#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nyk h PRO 47 N 0.00 0.53 0.00 -0.78 0.11 -1.99 0.57 132.00 130.44 1nyk h PRO 47 Ca 0.00 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.08 1nyk h PRO 47 Cb 0.00 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 30.99 1nyk h PRO 47 CO 0.00 0.35 0.00 0.93 -0.21 0.00 0.00 178.00 179.07 1nyk h GLU 48 N 0.55 0.00 -0.16 1.05 3.07 -1.94 -2.68 114.58 114.46 1nyk h GLU 48 Ca 0.40 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.26 1nyk h GLU 48 Cb 0.77 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.68 1nyk h GLU 48 CO -0.16 0.00 0.00 1.63 -1.40 0.00 0.00 179.01 179.08 1nyk n LYS 49 N -2.40 2.08 -1.94 2.33 5.02 0.16 -0.49 118.16 122.90 1nyk n LYS 49 Ca 0.03 -1.91 -0.37 0.00 -2.02 0.00 0.00 58.31 54.04 1nyk n LYS 49 Cb 0.30 -1.42 0.04 0.00 -0.02 0.00 0.00 35.03 33.92 1nyk n LYS 49 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 1nyk s GLU 50 N -1.57 3.00 0.56 1.97 2.12 -0.98 -4.61 118.70 119.19 1nyk s GLU 50 Ca 0.28 1.94 -0.20 0.00 0.36 0.00 0.00 54.97 57.36 1nyk s GLU 50 Cb 0.18 -2.02 -0.05 0.00 0.26 0.00 0.00 34.13 32.51 1nyk s GLU 50 CO 0.27 -1.22 1.20 -1.25 -0.54 0.00 0.00 175.26 173.72 1nyk s PRO 51 N -3.20 3.16 0.25 4.30 0.04 -1.26 -4.86 135.00 133.43 1nyk s PRO 51 Ca 0.76 1.81 -0.29 0.00 0.04 0.00 0.00 61.00 63.32 1nyk s PRO 51 Cb -0.33 -2.03 -0.15 0.00 0.04 0.00 0.00 34.50 32.03 1nyk s PRO 51 CO 0.37 -1.05 0.98 -0.11 0.04 0.00 0.00 177.00 177.23 1nyk n LEU 52 N -1.35 1.37 -4.18 -3.56 0.00 -1.26 -5.01 117.00 103.01 1nyk n LEU 52 Ca 0.12 1.17 -0.22 0.00 0.00 0.00 0.00 56.01 57.08 1nyk n LEU 52 Cb 0.49 -1.23 -0.13 0.00 0.00 0.00 0.00 43.42 42.55 1nyk n LEU 52 CO 0.45 -1.57 -0.48 -0.54 0.00 0.00 0.00 177.39 175.25 1nyk s LYS 53 N -1.25 1.06 0.26 1.96 -0.14 -1.26 -5.01 119.74 115.37 1nyk s LYS 53 Ca 0.62 -0.84 -0.29 0.00 -1.36 0.00 0.00 55.97 54.10 1nyk s LYS 53 Cb -0.76 -1.11 -0.14 0.00 -1.68 0.00 0.00 37.83 34.14 1nyk s LYS 53 CO 0.58 0.28 1.08 -2.30 -0.76 0.00 0.00 175.35 174.23 1nyk n PRO 54 N 1.82 1.40 0.00 -1.68 -0.02 -1.26 -1.50 135.00 133.75 1nyk n PRO 54 Ca -0.18 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 61.79 1nyk n PRO 54 Cb 0.54 -1.92 0.00 0.00 -0.02 0.00 0.00 33.50 32.10 1nyk n PRO 54 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1nyk n GLY 55 N 1.45 0.75 3.77 -1.23 0.00 0.94 -4.99 105.19 105.87 1nyk n GLY 55 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 1nyk n GLY 55 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1nyk s ASP 56 N -2.14 6.33 0.10 1.61 -0.00 -0.56 -4.64 116.67 117.36 1nyk s ASP 56 Ca 0.00 2.44 -0.28 0.00 -0.00 0.00 0.00 52.55 54.72 1nyk s ASP 56 Cb 0.00 -2.62 -0.06 0.00 -0.00 0.00 0.00 42.92 40.24 1nyk s ASP 56 CO 0.00 -0.82 0.88 -0.63 -0.00 0.00 0.00 175.17 174.60 1nyk s ILE 57 N -1.39 4.54 -0.13 0.77 -1.09 -0.16 -0.44 121.20 123.30 1nyk s ILE 57 Ca 0.59 1.89 -0.21 0.00 -2.23 0.00 0.00 60.65 60.69 1nyk s ILE 57 Cb -0.33 -4.24 -0.03 0.00 -1.58 0.00 0.00 42.46 36.28 1nyk s ILE 57 CO 0.41 0.36 0.60 -0.76 -1.23 0.00 0.00 174.94 174.32 1nyk s LEU 58 N -0.20 4.25 0.18 2.97 1.43 -0.17 -0.21 118.68 126.92 1nyk s LEU 58 Ca 0.43 0.94 0.11 0.00 -1.03 0.00 0.00 54.13 54.58 1nyk s LEU 58 Cb -0.22 -2.88 -0.04 0.00 0.03 0.00 0.00 46.19 43.07 1nyk s LEU 58 CO 0.27 -0.12 -0.24 0.68 0.23 0.00 0.00 176.35 177.17 1nyk s VAL 59 N 1.09 2.36 0.44 -1.59 -7.23 0.05 -0.42 120.40 115.10 1nyk s VAL 59 Ca 0.30 -1.96 -0.25 0.00 -1.81 0.00 0.00 61.98 58.27 1nyk s VAL 59 Cb -0.16 -2.11 -0.08 0.00 0.56 0.00 0.00 36.38 34.58 1nyk s VAL 59 CO 0.13 -0.07 1.34 -0.31 -0.31 0.00 0.00 175.10 175.88 1nyk s TYR 60 N -1.53 2.65 0.27 2.82 1.51 -0.70 -1.36 117.35 121.01 1nyk s TYR 60 Ca 0.19 1.37 -0.31 0.00 -1.01 0.00 0.00 57.07 57.32 1nyk s TYR 60 Cb -0.08 -3.74 -0.13 0.00 -0.11 0.00 0.00 41.96 37.90 1nyk s TYR 60 CO 0.09 -2.39 1.50 0.00 -1.11 0.00 0.00 175.55 173.63 1nyk n ALA 61 N -0.15 1.80 -2.90 3.71 0.00 -0.42 -4.69 120.51 117.86 1nyk n ALA 61 Ca 0.05 0.39 -0.12 0.00 0.00 0.00 0.00 53.44 53.77 1nyk n ALA 61 Cb 0.44 -2.36 -0.12 0.00 0.00 0.00 0.00 19.45 17.40 1nyk n ALA 61 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1nyk s GLN 62 N -0.45 0.40 0.00 0.00 2.00 -1.26 -5.02 119.66 115.33 1nyk s GLN 62 Ca 0.66 -0.59 0.00 0.00 -2.00 0.00 0.00 55.36 53.43 1nyk s GLN 62 Cb -0.58 -0.14 0.00 0.00 0.80 0.00 0.00 33.01 33.10 1nyk s GLN 62 CO 0.49 0.02 0.00 0.41 -0.50 0.00 0.00 175.29 175.71 1nyk n GLY 63 N 1.78 -0.41 2.00 2.59 0.00 -1.26 -5.06 105.19 104.83 1nyk n GLY 63 Ca -0.21 -0.76 -0.15 0.00 0.00 0.00 0.00 46.02 44.90 1nyk n GLY 63 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nyk n GLY 64 N 3.49 -1.05 0.00 -0.02 0.00 -1.26 -5.00 105.19 101.35 1nyk n GLY 64 Ca 0.00 -1.73 0.00 0.00 0.00 0.00 0.00 46.02 44.29 1nyk n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nyk n GLY 65 N 0.57 -0.27 3.75 -0.02 0.00 -1.26 -4.91 105.19 103.04 1nyk n GLY 65 Ca 0.09 -1.85 -0.41 0.00 0.00 0.00 0.00 46.02 43.84 1nyk n GLY 65 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1nyk s GLU 66 N -1.21 4.27 0.66 1.61 2.56 -1.26 -4.99 118.70 120.34 1nyk s GLU 66 Ca 0.00 2.30 -0.15 0.00 0.00 0.00 0.00 54.97 57.12 1nyk s GLU 66 Cb 0.00 -3.11 -0.00 0.00 2.00 0.00 0.00 34.13 33.02 1nyk s GLU 66 CO 0.00 -0.42 1.10 -1.25 -0.56 0.00 0.00 175.26 174.13 1nyk s PRO 67 N -0.41 2.85 -0.26 4.30 0.04 -1.26 -5.03 135.00 135.23 1nyk s PRO 67 Ca 0.59 1.33 -0.02 0.00 0.04 0.00 0.00 61.00 62.94 1nyk s PRO 67 Cb -0.42 -1.96 0.02 0.00 0.04 0.00 0.00 34.50 32.18 1nyk s PRO 67 CO 0.44 -1.20 -0.04 0.21 0.04 0.00 0.00 177.00 176.44 1nyk s LYS 68 N -4.18 2.87 0.52 4.56 2.20 -1.26 -5.06 119.74 119.39 1nyk s LYS 68 Ca 0.66 -0.96 -0.21 0.00 -0.36 0.00 0.00 55.97 55.10 1nyk s LYS 68 Cb -0.19 -3.05 -0.06 0.00 -1.51 0.00 0.00 37.83 33.02 1nyk s LYS 68 CO 0.42 -0.41 1.20 -1.25 -0.36 0.00 0.00 175.35 174.95 1nyk s PRO 69 N 1.35 3.42 -0.23 4.03 0.04 -1.26 -1.71 135.00 140.64 1nyk s PRO 69 Ca 0.00 1.82 -0.24 0.00 0.04 0.00 0.00 61.00 62.63 1nyk s PRO 69 Cb -0.17 -2.21 -0.01 0.00 0.04 0.00 0.00 34.50 32.16 1nyk s PRO 69 CO -0.03 -0.84 0.80 0.42 0.04 0.00 0.00 177.00 177.39 1nyk s ILE 70 N -1.56 4.86 -0.14 0.56 1.01 0.44 -4.81 121.20 121.56 1nyk s ILE 70 Ca 0.69 1.52 -0.08 0.00 0.00 0.00 0.00 60.65 62.79 1nyk s ILE 70 Cb -0.30 -4.10 -0.04 0.00 0.01 0.00 0.00 42.46 38.03 1nyk s ILE 70 CO 0.35 -0.05 0.14 -0.13 0.00 0.00 0.00 174.94 175.25 1nyk s ARG 71 N 2.70 3.60 0.28 2.79 0.52 -1.26 -0.99 118.95 126.59 1nyk s ARG 71 Ca 0.34 -0.16 -0.00 0.00 -0.52 0.00 0.00 55.73 55.40 1nyk s ARG 71 Cb -0.15 -3.24 0.64 0.00 0.52 0.00 0.00 34.95 32.72 1nyk s ARG 71 CO 0.08 0.67 1.65 1.25 0.02 0.00 0.00 175.30 178.97 1nyk h LEU 72 N 5.37 -0.04 -0.29 2.53 5.85 -1.37 -0.72 115.31 126.63 1nyk h LEU 72 Ca -0.52 0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.39 1nyk h LEU 72 Cb 1.21 0.27 0.00 0.00 0.37 0.00 0.00 40.66 42.51 1nyk h LEU 72 CO 0.62 -0.14 0.00 -1.84 -0.34 0.00 0.00 178.44 176.74 1nyk n GLU 73 N -5.23 0.08 0.14 1.25 0.28 -1.26 -1.80 120.64 114.09 1nyk n GLU 73 Ca 0.19 0.33 0.12 0.00 -0.16 0.00 0.00 57.16 57.65 1nyk n GLU 73 Cb 0.62 -1.65 0.22 0.00 1.43 0.00 0.00 31.44 32.06 1nyk n GLU 73 CO 0.00 0.00 0.00 0.93 -0.16 0.00 0.00 177.13 177.90 1nyk h GLU 74 N 0.00 0.00 -4.99 3.44 5.08 -1.51 -3.44 114.58 113.17 1nyk h GLU 74 Ca 0.00 0.00 -0.65 0.00 -1.00 0.00 0.00 59.36 57.71 1nyk h GLU 74 Cb 0.28 0.00 -0.16 0.00 0.50 0.00 0.00 28.75 29.37 1nyk h GLU 74 CO 0.00 0.00 -0.33 -0.51 -1.00 0.00 0.00 179.01 177.17 1nyk s LEU 75 N -5.25 4.25 -0.06 1.33 1.43 -0.75 -5.05 118.68 114.58 1nyk s LEU 75 Ca 0.07 -0.05 -0.26 0.00 -1.03 0.00 0.00 54.13 52.86 1nyk s LEU 75 Cb 0.09 -2.31 -0.03 0.00 0.03 0.00 0.00 46.19 43.97 1nyk s LEU 75 CO 0.67 -0.24 0.81 -0.75 0.23 0.00 0.00 176.35 177.08 1nyk s LYS 76 N 1.97 4.45 0.21 1.70 2.20 -1.26 -4.94 119.74 124.07 1nyk s LYS 76 Ca 0.11 1.07 -0.32 0.00 -0.36 0.00 0.00 55.97 56.47 1nyk s LYS 76 Cb -0.16 -3.47 -0.13 0.00 -1.51 0.00 0.00 37.83 32.55 1nyk s LYS 76 CO 0.11 -0.04 1.59 -2.30 -0.36 0.00 0.00 175.35 174.35 1nyk n PRO 77 N 4.07 2.38 0.00 4.03 -0.02 -1.26 -1.48 135.00 142.72 1nyk n PRO 77 Ca 0.02 0.85 0.00 0.00 -2.02 0.00 0.00 63.50 62.35 1nyk n PRO 77 Cb 0.51 -2.63 0.00 0.00 -0.02 0.00 0.00 33.50 31.36 1nyk n PRO 77 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1nyk n GLY 78 N 3.15 1.44 3.80 -1.23 0.00 0.07 -4.92 105.19 107.49 1nyk n GLY 78 Ca 0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.85 1nyk n GLY 78 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1nyk s ASP 79 N -2.03 5.13 0.67 1.61 1.11 -0.55 -4.99 116.67 117.61 1nyk s ASP 79 Ca 0.00 1.70 -0.17 0.00 0.18 0.00 0.00 52.55 54.25 1nyk s ASP 79 Cb 0.00 -2.51 -0.00 0.00 1.07 0.00 0.00 42.92 41.48 1nyk s ASP 79 CO 0.00 -1.61 1.23 -2.65 1.18 0.00 0.00 175.17 173.31 1nyk n PRO 80 N -3.19 0.93 -1.03 8.23 -0.02 -1.26 -4.62 135.00 134.03 1nyk n PRO 80 Ca 0.08 0.37 -0.30 0.00 -2.02 0.00 0.00 63.50 61.64 1nyk n PRO 80 Cb 0.53 -2.46 0.16 0.00 -0.02 0.00 0.00 33.50 31.71 1nyk n PRO 80 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 1nyk s PHE 81 N -1.52 2.07 0.12 6.00 -0.12 -1.26 -4.93 117.98 118.33 1nyk s PHE 81 Ca 0.80 1.31 0.08 0.00 -0.05 0.00 0.00 56.93 59.08 1nyk s PHE 81 Cb -0.37 -3.18 -0.04 0.00 -0.63 0.00 0.00 43.02 38.81 1nyk s PHE 81 CO 0.43 -2.69 -0.15 0.14 -0.05 0.00 0.00 175.22 172.90 1nyk s VAL 82 N -2.82 3.06 0.09 -2.49 -7.23 -0.19 -4.93 120.40 105.89 1nyk s VAL 82 Ca 0.65 -1.42 -0.26 0.00 -1.81 0.00 0.00 61.98 59.14 1nyk s VAL 82 Cb -0.20 -2.42 -0.06 0.00 0.56 0.00 0.00 36.38 34.26 1nyk s VAL 82 CO 0.58 0.09 0.79 -0.76 -0.31 0.00 0.00 175.10 175.50 1nyk s LEU 83 N -2.20 4.49 0.09 1.32 1.43 -1.26 -1.10 118.68 121.45 1nyk s LEU 83 Ca 0.20 1.54 -0.03 0.00 -1.03 0.00 0.00 54.13 54.81 1nyk s LEU 83 Cb -0.11 -3.29 -0.03 0.00 0.03 0.00 0.00 46.19 42.79 1nyk s LEU 83 CO 0.12 0.06 0.05 0.00 0.23 0.00 0.00 176.35 176.81 1nyk s ALA 84 N -0.34 0.45 0.16 4.21 0.00 -0.18 -1.30 121.76 124.76 1nyk s ALA 84 Ca 0.39 -1.16 0.05 0.00 0.00 0.00 0.00 51.96 51.23 1nyk s ALA 84 Cb -0.22 0.51 -0.05 0.00 0.00 0.00 0.00 23.12 23.37 1nyk s ALA 84 CO 0.25 -0.44 -0.09 0.71 0.00 0.00 0.00 175.76 176.18 1nyk s TYR 85 N -3.95 1.32 0.21 0.00 2.02 -0.46 -0.77 117.35 115.72 1nyk s TYR 85 Ca 0.12 -0.77 -0.22 0.00 -0.37 0.00 0.00 57.07 55.84 1nyk s TYR 85 Cb 0.07 -0.68 -0.08 0.00 -0.40 0.00 0.00 41.96 40.87 1nyk s TYR 85 CO -0.06 0.09 0.75 -1.25 -1.57 0.00 0.00 175.55 173.50 1nyk s PRO 86 N -3.75 4.37 -0.09 -1.71 0.04 -1.26 -0.77 135.00 131.82 1nyk s PRO 86 Ca 0.18 0.98 0.04 0.00 0.04 0.00 0.00 61.00 62.24 1nyk s PRO 86 Cb 0.03 -3.00 0.00 0.00 0.04 0.00 0.00 34.50 31.57 1nyk s PRO 86 CO 0.02 0.45 -0.22 1.41 0.04 0.00 0.00 177.00 178.69 1nyk s MET 87 N -1.70 2.76 0.07 4.56 1.75 0.70 -0.79 119.30 126.66 1nyk s MET 87 Ca 0.41 -0.81 -0.31 0.00 -1.25 0.00 0.00 55.69 53.73 1nyk s MET 87 Cb -0.19 -2.14 -0.08 0.00 2.84 0.00 0.00 34.83 35.26 1nyk s MET 87 CO 0.23 0.19 1.63 0.34 -0.65 0.00 0.00 175.02 176.76 1nyk s ASP 88 N 0.30 6.62 0.44 1.11 -1.08 -0.30 -0.99 116.67 122.77 1nyk s ASP 88 Ca -0.16 2.46 0.17 0.00 -0.52 0.00 0.00 52.55 54.50 1nyk s ASP 88 Cb -0.17 -2.56 1.00 0.00 -1.46 0.00 0.00 42.92 39.72 1nyk s ASP 88 CO 0.07 -0.87 1.94 1.55 0.52 0.00 0.00 175.17 178.38 1nyk h PRO 89 N 8.24 0.00 0.01 4.34 0.13 -1.90 0.16 132.00 142.98 1nyk h PRO 89 Ca -0.42 0.00 -0.37 0.00 -0.87 0.00 0.00 66.00 64.34 1nyk h PRO 89 Cb 1.20 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.26 1nyk h PRO 89 CO 0.93 0.24 -2.34 1.63 -0.23 0.00 0.00 178.00 178.23 1nyk n LYS 90 N -4.04 0.68 0.12 0.86 5.02 -1.26 -4.38 118.16 115.15 1nyk n LYS 90 Ca -0.02 0.08 0.12 0.00 -2.02 0.00 0.00 58.31 56.47 1nyk n LYS 90 Cb 0.31 -1.55 0.12 0.00 -0.02 0.00 0.00 35.03 33.88 1nyk n LYS 90 CO 0.00 0.00 0.00 1.79 -0.52 0.00 0.00 177.40 178.67 1nyk h THR 91 N 0.00 0.00 -0.41 -0.18 1.35 -1.96 -3.47 112.91 108.24 1nyk h THR 91 Ca -0.53 -0.82 -0.17 0.00 -0.55 0.00 0.00 66.41 64.34 1nyk h THR 91 Cb 2.11 1.49 -0.07 0.00 -1.73 0.00 0.00 68.15 69.95 1nyk h THR 91 CO 0.00 0.00 -0.16 0.29 -0.25 0.00 0.00 175.52 175.40 1nyk n LYS 92 N -2.58 -1.38 -2.29 4.72 4.76 0.57 -4.96 118.16 117.00 1nyk n LYS 92 Ca 0.02 0.75 -0.43 0.00 -2.87 0.00 0.00 58.31 55.79 1nyk n LYS 92 Cb 0.51 -4.95 -0.02 0.00 -1.84 0.00 0.00 35.03 28.72 1nyk n LYS 92 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1nyk s VAL 93 N -1.93 4.00 -0.08 -0.18 1.01 -1.25 -4.80 120.40 117.18 1nyk s VAL 93 Ca 0.00 1.17 -0.27 0.00 0.00 0.00 0.00 61.98 62.89 1nyk s VAL 93 Cb 0.00 -3.89 -0.03 0.00 0.00 0.00 0.00 36.38 32.46 1nyk s VAL 93 CO 0.00 -0.25 0.86 -0.69 0.00 0.00 0.00 175.10 175.02 1nyk s VAL 94 N 4.22 4.91 -0.34 2.92 1.01 -1.26 -1.15 120.40 130.72 1nyk s VAL 94 Ca 0.62 1.77 -0.03 0.00 0.00 0.00 0.00 61.98 64.33 1nyk s VAL 94 Cb -0.23 -4.19 0.04 0.00 0.00 0.00 0.00 36.38 32.00 1nyk s VAL 94 CO 0.22 0.13 2.73 0.29 0.00 0.00 0.00 175.10 178.48 1nyk n LYS 95 N 4.34 2.16 0.00 2.72 5.02 0.03 -4.49 118.16 127.94 1nyk n LYS 95 Ca 0.04 -1.89 0.14 0.00 -2.02 0.00 0.00 58.31 54.58 1nyk n LYS 95 Cb 0.50 -1.97 0.60 0.00 -0.02 0.00 0.00 35.03 34.14 1nyk n LYS 95 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1nyk n SER 96 N 1.05 0.49 0.13 4.39 3.41 -1.18 -3.61 113.62 118.29 1nyk n SER 96 Ca 0.42 -0.56 0.13 0.00 -0.26 0.00 0.00 58.87 58.60 1nyk n SER 96 Cb 0.62 -0.07 0.43 0.00 -0.26 0.00 0.00 64.21 64.93 1nyk n SER 96 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1nyk h GLY 97 N 4.96 0.00 -7.57 5.00 0.00 -1.01 -3.41 103.07 101.04 1nyk h GLY 97 Ca 0.00 0.00 -0.69 0.00 0.00 0.00 0.00 47.33 46.64 1nyk h GLY 97 CO 0.00 0.00 -0.53 1.85 0.00 0.00 0.00 176.54 177.86 1nyk s GLU 98 N -3.21 3.20 0.51 4.80 2.56 -1.21 -4.78 118.70 120.58 1nyk s GLU 98 Ca 0.08 -0.83 0.18 0.00 0.00 0.00 0.00 54.97 54.40 1nyk s GLU 98 Cb 0.11 -3.66 1.28 0.00 2.00 0.00 0.00 34.13 33.85 1nyk s GLU 98 CO 0.53 -0.51 2.10 0.00 -0.56 0.00 0.00 175.26 176.81 1nyk h ALA 99 N 8.41 2.13 0.00 6.30 0.00 -1.89 -1.80 119.26 132.40 1nyk h ALA 99 Ca -0.30 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1nyk h ALA 99 Cb 1.13 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1nyk h ALA 99 CO 0.64 -0.18 0.00 1.63 0.00 0.00 0.00 179.25 181.34 1nyk n LYS 100 N -4.49 0.70 0.00 0.00 5.02 -1.26 -1.22 118.16 116.91 1nyk n LYS 100 Ca 0.01 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.43 1nyk n LYS 100 Cb 0.24 -1.49 0.38 0.00 -0.02 0.00 0.00 35.03 34.14 1nyk n LYS 100 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1nyk n ASN 101 N -0.99 1.53 -4.72 4.39 3.02 -0.68 -4.95 115.26 112.86 1nyk n ASN 101 Ca 0.16 -1.32 -0.42 0.00 -0.03 0.00 0.00 54.58 52.97 1nyk n ASN 101 Cb 0.08 0.09 -0.03 0.00 -0.61 0.00 0.00 39.78 39.31 1nyk n ASN 101 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1nyk s THR 102 N -2.23 3.25 0.19 3.41 2.01 -0.36 -4.32 115.64 117.59 1nyk s THR 102 Ca 0.30 0.93 0.11 0.00 0.31 0.00 0.00 61.69 63.34 1nyk s THR 102 Cb 0.20 -3.60 -0.04 0.00 0.01 0.00 0.00 72.50 69.07 1nyk s THR 102 CO 0.42 0.09 -0.23 -0.76 -0.69 0.00 0.00 174.62 173.45 1nyk s LEU 103 N 0.77 2.43 -0.00 4.42 1.43 0.05 -0.95 118.68 126.84 1nyk s LEU 103 Ca 0.63 -0.86 0.05 0.00 -1.03 0.00 0.00 54.13 52.92 1nyk s LEU 103 Cb -0.37 -1.10 -0.03 0.00 0.03 0.00 0.00 46.19 44.72 1nyk s LEU 103 CO 0.32 0.09 -0.16 -1.48 0.23 0.00 0.00 176.35 175.36 1nyk s LEU 104 N -2.65 2.67 -0.06 1.79 0.05 0.34 -1.01 118.68 119.82 1nyk s LEU 104 Ca 0.19 -0.31 0.02 0.00 0.05 0.00 0.00 54.13 54.08 1nyk s LEU 104 Cb -0.08 -1.55 0.02 0.00 -2.05 0.00 0.00 46.19 42.53 1nyk s LEU 104 CO 0.09 0.30 -0.09 -0.69 -0.55 0.00 0.00 176.35 175.40 1nyk s VAL 105 N -0.84 0.91 0.07 1.48 1.01 -0.26 -1.21 120.40 121.57 1nyk s VAL 105 Ca 0.13 -0.35 -0.06 0.00 0.00 0.00 0.00 61.98 61.70 1nyk s VAL 105 Cb -0.11 -0.86 -0.01 0.00 0.00 0.00 0.00 36.38 35.40 1nyk s VAL 105 CO 0.03 0.30 0.13 0.00 0.00 0.00 0.00 175.10 175.56 1nyk s ALA 106 N 0.71 -0.02 -0.02 5.51 0.00 -0.20 -1.03 121.76 126.71 1nyk s ALA 106 Ca -0.13 -0.77 0.06 0.00 0.00 0.00 0.00 51.96 51.12 1nyk s ALA 106 Cb -0.15 0.41 -0.01 0.00 0.00 0.00 0.00 23.12 23.37 1nyk s ALA 106 CO 0.02 -0.46 -0.19 0.50 0.00 0.00 0.00 175.76 175.63 1nyk s ARG 107 N -3.80 1.59 0.20 0.00 3.52 -1.26 -0.60 118.95 118.59 1nyk s ARG 107 Ca 0.05 -0.69 0.03 0.00 -0.13 0.00 0.00 55.73 54.99 1nyk s ARG 107 Cb 0.05 -1.52 -0.05 0.00 -1.56 0.00 0.00 34.95 31.87 1nyk s ARG 107 CO -0.10 0.41 -0.03 -0.06 -0.81 0.00 0.00 175.30 174.71 1nyk s PHE 108 N -0.42 1.40 0.23 5.12 0.08 -0.38 -0.75 117.98 123.26 1nyk s PHE 108 Ca 0.07 -0.90 -0.32 0.00 0.12 0.00 0.00 56.93 55.90 1nyk s PHE 108 Cb -0.08 -0.79 -0.12 0.00 -0.57 0.00 0.00 43.02 41.47 1nyk s PHE 108 CO -0.01 -0.05 1.63 -0.25 -0.10 0.00 0.00 175.22 176.45 1nyk n ASP 109 N -0.32 3.71 0.17 1.36 8.00 -1.26 -4.39 116.55 123.82 1nyk n ASP 109 Ca -0.07 1.10 0.14 0.00 0.71 0.00 0.00 54.79 56.67 1nyk n ASP 109 Cb 0.63 -1.55 0.70 0.00 -0.02 0.00 0.00 41.12 40.88 1nyk n ASP 109 CO 0.00 0.00 0.00 -0.65 -0.39 0.00 0.00 177.20 176.16 1nyk h PRO 110 N 5.72 0.00 0.00 -0.24 0.11 -1.89 -0.54 132.00 135.17 1nyk h PRO 110 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1nyk h PRO 110 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1nyk h PRO 110 CO 0.87 0.00 0.00 1.05 -0.21 0.00 0.00 178.00 179.71 1nyk h GLU 111 N 0.00 0.00 -0.00 1.05 9.09 -2.00 -2.62 114.58 120.09 1nyk h GLU 111 Ca 0.09 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.50 1nyk h GLU 111 Cb 0.39 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.49 1nyk h GLU 111 CO -0.00 0.00 -0.28 0.39 0.05 0.00 0.00 179.01 179.17 1nyk n GLU 112 N -2.95 0.08 -2.94 1.06 -0.58 -0.21 -4.88 120.64 110.23 1nyk n GLU 112 Ca 0.01 -0.03 -0.37 0.00 -0.42 0.00 0.00 57.16 56.34 1nyk n GLU 112 Cb 0.29 -1.50 -0.06 0.00 -0.57 0.00 0.00 31.44 29.60 1nyk n GLU 112 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1nyk s LEU 113 N -2.94 4.40 0.36 -4.62 1.43 -0.99 -4.82 118.68 111.48 1nyk s LEU 113 Ca 0.14 1.64 -0.28 0.00 -1.03 0.00 0.00 54.13 54.60 1nyk s LEU 113 Cb 0.18 -3.71 -0.11 0.00 0.03 0.00 0.00 46.19 42.58 1nyk s LEU 113 CO 0.62 0.03 1.51 0.00 0.23 0.00 0.00 176.35 178.73 1nyk s ALA 114 N -1.49 3.61 0.29 4.21 0.00 -0.22 -4.75 121.76 123.42 1nyk s ALA 114 Ca 0.45 1.58 0.04 0.00 0.00 0.00 0.00 51.96 54.02 1nyk s ALA 114 Cb -0.19 -3.62 0.72 0.00 0.00 0.00 0.00 23.12 20.03 1nyk s ALA 114 CO 0.23 -1.04 1.73 -1.35 0.00 0.00 0.00 175.76 175.33 1nyk h PRO 115 N 3.42 0.52 -0.95 0.00 0.11 -1.95 0.19 132.00 133.35 1nyk h PRO 115 Ca -0.50 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 65.59 1nyk h PRO 115 Cb 1.23 -0.12 -0.05 0.00 0.11 0.00 0.00 31.00 32.18 1nyk h PRO 115 CO 0.68 0.35 0.63 1.49 -0.21 0.00 0.00 178.00 180.93 1nyk h GLU 116 N 0.54 1.25 -0.35 1.05 4.57 -1.98 -2.07 114.58 117.59 1nyk h GLU 116 Ca 0.56 -0.08 -0.13 0.00 -1.18 0.00 0.00 59.36 58.54 1nyk h GLU 116 Cb 0.98 -0.28 -0.01 0.00 -0.16 0.00 0.00 28.75 29.28 1nyk h GLU 116 CO -0.46 0.83 -0.28 0.28 -1.18 0.00 0.00 179.01 178.20 1nyk h VAL 117 N 1.29 1.29 -0.02 0.32 2.07 -1.09 -3.04 116.25 117.06 1nyk h VAL 117 Ca 0.35 -1.44 0.01 0.00 0.82 0.00 0.00 66.70 66.44 1nyk h VAL 117 Cb -0.14 1.42 -0.00 0.00 -1.52 0.00 0.00 31.29 31.05 1nyk h VAL 117 CO -0.08 0.47 0.02 0.00 0.02 0.00 0.00 177.57 178.00 1nyk h ALA 118 N 0.76 1.84 -0.40 1.67 0.00 -0.33 -1.64 119.26 121.16 1nyk h ALA 118 Ca 0.07 -0.00 0.12 0.00 0.00 0.00 0.00 54.91 55.09 1nyk h ALA 118 Cb 0.85 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 1nyk h ALA 118 CO 0.07 -0.03 0.32 1.96 0.00 0.00 0.00 179.25 181.58 1nyk h GLN 119 N 0.00 0.00 -0.12 0.00 1.08 -1.26 -2.31 115.11 112.49 1nyk h GLN 119 Ca 0.01 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.21 1nyk h GLN 119 Cb 0.04 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.47 1nyk h GLN 119 CO -0.00 0.00 0.00 0.72 -0.95 0.00 0.00 178.83 178.60 1nyk n HIS 120 N -4.20 0.20 -3.02 2.96 8.25 -0.63 -5.02 115.22 113.76 1nyk n HIS 120 Ca 0.07 -0.58 -0.18 0.00 -0.26 0.00 0.00 57.72 56.77 1nyk n HIS 120 Cb 0.51 -0.07 0.01 0.00 1.12 0.00 0.00 29.99 31.56 1nyk n HIS 120 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1nyk s ALA 121 N -1.32 4.34 -0.16 -1.41 0.00 -0.87 -1.97 121.76 120.37 1nyk s ALA 121 Ca 0.13 -1.55 -0.03 0.00 0.00 0.00 0.00 51.96 50.51 1nyk s ALA 121 Cb 0.09 -1.74 0.05 0.00 0.00 0.00 0.00 23.12 21.52 1nyk s ALA 121 CO 0.06 -0.33 0.04 0.00 0.00 0.00 0.00 175.76 175.53 1nyk s ALA 122 N -2.40 0.78 -1.60 0.00 0.00 -0.52 -4.80 121.76 113.22 1nyk s ALA 122 Ca 0.54 -0.47 -0.15 0.00 0.00 0.00 0.00 51.96 51.87 1nyk s ALA 122 Cb -0.10 -1.05 0.11 0.00 0.00 0.00 0.00 23.12 22.08 1nyk s ALA 122 CO 0.34 -1.03 0.86 0.39 0.00 0.00 0.00 175.76 176.32 1nyk n GLU 123 N 5.13 -4.35 -0.49 0.00 1.02 -1.26 -0.69 120.64 120.00 1nyk n GLU 123 Ca -0.08 0.49 0.00 0.00 -0.02 0.00 0.00 57.16 57.55 1nyk n GLU 123 Cb 0.48 -5.26 0.00 0.00 -0.02 0.00 0.00 31.44 26.65 1nyk n GLU 123 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1nyk n GLY 124 N -1.58 1.37 3.73 0.62 0.00 -1.26 -4.85 105.19 103.21 1nyk n GLY 124 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 1nyk n GLY 124 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nyk s VAL 125 N -3.25 4.80 0.10 1.61 1.01 0.13 -1.25 120.40 123.56 1nyk s VAL 125 Ca 0.00 1.76 0.09 0.00 0.00 0.00 0.00 61.98 63.83 1nyk s VAL 125 Cb 0.00 -4.18 -0.04 0.00 0.00 0.00 0.00 36.38 32.16 1nyk s VAL 125 CO 0.00 0.28 -0.24 0.68 0.00 0.00 0.00 175.10 175.82 1nyk s VAL 126 N 0.42 1.97 0.03 2.92 -7.23 0.23 -1.44 120.40 117.29 1nyk s VAL 126 Ca 0.43 -1.59 0.03 0.00 -1.81 0.00 0.00 61.98 59.05 1nyk s VAL 126 Cb -0.20 -1.75 -0.02 0.00 0.56 0.00 0.00 36.38 34.97 1nyk s VAL 126 CO 0.24 0.06 -0.11 0.00 -0.31 0.00 0.00 175.10 174.99 1nyk s ALA 127 N -1.06 0.85 0.06 1.32 0.00 -1.26 -1.04 121.76 120.64 1nyk s ALA 127 Ca 0.10 -0.69 0.00 0.00 0.00 0.00 0.00 51.96 51.38 1nyk s ALA 127 Cb -0.10 -0.10 -0.04 0.00 0.00 0.00 0.00 23.12 22.88 1nyk s ALA 127 CO 0.05 0.13 -0.05 0.71 0.00 0.00 0.00 175.76 176.60 1nyk s TYR 128 N -0.85 0.60 0.35 0.00 2.02 -0.35 -0.50 117.35 118.62 1nyk s TYR 128 Ca -0.02 -0.87 -0.28 0.00 -0.37 0.00 0.00 57.07 55.53 1nyk s TYR 128 Cb -0.07 -0.39 -0.12 0.00 -0.40 0.00 0.00 41.96 40.98 1nyk s TYR 128 CO 0.01 -0.25 1.39 0.45 -1.57 0.00 0.00 175.55 175.58 1nyk n SER 129 N 0.48 3.25 -1.35 2.29 2.88 -0.23 -0.51 113.62 120.43 1nyk n SER 129 Ca -0.16 1.21 0.11 0.00 -1.33 0.00 0.00 58.87 58.70 1nyk n SER 129 Cb 0.59 -1.55 0.32 0.00 -0.75 0.00 0.00 64.21 62.83 1nyk n SER 129 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1nyk n ALA 130 N 0.49 2.45 -2.54 -1.46 0.00 -0.12 -4.61 120.51 114.72 1nyk n ALA 130 Ca 0.04 -1.28 -0.42 0.00 0.00 0.00 0.00 53.44 51.78 1nyk n ALA 130 Cb 0.37 -0.95 -0.08 0.00 0.00 0.00 0.00 19.45 18.79 1nyk n ALA 130 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1nyk s VAL 131 N -1.11 5.00 0.29 0.00 1.01 -1.26 -0.50 120.40 123.83 1nyk s VAL 131 Ca 0.48 0.19 -0.30 0.00 0.00 0.00 0.00 61.98 62.35 1nyk s VAL 131 Cb 0.26 -4.01 -0.12 0.00 0.00 0.00 0.00 36.38 32.51 1nyk s VAL 131 CO 0.32 -0.30 1.51 0.00 0.00 0.00 0.00 175.10 176.63 1nyk n THR 133 N 1.82 0.03 0.00 0.00 -2.24 -1.26 -1.73 114.28 110.90 1nyk n THR 133 Ca 0.09 0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 1nyk n THR 133 Cb 0.35 -0.52 0.00 0.00 -2.10 0.00 0.00 70.33 68.06 1nyk n THR 133 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 1nyk n HIS 134 N -1.25 0.00 -1.82 4.78 -0.00 -1.26 -4.42 115.22 111.25 1nyk n HIS 134 Ca 0.15 0.00 0.04 0.00 -0.00 0.00 0.00 57.72 57.91 1nyk n HIS 134 Cb 0.22 -0.24 0.06 0.00 -0.00 0.00 0.00 29.99 30.03 1nyk n HIS 134 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 1nyk n LEU 135 N -1.22 1.07 0.00 0.27 4.77 -1.26 -4.81 117.00 115.82 1nyk n LEU 135 Ca 0.00 -2.02 0.00 0.00 -0.03 0.00 0.00 56.01 53.96 1nyk n LEU 135 Cb 0.00 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 40.93 1nyk n LEU 135 CO 0.00 0.54 0.00 0.61 -1.33 0.00 0.00 177.39 177.21 1nyk n GLY 136 N -0.38 0.77 3.72 -0.72 0.00 -0.70 -4.99 105.19 102.89 1nyk n GLY 136 Ca 0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.75 1nyk n GLY 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nyk s ILE 138 N -2.11 4.23 -1.09 0.00 -1.09 -1.26 -0.69 121.20 119.19 1nyk s ILE 138 Ca 0.72 1.60 -0.20 0.00 -2.23 0.00 0.00 60.65 60.54 1nyk s ILE 138 Cb -0.27 -4.02 0.08 0.00 -1.58 0.00 0.00 42.46 36.66 1nyk s ILE 138 CO 0.46 0.11 1.47 -0.69 -1.23 0.00 0.00 174.94 175.07 1nyk s VAL 139 N 1.14 4.17 -1.25 2.92 1.01 0.34 -4.58 120.40 124.16 1nyk s VAL 139 Ca 0.57 -1.31 0.17 0.00 0.00 0.00 0.00 61.98 61.41 1nyk s VAL 139 Cb -0.27 -5.04 -0.08 0.00 0.00 0.00 0.00 36.38 30.99 1nyk s VAL 139 CO 0.28 -1.87 0.82 -1.54 0.00 0.00 0.00 175.10 172.79 1nyk n SER 140 N 8.18 1.32 -4.76 3.32 3.41 -1.18 -4.75 113.62 119.15 1nyk n SER 140 Ca 0.36 -1.16 -0.28 0.00 -0.26 0.00 0.00 58.87 57.54 1nyk n SER 140 Cb 0.49 0.70 -0.06 0.00 -0.26 0.00 0.00 64.21 65.07 1nyk n SER 140 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1nyk s GLN 141 N -2.26 2.77 -0.09 4.33 -0.21 -0.63 -4.96 119.66 118.61 1nyk s GLN 141 Ca 0.11 -0.87 -0.04 0.00 0.02 0.00 0.00 55.36 54.57 1nyk s GLN 141 Cb 0.13 -2.60 -0.04 0.00 1.00 0.00 0.00 33.01 31.51 1nyk s GLN 141 CO 0.54 0.50 0.09 -0.46 -2.12 0.00 0.00 175.29 173.84 1nyk s TRP 142 N -1.63 3.42 -0.38 0.91 -0.11 -1.26 0.37 118.94 120.25 1nyk s TRP 142 Ca 0.29 0.38 -0.04 0.00 1.22 0.00 0.00 56.10 57.95 1nyk s TRP 142 Cb -0.10 -1.87 0.09 0.00 -1.50 0.00 0.00 33.47 30.09 1nyk s TRP 142 CO 0.22 0.63 0.16 0.08 -4.62 0.00 0.00 176.95 173.42 1nyk s VAL 143 N -1.01 3.44 0.15 5.86 1.01 0.81 -4.85 120.40 125.81 1nyk s VAL 143 Ca 0.16 -1.71 -0.16 0.00 0.00 0.00 0.00 61.98 60.26 1nyk s VAL 143 Cb -0.12 -3.19 0.01 0.00 0.00 0.00 0.00 36.38 33.08 1nyk s VAL 143 CO 0.05 -0.49 1.80 0.00 0.00 0.00 0.00 175.10 176.46 1nyk h ALA 144 N 8.12 0.52 -0.01 5.51 0.00 -1.97 0.13 119.26 131.56 1nyk h ALA 144 Ca -0.17 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1nyk h ALA 144 Cb 1.06 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1nyk h ALA 144 CO 0.67 -0.01 -0.04 -0.40 0.00 0.00 0.00 179.25 179.47 1nyk n ASP 145 N -4.78 1.16 -0.16 0.00 5.68 -1.26 -2.51 116.55 114.68 1nyk n ASP 145 Ca 0.01 -1.29 0.03 0.00 -0.50 0.00 0.00 54.79 53.04 1nyk n ASP 145 Cb 0.04 0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.03 1nyk n ASP 145 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1nyk n GLU 146 N -0.17 2.14 -3.95 0.11 -0.58 -1.06 -5.00 120.64 112.13 1nyk n GLU 146 Ca 0.19 -0.53 -0.25 0.00 -0.42 0.00 0.00 57.16 56.15 1nyk n GLU 146 Cb 0.31 -0.99 -0.02 0.00 -0.57 0.00 0.00 31.44 30.17 1nyk n GLU 146 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1nyk n GLU 147 N -0.27 -3.36 -4.33 3.49 1.02 0.42 -4.79 120.64 112.81 1nyk n GLU 147 Ca 0.03 0.41 -0.18 0.00 -0.02 0.00 0.00 57.16 57.40 1nyk n GLU 147 Cb 0.15 -4.57 -0.10 0.00 -0.02 0.00 0.00 31.44 26.89 1nyk n GLU 147 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1nyk s ALA 148 N -3.93 1.95 -0.19 0.62 0.00 -0.90 -3.31 121.76 116.00 1nyk s ALA 148 Ca 0.03 -1.61 -0.09 0.00 0.00 0.00 0.00 51.96 50.29 1nyk s ALA 148 Cb -0.02 -0.09 -0.05 0.00 0.00 0.00 0.00 23.12 22.97 1nyk s ALA 148 CO 0.89 0.07 0.11 0.00 0.00 0.00 0.00 175.76 176.83 1nyk s ALA 149 N -2.86 3.63 -0.09 0.00 0.00 -0.41 -0.13 121.76 121.88 1nyk s ALA 149 Ca 0.21 -0.70 0.02 0.00 0.00 0.00 0.00 51.96 51.49 1nyk s ALA 149 Cb -0.01 -2.08 -0.02 0.00 0.00 0.00 0.00 23.12 21.01 1nyk s ALA 149 CO 0.06 0.21 -0.16 -1.17 0.00 0.00 0.00 175.76 174.70 1nyk s LEU 150 N 0.22 2.57 -0.28 0.00 2.96 0.16 -0.80 118.68 123.51 1nyk s LEU 150 Ca 0.07 -0.34 -0.18 0.00 -0.22 0.00 0.00 54.13 53.46 1nyk s LEU 150 Cb -0.11 -1.54 -0.02 0.00 0.50 0.00 0.00 46.19 45.01 1nyk s LEU 150 CO -0.01 0.23 0.52 0.00 -1.32 0.00 0.00 176.35 175.77 1nyk n PRO 152 N 5.61 0.07 0.10 0.00 -0.04 -1.26 -1.61 135.00 137.86 1nyk n PRO 152 Ca -0.04 0.11 -0.10 0.00 -0.04 0.00 0.00 63.50 63.43 1nyk n PRO 152 Cb 0.50 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.39 1nyk n PRO 152 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1nyk n HIS 154 N -5.00 0.00 -0.94 0.00 8.25 -1.25 -5.03 115.22 111.25 1nyk n HIS 154 Ca -0.08 -0.32 0.00 0.00 -0.26 0.00 0.00 57.72 57.06 1nyk n HIS 154 Cb 0.25 -0.08 0.00 0.00 1.12 0.00 0.00 29.99 31.28 1nyk n HIS 154 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1nyk n GLY 155 N -0.46 0.42 3.73 -1.41 0.00 -0.64 -4.44 105.19 102.39 1nyk n GLY 155 Ca 0.05 -1.00 -0.42 0.00 0.00 0.00 0.00 46.02 44.65 1nyk n GLY 155 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nyk n GLY 156 N -2.94 1.10 2.93 -0.02 0.00 -1.24 -3.78 105.19 101.24 1nyk n GLY 156 Ca 0.00 0.44 -0.20 0.00 0.00 0.00 0.00 46.02 46.25 1nyk n GLY 156 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nyk s VAL 157 N -0.28 0.64 -0.11 1.61 1.01 -0.35 -0.35 120.40 122.57 1nyk s VAL 157 Ca 0.63 -0.21 0.03 0.00 0.00 0.00 0.00 61.98 62.43 1nyk s VAL 157 Cb -0.54 -0.63 0.00 0.00 0.00 0.00 0.00 36.38 35.22 1nyk s VAL 157 CO 0.52 0.24 -0.22 -0.31 0.00 0.00 0.00 175.10 175.33 1nyk s TYR 158 N 0.70 2.46 -0.79 5.22 2.02 0.02 -0.53 117.35 126.44 1nyk s TYR 158 Ca -0.10 -1.08 -0.22 0.00 -0.37 0.00 0.00 57.07 55.30 1nyk s TYR 158 Cb -0.13 -1.67 0.08 0.00 -0.40 0.00 0.00 41.96 39.85 1nyk s TYR 158 CO 0.01 -0.46 1.10 0.34 -1.57 0.00 0.00 175.55 174.96 1nyk s ASP 159 N 0.54 6.36 0.30 2.29 -1.08 0.24 -1.29 116.67 124.02 1nyk s ASP 159 Ca -0.15 -1.35 0.00 0.00 -0.52 0.00 0.00 52.55 50.54 1nyk s ASP 159 Cb -0.17 -2.44 0.45 0.00 -1.46 0.00 0.00 42.92 39.30 1nyk s ASP 159 CO 0.05 -1.36 1.84 -0.07 0.52 0.00 0.00 175.17 176.16 1nyk h LEU 160 N 11.34 0.71 -1.11 -1.34 3.38 -1.86 0.10 115.31 126.53 1nyk h LEU 160 Ca -0.09 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 57.72 1nyk h LEU 160 Cb 1.05 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.61 1nyk h LEU 160 CO 1.19 0.71 -0.17 0.03 0.09 0.00 0.00 178.44 180.29 1nyk h ARG 161 N 0.74 0.00 -1.61 1.13 3.08 -1.91 -3.27 114.38 112.54 1nyk h ARG 161 Ca 0.16 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.61 1nyk h ARG 161 Cb 0.29 0.00 -0.41 0.00 0.08 0.00 0.00 29.97 29.93 1nyk h ARG 161 CO -0.00 0.17 -0.55 0.72 -1.07 0.00 0.00 179.97 179.24 1nyk n HIS 162 N -3.31 3.41 -1.84 3.04 8.25 -0.81 -1.06 115.22 122.90 1nyk n HIS 162 Ca 0.00 -3.09 -0.10 0.00 -0.26 0.00 0.00 57.72 54.28 1nyk n HIS 162 Cb 0.41 -0.21 -0.02 0.00 1.12 0.00 0.00 29.99 31.29 1nyk n HIS 162 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1nyk n GLY 163 N -0.47 0.42 2.93 -1.41 0.00 -1.14 -2.21 105.19 103.30 1nyk n GLY 163 Ca 0.40 -0.52 -0.21 0.00 0.00 0.00 0.00 46.02 45.70 1nyk n GLY 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nyk n ALA 164 N -0.45 -0.92 -1.60 4.61 0.00 0.29 -4.82 120.51 117.61 1nyk n ALA 164 Ca -0.11 0.19 -0.47 0.00 0.00 0.00 0.00 53.44 53.05 1nyk n ALA 164 Cb 0.49 -2.96 -0.03 0.00 0.00 0.00 0.00 19.45 16.94 1nyk n ALA 164 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1nyk n GLN 165 N -3.61 1.43 -2.39 0.00 6.02 -0.94 -4.10 117.38 113.79 1nyk n GLN 165 Ca -0.11 0.51 -0.43 0.00 -0.01 0.00 0.00 57.00 56.96 1nyk n GLN 165 Cb 0.61 -2.00 -0.02 0.00 1.02 0.00 0.00 30.24 29.84 1nyk n GLN 165 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1nyk s VAL 166 N -0.43 4.10 -0.85 5.09 1.01 -1.26 -0.60 120.40 127.46 1nyk s VAL 166 Ca 0.67 1.24 0.08 0.00 0.00 0.00 0.00 61.98 63.97 1nyk s VAL 166 Cb -0.76 -4.10 0.04 0.00 0.00 0.00 0.00 36.38 31.56 1nyk s VAL 166 CO 0.54 -0.44 0.66 2.30 0.00 0.00 0.00 175.10 178.17 1nyk n ILE 167 N 6.19 0.00 -3.49 2.22 -5.35 0.31 -4.99 119.36 114.25 1nyk n ILE 167 Ca 0.15 -0.47 -0.15 0.00 -0.27 0.00 0.00 62.75 62.01 1nyk n ILE 167 Cb 0.46 1.13 -0.04 0.00 -1.74 0.00 0.00 39.64 39.45 1nyk n ILE 167 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1nyk s ALA 168 N -0.83 -1.72 0.00 -1.28 0.00 -1.22 -4.94 121.76 111.78 1nyk s ALA 168 Ca 0.08 1.03 0.00 0.00 0.00 0.00 0.00 51.96 53.07 1nyk s ALA 168 Cb 0.06 0.29 0.00 0.00 0.00 0.00 0.00 23.12 23.48 1nyk s ALA 168 CO 0.13 -0.51 0.00 0.41 0.00 0.00 0.00 175.76 175.79 1nyk n GLY 169 N 0.43 -2.29 0.15 0.00 0.00 -1.25 -1.21 105.19 101.02 1nyk n GLY 169 Ca -0.18 -1.54 0.15 0.00 0.00 0.00 0.00 46.02 44.46 1nyk n GLY 169 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1nyk n PRO 170 N -0.71 1.13 -1.63 1.61 -0.04 -1.26 -4.86 135.00 129.24 1nyk n PRO 170 Ca 0.00 -0.29 -0.52 0.00 -0.04 0.00 0.00 63.50 62.65 1nyk n PRO 170 Cb 0.00 -1.49 -0.06 0.00 -0.04 0.00 0.00 33.50 31.91 1nyk n PRO 170 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 1nyk n PRO 171 N -0.68 1.35 0.03 0.54 -0.02 -1.26 -4.79 135.00 130.17 1nyk n PRO 171 Ca 0.21 0.49 0.13 0.00 -2.02 0.00 0.00 63.50 62.31 1nyk n PRO 171 Cb 0.20 -2.17 0.54 0.00 -0.02 0.00 0.00 33.50 32.05 1nyk n PRO 171 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1nyk n PRO 172 N 3.51 0.06 -3.46 0.52 -0.04 -1.26 -4.89 135.00 129.44 1nyk n PRO 172 Ca 0.20 0.09 -0.10 0.00 -0.04 0.00 0.00 63.50 63.64 1nyk n PRO 172 Cb 0.20 -1.57 -0.02 0.00 -0.04 0.00 0.00 33.50 32.06 1nyk n PRO 172 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 1nyk s ARG 173 N -3.03 1.10 0.55 0.54 1.70 -1.26 -5.11 118.95 113.44 1nyk s ARG 173 Ca 0.12 -0.41 -0.22 0.00 -0.47 0.00 0.00 55.73 54.75 1nyk s ARG 173 Cb 0.16 0.51 -0.05 0.00 -0.57 0.00 0.00 34.95 35.00 1nyk s ARG 173 CO 0.51 -0.48 1.36 -2.14 -1.08 0.00 0.00 175.30 173.46 1nyk s PRO 174 N -3.50 3.12 0.32 3.89 0.02 -1.26 -4.71 135.00 132.88 1nyk s PRO 174 Ca 0.03 2.23 -0.29 0.00 0.02 0.00 0.00 61.00 62.99 1nyk s PRO 174 Cb -0.01 -2.25 -0.12 0.00 0.02 0.00 0.00 34.50 32.15 1nyk s PRO 174 CO -0.11 -1.20 1.50 1.33 -0.33 0.00 0.00 177.00 178.19 1nyk n VAL 175 N -1.05 1.43 -2.25 3.83 0.24 -1.26 -4.95 118.33 114.32 1nyk n VAL 175 Ca 0.10 -0.36 -0.38 0.00 -2.04 0.00 0.00 64.34 61.67 1nyk n VAL 175 Cb 0.45 -1.86 -0.01 0.00 -1.47 0.00 0.00 33.84 30.94 1nyk n VAL 175 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 1nyk s PRO 176 N -1.14 3.98 0.45 7.34 0.04 -1.26 -4.78 135.00 139.63 1nyk s PRO 176 Ca 0.60 1.88 -0.22 0.00 0.04 0.00 0.00 61.00 63.30 1nyk s PRO 176 Cb -0.52 -2.64 -0.08 0.00 0.04 0.00 0.00 34.50 31.30 1nyk s PRO 176 CO 0.55 -0.39 1.07 -1.14 0.04 0.00 0.00 177.00 177.13 1nyk s GLN 177 N -2.36 3.89 -0.27 4.56 0.74 -1.26 -1.07 119.66 123.89 1nyk s GLN 177 Ca 0.58 1.51 -0.05 0.00 0.05 0.00 0.00 55.36 57.45 1nyk s GLN 177 Cb -0.32 -2.30 0.00 0.00 1.10 0.00 0.00 33.01 31.50 1nyk s GLN 177 CO 0.40 -0.38 0.03 -1.17 -0.55 0.00 0.00 175.29 173.61 1nyk s LEU 178 N -3.12 3.48 0.39 3.68 2.96 0.34 -0.68 118.68 125.73 1nyk s LEU 178 Ca 0.64 -0.61 -0.27 0.00 -0.22 0.00 0.00 54.13 53.66 1nyk s LEU 178 Cb -0.21 -1.82 -0.11 0.00 0.50 0.00 0.00 46.19 44.56 1nyk s LEU 178 CO 0.26 -0.13 1.39 -2.65 -1.32 0.00 0.00 176.35 173.91 1nyk n PRO 179 N 4.82 2.34 -4.25 0.98 -0.02 -1.26 -4.06 135.00 133.55 1nyk n PRO 179 Ca -0.16 0.82 -0.15 0.00 -2.02 0.00 0.00 63.50 61.99 1nyk n PRO 179 Cb 0.49 -2.54 -0.10 0.00 -0.02 0.00 0.00 33.50 31.33 1nyk n PRO 179 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1nyk s VAL 180 N -1.14 1.24 0.14 -1.45 -7.23 -0.83 -0.70 120.40 110.43 1nyk s VAL 180 Ca 0.57 -1.97 -0.04 0.00 -1.81 0.00 0.00 61.98 58.73 1nyk s VAL 180 Cb -0.50 -1.76 -0.03 0.00 0.56 0.00 0.00 36.38 34.65 1nyk s VAL 180 CO 0.61 -0.65 0.13 0.00 -0.31 0.00 0.00 175.10 174.88 1nyk s ARG 181 N -3.44 1.00 -0.15 4.82 1.70 -0.37 -4.24 118.95 118.27 1nyk s ARG 181 Ca 0.15 -1.36 -0.02 0.00 -0.47 0.00 0.00 55.73 54.03 1nyk s ARG 181 Cb 0.00 0.29 -0.02 0.00 -0.57 0.00 0.00 34.95 34.65 1nyk s ARG 181 CO 0.02 -0.31 -0.07 0.08 -1.08 0.00 0.00 175.30 173.93 1nyk s VAL 182 N -4.02 3.57 -0.08 4.99 1.01 -1.26 -1.32 120.40 123.28 1nyk s VAL 182 Ca 0.22 -0.47 0.00 0.00 0.00 0.00 0.00 61.98 61.73 1nyk s VAL 182 Cb 0.06 -2.55 0.02 0.00 0.00 0.00 0.00 36.38 33.92 1nyk s VAL 182 CO 0.01 0.50 -0.06 -0.70 0.00 0.00 0.00 175.10 174.86 1nyk s GLU 183 N 0.39 1.22 -1.58 2.72 2.12 0.12 -4.77 118.70 118.93 1nyk s GLU 183 Ca -0.06 -0.17 -0.02 0.00 0.36 0.00 0.00 54.97 55.07 1nyk s GLU 183 Cb -0.15 -1.28 0.02 0.00 0.26 0.00 0.00 34.13 32.98 1nyk s GLU 183 CO 0.04 -0.19 0.07 -0.40 -0.54 0.00 0.00 175.26 174.24 1nyk n ASP 184 N 4.63 0.66 0.00 -1.70 3.85 -1.26 -1.33 116.55 121.40 1nyk n ASP 184 Ca -0.15 -1.27 0.00 0.00 -0.71 0.00 0.00 54.79 52.66 1nyk n ASP 184 Cb 0.50 -1.64 0.00 0.00 -1.35 0.00 0.00 41.12 38.63 1nyk n ASP 184 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1nyk n GLY 185 N -2.43 1.64 3.67 6.12 0.00 -1.26 -5.02 105.19 107.90 1nyk n GLY 185 Ca -0.29 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.38 1nyk n GLY 185 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nyk s VAL 186 N -3.67 4.23 0.08 1.61 1.01 -0.44 -0.92 120.40 122.29 1nyk s VAL 186 Ca 0.00 -0.28 -0.30 0.00 0.00 0.00 0.00 61.98 61.40 1nyk s VAL 186 Cb 0.00 -2.77 -0.05 0.00 0.00 0.00 0.00 36.38 33.56 1nyk s VAL 186 CO 0.00 0.60 1.04 -0.76 0.00 0.00 0.00 175.10 175.99 1nyk s LEU 187 N -0.87 4.43 -0.01 3.92 2.01 -0.16 -0.70 118.68 127.30 1nyk s LEU 187 Ca 0.13 1.85 0.04 0.00 0.01 0.00 0.00 54.13 56.16 1nyk s LEU 187 Cb -0.11 -3.58 -0.01 0.00 0.01 0.00 0.00 46.19 42.49 1nyk s LEU 187 CO 0.02 -0.24 -0.12 -0.69 1.01 0.00 0.00 176.35 176.33 1nyk s VAL 188 N 0.49 0.93 0.11 -1.59 1.01 -0.44 -1.00 120.40 119.91 1nyk s VAL 188 Ca 0.51 -0.52 -0.31 0.00 0.00 0.00 0.00 61.98 61.66 1nyk s VAL 188 Cb -0.25 -0.78 -0.09 0.00 0.00 0.00 0.00 36.38 35.26 1nyk s VAL 188 CO 0.30 0.25 1.65 0.00 0.00 0.00 0.00 175.10 177.31 1nyk s ALA 189 N -0.30 3.73 -2.10 5.51 0.00 0.41 -1.24 121.76 127.77 1nyk s ALA 189 Ca 0.04 1.29 0.21 0.00 0.00 0.00 0.00 51.96 53.51 1nyk s ALA 189 Cb -0.05 -3.68 0.03 0.00 0.00 0.00 0.00 23.12 19.42 1nyk s ALA 189 CO -0.00 -1.02 1.07 0.00 0.00 0.00 0.00 175.76 175.80 1nyk n ALA 190 N 5.11 3.22 -3.47 0.00 0.00 0.13 -0.04 120.51 125.45 1nyk n ALA 190 Ca 0.16 -0.63 0.06 0.00 0.00 0.00 0.00 53.44 53.03 1nyk n ALA 190 Cb 0.39 -0.73 0.01 0.00 0.00 0.00 0.00 19.45 19.12 1nyk n ALA 190 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nyk n GLY 191 N 1.32 0.69 3.79 0.00 0.00 -1.25 -4.88 105.19 104.86 1nyk n GLY 191 Ca 0.10 -0.99 -0.31 0.00 0.00 0.00 0.00 46.02 44.82 1nyk n GLY 191 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1nyk s GLU 192 N -2.02 2.51 0.50 1.61 0.41 -1.26 -4.41 118.70 116.03 1nyk s GLU 192 Ca 0.13 1.08 -0.21 0.00 -0.41 0.00 0.00 54.97 55.56 1nyk s GLU 192 Cb -0.01 -1.93 -0.09 0.00 -1.78 0.00 0.00 34.13 30.32 1nyk s GLU 192 CO 0.01 -1.44 0.88 1.19 -0.49 0.00 0.00 175.26 175.40 1nyk n PHE 193 N -3.38 0.62 1.45 1.61 3.72 -1.26 -4.37 117.46 115.84 1nyk n PHE 193 Ca 0.08 0.51 0.14 0.00 -0.05 0.00 0.00 57.45 58.13 1nyk n PHE 193 Cb 0.53 -2.14 0.74 0.00 -0.94 0.00 0.00 39.48 37.68 1nyk n PHE 193 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1nyk n LEU 194 N 0.22 0.00 -3.84 4.37 4.77 0.14 -4.85 117.00 117.80 1nyk n LEU 194 Ca 0.11 0.20 -0.03 0.00 -0.03 0.00 0.00 56.01 56.26 1nyk n LEU 194 Cb 0.43 -0.20 0.01 0.00 -2.33 0.00 0.00 43.42 41.32 1nyk n LEU 194 CO 0.54 -0.02 0.80 -0.83 -1.33 0.00 0.00 177.39 176.54 1nyk s GLY 195 N -2.41 0.02 0.56 -0.72 0.00 -1.26 -4.96 107.32 98.55 1nyk s GLY 195 Ca 0.31 -0.21 -0.21 0.00 0.00 0.00 0.00 44.72 44.61 1nyk s GLY 195 CO 0.40 1.76 1.36 -1.05 0.00 0.00 0.00 173.10 175.57 1nyk n PRO 196 N -0.64 1.66 -3.61 2.90 -0.02 -1.26 -4.81 135.00 129.22 1nyk n PRO 196 Ca -0.04 0.61 -0.38 0.00 -2.02 0.00 0.00 63.50 61.68 1nyk n PRO 196 Cb 0.60 -2.58 -0.06 0.00 -0.02 0.00 0.00 33.50 31.44 1nyk n PRO 196 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1nyk s VAL 197 N -1.29 5.16 0.00 -1.45 1.01 -1.26 -4.54 120.40 118.02 1nyk s VAL 197 Ca 0.73 0.65 0.00 0.00 0.00 0.00 0.00 61.98 63.36 1nyk s VAL 197 Cb -0.41 -3.63 0.00 0.00 0.00 0.00 0.00 36.38 32.34 1nyk s VAL 197 CO 0.48 0.57 0.00 0.61 0.00 0.00 0.00 175.10 176.77 1nyk n GLY 198 N 1.81 -0.01 3.69 4.51 0.00 -1.26 -4.75 105.19 109.18 1nyk n GLY 198 Ca -0.15 -0.97 -0.42 0.00 0.00 0.00 0.00 46.02 44.48 1nyk n GLY 198 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nyk s VAL 199 N 0.00 4.53 0.35 1.61 1.01 -1.26 -4.54 120.40 122.10 1nyk s VAL 199 Ca 0.00 1.82 0.04 0.00 0.00 0.00 0.00 61.98 63.84 1nyk s VAL 199 Cb 0.00 -4.17 -0.06 0.00 0.00 0.00 0.00 36.38 32.15 1nyk s VAL 199 CO 0.00 -0.00 0.06 -1.10 0.00 0.00 0.00 175.10 174.05 1nyk s GLN 200 N 2.12 1.74 0.00 2.72 -1.52 -1.26 -5.11 119.66 118.35 1nyk s GLN 200 Ca 0.52 -1.98 0.00 0.00 -1.95 0.00 0.00 55.36 51.95 1nyk s GLN 200 Cb -0.21 -0.98 0.00 0.00 -0.22 0.00 0.00 33.01 31.59 1nyk s GLN 200 CO 0.20 -0.20 0.24 0.00 -0.25 0.00 0.00 175.29 175.28