 0.70 0.00 0.00 55.95 58.38 1x6e s SER 10 Cb 0.47 -2.37 0.00 0.00 -1.71 0.00 0.00 66.02 62.41 1x6e s SER 10 CO -0.15 0.02 0.00 0.61 1.20 0.00 0.00 173.24 174.92 1x6e n GLY 11 N 2.75 3.57 1.96 9.45 0.00 -1.26 -4.98 105.19 116.68 1x6e n GLY 11 Ca -0.05 -0.37 -0.13 0.00 0.00 0.00 0.00 46.02 45.46 1x6e n GLY 11 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1x6e n GLU 12 N 0.00 1.80 -3.55 1.61 4.71 -1.26 -4.77 120.64 119.18 1x6e n GLU 12 Ca 0.00 -1.15 -0.41 0.00 -0.01 0.00 0.00 57.16 55.59 1x6e n GLU 12 Cb 0.00 -1.71 -0.07 0.00 -1.01 0.00 0.00 31.44 28.66 1x6e n GLU 12 CO 0.00 0.00 0.00 0.15 0.09 0.00 0.00 177.13 177.37 1x6e s LYS 13 N -0.39 2.97 0.00 3.49 1.02 -1.26 -4.66 119.74 120.90 1x6e s LYS 13 Ca 0.41 -2.45 0.15 0.00 0.02 0.00 0.00 55.97 54.11 1x6e s LYS 13 Cb 0.24 -4.02 0.83 0.00 -0.52 0.00 0.00 37.83 34.36 1x6e s LYS 13 CO -0.05 -1.22 1.38 -0.35 -0.92 0.00 0.00 175.35 174.18 1x6e n PRO 14 N 3.79 0.34 -4.26 -1.68 -0.04 -1.26 -4.58 135.00 127.30 1x6e n PRO 14 Ca 0.09 0.08 -0.34 0.00 -0.04 0.00 0.00 63.50 63.29 1x6e n PRO 14 Cb 0.42 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.23 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 -2.30 2.86 0.05 0.54 1.51 -1.23 -5.06 117.35 113.73 1x6e s TYR 15 Ca 0.18 -0.99 0.07 0.00 -1.01 0.00 0.00 57.07 55.33 1x6e s TYR 15 Cb 0.10 -1.97 -0.03 0.00 -0.11 0.00 0.00 41.96 39.95 1x6e s TYR 15 CO 0.20 -0.49 -0.21 0.20 -1.11 0.00 0.00 175.55 174.15 1x6e s GLY 16 N 1.05 1.14 0.38 0.71 0.00 -1.26 -0.74 107.32 108.59 1x6e s GLY 16 Ca -0.00 -1.09 -0.23 0.00 0.00 0.00 0.00 44.72 43.40 1x6e s GLY 16 CO -0.02 -1.03 0.94 0.00 0.00 0.00 0.00 173.10 172.99 1x6e n VAL 18 N -0.15 0.69 -0.23 0.00 3.14 -1.26 -2.59 118.33 117.92 1x6e n VAL 18 Ca 0.05 -0.65 -0.08 0.00 -2.96 0.00 0.00 64.34 60.70 1x6e n VAL 18 Cb 0.52 -0.25 0.04 0.00 -1.06 0.00 0.00 33.84 33.09 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 1.02 0.00 1.45 4.39 -1.96 -3.41 114.58 116.08 1x6e h GLU 19 Ca -0.27 -0.23 0.00 0.00 0.34 0.00 0.00 59.36 59.19 1x6e h GLU 19 Cb 1.60 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 30.10 1x6e h GLU 19 CO 0.01 0.91 -0.26 0.00 -1.16 0.00 0.00 179.01 178.51 1x6e n GLY 21 N 2.00 1.29 2.32 0.00 0.00 -1.07 -5.02 105.19 104.71 1x6e n GLY 21 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1x6e n GLY 21 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1x6e n LYS 22 N 0.00 0.00 -4.35 1.61 3.00 -1.26 -2.74 118.16 114.43 1x6e n LYS 22 Ca 0.00 0.00 -0.31 0.00 -0.00 0.00 0.00 58.31 58.00 1x6e n LYS 22 Cb 0.00 -0.98 -0.10 0.00 0.00 0.00 0.00 35.03 33.95 1x6e n LYS 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1x6e s ALA 23 N 0.33 2.97 -0.01 3.14 0.00 -1.26 0.12 121.76 127.05 1x6e s ALA 23 Ca 0.61 -1.15 0.01 0.00 0.00 0.00 0.00 51.96 51.43 1x6e s ALA 23 Cb -0.86 -0.99 0.00 0.00 0.00 0.00 0.00 23.12 21.28 1x6e s ALA 23 CO 0.40 0.63 -0.03 -0.06 0.00 0.00 0.00 175.76 176.70 1x6e s PHE 24 N -1.12 0.30 0.44 0.00 0.08 0.08 -4.98 117.98 112.79 1x6e s PHE 24 Ca 0.20 -0.05 0.20 0.00 0.12 0.00 0.00 56.93 57.39 1x6e s PHE 24 Cb -0.11 -0.23 1.16 0.00 -0.57 0.00 0.00 43.02 43.27 1x6e s PHE 24 CO 0.11 -0.02 1.88 0.77 -0.10 0.00 0.00 175.22 177.85 1x6e h SER 25 N 6.25 0.32 -1.79 1.36 0.02 -1.84 -3.25 113.55 114.62 1x6e h SER 25 Ca -0.29 0.03 -0.58 0.00 -0.84 0.00 0.00 61.79 60.12 1x6e h SER 25 Cb 1.19 -0.03 -0.10 0.00 0.14 0.00 0.00 62.40 63.60 1x6e h SER 25 CO 0.50 0.13 -0.56 -0.13 -1.14 0.00 0.00 176.83 175.63 1x6e s ARG 26 N -5.33 2.16 -0.11 3.45 3.00 -1.26 -4.54 118.95 116.31 1x6e s ARG 26 Ca -0.07 -1.78 -0.06 0.00 0.00 0.00 0.00 55.73 53.81 1x6e s ARG 26 Cb 0.22 -1.96 -0.05 0.00 0.00 0.00 0.00 34.95 33.16 1x6e s ARG 26 CO 0.78 0.03 0.11 1.03 0.00 0.00 0.00 175.30 177.24 1x6e h SER 27 N 1.64 0.00 -0.85 0.23 0.87 -1.97 -3.26 113.55 110.21 1x6e h SER 27 Ca -0.43 -0.17 0.20 0.00 -1.23 0.00 0.00 61.79 60.16 1x6e h SER 27 Cb 1.25 0.00 -0.16 0.00 -0.44 0.00 0.00 62.40 63.05 1x6e h SER 27 CO 0.68 0.63 -0.12 -1.20 -0.53 0.00 0.00 176.83 176.30 1x6e n SER 28 N -4.73 -0.22 -0.31 6.23 7.64 -1.26 0.23 113.62 121.21 1x6e n SER 28 Ca -0.03 1.46 -0.02 0.00 1.01 0.00 0.00 58.87 61.28 1x6e n SER 28 Cb 0.12 -0.48 0.14 0.00 -1.01 0.00 0.00 64.21 62.99 1x6e n SER 28 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 1x6e h ILE 29 N 0.00 1.24 0.19 0.44 2.04 -1.97 -2.25 117.51 117.19 1x6e h ILE 29 Ca 0.45 -0.52 -0.01 0.00 1.00 0.00 0.00 64.86 65.79 1x6e h ILE 29 Cb 0.80 -0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.87 1x6e h ILE 29 CO -0.84 0.25 -0.09 0.25 0.00 0.00 0.00 178.15 177.72 1x6e h LEU 30 N 1.22 -0.21 -0.78 1.44 5.85 0.29 -2.50 115.31 120.61 1x6e h LEU 30 Ca 0.32 -0.21 0.16 0.00 0.84 0.00 0.00 57.88 58.98 1x6e h LEU 30 Cb -0.06 0.06 -0.10 0.00 0.37 0.00 0.00 40.66 40.92 1x6e h LEU 30 CO -0.06 0.11 0.30 0.58 -0.34 0.00 0.00 178.44 179.03 1x6e h VAL 31 N -0.55 0.60 -0.20 1.05 2.07 -0.85 0.27 116.25 118.66 1x6e h VAL 31 Ca -0.03 -0.14 -0.04 0.00 0.82 0.00 0.00 66.70 67.31 1x6e h VAL 31 Cb 0.41 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 1x6e h VAL 31 CO 0.04 0.08 -0.07 1.56 0.02 0.00 0.00 177.57 179.19 1x6e h GLN 32 N 0.42 0.30 -0.00 1.57 4.20 -1.35 -1.17 115.11 119.08 1x6e h GLN 32 Ca 0.44 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 59.09 1x6e h GLN 32 Cb 0.72 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.45 1x6e h GLN 32 CO -0.44 0.39 -0.14 1.58 -0.67 0.00 0.00 178.83 179.56 1x6e n HIS 33 N -4.30 0.00 -0.00 2.96 -0.00 0.74 -3.43 115.22 111.19 1x6e n HIS 33 Ca -0.00 0.00 -0.04 0.00 0.46 0.00 0.00 57.72 58.14 1x6e n HIS 33 Cb 0.24 -0.43 -0.11 0.00 -0.12 0.00 0.00 29.99 29.57 1x6e n HIS 33 CO 0.00 0.00 0.00 1.04 0.46 0.00 0.00 176.34 177.84 1x6e n GLN 34 N -1.50 0.63 -0.03 1.57 6.02 0.05 -4.29 117.38 119.84 1x6e n GLN 34 Ca 0.07 0.22 -0.15 0.00 -0.01 0.00 0.00 57.00 57.13 1x6e n GLN 34 Cb 0.34 -1.77 -0.11 0.00 1.02 0.00 0.00 30.24 29.73 1x6e n GLN 34 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1x6e h ARG 35 N 0.00 0.21 -1.65 -1.09 3.08 -1.43 -3.21 114.38 110.29 1x6e h ARG 35 Ca -0.24 -0.20 0.49 0.00 0.07 0.00 0.00 59.98 60.10 1x6e h ARG 35 Cb 1.80 0.05 -0.08 0.00 0.08 0.00 0.00 29.97 31.82 1x6e h ARG 35 CO 0.06 0.88 1.17 -0.39 -1.07 0.00 0.00 179.97 180.62 1x6e h VAL 36 N -0.39 0.13 -0.80 2.04 -1.51 -1.74 0.45 116.25 114.44 1x6e h VAL 36 Ca -0.02 -0.01 0.16 0.00 -1.23 0.00 0.00 66.70 65.60 1x6e h VAL 36 Cb 0.95 0.11 -0.10 0.00 -2.13 0.00 0.00 31.29 30.12 1x6e h VAL 36 CO 0.05 0.00 0.33 0.45 -1.23 0.00 0.00 177.57 177.17 1x6e h HIS 37 N 0.02 0.56 -0.88 5.19 3.86 -1.75 -3.43 115.15 118.72 1x6e h HIS 37 Ca 0.82 0.04 -0.63 0.00 -1.16 0.00 0.00 60.37 59.44 1x6e h HIS 37 Cb 3.16 -0.13 0.08 0.00 1.06 0.00 0.00 27.41 31.58 1x6e h HIS 37 CO -0.00 0.05 -0.26 -2.37 0.86 0.00 0.00 177.93 176.21 1x6e n THR 38 N -5.00 1.06 0.00 2.45 5.66 0.16 -3.94 114.28 114.67 1x6e n THR 38 Ca 0.16 -0.26 0.00 0.00 -3.05 0.00 0.00 64.05 60.90 1x6e n THR 38 Cb 0.46 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.24 1x6e n THR 38 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1x6e n GLY 39 N 1.58 4.16 0.08 1.09 0.00 -1.26 -4.94 105.19 105.91 1x6e n GLY 39 Ca 0.17 -0.66 -0.10 0.00 0.00 0.00 0.00 46.02 45.42 1x6e n GLY 39 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1x6e h GLU 40 N 0.00 0.06 -2.55 1.61 4.81 -1.95 -3.39 114.58 113.17 1x6e h GLU 40 Ca 0.00 -0.11 -0.65 0.00 -0.13 0.00 0.00 59.36 58.47 1x6e h GLU 40 Cb 0.00 0.04 -0.39 0.00 0.63 0.00 0.00 28.75 29.03 1x6e h GLU 40 CO 0.00 0.82 -0.30 1.63 -0.73 0.00 0.00 179.01 180.43 1x6e n LYS 41 N -3.25 2.80 0.02 1.92 4.01 -1.26 -4.27 118.16 118.12 1x6e n LYS 41 Ca -0.12 -4.62 -0.06 0.00 -0.51 0.00 0.00 58.31 53.00 1x6e n LYS 41 Cb 1.01 -2.32 0.12 0.00 -0.51 0.00 0.00 35.03 33.34 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 4.73 0.48 -6.16 1.97 0.13 -1.77 -3.40 132.00 127.98 1x6e h PRO 42 Ca 0.19 -0.25 -0.54 0.00 -0.87 0.00 0.00 66.00 64.52 1x6e h PRO 42 Cb 0.68 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 31.79 1x6e h PRO 42 CO 0.91 0.82 1.30 0.71 -0.23 0.00 0.00 178.00 181.52 1x6e s TYR 43 N -4.17 1.76 0.07 1.56 2.02 -1.22 -4.94 117.35 112.43 1x6e s TYR 43 Ca -0.07 0.72 0.03 0.00 -0.37 0.00 0.00 57.07 57.39 1x6e s TYR 43 Cb 0.12 -4.11 -0.04 0.00 -0.40 0.00 0.00 41.96 37.54 1x6e s TYR 43 CO 0.81 -2.64 0.04 0.21 -1.57 0.00 0.00 175.55 172.40 1x6e s LYS 44 N 6.20 2.76 -0.42 -0.62 2.36 -1.26 -1.04 119.74 127.72 1x6e s LYS 44 Ca 0.75 -0.72 -0.18 0.00 -2.55 0.00 0.00 55.97 53.27 1x6e s LYS 44 Cb -0.18 -2.66 0.02 0.00 -1.05 0.00 0.00 37.83 33.96 1x6e s LYS 44 CO 0.29 0.57 0.45 0.00 1.55 0.00 0.00 175.35 178.21 1x6e n LEU 46 N 5.65 0.75 0.06 0.00 4.32 -1.26 -0.49 117.00 126.03 1x6e n LEU 46 Ca -0.07 0.60 -0.13 0.00 -0.02 0.00 0.00 56.01 56.39 1x6e n LEU 46 Cb 0.47 -0.40 -0.08 0.00 -1.62 0.00 0.00 43.42 41.79 1x6e n LEU 46 CO 0.47 -0.29 0.74 -0.33 -1.22 0.00 0.00 177.39 176.76 1x6e h GLU 47 N 0.00 -0.11 0.00 3.23 4.39 -1.96 -3.42 114.58 116.71 1x6e h GLU 47 Ca 0.00 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.71 1x6e h GLU 47 Cb 0.62 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.30 1x6e h GLU 47 CO 0.00 0.10 -0.70 0.00 -1.16 0.00 0.00 179.01 177.25 1x6e n GLY 49 N 2.77 0.85 3.26 0.00 0.00 0.36 -5.07 105.19 107.36 1x6e n GLY 49 Ca 0.00 -0.44 -0.10 0.00 0.00 0.00 0.00 46.02 45.48 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 1.13 0.04 1.61 -0.14 -1.19 -4.89 119.74 116.30 1x6e s LYS 50 Ca 0.00 -1.40 0.07 0.00 -1.36 0.00 0.00 55.97 53.28 1x6e s LYS 50 Cb 0.00 0.31 -0.02 0.00 -1.68 0.00 0.00 37.83 36.44 1x6e s LYS 50 CO 0.00 -0.38 -0.20 0.00 -0.76 0.00 0.00 175.35 174.01 1x6e s ALA 51 N -4.05 1.70 -0.07 5.17 0.00 -1.26 0.22 121.76 123.48 1x6e s ALA 51 Ca 0.26 -1.04 -0.03 0.00 0.00 0.00 0.00 51.96 51.15 1x6e s ALA 51 Cb 0.05 -0.33 0.04 0.00 0.00 0.00 0.00 23.12 22.88 1x6e s ALA 51 CO 0.05 0.38 0.15 -0.06 0.00 0.00 0.00 175.76 176.28 1x6e s PHE 52 N -0.81 -0.17 0.27 0.00 0.40 -0.21 -5.01 117.98 112.45 1x6e s PHE 52 Ca 0.07 0.48 -0.03 0.00 -0.60 0.00 0.00 56.93 56.85 1x6e s PHE 52 Cb -0.09 -0.06 0.38 0.00 0.51 0.00 0.00 43.02 43.77 1x6e s PHE 52 CO 0.02 -0.16 1.92 0.77 0.70 0.00 0.00 175.22 178.47 1x6e h SER 53 N 7.04 1.05 -1.89 1.36 0.02 -1.87 -3.24 113.55 116.02 1x6e h SER 53 Ca -0.40 -0.01 -0.55 0.00 -0.84 0.00 0.00 61.79 59.99 1x6e h SER 53 Cb 1.15 -0.24 -0.08 0.00 0.14 0.00 0.00 62.40 63.37 1x6e h SER 53 CO 0.42 0.72 -0.54 -1.10 -1.14 0.00 0.00 176.83 175.19 1x6e s GLN 54 N -6.03 2.36 -0.11 3.45 -0.21 -1.26 -4.70 119.66 113.16 1x6e s GLN 54 Ca -0.12 -1.55 -0.22 0.00 0.02 0.00 0.00 55.36 53.48 1x6e s GLN 54 Cb 0.19 -2.16 -0.27 0.00 1.00 0.00 0.00 33.01 31.76 1x6e s GLN 54 CO 0.81 0.12 0.68 -0.97 -2.12 0.00 0.00 175.29 173.81 1x6e h ASN 55 N 1.56 0.27 -0.63 5.90 -0.00 -1.97 -3.23 115.58 117.48 1x6e h ASN 55 Ca -0.44 -0.88 0.18 0.00 -0.00 0.00 0.00 56.30 55.16 1x6e h ASN 55 Cb 1.25 -0.09 -0.03 0.00 -0.00 0.00 0.00 38.32 39.46 1x6e h ASN 55 CO 0.63 1.37 0.81 -1.28 -0.00 0.00 0.00 177.43 178.96 1x6e h SER 56 N -0.59 0.00 0.03 1.15 0.87 -1.98 0.99 113.55 114.02 1x6e h SER 56 Ca -0.18 0.00 -0.18 0.00 -1.23 0.00 0.00 61.79 60.20 1x6e h SER 56 Cb 1.47 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.42 1x6e h SER 56 CO 0.04 0.00 -0.95 1.23 -0.53 0.00 0.00 176.83 176.62 1x6e h GLY 57 N 0.00 0.07 0.83 5.77 0.00 -1.98 -3.25 103.07 104.51 1x6e h GLY 57 Ca 0.30 -0.19 0.05 0.00 0.00 0.00 0.00 47.33 47.49 1x6e h GLY 57 CO -0.00 0.16 0.64 -2.00 0.00 0.00 0.00 176.54 175.34 1x6e h LEU 58 N -0.82 1.06 0.44 3.11 5.85 -0.89 -2.25 115.31 121.81 1x6e h LEU 58 Ca -0.24 -0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.45 1x6e h LEU 58 Cb 1.34 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 42.14 1x6e h LEU 58 CO -0.08 0.71 -0.21 0.40 -0.34 0.00 0.00 178.44 178.91 1x6e h ILE 59 N 1.22 0.57 0.00 4.05 2.04 -1.30 -1.33 117.51 122.76 1x6e h ILE 59 Ca 0.40 -0.03 0.00 0.00 1.00 0.00 0.00 64.86 66.24 1x6e h ILE 59 Cb 0.06 0.58 0.00 0.00 -0.74 0.00 0.00 36.82 36.72 1x6e h ILE 59 CO -0.14 0.01 0.01 0.59 0.00 0.00 0.00 178.15 178.62 1x6e n ASN 60 N -5.34 0.56 -0.09 1.72 3.02 -1.06 0.08 115.26 114.15 1x6e n ASN 60 Ca -0.11 0.76 0.11 0.00 -0.03 0.00 0.00 54.58 55.31 1x6e n ASN 60 Cb 0.25 -0.83 0.03 0.00 -0.61 0.00 0.00 39.78 38.63 1x6e n ASN 60 CO 0.00 0.00 0.00 1.57 -2.62 0.00 0.00 177.26 176.21 1x6e n HIS 61 N -2.26 0.00 -0.07 3.10 -0.00 -0.64 -4.21 115.22 111.14 1x6e n HIS 61 Ca -0.01 0.00 -0.05 0.00 0.46 0.00 0.00 57.72 58.11 1x6e n HIS 61 Cb 0.05 -0.08 -0.14 0.00 -0.12 0.00 0.00 29.99 29.70 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 -1.24 1.05 0.03 1.57 6.02 0.11 -4.39 117.38 120.54 1x6e n GLN 62 Ca 0.06 -0.04 0.12 0.00 -0.01 0.00 0.00 57.00 57.13 1x6e n GLN 62 Cb 0.35 -1.45 0.57 0.00 1.02 0.00 0.00 30.24 30.74 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 0.22 -0.07 -1.09 0.11 -1.37 -0.27 114.38 111.91 1x6e h ARG 63 Ca -0.39 -0.01 -0.13 0.00 0.10 0.00 0.00 59.98 59.55 1x6e h ARG 63 Cb 1.85 -0.05 -0.01 0.00 1.11 0.00 0.00 29.97 32.87 1x6e h ARG 63 CO 0.02 0.15 -0.56 -0.84 0.10 0.00 0.00 179.97 178.84 1x6e h ILE 64 N 0.23 1.37 -0.14 0.08 3.07 -1.77 -2.87 117.51 117.48 1x6e h ILE 64 Ca 0.19 -1.87 -0.05 0.00 1.55 0.00 0.00 64.86 64.68 1x6e h ILE 64 Cb 0.48 1.94 -0.03 0.00 -0.27 0.00 0.00 36.82 38.93 1x6e h ILE 64 CO -0.04 0.55 0.06 1.41 -1.05 0.00 0.00 178.15 179.09 1x6e n HIS 65 N -3.91 0.44 -1.71 0.16 8.25 -0.11 -4.10 115.22 114.24 1x6e n HIS 65 Ca -0.02 -0.44 -0.31 0.00 -0.26 0.00 0.00 57.72 56.69 1x6e n HIS 65 Cb 0.58 -0.27 0.05 0.00 1.12 0.00 0.00 29.99 31.47 1x6e n HIS 65 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1x6e n THR 66 N 0.17 3.18 -4.28 1.59 -2.24 -1.09 -4.99 114.28 106.61 1x6e n THR 66 Ca 0.08 -3.67 -0.28 0.00 -2.27 0.00 0.00 64.05 57.90 1x6e n THR 66 Cb 0.56 -1.17 -0.10 0.00 -2.10 0.00 0.00 70.33 67.52 1x6e n THR 66 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1x6e s SER 67 N -2.45 4.15 0.00 3.42 0.15 -1.26 -5.07 113.70 112.65 1x6e s SER 67 Ca 0.58 -0.53 0.00 0.00 0.70 0.00 0.00 55.95 56.70 1x6e s SER 67 Cb 0.46 -0.68 0.00 0.00 -1.71 0.00 0.00 66.02 64.09 1x6e s SER 67 CO -0.06 0.15 0.00 0.61 1.20 0.00 0.00 173.24 175.14 1x6e n GLY 68 N 0.47 0.85 0.08 9.45 0.00 -1.26 -4.81 105.19 109.97 1x6e n GLY 68 Ca -0.13 -2.16 -0.13 0.00 0.00 0.00 0.00 46.02 43.60 1x6e n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x6e h PRO 69 N 0.00 0.10 -6.17 1.61 0.13 -2.04 -3.46 132.00 122.18 1x6e h PRO 69 Ca 0.00 -0.05 -0.45 0.00 -0.87 0.00 0.00 66.00 64.63 1x6e h PRO 69 Cb 0.00 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 30.89 1x6e h PRO 69 CO 0.00 0.56 -0.67 0.45 -0.23 0.00 0.00 178.00 178.12 1x6e n SER 70 N -4.77 -0.68 -4.94 1.44 2.88 -1.26 -4.87 113.62 101.42 1x6e n SER 70 Ca -0.08 -0.90 -0.25 0.00 -1.33 0.00 0.00 58.87 56.31 1x6e n SER 70 Cb 0.28 -1.14 -0.02 0.00 -0.75 0.00 0.00 64.21 62.57 1x6e n SER 70 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1x6e s SER 71 N -3.05 6.34 0.00 -3.46 0.01 -1.26 -5.22 113.70 107.06 1x6e s SER 71 Ca 0.41 0.29 0.00 0.00 1.31 0.00 0.00 55.95 57.96 1x6e s SER 71 Cb -0.24 -1.96 0.00 0.00 0.21 0.00 0.00 66.02 64.03 1x6e s SER 71 CO 0.73 -0.09 0.00 0.61 0.41 0.00 0.00 173.24 174.90