#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xhn s SER 12 N 0.00 5.71 0.18 1.61 1.04 -1.26 -5.06 113.70 115.91 1xhn s SER 12 Ca 0.00 -0.19 -0.32 0.00 0.48 0.00 0.00 55.95 55.93 1xhn s SER 12 Cb 0.00 -1.49 -0.11 0.00 0.10 0.00 0.00 66.02 64.52 1xhn s SER 12 CO 0.00 -0.07 1.62 -0.22 0.98 0.00 0.00 173.24 175.55 1xhn s LEU 13 N -3.89 4.37 1.09 2.42 2.96 -1.26 -4.99 118.68 119.38 1xhn s LEU 13 Ca 0.34 2.70 -0.13 0.00 -0.22 0.00 0.00 54.13 56.82 1xhn s LEU 13 Cb -0.08 -3.60 0.24 0.00 0.50 0.00 0.00 46.19 43.25 1xhn s LEU 13 CO 0.26 -0.87 1.06 -2.84 -1.32 0.00 0.00 176.35 172.64 1xhn s PRO 14 N 1.15 -0.29 0.16 0.98 0.02 -1.26 -4.92 135.00 130.85 1xhn s PRO 14 Ca 0.72 0.62 -0.34 0.00 0.02 0.00 0.00 61.00 62.02 1xhn s PRO 14 Cb -0.46 -1.64 -0.13 0.00 0.02 0.00 0.00 34.50 32.29 1xhn s PRO 14 CO 0.31 -3.25 1.61 -2.30 -0.33 0.00 0.00 177.00 173.05 1xhn n PRO 15 N -4.55 2.26 0.25 5.54 -0.02 -1.26 -4.86 135.00 132.36 1xhn n PRO 15 Ca 0.04 0.82 0.09 0.00 -2.02 0.00 0.00 63.50 62.43 1xhn n PRO 15 Cb 0.56 -2.60 0.66 0.00 -0.02 0.00 0.00 33.50 32.09 1xhn n PRO 15 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1xhn h ARG 16 N 6.17 0.00 0.00 -0.52 3.08 -1.92 -0.50 114.38 120.68 1xhn h ARG 16 Ca -0.45 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.58 1xhn h ARG 16 Cb 1.24 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.29 1xhn h ARG 16 CO 0.90 0.09 -0.11 1.05 -1.07 0.00 0.00 179.97 180.84 1xhn h GLU 17 N 0.00 0.00 -4.49 0.04 4.11 -1.95 -3.29 114.58 108.99 1xhn h GLU 17 Ca -0.00 0.00 -0.75 0.00 0.07 0.00 0.00 59.36 58.68 1xhn h GLU 17 Cb 0.19 0.00 -0.20 0.00 0.50 0.00 0.00 28.75 29.24 1xhn h GLU 17 CO 0.01 0.11 1.20 -3.47 0.07 0.00 0.00 179.01 176.92 1xhn n ASP 18 N -3.76 5.29 0.06 3.06 -0.08 -0.20 -4.79 116.55 116.12 1xhn n ASP 18 Ca -0.02 -2.99 0.01 0.00 -1.51 0.00 0.00 54.79 50.27 1xhn n ASP 18 Cb 0.21 -1.53 0.33 0.00 2.34 0.00 0.00 41.12 42.47 1xhn n ASP 18 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1xhn h ALA 19 N 7.00 1.41 -0.13 -1.67 0.00 -1.79 -1.40 119.26 122.68 1xhn h ALA 19 Ca 0.29 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1xhn h ALA 19 Cb 0.87 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1xhn h ALA 19 CO 1.21 0.41 0.08 0.00 0.00 0.00 0.00 179.25 180.95 1xhn h ALA 20 N 1.55 0.16 -0.46 0.00 0.00 -1.91 0.40 119.26 119.00 1xhn h ALA 20 Ca 0.07 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1xhn h ALA 20 Cb 0.39 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1xhn h ALA 20 CO 0.02 -0.34 0.25 0.00 0.00 0.00 0.00 179.25 179.18 1xhn h ARG 21 N 0.16 0.65 -0.76 0.00 3.08 -1.81 -1.75 114.38 113.95 1xhn h ARG 21 Ca 0.05 -0.08 0.03 0.00 0.07 0.00 0.00 59.98 60.05 1xhn h ARG 21 Cb 0.00 -0.13 -0.05 0.00 0.08 0.00 0.00 29.97 29.88 1xhn h ARG 21 CO -0.01 0.51 0.48 0.28 -1.07 0.00 0.00 179.97 180.17 1xhn h VAL 22 N 0.61 1.12 -0.50 2.04 2.07 -1.13 0.10 116.25 120.56 1xhn h VAL 22 Ca 0.16 -0.33 -0.02 0.00 0.82 0.00 0.00 66.70 67.34 1xhn h VAL 22 Cb 0.05 0.09 -0.02 0.00 -1.52 0.00 0.00 31.29 29.89 1xhn h VAL 22 CO -0.03 0.17 0.23 0.00 0.02 0.00 0.00 177.57 177.97 1xhn h ALA 23 N 1.31 0.65 -0.71 1.67 0.00 -0.64 -1.28 119.26 120.26 1xhn h ALA 23 Ca 0.30 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 55.02 1xhn h ALA 23 Cb -0.01 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 1xhn h ALA 23 CO -0.10 0.22 0.20 0.00 0.00 0.00 0.00 179.25 179.57 1xhn h ARG 24 N 0.67 1.11 -0.03 0.00 2.47 -1.01 -0.91 114.38 116.69 1xhn h ARG 24 Ca 0.17 -0.25 0.03 0.00 -1.26 0.00 0.00 59.98 58.67 1xhn h ARG 24 Cb 0.13 -0.15 -0.05 0.00 -1.65 0.00 0.00 29.97 28.25 1xhn h ARG 24 CO -0.02 0.97 -0.25 0.35 0.56 0.00 0.00 179.97 181.57 1xhn h PHE 25 N 1.05 -0.68 -0.21 3.04 3.57 -0.25 -1.77 116.94 121.69 1xhn h PHE 25 Ca 0.22 0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.80 1xhn h PHE 25 Cb 0.34 0.31 -0.05 0.00 2.79 0.00 0.00 35.95 39.33 1xhn h PHE 25 CO 0.03 -0.34 -0.11 0.28 -2.23 0.00 0.00 178.31 175.94 1xhn h VAL 26 N -0.38 0.66 -0.33 1.41 2.07 -1.15 -0.43 116.25 118.11 1xhn h VAL 26 Ca 0.07 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.65 1xhn h VAL 26 Cb 0.47 0.66 -0.06 0.00 -1.52 0.00 0.00 31.29 30.85 1xhn h VAL 26 CO -0.24 0.00 -0.02 0.74 0.02 0.00 0.00 177.57 178.07 1xhn h THR 27 N -0.09 0.74 -0.66 2.57 2.02 -1.08 -2.46 112.91 113.94 1xhn h THR 27 Ca 0.12 -0.03 -0.06 0.00 0.77 0.00 0.00 66.41 67.21 1xhn h THR 27 Cb 0.26 0.66 -0.03 0.00 -1.74 0.00 0.00 68.15 67.30 1xhn h THR 27 CO -0.27 0.01 0.16 -0.74 0.37 0.00 0.00 175.52 175.06 1xhn h HIS 28 N 0.07 1.11 0.00 3.16 -0.00 -1.18 -3.01 115.15 115.30 1xhn h HIS 28 Ca 0.16 -0.13 0.00 0.00 -0.00 0.00 0.00 60.37 60.40 1xhn h HIS 28 Cb 0.23 -0.31 0.00 0.00 -0.00 0.00 0.00 27.41 27.32 1xhn h HIS 28 CO -0.25 0.91 0.00 1.33 -0.00 0.00 0.00 177.93 179.92 1xhn n VAL 29 N -4.29 0.45 -3.04 5.26 0.24 -0.18 -4.79 118.33 111.97 1xhn n VAL 29 Ca 0.04 0.11 -0.40 0.00 -2.04 0.00 0.00 64.34 62.06 1xhn n VAL 29 Cb 0.25 -0.73 -0.05 0.00 -1.47 0.00 0.00 33.84 31.84 1xhn n VAL 29 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1xhn s SER 30 N -2.96 6.96 0.00 -1.34 0.01 -0.95 -4.95 113.70 110.48 1xhn s SER 30 Ca 0.12 1.16 0.23 0.00 1.31 0.00 0.00 55.95 58.77 1xhn s SER 30 Cb 0.15 -2.41 0.12 0.00 0.21 0.00 0.00 66.02 64.09 1xhn s SER 30 CO 0.40 -0.14 1.14 0.47 0.41 0.00 0.00 173.24 175.52 1xhn n ASP 31 N 3.95 0.73 -3.89 2.44 8.00 -1.26 -4.71 116.55 121.81 1xhn n ASP 31 Ca -0.01 -0.58 -0.08 0.00 0.71 0.00 0.00 54.79 54.82 1xhn n ASP 31 Cb 0.51 0.66 -0.04 0.00 -0.02 0.00 0.00 41.12 42.23 1xhn n ASP 31 CO 0.00 0.00 0.00 -1.66 -0.39 0.00 0.00 177.20 175.15 1xhn s TRP 32 N -3.02 0.06 0.39 1.24 1.48 -1.26 -1.14 118.94 116.69 1xhn s TRP 32 Ca 0.09 -0.45 -0.14 0.00 -1.06 0.00 0.00 56.10 54.54 1xhn s TRP 32 Cb 0.16 0.42 0.05 0.00 -1.16 0.00 0.00 33.47 32.95 1xhn s TRP 32 CO 0.79 -1.07 0.76 0.20 -4.06 0.00 0.00 176.95 173.57 1xhn s GLY 33 N -2.95 0.55 -0.22 3.67 0.00 -0.41 -4.87 107.32 103.09 1xhn s GLY 33 Ca 0.16 -0.88 -0.06 0.00 0.00 0.00 0.00 44.72 43.94 1xhn s GLY 33 CO 0.06 -0.41 0.02 0.00 0.00 0.00 0.00 173.10 172.77 1xhn s ALA 34 N -2.25 3.06 -0.18 3.20 0.00 -0.78 -1.20 121.76 123.62 1xhn s ALA 34 Ca 0.18 -1.04 -0.08 0.00 0.00 0.00 0.00 51.96 51.01 1xhn s ALA 34 Cb -0.05 -1.87 -0.04 0.00 0.00 0.00 0.00 23.12 21.16 1xhn s ALA 34 CO 0.13 -0.27 0.08 -1.17 0.00 0.00 0.00 175.76 174.52 1xhn s LEU 35 N 1.22 3.93 -0.19 0.00 2.96 0.43 -1.06 118.68 125.98 1xhn s LEU 35 Ca 0.04 0.14 -0.08 0.00 -0.22 0.00 0.00 54.13 54.00 1xhn s LEU 35 Cb -0.15 -1.99 -0.04 0.00 0.50 0.00 0.00 46.19 44.51 1xhn s LEU 35 CO 0.02 0.19 0.09 0.00 -1.32 0.00 0.00 176.35 175.33 1xhn s ALA 36 N 0.26 3.50 0.32 5.97 0.00 0.45 -2.14 121.76 130.12 1xhn s ALA 36 Ca 0.05 -0.73 0.03 0.00 0.00 0.00 0.00 51.96 51.31 1xhn s ALA 36 Cb -0.12 -2.01 -0.04 0.00 0.00 0.00 0.00 23.12 20.95 1xhn s ALA 36 CO -0.00 0.17 0.12 0.95 0.00 0.00 0.00 175.76 176.99 1xhn s THR 37 N 0.37 0.61 -0.20 0.00 -4.23 -0.19 -2.38 115.64 109.62 1xhn s THR 37 Ca 0.05 -2.00 -0.12 0.00 -1.18 0.00 0.00 61.69 58.44 1xhn s THR 37 Cb -0.12 -2.57 -0.05 0.00 1.34 0.00 0.00 72.50 71.11 1xhn s THR 37 CO -0.01 0.00 0.21 -0.63 -0.54 0.00 0.00 174.62 173.65 1xhn s ILE 38 N -3.50 5.35 0.21 2.99 -1.09 -1.26 -0.41 121.20 123.49 1xhn s ILE 38 Ca 0.34 0.33 -0.30 0.00 -2.23 0.00 0.00 60.65 58.79 1xhn s ILE 38 Cb 0.06 -3.55 -0.08 0.00 -1.58 0.00 0.00 42.46 37.31 1xhn s ILE 38 CO 0.16 0.38 1.21 -0.55 -1.23 0.00 0.00 174.94 174.90 1xhn s SER 39 N 0.68 7.06 0.00 3.58 0.15 0.47 -4.70 113.70 120.93 1xhn s SER 39 Ca 0.11 2.29 0.14 0.00 0.70 0.00 0.00 55.95 59.20 1xhn s SER 39 Cb -0.13 -2.61 0.35 0.00 -1.71 0.00 0.00 66.02 61.92 1xhn s SER 39 CO 0.02 -0.37 1.26 0.35 1.20 0.00 0.00 173.24 175.70 1xhn n THR 40 N 2.23 0.80 -2.12 6.45 -2.24 -1.26 -0.71 114.28 117.43 1xhn n THR 40 Ca 0.04 -0.90 -0.42 0.00 -2.27 0.00 0.00 64.05 60.50 1xhn n THR 40 Cb 0.44 0.66 -0.03 0.00 -2.10 0.00 0.00 70.33 69.30 1xhn n THR 40 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1xhn s LEU 41 N -1.04 4.38 0.25 3.22 1.43 -1.26 -4.86 118.68 120.79 1xhn s LEU 41 Ca 0.28 2.41 -0.06 0.00 -1.03 0.00 0.00 54.13 55.73 1xhn s LEU 41 Cb 0.15 -3.59 0.46 0.00 0.03 0.00 0.00 46.19 43.24 1xhn s LEU 41 CO 0.20 -0.67 1.65 -0.08 0.23 0.00 0.00 176.35 177.68 1xhn h GLU 42 N 6.56 0.15 -0.32 1.70 4.57 -1.97 0.33 114.58 125.59 1xhn h GLU 42 Ca -0.43 -0.01 0.06 0.00 -1.18 0.00 0.00 59.36 57.81 1xhn h GLU 42 Cb 1.21 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 29.75 1xhn h GLU 42 CO 0.86 0.10 0.22 0.00 -1.18 0.00 0.00 179.01 179.01 1xhn h ALA 43 N 1.68 2.10 0.00 2.92 0.00 -2.00 -3.20 119.26 120.75 1xhn h ALA 43 Ca 0.42 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 55.16 1xhn h ALA 43 Cb 0.74 -0.03 -0.34 0.00 0.00 0.00 0.00 17.79 18.17 1xhn h ALA 43 CO -0.61 -0.17 -0.96 1.33 0.00 0.00 0.00 179.25 178.83 1xhn n VAL 44 N -4.47 0.25 -1.71 0.00 0.24 -0.52 -5.11 118.33 107.01 1xhn n VAL 44 Ca 0.04 -1.23 -0.43 0.00 -2.04 0.00 0.00 64.34 60.68 1xhn n VAL 44 Cb 0.28 0.85 -0.02 0.00 -1.47 0.00 0.00 33.84 33.47 1xhn n VAL 44 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 1xhn n ARG 45 N 0.30 2.53 0.00 7.34 0.63 0.10 -1.45 116.66 126.12 1xhn n ARG 45 Ca 0.07 0.90 0.00 0.00 -0.92 0.00 0.00 57.85 57.91 1xhn n ARG 45 Cb 1.09 -2.68 0.00 0.00 0.45 0.00 0.00 32.46 31.32 1xhn n ARG 45 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1xhn n GLY 46 N 2.82 2.42 3.78 5.14 0.00 0.12 -4.99 105.19 114.47 1xhn n GLY 46 Ca 0.12 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.77 1xhn n GLY 46 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xhn s ARG 47 N -0.60 4.13 0.25 1.61 0.52 -0.53 -4.65 118.95 119.68 1xhn s ARG 47 Ca 0.00 1.64 -0.30 0.00 -0.52 0.00 0.00 55.73 56.56 1xhn s ARG 47 Cb 0.00 -2.61 -0.10 0.00 0.52 0.00 0.00 34.95 32.76 1xhn s ARG 47 CO 0.00 -0.20 1.34 -1.25 0.02 0.00 0.00 175.30 175.21 1xhn s PRO 48 N -2.38 4.35 0.04 3.54 0.04 -1.26 -0.40 135.00 138.92 1xhn s PRO 48 Ca 0.57 2.17 0.07 0.00 0.04 0.00 0.00 61.00 63.85 1xhn s PRO 48 Cb -0.26 -3.13 -0.02 0.00 0.04 0.00 0.00 34.50 31.13 1xhn s PRO 48 CO 0.32 -0.27 -0.20 0.12 0.04 0.00 0.00 177.00 177.01 1xhn s PHE 49 N -0.32 1.78 0.15 0.56 5.36 0.46 -4.83 117.98 121.14 1xhn s PHE 49 Ca 0.55 -0.37 0.09 0.00 -0.96 0.00 0.00 56.93 56.24 1xhn s PHE 49 Cb -0.39 -1.07 -0.04 0.00 -0.34 0.00 0.00 43.02 41.18 1xhn s PHE 49 CO 0.44 0.07 -0.21 0.00 -1.46 0.00 0.00 175.22 174.07 1xhn s ALA 50 N -0.76 2.06 -0.05 11.12 0.00 -1.26 -1.03 121.76 131.84 1xhn s ALA 50 Ca 0.07 -1.44 -0.29 0.00 0.00 0.00 0.00 51.96 50.30 1xhn s ALA 50 Cb -0.09 -0.24 0.10 0.00 0.00 0.00 0.00 23.12 22.89 1xhn s ALA 50 CO 0.01 0.32 0.84 0.34 0.00 0.00 0.00 175.76 177.27 1xhn s ASP 51 N -2.40 -0.47 -0.28 0.00 2.15 -0.91 -4.97 116.67 109.79 1xhn s ASP 51 Ca 0.14 0.33 -0.13 0.00 0.43 0.00 0.00 52.55 53.32 1xhn s ASP 51 Cb -0.08 0.42 -0.04 0.00 -0.30 0.00 0.00 42.92 42.92 1xhn s ASP 51 CO 0.06 -0.56 0.27 -0.69 -0.17 0.00 0.00 175.17 174.08 1xhn s VAL 52 N -1.98 5.25 0.01 1.11 1.01 -1.26 -0.42 120.40 124.12 1xhn s VAL 52 Ca -0.02 0.31 0.08 0.00 0.00 0.00 0.00 61.98 62.35 1xhn s VAL 52 Cb -0.01 -3.61 -0.02 0.00 0.00 0.00 0.00 36.38 32.74 1xhn s VAL 52 CO -0.01 0.19 -0.25 -0.76 0.00 0.00 0.00 175.10 174.28 1xhn s LEU 53 N 1.89 2.11 0.53 3.92 1.43 -0.34 -4.98 118.68 123.24 1xhn s LEU 53 Ca 0.10 -0.51 -0.19 0.00 -1.03 0.00 0.00 54.13 52.50 1xhn s LEU 53 Cb -0.16 -1.22 -0.06 0.00 0.03 0.00 0.00 46.19 44.77 1xhn s LEU 53 CO 0.11 0.26 1.09 -0.44 0.23 0.00 0.00 176.35 177.59 1xhn s SER 54 N -0.91 5.95 0.20 2.29 0.01 -1.26 -1.28 113.70 118.69 1xhn s SER 54 Ca 0.10 2.04 -0.13 0.00 1.31 0.00 0.00 55.95 59.26 1xhn s SER 54 Cb -0.09 -2.57 0.01 0.00 0.21 0.00 0.00 66.02 63.57 1xhn s SER 54 CO 0.01 -1.06 0.43 -1.48 0.41 0.00 0.00 173.24 171.55 1xhn s LEU 55 N -3.79 0.45 -0.21 2.44 0.05 -0.29 -4.56 118.68 112.77 1xhn s LEU 55 Ca 0.69 -0.76 -0.23 0.00 0.05 0.00 0.00 54.13 53.89 1xhn s LEU 55 Cb -0.20 1.71 0.06 0.00 -2.05 0.00 0.00 46.19 45.71 1xhn s LEU 55 CO 0.26 -1.03 0.62 -0.55 -0.55 0.00 0.00 176.35 175.10 1xhn s SER 56 N -2.95 -0.64 -0.06 1.48 0.15 -1.07 -4.42 113.70 106.19 1xhn s SER 56 Ca 0.16 1.16 0.15 0.00 0.70 0.00 0.00 55.95 58.13 1xhn s SER 56 Cb 0.01 1.17 0.50 0.00 -1.71 0.00 0.00 66.02 65.98 1xhn s SER 56 CO 0.02 -0.27 1.42 -0.90 1.20 0.00 0.00 173.24 174.71 1xhn n ASP 57 N 2.49 3.71 0.00 5.45 5.75 -1.26 -1.50 116.55 131.19 1xhn n ASP 57 Ca -0.15 -2.29 0.00 0.00 -0.01 0.00 0.00 54.79 52.35 1xhn n ASP 57 Cb 0.56 -0.41 0.00 0.00 -1.03 0.00 0.00 41.12 40.24 1xhn n ASP 57 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1xhn n GLY 58 N 0.66 3.55 3.74 6.12 0.00 -1.26 -0.83 105.19 117.17 1xhn n GLY 58 Ca 0.19 -1.45 -0.30 0.00 0.00 0.00 0.00 46.02 44.46 1xhn n GLY 58 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1xhn s PRO 59 N -2.39 -0.16 -0.49 1.61 0.04 -1.26 -4.72 135.00 127.62 1xhn s PRO 59 Ca 0.00 -0.10 -0.24 0.00 0.04 0.00 0.00 61.00 60.69 1xhn s PRO 59 Cb 0.00 -1.72 -0.23 0.00 0.04 0.00 0.00 34.50 32.59 1xhn s PRO 59 CO 0.00 -3.00 1.80 -2.30 0.04 0.00 0.00 177.00 173.54 1xhn n PRO 60 N -4.25 0.96 0.00 0.56 -0.02 -1.26 -1.65 135.00 129.35 1xhn n PRO 60 Ca 0.12 -1.51 0.00 0.00 -2.02 0.00 0.00 63.50 60.10 1xhn n PRO 60 Cb 0.59 -2.74 0.00 0.00 -0.02 0.00 0.00 33.50 31.34 1xhn n PRO 60 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xhn n GLY 61 N 4.66 -0.41 2.75 -1.23 0.00 -1.26 -5.03 105.19 104.67 1xhn n GLY 61 Ca 0.48 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.46 1xhn n GLY 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xhn n ALA 62 N 0.00 2.71 -2.45 4.61 0.00 -0.66 -5.08 120.51 119.64 1xhn n ALA 62 Ca 0.00 -2.34 -0.43 0.00 0.00 0.00 0.00 53.44 50.67 1xhn n ALA 62 Cb 0.00 -0.89 -0.02 0.00 0.00 0.00 0.00 19.45 18.54 1xhn n ALA 62 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1xhn s GLY 63 N -2.87 1.49 0.00 0.00 0.00 -1.25 -4.19 107.32 100.51 1xhn s GLY 63 Ca 0.23 0.19 0.25 0.00 0.00 0.00 0.00 44.72 45.39 1xhn s GLY 63 CO -0.04 2.51 1.44 -1.14 0.00 0.00 0.00 173.10 175.87 1xhn n SER 64 N 7.21 0.87 0.00 1.64 3.41 -0.01 -4.93 113.62 121.82 1xhn n SER 64 Ca 0.14 -0.68 0.00 0.00 -0.26 0.00 0.00 58.87 58.07 1xhn n SER 64 Cb 0.46 0.25 0.00 0.00 -0.26 0.00 0.00 64.21 64.66 1xhn n SER 64 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xhn n GLY 65 N 1.42 2.40 3.63 5.00 0.00 -1.26 -4.95 105.19 111.42 1xhn n GLY 65 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 1xhn n GLY 65 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xhn s VAL 66 N -2.48 4.84 -0.34 1.61 1.01 -1.26 -4.99 120.40 118.79 1xhn s VAL 66 Ca 0.00 1.31 -0.29 0.00 0.00 0.00 0.00 61.98 63.00 1xhn s VAL 66 Cb 0.00 -4.10 0.01 0.00 0.00 0.00 0.00 36.38 32.28 1xhn s VAL 66 CO 0.00 -0.15 1.32 -2.84 0.00 0.00 0.00 175.10 173.43 1xhn s PRO 67 N 2.85 3.82 0.05 2.72 0.02 -1.26 -4.03 135.00 139.16 1xhn s PRO 67 Ca 0.32 1.12 -0.05 0.00 0.02 0.00 0.00 61.00 62.41 1xhn s PRO 67 Cb -0.15 -3.92 -0.05 0.00 0.02 0.00 0.00 34.50 30.41 1xhn s PRO 67 CO 0.10 -1.25 0.28 0.71 -0.33 0.00 0.00 177.00 176.51 1xhn s TYR 68 N 4.65 3.54 0.13 6.54 2.02 -0.57 -1.97 117.35 131.70 1xhn s TYR 68 Ca 0.57 0.51 0.07 0.00 -0.37 0.00 0.00 57.07 57.84 1xhn s TYR 68 Cb -0.15 -1.95 -0.04 0.00 -0.40 0.00 0.00 41.96 39.42 1xhn s TYR 68 CO 0.26 0.57 -0.15 -0.06 -1.57 0.00 0.00 175.55 174.59 1xhn s PHE 69 N -1.42 1.52 -0.27 2.71 0.08 -0.26 -2.59 117.98 117.74 1xhn s PHE 69 Ca 0.32 -0.52 -0.00 0.00 0.12 0.00 0.00 56.93 56.84 1xhn s PHE 69 Cb -0.13 -0.79 0.05 0.00 -0.57 0.00 0.00 43.02 41.58 1xhn s PHE 69 CO 0.20 0.19 -0.05 -0.47 -0.10 0.00 0.00 175.22 174.99 1xhn s TYR 70 N -2.01 3.21 0.18 0.36 5.04 -1.26 -0.87 117.35 122.00 1xhn s TYR 70 Ca 0.10 -1.91 0.09 0.00 -2.44 0.00 0.00 57.07 52.91 1xhn s TYR 70 Cb -0.06 -2.04 -0.04 0.00 0.35 0.00 0.00 41.96 40.17 1xhn s TYR 70 CO 0.04 -0.81 -0.19 -0.51 -1.34 0.00 0.00 175.55 172.74 1xhn s LEU 71 N 1.23 2.46 0.01 6.97 1.43 -0.38 -4.92 118.68 125.49 1xhn s LEU 71 Ca -0.05 -0.89 0.07 0.00 -1.03 0.00 0.00 54.13 52.23 1xhn s LEU 71 Cb -0.19 -0.88 -0.02 0.00 0.03 0.00 0.00 46.19 45.13 1xhn s LEU 71 CO -0.03 -0.02 -0.20 -0.55 0.23 0.00 0.00 176.35 175.78 1xhn s SER 72 N -2.80 2.35 0.61 2.29 0.15 -1.26 -0.25 113.70 114.79 1xhn s SER 72 Ca 0.18 -0.42 0.30 0.00 0.70 0.00 0.00 55.95 56.71 1xhn s SER 72 Cb -0.05 -0.23 1.62 0.00 -1.71 0.00 0.00 66.02 65.64 1xhn s SER 72 CO 0.08 0.20 2.00 -0.65 1.20 0.00 0.00 173.24 176.07 1xhn h PRO 73 N 5.32 0.00 0.00 5.44 0.11 -1.77 -1.45 132.00 139.65 1xhn h PRO 73 Ca -0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1xhn h PRO 73 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1xhn h PRO 73 CO 0.46 0.00 0.00 -0.07 -0.21 0.00 0.00 178.00 178.18 1xhn h LEU 74 N 0.00 0.00 -9.84 2.35 3.38 -1.95 -3.39 115.31 105.86 1xhn h LEU 74 Ca 0.11 0.00 -0.48 0.00 0.09 0.00 0.00 57.88 57.60 1xhn h LEU 74 Cb 0.76 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 1xhn h LEU 74 CO -0.00 0.00 0.38 -1.10 0.09 0.00 0.00 178.44 177.80 1xhn s GLN 75 N -3.58 4.63 0.27 1.13 -0.21 -0.55 -4.94 119.66 116.40 1xhn s GLN 75 Ca 0.01 1.48 -0.01 0.00 0.02 0.00 0.00 55.36 56.86 1xhn s GLN 75 Cb 0.09 -2.98 0.51 0.00 1.00 0.00 0.00 33.01 31.63 1xhn s GLN 75 CO 0.40 0.29 1.82 -0.07 -2.12 0.00 0.00 175.29 175.62 1xhn h LEU 76 N 3.50 0.82 -1.01 2.90 3.38 -1.89 -1.41 115.31 121.61 1xhn h LEU 76 Ca -0.46 0.05 -0.05 0.00 0.09 0.00 0.00 57.88 57.51 1xhn h LEU 76 Cb 1.20 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.81 1xhn h LEU 76 CO 0.66 0.44 0.15 0.28 0.09 0.00 0.00 178.44 180.06 1xhn h SER 77 N 0.91 0.81 -0.11 -0.43 0.02 -1.94 -2.28 113.55 110.53 1xhn h SER 77 Ca 0.47 -0.14 -0.14 0.00 -0.84 0.00 0.00 61.79 61.14 1xhn h SER 77 Cb 0.47 -0.21 0.01 0.00 0.14 0.00 0.00 62.40 62.80 1xhn h SER 77 CO -0.27 0.78 -0.47 0.58 -1.14 0.00 0.00 176.83 176.31 1xhn h VAL 78 N 0.84 1.37 -0.86 2.27 2.07 -1.64 -1.12 116.25 119.18 1xhn h VAL 78 Ca 0.19 -1.80 0.09 0.00 0.82 0.00 0.00 66.70 65.99 1xhn h VAL 78 Cb 0.28 2.18 -0.06 0.00 -1.52 0.00 0.00 31.29 32.17 1xhn h VAL 78 CO -0.00 0.54 0.56 -1.28 0.02 0.00 0.00 177.57 177.40 1xhn h SER 79 N 0.11 0.78 -0.46 0.57 0.87 -1.21 -1.38 113.55 112.83 1xhn h SER 79 Ca -0.03 0.02 -0.04 0.00 -1.23 0.00 0.00 61.79 60.51 1xhn h SER 79 Cb 1.12 -0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 62.91 1xhn h SER 79 CO 0.10 0.48 0.14 0.78 -0.53 0.00 0.00 176.83 177.79 1xhn h ASN 80 N 0.87 0.67 0.74 6.23 2.35 -1.11 -3.16 115.58 122.17 1xhn h ASN 80 Ca 0.39 -0.21 -0.03 0.00 -0.55 0.00 0.00 56.30 55.90 1xhn h ASN 80 Cb 0.35 -0.18 -0.00 0.00 0.05 0.00 0.00 38.32 38.54 1xhn h ASN 80 CO -0.16 0.71 -0.14 -0.07 -1.65 0.00 0.00 177.43 176.12 1xhn h LEU 81 N 0.60 0.00 -0.85 1.61 3.38 -0.31 -0.19 115.31 119.56 1xhn h LEU 81 Ca 0.15 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.01 1xhn h LEU 81 Cb 0.28 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1xhn h LEU 81 CO -0.00 0.14 -0.28 1.56 0.09 0.00 0.00 178.44 179.94 1xhn h GLN 82 N 0.00 0.53 0.16 1.13 4.20 -1.25 -3.03 115.11 116.85 1xhn h GLN 82 Ca -0.00 -0.22 -0.33 0.00 0.06 0.00 0.00 58.65 58.16 1xhn h GLN 82 Cb 0.54 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.30 1xhn h GLN 82 CO 0.02 0.76 -1.67 0.93 -0.67 0.00 0.00 178.83 178.20 1xhn h GLU 83 N 0.46 0.34 -2.53 1.46 4.39 -1.46 -3.45 114.58 113.79 1xhn h GLU 83 Ca 0.06 -0.58 -0.32 0.00 0.34 0.00 0.00 59.36 58.86 1xhn h GLU 83 Cb 0.73 0.22 -0.36 0.00 -0.10 0.00 0.00 28.75 29.24 1xhn h GLU 83 CO 0.06 1.23 -0.63 1.21 -1.16 0.00 0.00 179.01 179.73 1xhn s ASN 84 N -7.17 1.37 0.00 1.42 3.84 -0.13 -5.05 114.94 109.22 1xhn s ASN 84 Ca -0.13 -0.22 0.31 0.00 0.21 0.00 0.00 52.86 53.04 1xhn s ASN 84 Cb 0.06 0.38 1.76 0.00 -0.55 0.00 0.00 41.25 42.90 1xhn s ASN 84 CO 0.86 -0.33 2.16 -0.81 -2.79 0.00 0.00 177.10 176.19 1xhn n PRO 85 N 5.32 0.78 -2.27 0.43 -0.04 -1.15 -3.93 135.00 134.14 1xhn n PRO 85 Ca -0.05 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 63.00 1xhn n PRO 85 Cb 0.50 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.42 1xhn n PRO 85 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1xhn s TYR 86 N -2.22 3.30 0.15 0.54 2.02 -1.26 -1.08 117.35 118.81 1xhn s TYR 86 Ca 0.40 1.36 -0.17 0.00 -0.37 0.00 0.00 57.07 58.29 1xhn s TYR 86 Cb 0.21 -3.53 0.04 0.00 -0.40 0.00 0.00 41.96 38.27 1xhn s TYR 86 CO 0.40 -1.55 0.46 0.00 -1.57 0.00 0.00 175.55 173.29 1xhn s ALA 87 N -0.30 -1.00 -0.06 3.71 0.00 0.12 -4.60 121.76 119.64 1xhn s ALA 87 Ca 0.53 -0.05 0.01 0.00 0.00 0.00 0.00 51.96 52.45 1xhn s ALA 87 Cb -0.36 0.77 0.02 0.00 0.00 0.00 0.00 23.12 23.55 1xhn s ALA 87 CO 0.41 -0.70 -0.07 0.99 0.00 0.00 0.00 175.76 176.38 1xhn s THR 88 N -3.82 0.79 -0.17 0.00 2.01 -1.00 -1.14 115.64 112.31 1xhn s THR 88 Ca 0.05 -0.25 -0.08 0.00 0.31 0.00 0.00 61.69 61.72 1xhn s THR 88 Cb 0.01 -0.78 -0.04 0.00 0.01 0.00 0.00 72.50 71.69 1xhn s THR 88 CO -0.09 0.29 0.10 -0.22 -0.69 0.00 0.00 174.62 174.00 1xhn s LEU 89 N 0.98 4.06 0.48 4.42 2.96 0.53 -0.42 118.68 131.70 1xhn s LEU 89 Ca -0.10 0.22 0.02 0.00 -0.22 0.00 0.00 54.13 54.06 1xhn s LEU 89 Cb -0.15 -2.02 -0.02 0.00 0.50 0.00 0.00 46.19 44.50 1xhn s LEU 89 CO 0.00 0.24 0.03 0.28 -1.32 0.00 0.00 176.35 175.58 1xhn s THR 90 N -0.03 1.13 -0.24 3.68 -1.32 -0.22 -0.77 115.64 117.85 1xhn s THR 90 Ca 0.08 -2.00 -0.28 0.00 -1.21 0.00 0.00 61.69 58.28 1xhn s THR 90 Cb -0.12 -2.28 0.16 0.00 -1.51 0.00 0.00 72.50 68.75 1xhn s THR 90 CO 0.00 0.00 1.21 0.28 -2.21 0.00 0.00 174.62 173.90 1xhn s THR 92 N -2.93 0.00 -1.09 5.08 -1.32 -1.26 -1.86 115.64 112.25 1xhn s THR 92 Ca 0.12 0.00 0.11 0.00 -1.21 0.00 0.00 61.69 60.72 1xhn s THR 92 Cb 0.03 -1.00 0.12 0.00 -1.51 0.00 0.00 72.50 70.13 1xhn s THR 92 CO 0.07 0.00 1.34 0.18 -2.21 0.00 0.00 174.62 174.00 1xhn n LEU 93 N 0.97 0.00 0.03 9.08 4.77 0.14 -1.54 117.00 130.43 1xhn n LEU 93 Ca -0.07 0.45 0.06 0.00 -0.03 0.00 0.00 56.01 56.42 1xhn n LEU 93 Cb 0.58 -0.45 0.25 0.00 -2.33 0.00 0.00 43.42 41.47 1xhn n LEU 93 CO 0.09 -0.28 0.68 0.00 -1.33 0.00 0.00 177.39 176.55 1xhn n ALA 94 N -1.45 1.41 0.25 -1.18 0.00 -1.26 -1.07 120.51 117.20 1xhn n ALA 94 Ca 0.03 -0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.61 1xhn n ALA 94 Cb 0.12 -1.19 0.53 0.00 0.00 0.00 0.00 19.45 18.92 1xhn n ALA 94 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1xhn h GLN 95 N 0.00 0.00 0.00 0.00 4.20 -1.69 -3.45 115.11 114.18 1xhn h GLN 95 Ca 0.00 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.62 1xhn h GLN 95 Cb 0.17 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.95 1xhn h GLN 95 CO 0.00 0.09 -0.03 0.25 -0.67 0.00 0.00 178.83 178.48 1xhn n THR 96 N -3.21 0.00 1.36 -0.54 -2.24 -0.23 -5.02 114.28 104.40 1xhn n THR 96 Ca 0.01 -0.36 0.11 0.00 -2.27 0.00 0.00 64.05 61.53 1xhn n THR 96 Cb 0.38 -0.73 0.43 0.00 -2.10 0.00 0.00 70.33 68.31 1xhn n THR 96 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1xhn n ASN 97 N -2.55 1.44 -0.15 3.42 5.15 -1.26 -4.42 115.26 116.88 1xhn n ASN 97 Ca 0.02 -1.63 -0.02 0.00 -0.60 0.00 0.00 54.58 52.34 1xhn n ASN 97 Cb 0.11 -0.08 0.06 0.00 -0.53 0.00 0.00 39.78 39.34 1xhn n ASN 97 CO 0.00 0.00 0.00 0.15 1.40 0.00 0.00 177.26 178.81 1xhn h PHE 98 N 1.96 0.05 -0.08 1.20 3.57 -1.93 -1.08 116.94 120.62 1xhn h PHE 98 Ca 0.00 0.03 -0.21 0.00 3.53 0.00 0.00 57.97 61.33 1xhn h PHE 98 Cb 0.43 0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.22 1xhn h PHE 98 CO 0.08 -0.07 -0.81 0.00 -2.23 0.00 0.00 178.31 175.28 1xhn h LYS 100 N 0.35 0.25 -0.39 0.00 1.79 -1.73 0.22 116.57 117.05 1xhn h LYS 100 Ca -0.05 -0.07 -0.02 0.00 -2.18 0.00 0.00 60.65 58.32 1xhn h LYS 100 Cb 1.41 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 32.02 1xhn h LYS 100 CO 0.15 0.44 0.14 -0.22 -1.08 0.00 0.00 179.45 178.89 1xhn h LYS 101 N 0.01 0.55 -0.01 3.15 1.63 -1.19 -2.34 116.57 118.38 1xhn h LYS 101 Ca 0.04 -0.07 0.00 0.00 -0.85 0.00 0.00 60.65 59.77 1xhn h LYS 101 Cb 0.32 -0.10 0.00 0.00 -0.60 0.00 0.00 32.23 31.85 1xhn h LYS 101 CO 0.00 0.47 -0.39 0.72 -3.45 0.00 0.00 179.45 176.80 1xhn n HIS 102 N -4.37 0.00 -3.01 1.91 8.25 -1.05 -4.97 115.22 111.98 1xhn n HIS 102 Ca 0.03 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.37 1xhn n HIS 102 Cb 0.15 -0.09 0.04 0.00 1.12 0.00 0.00 29.99 31.21 1xhn n HIS 102 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1xhn n GLY 103 N 1.39 0.22 3.42 -1.41 0.00 -0.32 -5.01 105.19 103.48 1xhn n GLY 103 Ca 0.10 -0.23 -0.37 0.00 0.00 0.00 0.00 46.02 45.52 1xhn n GLY 103 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xhn s PHE 104 N -3.13 3.11 0.47 1.61 0.08 0.63 -5.04 117.98 115.70 1xhn s PHE 104 Ca 0.28 -0.56 -0.23 0.00 0.12 0.00 0.00 56.93 56.54 1xhn s PHE 104 Cb -0.12 -2.26 -0.09 0.00 -0.57 0.00 0.00 43.02 39.98 1xhn s PHE 104 CO 0.34 -0.42 1.03 -3.47 -0.10 0.00 0.00 175.22 172.60 1xhn n ASP 105 N 4.92 1.30 0.03 1.36 -0.08 -1.26 -4.46 116.55 118.36 1xhn n ASP 105 Ca -0.15 0.98 0.22 0.00 -1.51 0.00 0.00 54.79 54.32 1xhn n ASP 105 Cb 0.50 -1.38 0.73 0.00 2.34 0.00 0.00 41.12 43.31 1xhn n ASP 105 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1xhn h PRO 106 N 1.33 0.00 -0.01 -0.67 0.11 -1.93 -0.70 132.00 130.12 1xhn h PRO 106 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1xhn h PRO 106 Cb 1.34 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.45 1xhn h PRO 106 CO 0.56 0.00 -0.44 0.94 -0.21 0.00 0.00 178.00 178.84 1xhn n GLN 107 N -3.94 0.89 -2.11 1.05 7.27 -1.26 -4.81 117.38 114.48 1xhn n GLN 107 Ca 0.09 -0.66 -0.41 0.00 0.07 0.00 0.00 57.00 56.09 1xhn n GLN 107 Cb 0.66 -1.49 -0.03 0.00 2.41 0.00 0.00 30.24 31.80 1xhn n GLN 107 CO 0.00 0.00 0.00 0.45 0.07 0.00 0.00 177.06 177.58 1xhn s SER 108 N -2.56 6.77 0.53 1.69 0.15 -0.27 -4.89 113.70 115.11 1xhn s SER 108 Ca 0.19 2.55 0.35 0.00 0.70 0.00 0.00 55.95 59.75 1xhn s SER 108 Cb 0.18 -2.62 1.88 0.00 -1.71 0.00 0.00 66.02 63.75 1xhn s SER 108 CO 0.59 -0.61 2.08 1.55 1.20 0.00 0.00 173.24 178.05 1xhn h PRO 109 N 5.12 0.00 0.00 5.44 0.13 -1.86 0.26 132.00 141.08 1xhn h PRO 109 Ca -0.46 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.62 1xhn h PRO 109 Cb 1.22 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 1xhn h PRO 109 CO 0.77 0.00 -0.25 -0.07 -0.23 0.00 0.00 178.00 178.22 1xhn h LEU 110 N 0.00 0.00 -8.02 1.56 -0.00 -1.85 -3.25 115.31 103.75 1xhn h LEU 110 Ca 0.00 0.00 -0.65 0.00 -0.00 0.00 0.00 57.88 57.23 1xhn h LEU 110 Cb 0.06 0.00 -0.13 0.00 -0.00 0.00 0.00 40.66 40.59 1xhn h LEU 110 CO 0.00 0.25 1.33 0.00 -0.00 0.00 0.00 178.44 180.02 1xhn n VAL 112 N 6.22 0.16 -4.18 0.00 0.31 -1.23 -4.68 118.33 114.92 1xhn n VAL 112 Ca 0.32 -0.03 -0.17 0.00 -0.01 0.00 0.00 64.34 64.44 1xhn n VAL 112 Cb 0.49 -1.44 -0.12 0.00 -0.91 0.00 0.00 33.84 31.87 1xhn n VAL 112 CO 0.00 0.00 0.00 -1.38 -1.32 0.00 0.00 176.83 174.13 1xhn s HIS 113 N 1.79 1.21 0.00 3.52 -3.43 -0.97 -0.69 115.29 116.72 1xhn s HIS 113 Ca 0.85 -0.52 0.00 0.00 -0.80 0.00 0.00 55.06 54.59 1xhn s HIS 113 Cb -0.77 -0.66 0.00 0.00 -1.43 0.00 0.00 32.58 29.71 1xhn s HIS 113 CO 0.45 0.06 0.00 0.44 -2.00 0.00 0.00 174.74 173.70 1xhn n ILE 114 N 0.98 0.00 -3.22 -5.38 -5.35 -1.26 -0.83 119.36 104.30 1xhn n ILE 114 Ca -0.19 0.00 0.04 0.00 -0.27 0.00 0.00 62.75 62.33 1xhn n ILE 114 Cb 0.55 0.00 -0.04 0.00 -1.74 0.00 0.00 39.64 38.42 1xhn n ILE 114 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 1xhn s LEU 116 N 0.00 -0.21 0.06 7.28 1.43 0.05 -4.34 118.68 122.94 1xhn s LEU 116 Ca 0.00 0.25 0.07 0.00 -1.03 0.00 0.00 54.13 53.42 1xhn s LEU 116 Cb 0.00 1.23 -0.03 0.00 0.03 0.00 0.00 46.19 47.41 1xhn s LEU 116 CO 0.00 -0.04 -0.14 -0.55 0.23 0.00 0.00 176.35 175.85 1xhn s SER 117 N 2.34 4.10 0.00 2.29 0.15 0.39 -0.34 113.70 122.62 1xhn s SER 117 Ca -0.02 -0.38 0.00 0.00 0.70 0.00 0.00 55.95 56.26 1xhn s SER 117 Cb -0.04 -0.74 0.00 0.00 -1.71 0.00 0.00 66.02 63.53 1xhn s SER 117 CO -0.15 0.24 0.00 0.61 1.20 0.00 0.00 173.24 175.14 1xhn n GLY 118 N 1.29 -0.74 3.36 9.45 0.00 -0.29 -0.97 105.19 117.29 1xhn n GLY 118 Ca -0.15 -0.30 -0.27 0.00 0.00 0.00 0.00 46.02 45.29 1xhn n GLY 118 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1xhn s THR 119 N -4.00 2.09 -0.22 2.61 -4.23 -0.99 -0.70 115.64 110.20 1xhn s THR 119 Ca 0.00 -1.68 -0.10 0.00 -1.18 0.00 0.00 61.69 58.73 1xhn s THR 119 Cb 0.00 -1.86 -0.05 0.00 1.34 0.00 0.00 72.50 71.93 1xhn s THR 119 CO 0.00 0.05 0.13 -0.69 -0.54 0.00 0.00 174.62 173.57 1xhn s VAL 120 N -1.08 5.27 0.21 2.29 1.01 -0.24 -0.85 120.40 127.00 1xhn s VAL 120 Ca 0.12 0.14 0.04 0.00 0.00 0.00 0.00 61.98 62.28 1xhn s VAL 120 Cb -0.10 -3.43 -0.05 0.00 0.00 0.00 0.00 36.38 32.80 1xhn s VAL 120 CO 0.05 0.40 -0.03 0.42 0.00 0.00 0.00 175.10 175.95 1xhn s THR 121 N 0.69 1.04 0.29 3.92 -4.23 -0.65 -4.85 115.64 111.85 1xhn s THR 121 Ca 0.07 -2.04 -0.29 0.00 -1.18 0.00 0.00 61.69 58.25 1xhn s THR 121 Cb -0.12 -2.20 -0.10 0.00 1.34 0.00 0.00 72.50 71.42 1xhn s THR 121 CO 0.01 -0.44 1.27 -0.54 -0.54 0.00 0.00 174.62 174.38 1xhn s LYS 122 N -3.84 4.42 0.29 3.99 1.02 -1.26 -0.76 119.74 123.59 1xhn s LYS 122 Ca 0.25 2.10 -0.29 0.00 0.02 0.00 0.00 55.97 58.05 1xhn s LYS 122 Cb 0.05 -3.12 -0.10 0.00 -0.52 0.00 0.00 37.83 34.14 1xhn s LYS 122 CO 0.06 -0.13 1.17 0.08 -0.92 0.00 0.00 175.35 175.60 1xhn s VAL 123 N -0.80 3.27 0.67 3.17 1.01 -0.07 -4.81 120.40 122.84 1xhn s VAL 123 Ca 0.50 1.26 -0.17 0.00 0.00 0.00 0.00 61.98 63.58 1xhn s VAL 123 Cb -0.38 -3.80 -0.03 0.00 0.00 0.00 0.00 36.38 32.17 1xhn s VAL 123 CO 0.47 0.29 0.79 0.59 0.00 0.00 0.00 175.10 177.24 1xhn n ASN 124 N 1.19 -0.10 -0.22 3.32 3.02 -1.26 -4.94 115.26 116.27 1xhn n ASN 124 Ca -0.00 0.69 -0.00 0.00 -0.03 0.00 0.00 54.58 55.23 1xhn n ASN 124 Cb 0.44 -1.32 0.07 0.00 -0.61 0.00 0.00 39.78 38.36 1xhn n ASN 124 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 1xhn h GLU 125 N -0.04 0.01 0.00 3.52 5.08 -2.02 -1.40 114.58 119.73 1xhn h GLU 125 Ca -0.47 -0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 57.88 1xhn h GLU 125 Cb 1.36 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.60 1xhn h GLU 125 CO 0.47 0.01 -0.06 1.79 -1.00 0.00 0.00 179.01 180.22 1xhn h THR 126 N 0.01 0.22 -2.72 1.13 1.35 -2.04 -3.40 112.91 107.45 1xhn h THR 126 Ca 0.31 -0.45 -0.76 0.00 -0.55 0.00 0.00 66.41 64.96 1xhn h THR 126 Cb 0.48 1.36 -0.31 0.00 -1.73 0.00 0.00 68.15 67.95 1xhn h THR 126 CO -0.65 0.05 0.50 1.21 -0.25 0.00 0.00 175.52 176.38 1xhn n GLU 127 N -3.28 4.12 0.00 4.72 2.13 -0.53 -4.76 120.64 123.04 1xhn n GLU 127 Ca -0.01 -4.59 0.00 0.00 0.66 0.00 0.00 57.16 53.22 1xhn n GLU 127 Cb 0.24 -2.45 0.00 0.00 0.27 0.00 0.00 31.44 29.50 1xhn n GLU 127 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 1xhn n ASP 129 N 1.12 0.00 -0.27 4.31 2.03 -1.26 -1.83 116.55 120.64 1xhn n ASP 129 Ca 0.28 0.00 -0.06 0.00 0.52 0.00 0.00 54.79 55.53 1xhn n ASP 129 Cb 0.34 0.00 0.06 0.00 -0.72 0.00 0.00 41.12 40.80 1xhn n ASP 129 CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 1xhn h ILE 130 N 0.00 1.25 -0.52 5.18 2.10 -1.96 0.21 117.51 123.77 1xhn h ILE 130 Ca 0.00 -0.72 0.01 0.00 1.08 0.00 0.00 64.86 65.22 1xhn h ILE 130 Cb 0.00 0.33 -0.03 0.00 -1.09 0.00 0.00 36.82 36.03 1xhn h ILE 130 CO 0.00 0.30 0.34 0.00 -1.08 0.00 0.00 178.15 177.71 1xhn h ALA 131 N 1.17 0.65 -0.05 0.18 0.00 -1.77 0.12 119.26 119.56 1xhn h ALA 131 Ca 0.26 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 1xhn h ALA 131 Cb 0.15 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 1xhn h ALA 131 CO -0.03 0.09 0.01 -0.22 0.00 0.00 0.00 179.25 179.11 1xhn h LYS 132 N 0.70 0.09 -0.28 0.00 3.64 -1.74 0.55 116.57 119.51 1xhn h LYS 132 Ca 0.19 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.55 1xhn h LYS 132 Cb -0.08 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 1xhn h LYS 132 CO -0.04 0.30 0.17 1.25 -2.27 0.00 0.00 179.45 178.85 1xhn h HIS 133 N -0.14 0.37 -0.21 1.91 2.76 -0.43 0.10 115.15 119.51 1xhn h HIS 133 Ca 0.02 -0.00 0.05 0.00 -2.20 0.00 0.00 60.37 58.24 1xhn h HIS 133 Cb 0.25 -0.12 -0.05 0.00 1.55 0.00 0.00 27.41 29.04 1xhn h HIS 133 CO 0.01 0.27 -0.11 0.77 -1.30 0.00 0.00 177.93 177.57 1xhn h SER 134 N 0.36 -0.37 -0.05 3.26 0.02 -0.58 -2.53 113.55 113.66 1xhn h SER 134 Ca 0.10 0.09 -0.03 0.00 -0.84 0.00 0.00 61.79 61.11 1xhn h SER 134 Cb 0.01 0.20 -0.00 0.00 0.14 0.00 0.00 62.40 62.75 1xhn h SER 134 CO -0.02 -0.14 -0.07 -0.07 -1.14 0.00 0.00 176.83 175.38 1xhn h LEU 135 N -0.09 0.15 -0.81 5.07 3.38 -0.75 -2.93 115.31 119.33 1xhn h LEU 135 Ca 0.12 -0.54 -0.13 0.00 0.09 0.00 0.00 57.88 57.42 1xhn h LEU 135 Cb 0.26 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1xhn h LEU 135 CO -0.27 0.66 -0.51 -0.26 0.09 0.00 0.00 178.44 178.14 1xhn h PHE 136 N -0.36 0.26 -0.34 1.13 0.05 -0.80 0.78 116.94 117.66 1xhn h PHE 136 Ca 0.00 -0.09 -0.09 0.00 3.82 0.00 0.00 57.97 61.62 1xhn h PHE 136 Cb 0.63 -0.05 -0.01 0.00 2.00 0.00 0.00 35.95 38.52 1xhn h PHE 136 CO 0.11 0.68 -0.13 0.82 -0.18 0.00 0.00 178.31 179.61 1xhn h ILE 137 N 0.17 1.29 -0.03 -0.55 1.08 -1.56 -2.91 117.51 114.99 1xhn h ILE 137 Ca 0.00 -1.22 -0.18 0.00 -0.39 0.00 0.00 64.86 63.07 1xhn h ILE 137 Cb 0.97 1.37 -0.01 0.00 -3.07 0.00 0.00 36.82 36.08 1xhn h ILE 137 CO 0.08 0.40 -0.79 -0.09 -0.69 0.00 0.00 178.15 177.06 1xhn h ARG 138 N 0.46 0.26 -2.45 2.37 9.65 -1.20 -3.39 114.38 120.07 1xhn h ARG 138 Ca 0.08 -0.24 -0.60 0.00 -1.10 0.00 0.00 59.98 58.12 1xhn h ARG 138 Cb 0.65 0.06 -0.41 0.00 -1.39 0.00 0.00 29.97 28.88 1xhn h ARG 138 CO 0.04 0.92 -0.74 0.72 2.80 0.00 0.00 179.97 183.72 1xhn n HIS 139 N -3.75 2.14 0.25 2.20 8.25 0.26 -4.97 115.22 119.61 1xhn n HIS 139 Ca -0.04 -3.97 0.17 0.00 -0.26 0.00 0.00 57.72 53.63 1xhn n HIS 139 Cb 0.74 -0.42 0.90 0.00 1.12 0.00 0.00 29.99 32.34 1xhn n HIS 139 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1xhn h PRO 140 N 4.72 0.00 -2.76 -0.41 0.13 -1.71 -3.41 132.00 128.56 1xhn h PRO 140 Ca 0.17 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.28 1xhn h PRO 140 Cb 0.76 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.89 1xhn h PRO 140 CO 0.67 0.00 0.33 -1.91 -0.23 0.00 0.00 178.00 176.86 1xhn n GLU 141 N -3.61 0.25 0.00 0.86 2.13 -1.26 -4.37 120.64 114.64 1xhn n GLU 141 Ca -0.00 -0.12 0.00 0.00 0.66 0.00 0.00 57.16 57.70 1xhn n GLU 141 Cb 0.25 -1.55 0.00 0.00 0.27 0.00 0.00 31.44 30.41 1xhn n GLU 141 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1xhn n LYS 143 N 2.81 0.00 0.00 5.31 5.02 -1.26 -3.22 118.16 126.82 1xhn n LYS 143 Ca 0.05 0.00 0.12 0.00 -2.02 0.00 0.00 58.31 56.46 1xhn n LYS 143 Cb 0.12 -0.44 0.17 0.00 -0.02 0.00 0.00 35.03 34.85 1xhn n LYS 143 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1xhn n THR 144 N -0.02 0.00 -1.96 -0.18 -2.24 -1.26 -4.98 114.28 103.63 1xhn n THR 144 Ca 0.00 -0.20 -0.38 0.00 -2.27 0.00 0.00 64.05 61.20 1xhn n THR 144 Cb 0.00 0.88 0.02 0.00 -2.10 0.00 0.00 70.33 69.13 1xhn n THR 144 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 1xhn s TRP 145 N -2.48 2.53 0.05 4.78 0.52 -1.20 -4.91 118.94 118.23 1xhn s TRP 145 Ca 0.21 1.43 -0.30 0.00 0.02 0.00 0.00 56.10 57.46 1xhn s TRP 145 Cb 0.19 -3.65 -0.09 0.00 -1.15 0.00 0.00 33.47 28.77 1xhn s TRP 145 CO 0.55 -2.37 1.88 -1.25 0.02 0.00 0.00 176.95 175.77 1xhn s PRO 146 N -2.78 4.15 0.59 4.98 0.04 -1.26 -4.89 135.00 135.82 1xhn s PRO 146 Ca 0.68 2.55 0.29 0.00 0.04 0.00 0.00 61.00 64.55 1xhn s PRO 146 Cb -0.36 -3.96 1.66 0.00 0.04 0.00 0.00 34.50 31.87 1xhn s PRO 146 CO 0.44 -0.90 2.10 0.66 0.04 0.00 0.00 177.00 179.33 1xhn h SER 147 N 9.83 0.00 0.11 6.66 4.64 -1.98 -1.74 113.55 131.08 1xhn h SER 147 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1xhn h SER 147 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1xhn h SER 147 CO 0.94 0.00 0.00 0.77 -0.87 0.00 0.00 176.83 177.67 1xhn h SER 148 N 0.00 0.00 0.17 4.97 4.64 -2.03 -1.03 113.55 120.28 1xhn h SER 148 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1xhn h SER 148 Cb 0.49 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 1xhn h SER 148 CO -0.00 0.00 -0.11 1.41 -0.87 0.00 0.00 176.83 177.26 1xhn n HIS 149 N -2.48 0.00 -3.62 4.77 -0.00 -0.65 -4.96 115.22 108.27 1xhn n HIS 149 Ca -0.01 0.00 -0.21 0.00 -0.00 0.00 0.00 57.72 57.49 1xhn n HIS 149 Cb 0.07 -0.09 0.04 0.00 -0.00 0.00 0.00 29.99 30.02 1xhn n HIS 149 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.34 176.43 1xhn n ASN 150 N -0.50 -2.21 -4.74 0.41 3.02 -0.39 -4.07 115.26 106.79 1xhn n ASN 150 Ca 0.16 -0.80 -0.42 0.00 -0.03 0.00 0.00 54.58 53.49 1xhn n ASN 150 Cb 0.31 -4.23 -0.01 0.00 -0.61 0.00 0.00 39.78 35.24 1xhn n ASN 150 CO 0.00 0.00 0.00 0.79 -2.62 0.00 0.00 177.26 175.43 1xhn n TRP 151 N -4.14 2.67 -4.15 3.10 7.02 -1.26 -4.41 117.44 116.27 1xhn n TRP 151 Ca -0.26 0.47 -0.13 0.00 -1.02 0.00 0.00 57.50 56.56 1xhn n TRP 151 Cb 0.66 -2.49 -0.11 0.00 -2.42 0.00 0.00 31.31 26.96 1xhn n TRP 151 CO 0.00 0.00 0.00 -0.59 -2.02 0.00 0.00 177.69 175.08 1xhn s PHE 152 N -0.96 0.95 -0.10 -5.99 -0.71 0.66 -4.95 117.98 106.88 1xhn s PHE 152 Ca 0.56 -0.69 -0.26 0.00 -1.04 0.00 0.00 56.93 55.49 1xhn s PHE 152 Cb -0.52 -0.53 -0.02 0.00 -1.21 0.00 0.00 43.02 40.73 1xhn s PHE 152 CO 0.61 -0.05 0.86 -0.06 -1.34 0.00 0.00 175.22 175.24 1xhn s PHE 153 N -2.55 3.53 0.23 3.49 0.08 -1.26 -1.25 117.98 120.25 1xhn s PHE 153 Ca 0.04 1.40 0.08 0.00 0.12 0.00 0.00 56.93 58.58 1xhn s PHE 153 Cb -0.02 -3.01 -0.05 0.00 -0.57 0.00 0.00 43.02 39.37 1xhn s PHE 153 CO -0.01 -0.10 -0.13 0.00 -0.10 0.00 0.00 175.22 174.88 1xhn s ALA 154 N 1.52 2.20 0.07 5.36 0.00 -0.05 -0.89 121.76 129.96 1xhn s ALA 154 Ca 0.43 -1.76 -0.01 0.00 0.00 0.00 0.00 51.96 50.63 1xhn s ALA 154 Cb -0.18 -0.03 -0.04 0.00 0.00 0.00 0.00 23.12 22.87 1xhn s ALA 154 CO 0.18 0.05 -0.03 -1.59 0.00 0.00 0.00 175.76 174.38 1xhn s LYS 155 N -3.65 0.68 -0.26 0.00 -2.85 0.06 -1.10 119.74 112.61 1xhn s LYS 155 Ca 0.25 -1.26 -0.15 0.00 -1.00 0.00 0.00 55.97 53.81 1xhn s LYS 155 Cb 0.00 0.14 -0.04 0.00 -2.06 0.00 0.00 37.83 35.87 1xhn s LYS 155 CO 0.09 -0.11 0.37 -1.17 0.10 0.00 0.00 175.35 174.63 1xhn s LEU 156 N -2.95 4.05 -0.47 2.77 2.96 -0.83 -1.63 118.68 122.57 1xhn s LEU 156 Ca 0.09 0.30 -0.24 0.00 -0.22 0.00 0.00 54.13 54.06 1xhn s LEU 156 Cb 0.07 -2.42 0.03 0.00 0.50 0.00 0.00 46.19 44.37 1xhn s LEU 156 CO -0.08 -0.17 0.84 0.20 -1.32 0.00 0.00 176.35 175.82 1xhn s ASN 157 N 1.59 6.41 -0.22 3.68 0.01 -0.03 -4.43 114.94 121.95 1xhn s ASN 157 Ca 0.15 -0.13 -0.20 0.00 -0.71 0.00 0.00 52.86 51.97 1xhn s ASN 157 Cb -0.16 -2.41 -0.03 0.00 0.41 0.00 0.00 41.25 39.07 1xhn s ASN 157 CO 0.10 -1.00 0.59 -0.63 -1.51 0.00 0.00 177.10 174.64 1xhn s ILE 158 N 3.49 5.04 -0.06 0.60 1.01 -1.26 -2.35 121.20 127.66 1xhn s ILE 158 Ca 0.31 1.07 0.13 0.00 0.00 0.00 0.00 60.65 62.16 1xhn s ILE 158 Cb -0.12 -3.90 -0.20 0.00 0.01 0.00 0.00 42.46 38.26 1xhn s ILE 158 CO 0.23 0.10 0.21 0.35 0.00 0.00 0.00 174.94 175.83 1xhn n THR 159 N 4.84 0.33 -4.06 2.92 -2.24 -0.15 -4.75 114.28 111.17 1xhn n THR 159 Ca -0.02 -0.40 -0.14 0.00 -2.27 0.00 0.00 64.05 61.21 1xhn n THR 159 Cb 0.50 -0.13 -0.14 0.00 -2.10 0.00 0.00 70.33 68.46 1xhn n THR 159 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 1xhn s ASN 160 N -3.97 0.47 -0.03 3.42 0.01 -0.75 -4.62 114.94 109.47 1xhn s ASN 160 Ca -0.06 -0.16 0.00 0.00 -0.71 0.00 0.00 52.86 51.93 1xhn s ASN 160 Cb 0.07 -0.03 0.03 0.00 0.41 0.00 0.00 41.25 41.73 1xhn s ASN 160 CO 0.56 -0.01 0.01 -0.63 -1.51 0.00 0.00 177.10 175.52 1xhn s ILE 161 N -0.36 0.10 -0.04 0.60 1.01 -1.24 -0.46 121.20 120.82 1xhn s ILE 161 Ca -0.01 0.15 0.07 0.00 0.00 0.00 0.00 60.65 60.85 1xhn s ILE 161 Cb -0.03 -0.22 -0.02 0.00 0.01 0.00 0.00 42.46 42.20 1xhn s ILE 161 CO -0.00 0.13 -0.24 0.26 0.00 0.00 0.00 174.94 175.09 1xhn s TRP 162 N 1.13 2.42 -0.12 3.97 0.51 -1.26 -2.08 118.94 123.51 1xhn s TRP 162 Ca -0.08 -0.48 0.01 0.00 -2.12 0.00 0.00 56.10 53.44 1xhn s TRP 162 Cb -0.13 -1.55 0.02 0.00 -0.81 0.00 0.00 33.47 30.99 1xhn s TRP 162 CO -0.02 -0.06 -0.15 0.08 -0.51 0.00 0.00 176.95 176.29 1xhn s VAL 163 N -0.50 1.51 -0.50 4.03 1.01 0.37 -4.48 120.40 121.83 1xhn s VAL 163 Ca 0.06 -0.63 -0.08 0.00 0.00 0.00 0.00 61.98 61.33 1xhn s VAL 163 Cb -0.11 -1.39 0.13 0.00 0.00 0.00 0.00 36.38 35.01 1xhn s VAL 163 CO 0.01 0.44 0.37 -0.76 0.00 0.00 0.00 175.10 175.16 1xhn s LEU 164 N 1.13 5.67 0.00 3.92 2.01 -0.01 -0.66 118.68 130.75 1xhn s LEU 164 Ca -0.03 -2.07 0.00 0.00 0.01 0.00 0.00 54.13 52.03 1xhn s LEU 164 Cb -0.14 -1.99 0.00 0.00 0.01 0.00 0.00 46.19 44.07 1xhn s LEU 164 CO -0.04 -0.64 0.37 -0.90 1.01 0.00 0.00 176.35 176.15 1xhn n ASP 165 N 4.67 0.47 -3.80 2.29 5.75 -1.23 -2.29 116.55 122.41 1xhn n ASP 165 Ca -0.04 -1.14 -0.07 0.00 -0.01 0.00 0.00 54.79 53.53 1xhn n ASP 165 Cb 0.41 0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.48 1xhn n ASP 165 CO 0.00 0.00 0.00 -0.47 -0.11 0.00 0.00 177.20 176.62 1xhn s TYR 166 N -0.14 -0.21 0.84 2.11 6.14 -1.23 -4.39 117.35 120.48 1xhn s TYR 166 Ca 0.00 -0.20 -0.13 0.00 0.64 0.00 0.00 57.07 57.39 1xhn s TYR 166 Cb 0.00 0.68 0.08 0.00 0.42 0.00 0.00 41.96 43.14 1xhn s TYR 166 CO 0.00 -1.12 1.03 1.19 0.64 0.00 0.00 175.55 177.28 1xhn n PHE 167 N -0.45 0.64 0.00 4.97 3.72 -1.26 -4.18 117.46 120.90 1xhn n PHE 167 Ca -0.06 0.38 0.00 0.00 -0.05 0.00 0.00 57.45 57.72 1xhn n PHE 167 Cb 0.60 -2.02 0.00 0.00 -0.94 0.00 0.00 39.48 37.11 1xhn n PHE 167 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1xhn n GLY 168 N 0.71 0.92 0.00 1.37 0.00 -1.26 -5.00 105.19 101.93 1xhn n GLY 168 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1xhn n GLY 168 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xhn n GLY 169 N -1.59 -0.30 3.76 -0.02 0.00 -1.26 -4.99 105.19 100.79 1xhn n GLY 169 Ca 0.00 -1.83 -0.39 0.00 0.00 0.00 0.00 46.02 43.80 1xhn n GLY 169 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1xhn s PRO 170 N -1.29 3.68 -0.15 1.61 0.02 -1.26 -4.81 135.00 132.81 1xhn s PRO 170 Ca 0.00 2.13 -0.04 0.00 0.02 0.00 0.00 61.00 63.11 1xhn s PRO 170 Cb 0.00 -2.55 -0.03 0.00 0.02 0.00 0.00 34.50 31.94 1xhn s PRO 170 CO 0.00 -0.72 -0.02 0.15 -0.33 0.00 0.00 177.00 176.08 1xhn s LYS 171 N -2.52 3.65 -0.00 5.54 1.02 0.17 -4.90 119.74 122.69 1xhn s LYS 171 Ca 0.62 -0.49 -0.17 0.00 0.02 0.00 0.00 55.97 55.96 1xhn s LYS 171 Cb -0.37 -2.94 -0.06 0.00 -0.52 0.00 0.00 37.83 33.94 1xhn s LYS 171 CO 0.47 0.29 0.47 0.42 -0.92 0.00 0.00 175.35 176.07 1xhn s ILE 172 N 0.25 4.98 -0.05 2.17 -1.09 -1.26 -0.48 121.20 125.73 1xhn s ILE 172 Ca -0.02 0.97 0.02 0.00 -2.23 0.00 0.00 60.65 59.39 1xhn s ILE 172 Cb -0.14 -3.79 0.02 0.00 -1.58 0.00 0.00 42.46 36.97 1xhn s ILE 172 CO 0.02 0.52 -0.08 -0.69 -1.23 0.00 0.00 174.94 173.48 1xhn s VAL 173 N -0.71 0.76 0.49 2.92 1.01 -0.89 -4.99 120.40 119.00 1xhn s VAL 173 Ca 0.26 -0.28 -0.18 0.00 0.00 0.00 0.00 61.98 61.78 1xhn s VAL 173 Cb -0.17 -0.73 -0.09 0.00 0.00 0.00 0.00 36.38 35.40 1xhn s VAL 173 CO 0.14 0.26 0.98 0.42 0.00 0.00 0.00 175.10 176.90 1xhn s THR 174 N 0.66 4.49 0.39 3.92 -4.23 -1.26 -3.60 115.64 116.02 1xhn s THR 174 Ca -0.11 1.29 0.16 0.00 -1.18 0.00 0.00 61.69 61.85 1xhn s THR 174 Cb -0.13 -3.69 0.37 0.00 1.34 0.00 0.00 72.50 70.39 1xhn s THR 174 CO 0.01 -0.59 1.82 -0.65 -0.54 0.00 0.00 174.62 174.67 1xhn h PRO 175 N 1.19 0.45 -0.02 3.99 0.11 -1.85 -0.47 132.00 135.39 1xhn h PRO 175 Ca -0.47 -0.03 -0.21 0.00 0.11 0.00 0.00 66.00 65.39 1xhn h PRO 175 Cb 1.18 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1xhn h PRO 175 CO 0.61 0.30 -0.88 1.05 -0.21 0.00 0.00 178.00 178.87 1xhn h GLU 176 N 0.46 0.41 -0.23 1.05 9.09 -1.95 -0.63 114.58 122.78 1xhn h GLU 176 Ca 0.53 -0.41 -0.00 0.00 0.05 0.00 0.00 59.36 59.52 1xhn h GLU 176 Cb 1.23 0.11 -0.01 0.00 -1.65 0.00 0.00 28.75 28.43 1xhn h GLU 176 CO -0.24 1.07 0.15 0.93 0.05 0.00 0.00 179.01 180.96 1xhn h GLU 177 N 0.25 0.31 -0.30 1.06 5.08 -1.73 -0.58 114.58 118.67 1xhn h GLU 177 Ca -0.07 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.29 1xhn h GLU 177 Cb 1.50 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.66 1xhn h GLU 177 CO 0.15 0.24 0.16 -0.92 -1.00 0.00 0.00 179.01 177.64 1xhn h TYR 178 N 0.30 0.30 0.00 4.33 3.20 -0.89 -2.87 116.97 121.34 1xhn h TYR 178 Ca 0.08 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.97 1xhn h TYR 178 Cb -0.00 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.18 1xhn h TYR 178 CO -0.05 0.18 0.00 0.66 -1.64 0.00 0.00 178.16 177.30 1xhn n TYR 179 N -4.94 0.43 1.19 -3.82 4.01 -0.26 -2.87 117.16 110.90 1xhn n TYR 179 Ca -0.01 0.13 0.13 0.00 -0.16 0.00 0.00 57.90 57.99 1xhn n TYR 179 Cb 0.06 -0.71 0.50 0.00 -0.31 0.00 0.00 39.34 38.88 1xhn n TYR 179 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1xhn n ASN 180 N -1.86 0.41 -4.70 7.72 4.13 -0.23 -4.86 115.26 115.87 1xhn n ASN 180 Ca 0.06 -0.26 -0.43 0.00 1.68 0.00 0.00 54.58 55.63 1xhn n ASN 180 Cb 0.37 -0.07 -0.03 0.00 -1.54 0.00 0.00 39.78 38.51 1xhn n ASN 180 CO 0.00 0.00 0.00 0.52 0.28 0.00 0.00 177.26 178.06 1xhn n VAL 181 N -1.21 0.02 0.69 2.41 0.31 -1.13 -5.08 118.33 114.33 1xhn n VAL 181 Ca 0.10 -0.00 0.08 0.00 -0.01 0.00 0.00 64.34 64.51 1xhn n VAL 181 Cb 0.31 -1.86 0.07 0.00 -0.91 0.00 0.00 33.84 31.45 1xhn n VAL 181 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86