#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x9s n PRO 2 N 0.00 0.18 -3.39 2.12 -0.04 -1.26 -4.77 135.00 127.84 2x9s n PRO 2 Ca 0.00 0.07 -0.19 0.00 -0.04 0.00 0.00 63.50 63.33 2x9s n PRO 2 Cb 0.00 -1.60 -0.02 0.00 -0.04 0.00 0.00 33.50 31.85 2x9s n PRO 2 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 2x9s s ARG 3 N 2.84 2.68 0.17 0.54 1.70 -0.57 -3.62 118.95 122.70 2x9s s ARG 3 Ca 1.03 -1.39 0.07 0.00 -0.47 0.00 0.00 55.73 54.97 2x9s s ARG 3 Cb -1.41 -2.54 -0.04 0.00 -0.57 0.00 0.00 34.95 30.39 2x9s s ARG 3 CO 0.77 -0.18 0.04 -0.51 -1.08 0.00 0.00 175.30 174.34 2x9s s LEU 4 N -4.20 3.46 -0.37 -1.89 1.43 0.13 -1.80 118.68 115.44 2x9s s LEU 4 Ca 0.50 -0.32 0.01 0.00 -1.03 0.00 0.00 54.13 53.28 2x9s s LEU 4 Cb -0.06 -2.09 0.15 0.00 0.03 0.00 0.00 46.19 44.22 2x9s s LEU 4 CO 0.30 0.08 0.25 -0.75 0.23 0.00 0.00 176.35 176.45 2x9s s LYS 5 N -3.01 0.69 0.12 1.70 2.20 -0.21 0.95 119.74 122.17 2x9s s LYS 5 Ca 0.29 -1.57 -0.14 0.00 -0.36 0.00 0.00 55.97 54.18 2x9s s LYS 5 Cb -0.09 -1.40 -0.07 0.00 -1.51 0.00 0.00 37.83 34.76 2x9s s LYS 5 CO 0.20 -1.25 0.52 0.14 -0.36 0.00 0.00 175.35 174.60 2x9s s VAL 6 N 0.76 4.90 -0.12 4.02 -7.23 -0.77 -2.01 120.40 119.95 2x9s s VAL 6 Ca 0.22 0.80 0.01 0.00 -1.81 0.00 0.00 61.98 61.20 2x9s s VAL 6 Cb -0.16 -3.73 0.02 0.00 0.56 0.00 0.00 36.38 33.06 2x9s s VAL 6 CO -0.04 0.30 -0.12 -0.75 -0.31 0.00 0.00 175.10 174.18 2x9s s LYS 7 N -1.81 1.99 -0.17 4.82 2.20 -0.60 -1.10 119.74 125.08 2x9s s LYS 7 Ca 0.35 -0.46 -0.29 0.00 -0.36 0.00 0.00 55.97 55.21 2x9s s LYS 7 Cb -0.15 -1.82 -0.03 0.00 -1.51 0.00 0.00 37.83 34.31 2x9s s LYS 7 CO 0.19 -0.17 1.64 -1.17 -0.36 0.00 0.00 175.35 175.47 2x9s s LEU 8 N 1.32 4.01 -0.03 5.43 0.20 -0.86 -1.75 118.68 127.00 2x9s s LEU 8 Ca -0.00 1.80 0.03 0.00 0.69 0.00 0.00 54.13 56.65 2x9s s LEU 8 Cb -0.14 -3.53 -0.04 0.00 -0.43 0.00 0.00 46.19 42.05 2x9s s LEU 8 CO -0.06 -1.17 0.02 1.33 -0.29 0.00 0.00 176.35 176.18 2x9s n VAL 9 N 6.16 0.20 -4.84 1.68 0.24 0.41 0.52 118.33 122.71 2x9s n VAL 9 Ca 0.19 -0.14 -0.33 0.00 -2.04 0.00 0.00 64.34 62.02 2x9s n VAL 9 Cb 0.45 -0.72 -0.13 0.00 -1.47 0.00 0.00 33.84 31.96 2x9s n VAL 9 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 2x9s s LYS 10 N -2.11 2.73 0.19 7.34 2.20 -0.74 -4.85 119.74 124.51 2x9s s LYS 10 Ca -0.02 -0.68 -0.31 0.00 -0.36 0.00 0.00 55.97 54.61 2x9s s LYS 10 Cb 0.01 -2.46 -0.10 0.00 -1.51 0.00 0.00 37.83 33.77 2x9s s LYS 10 CO 0.14 0.54 1.51 0.45 -0.36 0.00 0.00 175.35 177.63 2x9s s SER 11 N -0.49 6.62 0.00 1.43 0.15 -1.26 -4.82 113.70 115.33 2x9s s SER 11 Ca 0.07 2.62 0.26 0.00 0.70 0.00 0.00 55.95 59.59 2x9s s SER 11 Cb -0.12 -2.60 1.18 0.00 -1.71 0.00 0.00 66.02 62.77 2x9s s SER 11 CO 0.02 -0.77 1.85 -0.81 1.20 0.00 0.00 173.24 174.73 2x9s n PRO 12 N 3.39 0.12 -1.61 5.44 -0.04 -1.26 -4.84 135.00 136.20 2x9s n PRO 12 Ca 0.11 0.05 -0.45 0.00 -0.04 0.00 0.00 63.50 63.17 2x9s n PRO 12 Cb 0.39 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.31 2x9s n PRO 12 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 2x9s n ILE 13 N -1.43 0.47 0.00 0.52 5.41 -1.26 -1.23 119.36 121.84 2x9s n ILE 13 Ca 0.08 -0.27 0.00 0.00 1.00 0.00 0.00 62.75 63.56 2x9s n ILE 13 Cb 0.27 -2.19 0.00 0.00 -0.71 0.00 0.00 39.64 37.01 2x9s n ILE 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2x9s n GLY 14 N 5.31 0.78 3.96 7.39 0.00 -1.26 -5.10 105.19 116.27 2x9s n GLY 14 Ca 0.28 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.08 2x9s n GLY 14 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2x9s s TYR 15 N -2.00 3.46 0.84 1.61 1.51 -0.36 -5.08 117.35 117.32 2x9s s TYR 15 Ca 0.00 0.02 -0.15 0.00 -1.01 0.00 0.00 57.07 55.93 2x9s s TYR 15 Cb 0.00 -1.60 -0.02 0.00 -0.11 0.00 0.00 41.96 40.23 2x9s s TYR 15 CO 0.00 0.44 0.35 -2.30 -1.11 0.00 0.00 175.55 172.93 2x9s n PRO 16 N -1.28 0.02 0.09 -1.71 -0.02 -1.26 -4.79 135.00 126.04 2x9s n PRO 16 Ca -0.08 0.05 -0.12 0.00 -2.02 0.00 0.00 63.50 61.32 2x9s n PRO 16 Cb 0.56 -1.75 -0.05 0.00 -0.02 0.00 0.00 33.50 32.24 2x9s n PRO 16 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2x9s h LYS 17 N -0.92 -0.44 -0.74 -0.52 1.79 -1.98 -2.60 116.57 111.17 2x9s h LYS 17 Ca -0.44 0.03 0.16 0.00 -2.18 0.00 0.00 60.65 58.21 2x9s h LYS 17 Cb 1.32 0.10 -0.14 0.00 -1.58 0.00 0.00 32.23 31.93 2x9s h LYS 17 CO 0.37 -0.29 -0.11 0.38 -1.08 0.00 0.00 179.45 178.72 2x9s h ASP 18 N -0.46 -0.55 0.14 0.86 2.03 -1.99 0.53 116.42 116.99 2x9s h ASP 18 Ca 0.05 0.21 -0.02 0.00 -0.73 0.00 0.00 57.03 56.54 2x9s h ASP 18 Cb 0.51 0.41 -0.00 0.00 -0.83 0.00 0.00 39.33 39.42 2x9s h ASP 18 CO -0.20 -0.22 -0.08 1.56 -1.03 0.00 0.00 179.24 179.27 2x9s h GLN 19 N 0.04 0.00 0.00 4.15 4.20 -1.82 0.57 115.11 122.24 2x9s h GLN 19 Ca 0.38 0.00 -0.14 0.00 0.06 0.00 0.00 58.65 58.95 2x9s h GLN 19 Cb 0.62 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.38 2x9s h GLN 19 CO -0.72 0.08 -0.65 0.87 -0.67 0.00 0.00 178.83 177.74 2x9s h LYS 20 N 0.00 0.00 0.13 1.46 1.57 0.32 -3.15 116.57 116.90 2x9s h LYS 20 Ca -0.00 0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 58.54 2x9s h LYS 20 Cb 0.17 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.51 2x9s h LYS 20 CO 0.01 0.65 -1.03 0.00 -0.57 0.00 0.00 179.45 178.51 2x9s h ALA 21 N 1.35 -0.05 -0.71 3.86 0.00 0.14 -2.86 119.26 121.00 2x9s h ALA 21 Ca -0.01 -0.72 0.13 0.00 0.00 0.00 0.00 54.91 54.31 2x9s h ALA 21 Cb 1.42 0.10 -0.09 0.00 0.00 0.00 0.00 17.79 19.22 2x9s h ALA 21 CO 0.08 0.53 0.24 0.00 0.00 0.00 0.00 179.25 180.10 2x9s h ALA 22 N 0.21 0.95 -0.89 0.00 0.00 -1.01 0.75 119.26 119.27 2x9s h ALA 22 Ca -0.16 0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.87 2x9s h ALA 22 Cb 1.76 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 19.63 2x9s h ALA 22 CO 0.20 -0.25 0.58 -0.07 0.00 0.00 0.00 179.25 179.70 2x9s h LEU 23 N 0.38 1.03 0.31 0.00 3.38 -1.56 -0.11 115.31 118.73 2x9s h LEU 23 Ca 0.38 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.30 2x9s h LEU 23 Cb 0.58 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.08 2x9s h LEU 23 CO -0.41 0.76 -0.15 0.50 0.09 0.00 0.00 178.44 179.22 2x9s h LYS 24 N 1.21 -0.40 -0.94 1.13 3.64 0.46 -0.03 116.57 121.64 2x9s h LYS 24 Ca 0.32 0.03 0.21 0.00 -1.27 0.00 0.00 60.65 59.94 2x9s h LYS 24 Cb -0.12 0.09 -0.12 0.00 -0.41 0.00 0.00 32.23 31.68 2x9s h LYS 24 CO -0.07 -0.20 0.50 0.00 -2.27 0.00 0.00 179.45 177.41 2x9s h ALA 25 N 0.12 1.55 -0.12 5.00 0.00 0.53 0.33 119.26 126.68 2x9s h ALA 25 Ca -0.04 0.12 -0.13 0.00 0.00 0.00 0.00 54.91 54.86 2x9s h ALA 25 Cb 0.40 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2x9s h ALA 25 CO 0.07 -0.22 -0.50 -0.07 0.00 0.00 0.00 179.25 178.53 2x9s h LEU 26 N 0.56 0.35 0.00 0.00 3.38 -0.69 -3.47 115.31 115.43 2x9s h LEU 26 Ca 0.57 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.37 2x9s h LEU 26 Cb 1.01 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.66 2x9s h LEU 26 CO -0.46 0.79 0.00 0.61 0.09 0.00 0.00 178.44 179.47 2x9s n GLY 27 N 0.06 1.20 3.60 0.83 0.00 0.12 -5.05 105.19 105.96 2x9s n GLY 27 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 2x9s n GLY 27 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2x9s s LEU 28 N 0.00 4.11 -0.14 0.99 1.43 -0.58 -4.95 118.68 119.54 2x9s s LEU 28 Ca 0.00 0.40 -0.15 0.00 -1.03 0.00 0.00 54.13 53.35 2x9s s LEU 28 Cb 0.00 -2.64 -0.05 0.00 0.03 0.00 0.00 46.19 43.53 2x9s s LEU 28 CO 0.00 -0.33 -0.29 0.54 0.23 0.00 0.00 176.35 176.50 2x9s n ARG 29 N 5.59 0.44 -3.75 1.70 1.74 -1.26 -4.44 116.66 116.68 2x9s n ARG 29 Ca -0.04 0.18 -0.20 0.00 -0.77 0.00 0.00 57.85 57.01 2x9s n ARG 29 Cb 0.50 -1.28 -0.02 0.00 -1.02 0.00 0.00 32.46 30.64 2x9s n ARG 29 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2x9s s ARG 30 N -2.72 3.11 0.26 5.56 0.52 -1.26 -5.08 118.95 119.34 2x9s s ARG 30 Ca -0.24 -1.00 -0.29 0.00 -0.52 0.00 0.00 55.73 53.67 2x9s s ARG 30 Cb 0.03 -2.74 -0.09 0.00 0.52 0.00 0.00 34.95 32.67 2x9s s ARG 30 CO 0.36 0.21 1.13 -0.51 0.02 0.00 0.00 175.30 176.51 2x9s s LEU 31 N -4.05 4.52 0.00 2.53 1.43 -1.26 -2.80 118.68 119.05 2x9s s LEU 31 Ca 0.40 2.29 0.00 0.00 -1.03 0.00 0.00 54.13 55.78 2x9s s LEU 31 Cb -0.08 -3.62 0.00 0.00 0.03 0.00 0.00 46.19 42.51 2x9s s LEU 31 CO 0.29 -0.21 0.00 0.00 0.23 0.00 0.00 176.35 176.66 2x9s n GLN 32 N 1.44 0.00 -2.18 1.70 1.13 0.19 -5.02 117.38 114.64 2x9s n GLN 32 Ca 0.00 0.00 -0.41 0.00 -1.94 0.00 0.00 57.00 54.65 2x9s n GLN 32 Cb 0.45 -1.15 -0.03 0.00 0.11 0.00 0.00 30.24 29.62 2x9s n GLN 32 CO 0.00 0.00 0.00 -1.14 -1.44 0.00 0.00 177.06 174.48 2x9s s GLN 33 N -0.30 4.40 0.15 -1.09 0.74 -1.12 -4.77 119.66 117.67 2x9s s GLN 33 Ca 0.00 2.13 0.08 0.00 0.05 0.00 0.00 55.36 57.62 2x9s s GLN 33 Cb 0.00 -3.12 -0.04 0.00 1.10 0.00 0.00 33.01 30.95 2x9s s GLN 33 CO 0.00 -0.16 -0.09 -1.21 -0.55 0.00 0.00 175.29 173.28 2x9s s GLU 34 N -1.28 2.09 -0.17 1.67 2.02 -1.26 -2.04 118.70 119.73 2x9s s GLU 34 Ca 0.51 -1.17 -0.07 0.00 0.02 0.00 0.00 54.97 54.26 2x9s s GLU 34 Cb -0.38 -2.22 0.08 0.00 0.10 0.00 0.00 34.13 31.70 2x9s s GLU 34 CO 0.47 0.46 0.37 1.03 0.02 0.00 0.00 175.26 177.62 2x9s s ARG 35 N -2.60 0.28 -0.18 1.61 0.52 -0.26 -4.99 118.95 113.34 2x9s s ARG 35 Ca 0.23 0.91 -0.22 0.00 -0.52 0.00 0.00 55.73 56.13 2x9s s ARG 35 Cb -0.10 0.17 -0.02 0.00 0.52 0.00 0.00 34.95 35.52 2x9s s ARG 35 CO 0.15 -0.24 0.69 0.08 0.02 0.00 0.00 175.30 175.99 2x9s s VAL 36 N 2.34 4.99 0.32 3.52 1.01 -1.25 -1.84 120.40 129.48 2x9s s VAL 36 Ca -0.02 1.32 0.03 0.00 0.00 0.00 0.00 61.98 63.31 2x9s s VAL 36 Cb -0.11 -4.00 -0.05 0.00 0.00 0.00 0.00 36.38 32.21 2x9s s VAL 36 CO -0.11 0.10 0.08 -0.76 0.00 0.00 0.00 175.10 174.41 2x9s s LEU 37 N 1.87 2.00 0.87 3.92 1.43 0.27 -4.93 118.68 124.10 2x9s s LEU 37 Ca 0.32 -1.43 -0.11 0.00 -1.03 0.00 0.00 54.13 51.87 2x9s s LEU 37 Cb -0.16 -0.22 0.11 0.00 0.03 0.00 0.00 46.19 45.95 2x9s s LEU 37 CO 0.11 -0.70 1.09 -1.61 0.23 0.00 0.00 176.35 175.48 2x9s s GLU 38 N -3.90 1.47 -0.06 1.70 0.41 -1.26 0.21 118.70 117.28 2x9s s GLU 38 Ca 0.35 0.92 0.17 0.00 -0.41 0.00 0.00 54.97 56.01 2x9s s GLU 38 Cb 0.07 -1.83 0.60 0.00 -1.78 0.00 0.00 34.13 31.20 2x9s s GLU 38 CO 0.15 -2.12 1.49 -3.47 -0.49 0.00 0.00 175.26 170.82 2x9s n ASP 39 N -3.82 3.85 -4.36 -0.19 2.03 -1.24 -4.33 116.55 108.50 2x9s n ASP 39 Ca 0.08 -2.22 -0.34 0.00 0.52 0.00 0.00 54.79 52.83 2x9s n ASP 39 Cb 0.55 -0.49 0.10 0.00 -0.72 0.00 0.00 41.12 40.56 2x9s n ASP 39 CO 0.00 0.00 0.00 1.07 -1.92 0.00 0.00 177.20 176.35 2x9s n THR 40 N 1.13 0.22 -0.15 5.18 5.66 -1.26 -4.74 114.28 120.33 2x9s n THR 40 Ca 0.22 -0.26 0.01 0.00 -3.05 0.00 0.00 64.05 60.97 2x9s n THR 40 Cb 0.68 -0.54 0.28 0.00 -1.55 0.00 0.00 70.33 69.20 2x9s n THR 40 CO 0.00 0.00 0.00 -0.65 -3.05 0.00 0.00 175.07 171.37 2x9s h PRO 41 N -1.32 0.85 0.00 1.09 0.11 -2.00 -2.47 132.00 128.26 2x9s h PRO 41 Ca -0.44 -0.07 -0.05 0.00 0.11 0.00 0.00 66.00 65.56 2x9s h PRO 41 Cb 1.29 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 2x9s h PRO 41 CO 0.34 0.59 -0.23 0.00 -0.21 0.00 0.00 178.00 178.49 2x9s h ALA 42 N 1.56 1.11 0.00 -0.75 0.00 -1.98 -1.43 119.26 117.77 2x9s h ALA 42 Ca 0.23 -0.21 -0.18 0.00 0.00 0.00 0.00 54.91 54.75 2x9s h ALA 42 Cb -0.04 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 2x9s h ALA 42 CO -0.04 0.28 -1.11 0.82 0.00 0.00 0.00 179.25 179.20 2x9s h ILE 43 N 0.00 0.94 0.08 0.00 1.08 -1.77 -3.35 117.51 114.49 2x9s h ILE 43 Ca -0.00 -2.51 -0.15 0.00 -0.39 0.00 0.00 64.86 61.81 2x9s h ILE 43 Cb 0.64 2.40 0.02 0.00 -3.07 0.00 0.00 36.82 36.80 2x9s h ILE 43 CO 0.03 0.54 -0.63 0.03 -0.69 0.00 0.00 178.15 177.42 2x9s h ARG 44 N 0.00 0.28 -1.00 2.37 3.08 -1.25 -3.13 114.38 114.74 2x9s h ARG 44 Ca -0.10 -0.41 0.31 0.00 0.07 0.00 0.00 59.98 59.84 2x9s h ARG 44 Cb 1.65 0.14 -0.18 0.00 0.08 0.00 0.00 29.97 31.66 2x9s h ARG 44 CO 0.08 1.16 0.15 0.78 -1.07 0.00 0.00 179.97 181.07 2x9s h GLY 45 N -0.39 1.51 1.61 0.04 0.00 -1.40 0.77 103.07 105.21 2x9s h GLY 45 Ca -0.10 0.08 -0.21 0.00 0.00 0.00 0.00 47.33 47.10 2x9s h GLY 45 CO 0.12 -0.59 -0.87 3.43 0.00 0.00 0.00 176.54 178.63 2x9s h ASN 46 N 0.01 0.45 1.30 0.19 -0.26 -1.71 -1.77 115.58 113.80 2x9s h ASN 46 Ca 0.66 -0.35 -0.00 0.00 -0.56 0.00 0.00 56.30 56.06 2x9s h ASN 46 Cb 1.49 -0.14 -0.00 0.00 -1.06 0.00 0.00 38.32 38.61 2x9s h ASN 46 CO -0.89 1.13 -0.01 0.58 -1.06 0.00 0.00 177.43 177.18 2x9s h VAL 47 N 0.21 0.02 0.25 2.81 2.07 0.30 -2.17 116.25 119.75 2x9s h VAL 47 Ca -0.06 -0.68 -0.33 0.00 0.82 0.00 0.00 66.70 66.45 2x9s h VAL 47 Cb 1.49 1.66 0.04 0.00 -1.52 0.00 0.00 31.29 32.96 2x9s h VAL 47 CO 0.15 0.01 -1.47 -0.33 0.02 0.00 0.00 177.57 175.95 2x9s h GLU 48 N 0.00 0.53 -0.11 1.57 4.39 0.21 -2.61 114.58 118.57 2x9s h GLU 48 Ca -0.00 -0.91 -0.01 0.00 0.34 0.00 0.00 59.36 58.78 2x9s h GLU 48 Cb 0.66 0.34 -0.01 0.00 -0.10 0.00 0.00 28.75 29.64 2x9s h GLU 48 CO 0.00 1.44 0.01 -0.22 -1.16 0.00 0.00 179.01 179.08 2x9s h LYS 49 N 0.13 0.15 -0.25 2.33 3.64 -0.96 -2.80 116.57 118.80 2x9s h LYS 49 Ca -0.26 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.11 2x9s h LYS 49 Cb 2.15 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.94 2x9s h LYS 49 CO 0.27 0.16 0.00 1.33 -2.27 0.00 0.00 179.45 178.94 2x9s n VAL 50 N -4.45 1.74 -0.34 2.00 0.24 -0.85 -4.78 118.33 111.89 2x9s n VAL 50 Ca -0.01 -1.55 0.05 0.00 -2.04 0.00 0.00 64.34 60.78 2x9s n VAL 50 Cb 0.13 0.05 0.13 0.00 -1.47 0.00 0.00 33.84 32.69 2x9s n VAL 50 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2x9s h ALA 51 N 1.63 0.62 0.00 2.33 0.00 -1.18 0.48 119.26 123.14 2x9s h ALA 51 Ca 0.00 0.37 0.00 0.00 0.00 0.00 0.00 54.91 55.28 2x9s h ALA 51 Cb 1.11 0.74 0.00 0.00 0.00 0.00 0.00 17.79 19.63 2x9s h ALA 51 CO 0.12 -0.39 0.09 -2.39 0.00 0.00 0.00 179.25 176.68 2x9s n HIS 52 N -5.61 0.26 0.05 0.00 1.44 -1.26 -1.42 115.22 108.68 2x9s n HIS 52 Ca 0.15 0.14 0.01 0.00 -2.01 0.00 0.00 57.72 56.00 2x9s n HIS 52 Cb 0.48 -0.64 0.00 0.00 0.12 0.00 0.00 29.99 29.95 2x9s n HIS 52 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2x9s n LEU 53 N -1.74 0.71 -4.28 2.39 4.77 0.16 -4.77 117.00 114.24 2x9s n LEU 53 Ca -0.01 -0.82 -0.27 0.00 -0.03 0.00 0.00 56.01 54.89 2x9s n LEU 53 Cb 0.10 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.05 2x9s n LEU 53 CO 0.03 0.17 -0.53 -0.69 -1.33 0.00 0.00 177.39 175.04 2x9s s VAL 54 N -0.45 1.81 -0.31 4.08 1.01 -0.51 -0.44 120.40 125.59 2x9s s VAL 54 Ca 0.01 -1.32 -0.06 0.00 0.00 0.00 0.00 61.98 60.61 2x9s s VAL 54 Cb 0.01 -1.58 0.02 0.00 0.00 0.00 0.00 36.38 34.83 2x9s s VAL 54 CO 0.02 0.20 0.07 -0.60 0.00 0.00 0.00 175.10 174.79 2x9s s ARG 55 N -1.34 2.87 -0.07 2.72 3.52 -0.72 -4.81 118.95 121.13 2x9s s ARG 55 Ca 0.09 -1.00 -0.04 0.00 -0.13 0.00 0.00 55.73 54.64 2x9s s ARG 55 Cb -0.09 -3.35 -0.04 0.00 -1.56 0.00 0.00 34.95 29.90 2x9s s ARG 55 CO 0.02 -0.53 0.14 0.08 -0.81 0.00 0.00 175.30 174.21 2x9s s VAL 56 N 1.44 5.30 -0.06 7.11 1.01 -1.26 -1.55 120.40 132.39 2x9s s VAL 56 Ca 0.00 -0.02 0.01 0.00 0.00 0.00 0.00 61.98 61.98 2x9s s VAL 56 Cb -0.18 -3.37 0.02 0.00 0.00 0.00 0.00 36.38 32.85 2x9s s VAL 56 CO 0.02 0.49 -0.07 -0.70 0.00 0.00 0.00 175.10 174.83 2x9s s GLU 57 N -1.40 1.20 -0.50 2.72 2.12 -0.85 -5.00 118.70 116.99 2x9s s GLU 57 Ca 0.20 -0.22 -0.24 0.00 0.36 0.00 0.00 54.97 55.07 2x9s s GLU 57 Cb -0.12 -1.11 0.03 0.00 0.26 0.00 0.00 34.13 33.19 2x9s s GLU 57 CO 0.10 -0.07 0.88 0.08 -0.54 0.00 0.00 175.26 175.71 2x9s s VAL 58 N 0.93 4.51 0.18 3.70 1.01 -1.26 -1.05 120.40 128.41 2x9s s VAL 58 Ca -0.10 0.42 -0.02 0.00 0.00 0.00 0.00 61.98 62.28 2x9s s VAL 58 Cb -0.15 -4.44 -0.04 0.00 0.00 0.00 0.00 36.38 31.76 2x9s s VAL 58 CO 0.01 -0.91 0.12 -0.69 0.00 0.00 0.00 175.10 173.62 2x9s s VAL 59 N 3.65 0.04 0.00 2.92 1.01 -0.74 -5.01 120.40 122.26 2x9s s VAL 59 Ca 0.31 -1.94 0.00 0.00 0.00 0.00 0.00 61.98 60.36 2x9s s VAL 59 Cb -0.12 -2.31 0.00 0.00 0.00 0.00 0.00 36.38 33.95 2x9s s VAL 59 CO 0.22 -0.17 0.00 1.21 0.00 0.00 0.00 175.10 176.36