#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ub6 s ALA 3 N 0.00 -1.01 -0.07 0.00 0.00 -0.09 -4.96 121.76 115.62 1ub6 s ALA 3 Ca 0.00 0.86 0.03 0.00 0.00 0.00 0.00 51.96 52.85 1ub6 s ALA 3 Cb 0.00 -0.32 -0.02 0.00 0.00 0.00 0.00 23.12 22.78 1ub6 s ALA 3 CO 0.00 -0.24 -0.16 -0.51 0.00 0.00 0.00 175.76 174.85 1ub6 s LEU 4 N -0.54 2.60 -0.20 0.00 1.43 -1.26 -0.43 118.68 120.29 1ub6 s LEU 4 Ca -0.07 -0.29 -0.01 0.00 -1.03 0.00 0.00 54.13 52.73 1ub6 s LEU 4 Cb -0.04 -1.53 0.05 0.00 0.03 0.00 0.00 46.19 44.70 1ub6 s LEU 4 CO 0.03 0.28 -0.02 -0.22 0.23 0.00 0.00 176.35 176.64 1ub6 s LEU 5 N -0.31 1.79 0.46 1.79 2.96 -0.45 -4.01 118.68 120.90 1ub6 s LEU 5 Ca 0.02 -0.88 -0.13 0.00 -0.22 0.00 0.00 54.13 52.92 1ub6 s LEU 5 Cb -0.13 -0.89 -0.07 0.00 0.50 0.00 0.00 46.19 45.60 1ub6 s LEU 5 CO 0.03 -0.24 0.87 -1.61 -1.32 0.00 0.00 176.35 174.07 1ub6 s GLU 6 N 1.63 3.84 0.17 1.98 8.01 -1.26 -1.89 118.70 131.19 1ub6 s GLU 6 Ca -0.02 0.68 -0.23 0.00 0.01 0.00 0.00 54.97 55.41 1ub6 s GLU 6 Cb -0.17 -2.27 0.06 0.00 -4.31 0.00 0.00 34.13 27.44 1ub6 s GLU 6 CO -0.07 -0.15 0.69 -1.54 0.01 0.00 0.00 175.26 174.20 1ub6 s SER 7 N -3.16 -0.43 0.00 -0.19 1.04 -0.64 -4.77 113.70 105.55 1ub6 s SER 7 Ca 0.55 -0.19 0.00 0.00 0.48 0.00 0.00 55.95 56.78 1ub6 s SER 7 Cb -0.10 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.62 1ub6 s SER 7 CO 0.32 -1.03 0.00 0.61 0.98 0.00 0.00 173.24 174.12 1ub6 n GLY 8 N -0.39 0.51 3.62 7.32 0.00 -1.26 -1.11 105.19 113.87 1ub6 n GLY 8 Ca -0.12 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.62 1ub6 n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ub6 s GLY 9 N -1.61 1.55 0.00 -0.02 0.00 -1.26 -4.71 107.32 101.28 1ub6 s GLY 9 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 44.72 44.35 1ub6 s GLY 9 CO 0.00 0.30 0.00 0.61 0.00 0.00 0.00 173.10 174.01 1ub6 n GLY 10 N -0.57 -1.59 3.74 0.20 0.00 0.95 -4.91 105.19 103.01 1ub6 n GLY 10 Ca 0.05 -1.31 -0.40 0.00 0.00 0.00 0.00 46.02 44.36 1ub6 n GLY 10 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ub6 s LEU 11 N 0.00 4.42 -0.02 0.99 1.02 -1.26 -0.77 118.68 123.06 1ub6 s LEU 11 Ca 0.00 1.33 -0.03 0.00 0.02 0.00 0.00 54.13 55.45 1ub6 s LEU 11 Cb 0.00 -3.13 0.00 0.00 0.02 0.00 0.00 46.19 43.08 1ub6 s LEU 11 CO 0.00 0.01 0.08 -0.69 0.02 0.00 0.00 176.35 175.77 1ub6 s VAL 12 N 0.06 0.03 0.49 -1.59 1.01 0.70 -4.94 120.40 116.16 1ub6 s VAL 12 Ca 0.37 -0.28 -0.18 0.00 0.00 0.00 0.00 61.98 61.88 1ub6 s VAL 12 Cb -0.19 -0.21 -0.09 0.00 0.00 0.00 0.00 36.38 35.89 1ub6 s VAL 12 CO 0.21 -0.16 0.98 -0.54 0.00 0.00 0.00 175.10 175.60 1ub6 s LYS 13 N -0.48 3.98 0.43 2.72 1.02 -1.25 -1.47 119.74 124.70 1ub6 s LYS 13 Ca -0.05 1.07 -0.24 0.00 0.02 0.00 0.00 55.97 56.77 1ub6 s LYS 13 Cb -0.04 -2.14 -0.10 0.00 -0.52 0.00 0.00 37.83 35.04 1ub6 s LYS 13 CO 0.00 -0.25 1.03 -2.30 -0.92 0.00 0.00 175.35 172.92 1ub6 n PRO 14 N -1.23 1.38 -0.14 -1.68 -0.02 -1.26 -0.45 135.00 131.61 1ub6 n PRO 14 Ca 0.07 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 1ub6 n PRO 14 Cb 0.54 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 1ub6 n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ub6 n GLY 15 N 1.15 2.68 3.81 -1.23 0.00 0.18 -4.90 105.19 106.88 1ub6 n GLY 15 Ca 0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 1ub6 n GLY 15 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ub6 s GLY 16 N -2.00 1.75 0.09 -0.02 0.00 0.41 -3.73 107.32 103.81 1ub6 s GLY 16 Ca 0.00 -1.25 0.04 0.00 0.00 0.00 0.00 44.72 43.51 1ub6 s GLY 16 CO 0.00 -0.37 -0.11 -1.35 0.00 0.00 0.00 173.10 171.27 1ub6 s SER 17 N -4.64 1.47 -0.05 1.64 1.04 -1.26 -0.66 113.70 111.23 1ub6 s SER 17 Ca 0.75 -0.77 -0.18 0.00 0.48 0.00 0.00 55.95 56.23 1ub6 s SER 17 Cb -0.04 -0.00 0.04 0.00 0.10 0.00 0.00 66.02 66.12 1ub6 s SER 17 CO 0.54 -0.23 0.41 -0.22 0.98 0.00 0.00 173.24 174.72 1ub6 s LEU 18 N -2.31 0.44 -0.19 2.42 2.96 -0.33 -4.98 118.68 116.69 1ub6 s LEU 18 Ca 0.04 0.39 0.01 0.00 -0.22 0.00 0.00 54.13 54.35 1ub6 s LEU 18 Cb -0.04 1.57 0.03 0.00 0.50 0.00 0.00 46.19 48.24 1ub6 s LEU 18 CO 0.00 -0.41 -0.18 -0.75 -1.32 0.00 0.00 176.35 173.69 1ub6 s LYS 19 N -0.95 2.85 0.08 1.98 2.20 -1.26 0.54 119.74 125.18 1ub6 s LYS 19 Ca -0.10 -0.90 -0.09 0.00 -0.36 0.00 0.00 55.97 54.51 1ub6 s LYS 19 Cb -0.04 -2.61 -0.06 0.00 -1.51 0.00 0.00 37.83 33.62 1ub6 s LYS 19 CO 0.05 -0.27 0.39 -0.51 -0.36 0.00 0.00 175.35 174.65 1ub6 s LEU 20 N 1.27 4.34 0.29 5.43 1.43 0.45 -4.66 118.68 127.23 1ub6 s LEU 20 Ca 0.03 0.77 0.06 0.00 -1.03 0.00 0.00 54.13 53.96 1ub6 s LEU 20 Cb -0.14 -3.00 -0.06 0.00 0.03 0.00 0.00 46.19 43.01 1ub6 s LEU 20 CO -0.12 0.16 -0.04 -0.94 0.23 0.00 0.00 176.35 175.64 1ub6 s SER 21 N -1.82 2.84 -0.18 2.29 1.04 -0.27 -0.82 113.70 116.77 1ub6 s SER 21 Ca 0.34 -1.22 -0.08 0.00 0.48 0.00 0.00 55.95 55.47 1ub6 s SER 21 Cb -0.14 -0.18 0.08 0.00 0.10 0.00 0.00 66.02 65.88 1ub6 s SER 21 CO 0.18 -0.37 0.41 0.00 0.98 0.00 0.00 173.24 174.44 1ub6 s THR 23 N 2.12 2.87 0.03 0.00 -4.23 -0.79 -1.48 115.64 114.16 1ub6 s THR 23 Ca -0.05 -1.37 -0.17 0.00 -1.18 0.00 0.00 61.69 58.92 1ub6 s THR 23 Cb -0.11 -3.04 0.03 0.00 1.34 0.00 0.00 72.50 70.72 1ub6 s THR 23 CO -0.13 -0.05 0.37 0.00 -0.54 0.00 0.00 174.62 174.28 1ub6 s ALA 24 N -2.43 -0.90 -0.14 3.99 0.00 -1.26 -1.35 121.76 119.67 1ub6 s ALA 24 Ca 0.46 0.26 0.00 0.00 0.00 0.00 0.00 51.96 52.69 1ub6 s ALA 24 Cb -0.04 0.27 0.02 0.00 0.00 0.00 0.00 23.12 23.38 1ub6 s ALA 24 CO 0.27 -0.40 -0.13 0.45 0.00 0.00 0.00 175.76 175.95 1ub6 s SER 25 N -1.85 2.56 0.00 0.00 0.15 0.43 -4.72 113.70 110.27 1ub6 s SER 25 Ca -0.07 -0.44 0.00 0.00 0.70 0.00 0.00 55.95 56.14 1ub6 s SER 25 Cb -0.02 -1.10 0.00 0.00 -1.71 0.00 0.00 66.02 63.19 1ub6 s SER 25 CO -0.01 -0.06 0.00 0.61 1.20 0.00 0.00 173.24 174.98 1ub6 n GLY 26 N 4.73 0.77 2.94 9.45 0.00 -1.26 -0.92 105.19 120.90 1ub6 n GLY 26 Ca -0.16 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.63 1ub6 n GLY 26 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ub6 s ILE 27 N -2.85 0.85 -0.66 -0.61 1.01 -1.26 -4.91 121.20 112.77 1ub6 s ILE 27 Ca 0.00 -0.28 -0.14 0.00 0.00 0.00 0.00 60.65 60.23 1ub6 s ILE 27 Cb 0.00 -0.82 0.17 0.00 0.01 0.00 0.00 42.46 41.81 1ub6 s ILE 27 CO 0.00 0.30 0.59 -0.89 0.00 0.00 0.00 174.94 174.94 1ub6 s THR 28 N 0.96 5.18 0.31 2.92 2.01 -1.26 -4.84 115.64 120.92 1ub6 s THR 28 Ca -0.10 -2.04 0.07 0.00 0.31 0.00 0.00 61.69 59.93 1ub6 s THR 28 Cb -0.15 -4.27 0.34 0.00 0.01 0.00 0.00 72.50 68.43 1ub6 s THR 28 CO 0.00 -0.93 1.62 -0.26 -0.69 0.00 0.00 174.62 174.37 1ub6 h PHE 29 N 8.25 0.43 0.00 4.92 0.05 -1.95 -1.57 116.94 127.07 1ub6 h PHE 29 Ca -0.10 0.05 0.00 0.00 3.82 0.00 0.00 57.97 61.74 1ub6 h PHE 29 Cb 1.06 -0.04 0.00 0.00 2.00 0.00 0.00 35.95 38.98 1ub6 h PHE 29 CO 0.85 -0.29 0.06 0.66 -0.18 0.00 0.00 178.31 179.41 1ub6 h SER 30 N 0.15 0.00 0.52 2.17 4.64 -1.93 -2.39 113.55 116.72 1ub6 h SER 30 Ca 0.64 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.96 1ub6 h SER 30 Cb 1.40 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.49 1ub6 h SER 30 CO -0.72 0.00 -0.78 0.54 -0.87 0.00 0.00 176.83 174.99 1ub6 n ARG 32 N -2.27 0.19 -4.01 4.77 1.74 -0.59 -4.67 116.66 111.81 1ub6 n ARG 32 Ca -0.01 0.02 -0.23 0.00 -0.77 0.00 0.00 57.85 56.86 1ub6 n ARG 32 Cb 0.09 -1.58 -0.06 0.00 -1.02 0.00 0.00 32.46 29.89 1ub6 n ARG 32 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1ub6 n TYR 34 N -1.84 0.49 -2.97 -1.55 4.02 -0.90 -4.79 117.16 109.63 1ub6 n TYR 34 Ca 0.03 -2.04 -0.44 0.00 -0.01 0.00 0.00 57.90 55.45 1ub6 n TYR 34 Cb 0.40 -0.13 -0.04 0.00 -0.02 0.00 0.00 39.34 39.55 1ub6 n TYR 34 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1ub6 s ILE 35 N -2.62 4.54 0.18 -0.72 1.01 -1.26 -3.25 121.20 119.07 1ub6 s ILE 35 Ca 0.09 -0.55 -0.15 0.00 0.00 0.00 0.00 60.65 60.03 1ub6 s ILE 35 Cb 0.00 -4.58 -0.07 0.00 0.01 0.00 0.00 42.46 37.82 1ub6 s ILE 35 CO 0.06 -1.28 0.60 -0.04 0.00 0.00 0.00 174.94 174.29 1ub6 s MET 36 N 3.48 4.04 0.18 2.79 -1.94 -0.54 -4.30 119.30 123.02 1ub6 s MET 36 Ca 0.18 0.59 0.01 0.00 -1.71 0.00 0.00 55.69 54.76 1ub6 s MET 36 Cb -0.19 -2.88 -0.05 0.00 2.01 0.00 0.00 34.83 33.72 1ub6 s MET 36 CO 0.09 0.43 0.04 -1.12 -0.01 0.00 0.00 175.02 174.46 1ub6 s SER 37 N -1.76 0.94 -0.02 3.03 0.01 -0.21 -0.78 113.70 114.90 1ub6 s SER 37 Ca 0.40 -1.24 0.05 0.00 1.31 0.00 0.00 55.95 56.47 1ub6 s SER 37 Cb -0.15 0.18 -0.01 0.00 0.21 0.00 0.00 66.02 66.25 1ub6 s SER 37 CO 0.20 -0.66 -0.18 0.26 0.41 0.00 0.00 173.24 173.27 1ub6 s TRP 38 N -3.80 1.66 0.13 2.43 0.52 0.83 -0.74 118.94 119.97 1ub6 s TRP 38 Ca 0.28 -0.35 -0.00 0.00 0.02 0.00 0.00 56.10 56.05 1ub6 s TRP 38 Cb 0.07 -1.08 -0.04 0.00 -1.15 0.00 0.00 33.47 31.27 1ub6 s TRP 38 CO 0.06 -0.06 0.03 0.14 0.02 0.00 0.00 176.95 177.14 1ub6 s VAL 39 N -0.32 0.29 0.04 4.03 -7.23 -0.29 -1.14 120.40 115.77 1ub6 s VAL 39 Ca 0.05 -1.92 -0.10 0.00 -1.81 0.00 0.00 61.98 58.20 1ub6 s VAL 39 Cb -0.08 -1.98 0.01 0.00 0.56 0.00 0.00 36.38 34.88 1ub6 s VAL 39 CO -0.00 -0.55 0.21 0.00 -0.31 0.00 0.00 175.10 174.44 1ub6 s ARG 40 N -3.99 0.70 -0.03 4.82 1.70 0.06 0.23 118.95 122.44 1ub6 s ARG 40 Ca 0.21 -0.61 0.01 0.00 -0.47 0.00 0.00 55.73 54.88 1ub6 s ARG 40 Cb 0.07 0.29 0.02 0.00 -0.57 0.00 0.00 34.95 34.77 1ub6 s ARG 40 CO 0.01 -0.21 -0.02 1.14 -1.08 0.00 0.00 175.30 175.14 1ub6 s GLN 41 N -2.53 0.52 0.08 3.89 -2.07 -0.55 -0.05 119.66 118.97 1ub6 s GLN 41 Ca -0.05 -0.01 -0.21 0.00 -1.82 0.00 0.00 55.36 53.27 1ub6 s GLN 41 Cb -0.01 -0.62 -0.07 0.00 -1.09 0.00 0.00 33.01 31.22 1ub6 s GLN 41 CO -0.04 -0.10 0.62 0.42 -1.32 0.00 0.00 175.29 174.87 1ub6 s ILE 42 N 0.93 4.68 0.51 3.63 1.09 -1.26 -1.80 121.20 128.98 1ub6 s ILE 42 Ca -0.11 1.32 0.46 0.00 -1.10 0.00 0.00 60.65 61.22 1ub6 s ILE 42 Cb -0.14 -3.95 0.67 0.00 -1.06 0.00 0.00 42.46 37.98 1ub6 s ILE 42 CO -0.01 0.53 1.47 -2.65 -0.10 0.00 0.00 174.94 174.19 1ub6 n PRO 43 N 1.80 -0.00 0.24 2.79 -0.02 -1.26 0.23 135.00 138.78 1ub6 n PRO 43 Ca -0.09 1.04 0.12 0.00 -2.02 0.00 0.00 63.50 62.55 1ub6 n PRO 43 Cb 0.50 -2.36 0.65 0.00 -0.02 0.00 0.00 33.50 32.27 1ub6 n PRO 43 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1ub6 h GLU 44 N 0.00 0.00 0.00 -0.52 4.22 -2.01 -3.47 114.58 112.80 1ub6 h GLU 44 Ca 0.88 0.00 0.00 0.00 0.08 0.00 0.00 59.36 60.32 1ub6 h GLU 44 Cb 3.46 0.00 0.00 0.00 0.50 0.00 0.00 28.75 32.71 1ub6 h GLU 44 CO -0.07 0.00 0.00 1.63 -2.18 0.00 0.00 179.01 178.39 1ub6 n LYS 45 N -2.49 0.00 -0.62 1.92 4.76 0.63 -5.12 118.16 117.24 1ub6 n LYS 45 Ca -0.02 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.42 1ub6 n LYS 45 Cb 0.27 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.46 1ub6 n LYS 45 CO 0.00 0.00 0.00 -2.13 -1.37 0.00 0.00 177.40 173.90 1ub6 n ARG 46 N -1.53 0.00 -1.80 1.97 0.63 -1.26 -4.71 116.66 109.96 1ub6 n ARG 46 Ca 0.00 0.31 -0.38 0.00 -0.92 0.00 0.00 57.85 56.86 1ub6 n ARG 46 Cb 0.00 -0.30 0.04 0.00 0.45 0.00 0.00 32.46 32.65 1ub6 n ARG 46 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1ub6 s LEU 47 N 0.00 3.79 -0.11 6.15 1.43 -1.26 -4.58 118.68 124.10 1ub6 s LEU 47 Ca 0.00 2.71 0.01 0.00 -1.03 0.00 0.00 54.13 55.82 1ub6 s LEU 47 Cb 0.00 -4.36 0.02 0.00 0.03 0.00 0.00 46.19 41.88 1ub6 s LEU 47 CO 0.00 -1.64 -0.14 -0.70 0.23 0.00 0.00 176.35 174.10 1ub6 s GLU 48 N -3.01 2.12 0.29 1.70 2.12 0.93 -4.95 118.70 117.89 1ub6 s GLU 48 Ca 0.74 -0.52 -0.29 0.00 0.36 0.00 0.00 54.97 55.26 1ub6 s GLU 48 Cb -0.39 -1.85 -0.10 0.00 0.26 0.00 0.00 34.13 32.05 1ub6 s GLU 48 CO 0.45 -0.10 1.34 -0.46 -0.54 0.00 0.00 175.26 175.94 1ub6 s TRP 49 N 1.11 3.09 -0.06 5.30 -0.00 -1.26 -0.76 118.94 126.35 1ub6 s TRP 49 Ca -0.04 1.29 0.01 0.00 -0.00 0.00 0.00 56.10 57.36 1ub6 s TRP 49 Cb -0.14 -3.69 -0.04 0.00 -0.00 0.00 0.00 33.47 29.59 1ub6 s TRP 49 CO -0.03 -2.04 -0.04 0.28 -0.00 0.00 0.00 176.95 175.12 1ub6 n VAL 50 N 1.49 0.34 -3.62 5.86 0.31 -0.29 -4.81 118.33 117.62 1ub6 n VAL 50 Ca 0.03 -0.15 -0.04 0.00 -0.01 0.00 0.00 64.34 64.17 1ub6 n VAL 50 Cb 0.42 -0.75 -0.03 0.00 -0.91 0.00 0.00 33.84 32.56 1ub6 n VAL 50 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ub6 s ALA 51 N -2.12 -2.09 0.04 3.52 0.00 -1.02 -4.33 121.76 115.76 1ub6 s ALA 51 Ca -0.07 1.74 -0.06 0.00 0.00 0.00 0.00 51.96 53.58 1ub6 s ALA 51 Cb 0.02 -0.74 -0.01 0.00 0.00 0.00 0.00 23.12 22.39 1ub6 s ALA 51 CO 0.15 -0.42 0.10 -1.12 0.00 0.00 0.00 175.76 174.47 1ub6 s SER 52 N -1.59 0.17 -0.04 0.00 0.01 -0.79 -0.12 113.70 111.34 1ub6 s SER 52 Ca 0.08 -0.51 -0.01 0.00 1.31 0.00 0.00 55.95 56.81 1ub6 s SER 52 Cb -0.01 0.23 0.03 0.00 0.21 0.00 0.00 66.02 66.48 1ub6 s SER 52 CO -0.05 -0.50 0.07 -0.51 0.41 0.00 0.00 173.24 172.66 1ub6 s ILE 53 N -2.53 -0.10 1.07 1.44 2.07 0.04 -0.84 121.20 122.36 1ub6 s ILE 53 Ca -0.06 0.32 -0.17 0.00 -1.41 0.00 0.00 60.65 59.34 1ub6 s ILE 53 Cb -0.02 -0.15 0.23 0.00 0.13 0.00 0.00 42.46 42.66 1ub6 s ILE 53 CO -0.04 0.13 1.16 -0.94 -1.91 0.00 0.00 174.94 173.34 1ub6 s SER 54 N 1.67 2.06 0.31 4.50 1.04 0.48 -1.46 113.70 122.30 1ub6 s SER 54 Ca -0.02 0.66 0.03 0.00 0.48 0.00 0.00 55.95 57.10 1ub6 s SER 54 Cb -0.12 -0.96 0.51 0.00 0.10 0.00 0.00 66.02 65.54 1ub6 s SER 54 CO -0.04 -3.42 1.82 -1.28 0.98 0.00 0.00 173.24 171.30 1ub6 h SER 55 N -2.10 0.55 0.00 7.02 0.87 -1.82 -1.51 113.55 116.56 1ub6 h SER 55 Ca -0.47 -0.12 0.00 0.00 -1.23 0.00 0.00 61.79 59.97 1ub6 h SER 55 Cb 1.29 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 63.11 1ub6 h SER 55 CO 0.43 0.65 0.00 0.61 -0.53 0.00 0.00 176.83 177.99 1ub6 n GLY 56 N -0.73 -0.98 1.85 5.77 0.00 -1.26 -4.87 105.19 104.96 1ub6 n GLY 56 Ca 0.01 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1ub6 n GLY 56 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ub6 n GLY 57 N 0.65 0.72 3.73 -0.02 0.00 -0.57 -5.03 105.19 104.66 1ub6 n GLY 57 Ca 0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 1ub6 n GLY 57 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ub6 s ILE 58 N -2.59 3.88 -0.07 -0.61 -1.09 -1.26 -4.73 121.20 114.72 1ub6 s ILE 58 Ca 0.00 1.50 -0.03 0.00 -2.23 0.00 0.00 60.65 59.89 1ub6 s ILE 58 Cb 0.00 -3.96 -0.04 0.00 -1.58 0.00 0.00 42.46 36.89 1ub6 s ILE 58 CO 0.00 0.20 0.06 0.42 -1.23 0.00 0.00 174.94 174.39 1ub6 s THR 59 N 0.30 4.72 -0.01 2.92 -4.23 -1.26 -0.39 115.64 117.70 1ub6 s THR 59 Ca 0.54 -0.17 0.05 0.00 -1.18 0.00 0.00 61.69 60.93 1ub6 s THR 59 Cb -0.30 -3.05 -0.01 0.00 1.34 0.00 0.00 72.50 70.48 1ub6 s THR 59 CO 0.33 0.54 -0.17 -0.31 -0.54 0.00 0.00 174.62 174.48 1ub6 s TYR 60 N -1.00 1.48 -0.04 3.99 1.51 -0.02 -5.00 117.35 118.28 1ub6 s TYR 60 Ca 0.16 -0.29 -0.08 0.00 -1.01 0.00 0.00 57.07 55.85 1ub6 s TYR 60 Cb -0.12 -0.95 0.01 0.00 -0.11 0.00 0.00 41.96 40.80 1ub6 s TYR 60 CO 0.06 -0.02 0.19 0.71 -1.11 0.00 0.00 175.55 175.38 1ub6 s TYR 61 N -0.43 -0.11 0.54 2.71 2.02 -1.26 -1.88 117.35 118.94 1ub6 s TYR 61 Ca 0.06 0.24 -0.07 0.00 -0.37 0.00 0.00 57.07 56.93 1ub6 s TYR 61 Cb -0.07 0.03 -0.03 0.00 -0.40 0.00 0.00 41.96 41.49 1ub6 s TYR 61 CO -0.00 -0.22 0.89 -1.25 -1.57 0.00 0.00 175.55 173.39 1ub6 s PRO 62 N -0.69 3.50 0.37 -1.71 0.04 -1.26 -4.80 135.00 130.44 1ub6 s PRO 62 Ca -0.08 0.38 0.13 0.00 0.04 0.00 0.00 61.00 61.47 1ub6 s PRO 62 Cb -0.04 -2.26 0.95 0.00 0.04 0.00 0.00 34.50 33.18 1ub6 s PRO 62 CO 0.01 -0.39 1.81 -0.44 0.04 0.00 0.00 177.00 178.04 1ub6 h ASP 63 N -0.01 0.57 -0.29 6.66 3.32 -1.98 -1.40 116.42 123.29 1ub6 h ASP 63 Ca -0.46 0.07 0.08 0.00 0.02 0.00 0.00 57.03 56.74 1ub6 h ASP 63 Cb 1.20 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.71 1ub6 h ASP 63 CO 0.62 0.21 0.55 0.77 -1.72 0.00 0.00 179.24 179.67 1ub6 h SER 64 N 0.55 0.00 0.00 6.45 4.64 -1.97 -2.69 113.55 120.53 1ub6 h SER 64 Ca 0.53 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.85 1ub6 h SER 64 Cb 1.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 1ub6 h SER 64 CO -0.27 0.00 0.00 1.33 -0.87 0.00 0.00 176.83 177.02 1ub6 n VAL 65 N -3.22 0.00 -0.08 0.95 0.24 -0.90 -4.96 118.33 110.36 1ub6 n VAL 65 Ca 0.05 -0.09 0.04 0.00 -2.04 0.00 0.00 64.34 62.31 1ub6 n VAL 65 Cb 0.68 1.56 0.08 0.00 -1.47 0.00 0.00 33.84 34.69 1ub6 n VAL 65 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ub6 n ALA 66 N -0.05 0.14 -0.01 2.33 0.00 -0.58 -0.23 120.51 122.11 1ub6 n ALA 66 Ca 0.00 0.24 0.02 0.00 0.00 0.00 0.00 53.44 53.70 1ub6 n ALA 66 Cb 0.14 -0.19 0.05 0.00 0.00 0.00 0.00 19.45 19.45 1ub6 n ALA 66 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ub6 n GLY 67 N -1.10 1.94 0.04 0.00 0.00 -1.26 -4.67 105.19 100.13 1ub6 n GLY 67 Ca 0.06 -0.14 -0.04 0.00 0.00 0.00 0.00 46.02 45.90 1ub6 n GLY 67 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ub6 n ARG 68 N -0.02 2.29 -4.07 1.61 1.74 0.68 -5.01 116.66 113.87 1ub6 n ARG 68 Ca 0.04 -0.01 -0.34 0.00 -0.77 0.00 0.00 57.85 56.77 1ub6 n ARG 68 Cb 0.27 -1.24 -0.07 0.00 -1.02 0.00 0.00 32.46 30.39 1ub6 n ARG 68 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1ub6 s PHE 69 N -2.26 3.37 -0.15 -1.55 2.99 -0.73 -1.72 117.98 117.92 1ub6 s PHE 69 Ca -0.05 0.30 -0.01 0.00 0.00 0.00 0.00 56.93 57.17 1ub6 s PHE 69 Cb 0.03 -1.81 0.04 0.00 0.00 0.00 0.00 43.02 41.29 1ub6 s PHE 69 CO 0.39 0.59 -0.02 0.99 -0.00 0.00 0.00 175.22 177.17 1ub6 s THR 70 N -1.12 0.79 -0.07 0.64 2.01 0.91 -4.88 115.64 113.92 1ub6 s THR 70 Ca 0.20 -0.43 -0.14 0.00 0.31 0.00 0.00 61.69 61.63 1ub6 s THR 70 Cb -0.12 -1.04 -0.05 0.00 0.01 0.00 0.00 72.50 71.30 1ub6 s THR 70 CO 0.10 0.08 0.36 -0.51 -0.69 0.00 0.00 174.62 173.97 1ub6 s ILE 71 N 1.77 5.17 0.20 1.82 2.07 -1.26 -0.32 121.20 130.65 1ub6 s ILE 71 Ca 0.01 0.72 -0.08 0.00 -1.41 0.00 0.00 60.65 59.90 1ub6 s ILE 71 Cb -0.15 -3.68 -0.02 0.00 0.13 0.00 0.00 42.46 38.75 1ub6 s ILE 71 CO -0.07 0.50 0.30 -0.94 -1.91 0.00 0.00 174.94 172.82 1ub6 s SER 72 N -0.47 0.03 -0.05 4.50 1.04 -0.85 -5.00 113.70 112.90 1ub6 s SER 72 Ca 0.21 -1.05 -0.04 0.00 0.48 0.00 0.00 55.95 55.55 1ub6 s SER 72 Cb -0.15 0.47 0.02 0.00 0.10 0.00 0.00 66.02 66.46 1ub6 s SER 72 CO 0.10 -0.96 0.13 -0.60 0.98 0.00 0.00 173.24 172.88 1ub6 s ARG 73 N -4.04 0.12 -0.60 4.02 3.52 -1.26 -0.23 118.95 120.48 1ub6 s ARG 73 Ca 0.26 0.24 -0.13 0.00 -0.13 0.00 0.00 55.73 55.97 1ub6 s ARG 73 Cb 0.03 -0.02 0.15 0.00 -1.56 0.00 0.00 34.95 33.55 1ub6 s ARG 73 CO 0.07 -0.07 0.52 0.34 -0.81 0.00 0.00 175.30 175.35 1ub6 s ASP 74 N 0.46 6.13 0.56 -2.12 3.68 0.35 -4.94 116.67 120.79 1ub6 s ASP 74 Ca -0.03 -2.11 0.23 0.00 2.13 0.00 0.00 52.55 52.77 1ub6 s ASP 74 Cb -0.05 -2.13 1.54 0.00 -1.45 0.00 0.00 42.92 40.83 1ub6 s ASP 74 CO -0.02 -0.71 2.18 0.78 0.13 0.00 0.00 175.17 177.52 1ub6 h ASN 75 N 8.37 0.00 0.00 -0.34 2.35 -1.96 0.21 115.58 124.21 1ub6 h ASN 75 Ca -0.16 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.59 1ub6 h ASN 75 Cb 1.07 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.44 1ub6 h ASN 75 CO 0.90 0.00 -0.00 0.58 -1.65 0.00 0.00 177.43 177.26 1ub6 h VAL 76 N 0.00 1.60 -0.00 2.81 2.07 -1.97 -3.30 116.25 117.46 1ub6 h VAL 76 Ca 0.03 -2.12 0.00 0.00 0.82 0.00 0.00 66.70 65.43 1ub6 h VAL 76 Cb 0.12 2.98 0.00 0.00 -1.52 0.00 0.00 31.29 32.87 1ub6 h VAL 76 CO -0.00 0.53 -0.05 0.54 0.02 0.00 0.00 177.57 178.60 1ub6 n ARG 77 N -4.65 0.23 -3.28 1.57 3.00 -1.19 -4.95 116.66 107.39 1ub6 n ARG 77 Ca -0.09 -0.03 -0.16 0.00 -0.01 0.00 0.00 57.85 57.56 1ub6 n ARG 77 Cb 0.42 -1.50 0.06 0.00 0.00 0.00 0.00 32.46 31.44 1ub6 n ARG 77 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 1ub6 n ASN 78 N -1.36 -6.59 -4.05 0.55 5.15 0.67 -4.99 115.26 104.63 1ub6 n ASN 78 Ca 0.10 -0.70 -0.21 0.00 -0.60 0.00 0.00 54.58 53.16 1ub6 n ASN 78 Cb 0.30 -5.03 -0.15 0.00 -0.53 0.00 0.00 39.78 34.37 1ub6 n ASN 78 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1ub6 s ILE 79 N -3.37 0.95 -0.13 -1.44 1.01 -0.84 -4.33 121.20 113.05 1ub6 s ILE 79 Ca 0.43 -0.48 -0.04 0.00 0.00 0.00 0.00 60.65 60.57 1ub6 s ILE 79 Cb -0.07 -0.82 -0.03 0.00 0.01 0.00 0.00 42.46 41.55 1ub6 s ILE 79 CO 0.75 0.28 0.01 -0.22 0.00 0.00 0.00 174.94 175.76 1ub6 s LEU 80 N -0.02 3.56 0.20 2.97 0.20 -0.55 -0.49 118.68 124.56 1ub6 s LEU 80 Ca -0.00 0.06 0.10 0.00 0.69 0.00 0.00 54.13 54.98 1ub6 s LEU 80 Cb -0.08 -1.85 -0.04 0.00 -0.43 0.00 0.00 46.19 43.79 1ub6 s LEU 80 CO 0.00 0.28 -0.20 -0.31 -0.29 0.00 0.00 176.35 175.83 1ub6 s TYR 81 N -0.26 2.08 -0.30 5.38 1.51 0.68 -0.57 117.35 125.87 1ub6 s TYR 81 Ca 0.06 -0.41 -0.03 0.00 -1.01 0.00 0.00 57.07 55.68 1ub6 s TYR 81 Cb -0.12 -1.00 0.11 0.00 -0.11 0.00 0.00 41.96 40.84 1ub6 s TYR 81 CO 0.02 0.47 0.16 -1.17 -1.11 0.00 0.00 175.55 173.92 1ub6 s LEU 82 N -2.89 0.51 -0.36 -1.29 1.98 0.00 -2.01 118.68 114.62 1ub6 s LEU 82 Ca 0.21 -1.34 -0.22 0.00 -2.89 0.00 0.00 54.13 49.89 1ub6 s LEU 82 Cb -0.06 -0.27 0.01 0.00 0.66 0.00 0.00 46.19 46.53 1ub6 s LEU 82 CO 0.09 -0.42 0.72 -1.58 -1.89 0.00 0.00 176.35 173.27 1ub6 s GLN 83 N 2.01 3.73 -0.04 1.98 2.00 0.56 -0.41 119.66 129.50 1ub6 s GLN 83 Ca 0.10 0.22 -0.01 0.00 -2.00 0.00 0.00 55.36 53.66 1ub6 s GLN 83 Cb -0.17 -3.80 -0.04 0.00 0.80 0.00 0.00 33.01 29.80 1ub6 s GLN 83 CO -0.32 -0.79 0.06 -1.64 -0.50 0.00 0.00 175.29 172.09 1ub6 s MET 84 N 2.92 3.05 0.08 1.67 -1.94 0.19 -0.06 119.30 125.20 1ub6 s MET 84 Ca 0.28 -0.44 -0.06 0.00 -1.71 0.00 0.00 55.69 53.77 1ub6 s MET 84 Cb -0.14 -2.85 -0.02 0.00 2.01 0.00 0.00 34.83 33.83 1ub6 s MET 84 CO 0.16 0.68 0.11 -1.12 -0.01 0.00 0.00 175.02 174.84 1ub6 s SER 85 N -1.39 0.25 -1.45 3.03 0.01 -0.70 -1.19 113.70 112.26 1ub6 s SER 85 Ca 0.19 -0.80 -0.05 0.00 1.31 0.00 0.00 55.95 56.60 1ub6 s SER 85 Cb -0.12 0.30 0.04 0.00 0.21 0.00 0.00 66.02 66.44 1ub6 s SER 85 CO 0.09 -0.69 0.59 -1.20 0.41 0.00 0.00 173.24 172.43 1ub6 n SER 86 N -0.01 -1.44 -4.73 2.44 7.64 -0.92 -4.71 113.62 111.89 1ub6 n SER 86 Ca -0.14 -0.95 -0.42 0.00 1.01 0.00 0.00 58.87 58.37 1ub6 n SER 86 Cb 0.62 -3.27 -0.01 0.00 -1.01 0.00 0.00 64.21 60.54 1ub6 n SER 86 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1ub6 n LEU 87 N -4.41 4.01 -4.58 -3.43 4.77 0.16 -4.57 117.00 108.95 1ub6 n LEU 87 Ca -0.21 1.17 -0.24 0.00 -0.03 0.00 0.00 56.01 56.70 1ub6 n LEU 87 Cb 0.64 -1.54 -0.08 0.00 -2.33 0.00 0.00 43.42 40.10 1ub6 n LEU 87 CO 0.76 -0.11 -0.39 -0.13 -1.33 0.00 0.00 177.39 176.19 1ub6 s ARG 88 N -1.05 2.08 0.24 3.23 3.00 -1.26 0.50 118.95 125.69 1ub6 s ARG 88 Ca 0.61 -1.45 -0.05 0.00 0.00 0.00 0.00 55.73 54.85 1ub6 s ARG 88 Cb -0.54 -2.07 0.41 0.00 0.00 0.00 0.00 34.95 32.75 1ub6 s ARG 88 CO 0.54 0.38 1.78 0.66 0.00 0.00 0.00 175.30 178.66 1ub6 h SER 89 N 2.28 0.50 0.05 0.23 4.64 -1.95 0.70 113.55 120.00 1ub6 h SER 89 Ca -0.44 0.07 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 1ub6 h SER 89 Cb 1.24 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1ub6 h SER 89 CO 0.58 0.26 0.00 -1.84 -0.87 0.00 0.00 176.83 174.96 1ub6 n GLU 90 N -4.86 0.27 0.00 4.77 0.28 -1.26 -1.69 120.64 118.16 1ub6 n GLU 90 Ca 0.13 0.05 0.12 0.00 -0.16 0.00 0.00 57.16 57.30 1ub6 n GLU 90 Cb 0.33 -1.50 0.21 0.00 1.43 0.00 0.00 31.44 31.91 1ub6 n GLU 90 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1ub6 n ASP 91 N -1.07 0.62 -4.69 -1.84 8.00 0.24 -4.90 116.55 112.90 1ub6 n ASP 91 Ca 0.07 -0.41 -0.42 0.00 0.71 0.00 0.00 54.79 54.74 1ub6 n ASP 91 Cb 0.05 0.35 -0.03 0.00 -0.02 0.00 0.00 41.12 41.46 1ub6 n ASP 91 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1ub6 s THR 92 N -2.96 2.65 -0.98 -3.53 2.01 -0.68 -4.90 115.64 107.26 1ub6 s THR 92 Ca 0.12 0.21 0.00 0.00 0.31 0.00 0.00 61.69 62.32 1ub6 s THR 92 Cb 0.17 -3.13 0.00 0.00 0.01 0.00 0.00 72.50 69.55 1ub6 s THR 92 CO 0.71 0.00 0.00 0.00 -0.69 0.00 0.00 174.62 174.64 1ub6 n ALA 93 N 5.40 0.00 -2.60 7.40 0.00 -0.64 -4.72 120.51 125.35 1ub6 n ALA 93 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.22 1ub6 n ALA 93 Cb 0.39 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.73 1ub6 n ALA 93 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1ub6 s LEU 94 N 0.00 4.03 -0.16 0.00 0.20 -0.74 -0.96 118.68 121.05 1ub6 s LEU 94 Ca 0.00 0.12 -0.11 0.00 0.69 0.00 0.00 54.13 54.83 1ub6 s LEU 94 Cb 0.00 -2.25 -0.05 0.00 -0.43 0.00 0.00 46.19 43.47 1ub6 s LEU 94 CO 0.00 -0.10 0.20 -0.31 -0.29 0.00 0.00 176.35 175.85 1ub6 s TYR 95 N 1.87 3.48 0.05 5.38 1.51 0.22 -1.48 117.35 128.38 1ub6 s TYR 95 Ca 0.10 0.49 0.08 0.00 -1.01 0.00 0.00 57.07 56.73 1ub6 s TYR 95 Cb -0.16 -2.18 -0.03 0.00 -0.11 0.00 0.00 41.96 39.47 1ub6 s TYR 95 CO 0.10 0.38 -0.21 0.71 -1.11 0.00 0.00 175.55 175.42 1ub6 s TYR 96 N 0.06 2.48 -0.11 2.71 2.02 0.14 -1.74 117.35 122.91 1ub6 s TYR 96 Ca 0.13 -0.30 -0.15 0.00 -0.37 0.00 0.00 57.07 56.38 1ub6 s TYR 96 Cb -0.12 -1.43 -0.05 0.00 -0.40 0.00 0.00 41.96 39.96 1ub6 s TYR 96 CO 0.02 0.23 0.35 0.00 -1.57 0.00 0.00 175.55 174.58 1ub6 s ALA 98 N 0.08 -0.52 -0.76 0.00 0.00 0.08 -2.57 121.76 118.06 1ub6 s ALA 98 Ca 0.20 0.69 -0.09 0.00 0.00 0.00 0.00 51.96 52.75 1ub6 s ALA 98 Cb -0.14 -0.41 0.20 0.00 0.00 0.00 0.00 23.12 22.77 1ub6 s ALA 98 CO 0.07 -0.12 0.66 0.50 0.00 0.00 0.00 175.76 176.87 1ub6 s ARG 99 N 0.39 3.23 0.34 0.00 3.00 -0.29 -1.04 118.95 124.59 1ub6 s ARG 99 Ca -0.02 -2.54 0.25 0.00 -1.00 0.00 0.00 55.73 52.42 1ub6 s ARG 99 Cb -0.04 -4.16 0.65 0.00 0.00 0.00 0.00 34.95 31.40 1ub6 s ARG 99 CO -0.02 -1.25 1.71 0.78 0.00 0.00 0.00 175.30 176.53 1ub6 h GLY 100 N 7.42 0.00 -3.18 8.12 0.00 -1.81 -2.00 103.07 111.62 1ub6 h GLY 100 Ca 0.07 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.88 1ub6 h GLY 100 CO 0.74 0.00 0.55 1.20 0.00 0.00 0.00 176.54 179.03 1ub6 s GLN 101 N -3.21 3.94 6.06 4.80 -0.21 -1.26 -4.24 119.66 125.53 1ub6 s GLN 101 Ca 0.08 1.98 0.00 0.00 0.02 0.00 0.00 55.36 57.44 1ub6 s GLN 101 Cb 0.09 -2.66 0.00 0.00 1.00 0.00 0.00 33.01 31.44 1ub6 s GLN 101 CO 0.61 -0.46 0.00 0.41 -2.12 0.00 0.00 175.29 173.73 1ub6 n GLY 102 N 0.64 1.41 3.46 3.09 0.00 -1.26 -4.14 105.19 108.38 1ub6 n GLY 102 Ca 0.05 0.35 -0.44 0.00 0.00 0.00 0.00 46.02 45.98 1ub6 n GLY 102 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1ub6 s ARG 103 N 0.00 3.10 0.30 1.61 3.00 -1.26 -5.04 118.95 120.66 1ub6 s ARG 103 Ca 0.00 -0.88 -0.30 0.00 -1.00 0.00 0.00 55.73 53.56 1ub6 s ARG 103 Cb 0.00 -4.05 -0.11 0.00 0.00 0.00 0.00 34.95 30.79 1ub6 s ARG 103 CO 0.00 -1.04 1.55 -2.14 0.00 0.00 0.00 175.30 173.66 1ub6 s PRO 104 N 2.31 4.15 0.01 5.12 0.02 -1.26 -4.86 135.00 140.49 1ub6 s PRO 104 Ca 0.13 2.52 0.05 0.00 0.02 0.00 0.00 61.00 63.72 1ub6 s PRO 104 Cb -0.19 -3.03 -0.02 0.00 0.02 0.00 0.00 34.50 31.28 1ub6 s PRO 104 CO 0.12 -0.57 -0.17 0.71 -0.33 0.00 0.00 177.00 176.76 1ub6 s TYR 105 N -0.16 1.47 0.10 6.54 2.02 -0.75 -5.00 117.35 121.57 1ub6 s TYR 105 Ca 0.61 -0.31 -0.08 0.00 -0.37 0.00 0.00 57.07 56.92 1ub6 s TYR 105 Cb -0.46 -0.92 -0.00 0.00 -0.40 0.00 0.00 41.96 40.17 1ub6 s TYR 105 CO 0.49 0.01 0.20 1.67 -1.57 0.00 0.00 175.55 176.34 1ub6 s TRP 106 N -0.55 0.22 0.00 2.71 -2.14 -1.26 -1.13 118.94 116.78 1ub6 s TRP 106 Ca 0.06 -0.64 0.00 0.00 2.66 0.00 0.00 56.10 58.18 1ub6 s TRP 106 Cb -0.07 -0.08 0.00 0.00 -3.10 0.00 0.00 33.47 30.22 1ub6 s TRP 106 CO 0.00 -0.57 0.00 0.41 -2.66 0.00 0.00 176.95 174.13 1ub6 n GLY 107 N -0.08 -0.41 0.19 3.67 0.00 -1.06 -4.57 105.19 102.91 1ub6 n GLY 107 Ca -0.14 -1.77 0.12 0.00 0.00 0.00 0.00 46.02 44.24 1ub6 n GLY 107 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1ub6 h GLN 108 N 0.00 0.00 0.00 1.61 1.08 -1.94 -3.47 115.11 112.39 1ub6 h GLN 108 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1ub6 h GLN 108 Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 1ub6 h GLN 108 CO 0.00 0.00 0.00 0.41 -0.95 0.00 0.00 178.83 178.29 1ub6 n GLY 109 N 1.16 0.63 2.97 3.46 0.00 -1.26 -5.05 105.19 107.10 1ub6 n GLY 109 Ca 0.04 -1.66 -0.22 0.00 0.00 0.00 0.00 46.02 44.19 1ub6 n GLY 109 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1ub6 s THR 110 N -2.77 0.82 0.08 2.61 -1.32 -0.71 -4.82 115.64 109.53 1ub6 s THR 110 Ca 0.00 -0.32 -0.27 0.00 -1.21 0.00 0.00 61.69 59.89 1ub6 s THR 110 Cb 0.00 -0.77 -0.06 0.00 -1.51 0.00 0.00 72.50 70.17 1ub6 s THR 110 CO 0.00 0.28 0.84 -0.22 -2.21 0.00 0.00 174.62 173.31 1ub6 s LEU 111 N 0.57 4.48 -0.20 9.08 2.96 -1.26 -0.61 118.68 133.70 1ub6 s LEU 111 Ca -0.10 1.60 0.01 0.00 -0.22 0.00 0.00 54.13 55.42 1ub6 s LEU 111 Cb -0.13 -3.38 0.05 0.00 0.50 0.00 0.00 46.19 43.23 1ub6 s LEU 111 CO 0.01 -0.00 -0.09 -0.69 -1.32 0.00 0.00 176.35 174.26 1ub6 s VAL 112 N -0.11 1.57 -0.26 1.68 1.01 -0.13 -0.03 120.40 124.13 1ub6 s VAL 112 Ca 0.42 -1.01 -0.06 0.00 0.00 0.00 0.00 61.98 61.33 1ub6 s VAL 112 Cb -0.22 -1.69 -0.00 0.00 0.00 0.00 0.00 36.38 34.47 1ub6 s VAL 112 CO 0.26 0.12 0.03 -0.89 0.00 0.00 0.00 175.10 174.62 1ub6 s THR 113 N 1.42 3.76 -0.73 3.92 2.01 0.05 -1.62 115.64 124.46 1ub6 s THR 113 Ca -0.02 -0.58 -0.13 0.00 0.31 0.00 0.00 61.69 61.28 1ub6 s THR 113 Cb -0.17 -2.85 0.19 0.00 0.01 0.00 0.00 72.50 69.68 1ub6 s THR 113 CO -0.08 0.23 0.65 -0.69 -0.69 0.00 0.00 174.62 174.04 1ub6 s VAL 114 N 1.50 5.20 0.17 3.82 1.01 -1.26 -0.21 120.40 130.62 1ub6 s VAL 114 Ca 0.04 -2.32 -0.05 0.00 0.00 0.00 0.00 61.98 59.65 1ub6 s VAL 114 Cb -0.16 -4.26 -0.02 0.00 0.00 0.00 0.00 36.38 31.93 1ub6 s VAL 114 CO 0.00 -0.96 0.20 -0.55 0.00 0.00 0.00 175.10 173.79 1ub6 s SER 115 N 2.26 0.14 -0.14 3.32 0.15 -0.54 -4.49 113.70 114.39 1ub6 s SER 115 Ca 0.14 -1.08 0.15 0.00 0.70 0.00 0.00 55.95 55.86 1ub6 s SER 115 Cb -0.16 0.39 -0.21 0.00 -1.71 0.00 0.00 66.02 64.33 1ub6 s SER 115 CO -0.05 -0.85 0.10 0.00 1.20 0.00 0.00 173.24 173.63 1ub6 n ALA 116 N -0.20 1.74 -1.61 5.45 0.00 -1.26 -3.90 120.51 120.73 1ub6 n ALA 116 Ca -0.04 -1.00 -0.41 0.00 0.00 0.00 0.00 53.44 51.98 1ub6 n ALA 116 Cb 0.64 -0.17 0.01 0.00 0.00 0.00 0.00 19.45 19.93 1ub6 n ALA 116 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ub6 n ALA 117 N -2.54 0.16 -2.43 0.00 0.00 -1.26 -4.95 120.51 109.49 1ub6 n ALA 117 Ca -0.24 0.22 -0.42 0.00 0.00 0.00 0.00 53.44 53.01 1ub6 n ALA 117 Cb 0.96 -2.08 -0.03 0.00 0.00 0.00 0.00 19.45 18.30 1ub6 n ALA 117 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1ub6 s LYS 118 N -2.04 4.57 0.37 0.00 1.02 -1.26 -5.02 119.74 117.38 1ub6 s LYS 118 Ca 0.64 1.56 -0.27 0.00 0.02 0.00 0.00 55.97 57.92 1ub6 s LYS 118 Cb -0.55 -3.38 -0.09 0.00 -0.52 0.00 0.00 37.83 33.29 1ub6 s LYS 118 CO 0.56 -0.02 1.26 -0.08 -0.92 0.00 0.00 175.35 176.15 1ub6 s THR 119 N 0.57 2.85 -0.04 2.17 -1.32 -1.26 -4.81 115.64 113.80 1ub6 s THR 119 Ca 0.52 0.78 -0.04 0.00 -1.21 0.00 0.00 61.69 61.75 1ub6 s THR 119 Cb -0.25 -3.47 0.01 0.00 -1.51 0.00 0.00 72.50 67.28 1ub6 s THR 119 CO 0.30 0.14 0.10 0.42 -2.21 0.00 0.00 174.62 173.37 1ub6 s THR 120 N -1.25 0.01 0.88 5.08 -4.23 -1.26 -4.96 115.64 109.91 1ub6 s THR 120 Ca 0.53 -0.06 -0.11 0.00 -1.18 0.00 0.00 61.69 60.88 1ub6 s THR 120 Cb -0.36 -0.17 0.12 0.00 1.34 0.00 0.00 72.50 73.43 1ub6 s THR 120 CO 0.47 -0.03 1.10 -2.16 -0.54 0.00 0.00 174.62 173.46 1ub6 s PRO 121 N -0.05 1.39 0.23 3.99 0.04 -1.26 -2.99 135.00 136.34 1ub6 s PRO 121 Ca -0.01 1.07 -0.16 0.00 0.04 0.00 0.00 61.00 61.94 1ub6 s PRO 121 Cb -0.01 -1.81 -0.08 0.00 0.04 0.00 0.00 34.50 32.64 1ub6 s PRO 121 CO 0.00 -2.22 0.66 -1.25 0.04 0.00 0.00 177.00 174.23 1ub6 s PRO 122 N -4.84 4.05 -0.30 0.56 0.04 -1.26 -4.15 135.00 129.10 1ub6 s PRO 122 Ca 0.64 0.64 -0.13 0.00 0.04 0.00 0.00 61.00 62.18 1ub6 s PRO 122 Cb -0.19 -2.74 -0.03 0.00 0.04 0.00 0.00 34.50 31.57 1ub6 s PRO 122 CO 0.57 0.34 0.26 -1.12 0.04 0.00 0.00 177.00 177.09 1ub6 s SER 123 N -1.93 6.09 -0.24 6.66 0.01 0.22 -4.95 113.70 119.56 1ub6 s SER 123 Ca 0.45 -0.10 -0.11 0.00 1.31 0.00 0.00 55.95 57.51 1ub6 s SER 123 Cb -0.14 -2.15 -0.05 0.00 0.21 0.00 0.00 66.02 63.89 1ub6 s SER 123 CO 0.20 -0.16 0.18 -0.69 0.41 0.00 0.00 173.24 173.18 1ub6 s VAL 124 N 1.84 5.34 -0.11 3.43 1.01 -1.26 -1.60 120.40 129.06 1ub6 s VAL 124 Ca 0.09 0.23 0.03 0.00 0.00 0.00 0.00 61.98 62.33 1ub6 s VAL 124 Cb -0.16 -3.52 0.00 0.00 0.00 0.00 0.00 36.38 32.70 1ub6 s VAL 124 CO 0.11 0.33 -0.23 -0.31 0.00 0.00 0.00 175.10 175.01 1ub6 s TYR 125 N 1.09 2.50 0.25 5.22 2.02 0.16 -4.96 117.35 123.64 1ub6 s TYR 125 Ca 0.09 -1.08 -0.30 0.00 -0.37 0.00 0.00 57.07 55.41 1ub6 s TYR 125 Cb -0.14 -1.68 -0.09 0.00 -0.40 0.00 0.00 41.96 39.65 1ub6 s TYR 125 CO 0.05 -0.45 1.05 -1.25 -1.57 0.00 0.00 175.55 173.38 1ub6 s PRO 126 N 0.48 4.70 -0.44 -1.71 0.04 -1.26 0.52 135.00 137.33 1ub6 s PRO 126 Ca -0.16 1.70 -0.01 0.00 0.04 0.00 0.00 61.00 62.57 1ub6 s PRO 126 Cb -0.17 -3.23 0.12 0.00 0.04 0.00 0.00 34.50 31.26 1ub6 s PRO 126 CO 0.06 0.28 0.22 0.00 0.04 0.00 0.00 177.00 177.60 1ub6 s ALA 127 N -1.03 3.19 0.18 8.56 0.00 0.29 -4.86 121.76 128.09 1ub6 s ALA 127 Ca 0.44 -2.73 0.10 0.00 0.00 0.00 0.00 51.96 49.78 1ub6 s ALA 127 Cb -0.30 -2.35 -0.04 0.00 0.00 0.00 0.00 23.12 20.43 1ub6 s ALA 127 CO 0.38 -1.85 -0.21 0.00 0.00 0.00 0.00 175.76 174.07 1ub6 s ALA 128 N 0.76 2.30 -0.02 0.00 0.00 -1.26 -1.42 121.76 122.12 1ub6 s ALA 128 Ca 0.11 -1.58 -0.30 0.00 0.00 0.00 0.00 51.96 50.19 1ub6 s ALA 128 Cb -0.22 -0.26 -0.08 0.00 0.00 0.00 0.00 23.12 22.56 1ub6 s ALA 128 CO -0.05 0.33 2.01 -1.25 0.00 0.00 0.00 175.76 176.81 1ub6 s PRO 129 N -2.76 3.93 0.00 0.00 0.04 -1.26 -4.98 135.00 129.96 1ub6 s PRO 129 Ca 0.19 2.48 0.00 0.00 0.04 0.00 0.00 61.00 63.70 1ub6 s PRO 129 Cb -0.07 -4.20 0.00 0.00 0.04 0.00 0.00 34.50 30.27 1ub6 s PRO 129 CO 0.09 -1.20 0.00 0.41 0.04 0.00 0.00 177.00 176.34 1ub6 n GLY 130 N 4.79 -0.50 3.49 0.56 0.00 -1.26 -4.98 105.19 107.29 1ub6 n GLY 130 Ca 0.22 -0.69 -0.38 0.00 0.00 0.00 0.00 46.02 45.17 1ub6 n GLY 130 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ub6 n GLY 132 N 5.00 0.02 3.32 0.00 0.00 -1.26 -5.12 105.19 107.14 1ub6 n GLY 132 Ca -0.14 -0.35 -0.13 0.00 0.00 0.00 0.00 46.02 45.39 1ub6 n GLY 132 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ub6 s ASP 133 N -1.96 -0.41 -0.19 1.61 1.01 -1.26 -5.11 116.67 110.35 1ub6 s ASP 133 Ca 0.00 0.72 -0.28 0.00 0.71 0.00 0.00 52.55 53.69 1ub6 s ASP 133 Cb 0.00 0.76 -0.05 0.00 1.01 0.00 0.00 42.92 44.64 1ub6 s ASP 133 CO 0.00 -0.23 2.09 0.28 0.21 0.00 0.00 175.17 177.52 1ub6 s THR 134 N -0.14 3.11 0.00 -1.27 -1.32 -1.26 -4.90 115.64 109.86 1ub6 s THR 134 Ca -0.03 0.12 0.00 0.00 -1.21 0.00 0.00 61.69 60.57 1ub6 s THR 134 Cb -0.03 -3.13 0.00 0.00 -1.51 0.00 0.00 72.50 67.83 1ub6 s THR 134 CO 0.02 -0.07 0.00 0.35 -2.21 0.00 0.00 174.62 172.70 1ub6 n THR 135 N 7.29 0.00 0.00 5.08 -2.24 -1.26 -4.94 114.28 118.21 1ub6 n THR 135 Ca 0.27 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.05 1ub6 n THR 135 Cb 0.45 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.68 1ub6 n THR 135 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ub6 n GLY 136 N 3.50 2.16 3.52 3.38 0.00 -1.26 -4.75 105.19 111.75 1ub6 n GLY 136 Ca 0.00 -0.11 -0.33 0.00 0.00 0.00 0.00 46.02 45.58 1ub6 n GLY 136 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1ub6 n SER 137 N 10.03 0.96 -2.21 1.61 2.88 -1.26 -0.89 113.62 124.74 1ub6 n SER 137 Ca 0.00 -0.37 0.00 0.00 -1.33 0.00 0.00 58.87 57.17 1ub6 n SER 137 Cb 0.00 -1.20 0.00 0.00 -0.75 0.00 0.00 64.21 62.26 1ub6 n SER 137 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1ub6 n SER 138 N 12.79 -8.26 -4.53 -3.46 7.64 -1.25 -4.86 113.62 111.70 1ub6 n SER 138 Ca 0.54 1.62 -0.26 0.00 1.01 0.00 0.00 58.87 61.77 1ub6 n SER 138 Cb 0.28 -4.77 -0.10 0.00 -1.01 0.00 0.00 64.21 58.61 1ub6 n SER 138 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1ub6 s VAL 139 N -0.50 2.95 -0.34 0.44 0.11 0.17 -4.87 120.40 118.35 1ub6 s VAL 139 Ca 0.00 -1.80 -0.12 0.00 -2.93 0.00 0.00 61.98 57.13 1ub6 s VAL 139 Cb 0.00 -2.46 -0.00 0.00 -1.53 0.00 0.00 36.38 32.38 1ub6 s VAL 139 CO 0.00 -0.14 0.21 -0.89 -3.33 0.00 0.00 175.10 170.95 1ub6 s THR 140 N -1.76 4.91 0.23 5.04 2.01 -1.26 -2.34 115.64 122.46 1ub6 s THR 140 Ca 0.24 -0.44 0.09 0.00 0.31 0.00 0.00 61.69 61.90 1ub6 s THR 140 Cb -0.08 -3.57 -0.04 0.00 0.01 0.00 0.00 72.50 68.82 1ub6 s THR 140 CO 0.14 -0.04 -0.05 -0.76 -0.69 0.00 0.00 174.62 173.22 1ub6 s LEU 141 N 1.65 3.08 0.14 4.42 1.43 0.46 -4.68 118.68 125.18 1ub6 s LEU 141 Ca 0.05 -0.63 -0.25 0.00 -1.03 0.00 0.00 54.13 52.26 1ub6 s LEU 141 Cb -0.18 -1.67 0.07 0.00 0.03 0.00 0.00 46.19 44.44 1ub6 s LEU 141 CO 0.08 0.05 0.98 -0.83 0.23 0.00 0.00 176.35 176.86 1ub6 s GLY 142 N -3.32 -0.24 -0.06 -3.19 0.00 -0.50 0.14 107.32 100.15 1ub6 s GLY 142 Ca 0.29 0.15 0.02 0.00 0.00 0.00 0.00 44.72 45.18 1ub6 s GLY 142 CO 0.18 0.01 -0.11 0.00 0.00 0.00 0.00 173.10 173.18 1ub6 s LEU 144 N 0.63 4.19 -0.28 0.00 2.96 0.18 -1.88 118.68 124.49 1ub6 s LEU 144 Ca -0.13 0.29 0.03 0.00 -0.22 0.00 0.00 54.13 54.11 1ub6 s LEU 144 Cb -0.15 -2.20 0.07 0.00 0.50 0.00 0.00 46.19 44.41 1ub6 s LEU 144 CO 0.03 0.10 -0.07 -0.69 -1.32 0.00 0.00 176.35 174.40 1ub6 s VAL 145 N 0.68 2.19 0.20 1.68 1.01 0.08 0.39 120.40 126.63 1ub6 s VAL 145 Ca 0.11 -1.81 0.03 0.00 0.00 0.00 0.00 61.98 60.31 1ub6 s VAL 145 Cb -0.13 -2.38 -0.05 0.00 0.00 0.00 0.00 36.38 33.83 1ub6 s VAL 145 CO 0.02 -0.17 0.00 -1.59 0.00 0.00 0.00 175.10 173.36 1ub6 s LYS 146 N 1.05 1.23 0.00 2.72 -2.85 -0.63 -0.74 119.74 120.52 1ub6 s LYS 146 Ca -0.04 -1.61 0.00 0.00 -1.00 0.00 0.00 55.97 53.32 1ub6 s LYS 146 Cb -0.20 -0.44 0.00 0.00 -2.06 0.00 0.00 37.83 35.13 1ub6 s LYS 146 CO -0.06 -0.12 0.00 0.41 0.10 0.00 0.00 175.35 175.69 1ub6 n GLY 147 N -0.34 0.44 3.60 0.59 0.00 -0.99 -0.61 105.19 107.88 1ub6 n GLY 147 Ca -0.06 -0.97 -0.24 0.00 0.00 0.00 0.00 46.02 44.76 1ub6 n GLY 147 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ub6 s TYR 148 N -2.00 2.56 0.00 1.61 1.13 -1.18 -4.57 117.35 114.89 1ub6 s TYR 148 Ca 0.00 -0.32 0.00 0.00 -1.41 0.00 0.00 57.07 55.34 1ub6 s TYR 148 Cb 0.00 -1.26 0.00 0.00 -1.10 0.00 0.00 41.96 39.60 1ub6 s TYR 148 CO 0.00 0.59 0.00 0.34 -2.51 0.00 0.00 175.55 173.97 1ub6 n PHE 149 N -0.86 0.00 -1.51 -3.49 7.35 -1.16 0.53 117.46 118.32 1ub6 n PHE 149 Ca -0.05 0.00 -0.40 0.00 -0.76 0.00 0.00 57.45 56.23 1ub6 n PHE 149 Cb 0.60 0.00 -0.12 0.00 0.35 0.00 0.00 39.48 40.31 1ub6 n PHE 149 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 1ub6 n PRO 150 N -0.87 0.23 -0.32 -7.13 -0.04 -1.26 -4.65 135.00 120.96 1ub6 n PRO 150 Ca 0.00 0.00 0.23 0.00 -0.04 0.00 0.00 63.50 63.69 1ub6 n PRO 150 Cb 0.00 -1.93 0.42 0.00 -0.04 0.00 0.00 33.50 31.96 1ub6 n PRO 150 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1ub6 n GLU 151 N 8.59 -0.07 -1.50 0.54 2.13 -1.26 -4.47 120.64 124.60 1ub6 n GLU 151 Ca 0.59 1.36 -0.41 0.00 0.66 0.00 0.00 57.16 59.37 1ub6 n GLU 151 Cb 0.14 -2.31 -0.12 0.00 0.27 0.00 0.00 31.44 29.42 1ub6 n GLU 151 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 1ub6 n SER 152 N -5.27 0.79 -3.78 4.31 3.41 -1.26 -4.86 113.62 106.95 1ub6 n SER 152 Ca 0.29 0.05 -0.13 0.00 -0.26 0.00 0.00 58.87 58.83 1ub6 n SER 152 Cb 0.99 -1.07 -0.11 0.00 -0.26 0.00 0.00 64.21 63.75 1ub6 n SER 152 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1ub6 s VAL 153 N 9.58 0.01 -0.04 -3.33 0.11 -1.26 -4.56 120.40 120.90 1ub6 s VAL 153 Ca 1.27 -0.05 0.02 0.00 -2.93 0.00 0.00 61.98 60.29 1ub6 s VAL 153 Cb -1.02 -0.39 0.01 0.00 -1.53 0.00 0.00 36.38 33.45 1ub6 s VAL 153 CO 0.45 -0.03 -0.08 0.28 -3.33 0.00 0.00 175.10 172.38 1ub6 s THR 154 N 0.02 0.80 -0.10 5.04 -1.32 -0.36 -4.99 115.64 114.72 1ub6 s THR 154 Ca -0.01 -0.32 -0.02 0.00 -1.21 0.00 0.00 61.69 60.12 1ub6 s THR 154 Cb -0.02 -0.74 -0.03 0.00 -1.51 0.00 0.00 72.50 70.19 1ub6 s THR 154 CO 0.01 0.27 -0.00 -0.69 -2.21 0.00 0.00 174.62 171.99 1ub6 s VAL 155 N 0.52 4.25 -0.03 5.08 1.01 -1.26 -0.10 120.40 129.86 1ub6 s VAL 155 Ca -0.09 -0.26 0.02 0.00 0.00 0.00 0.00 61.98 61.65 1ub6 s VAL 155 Cb -0.12 -2.81 0.01 0.00 0.00 0.00 0.00 36.38 33.46 1ub6 s VAL 155 CO 0.01 0.57 -0.08 -0.89 0.00 0.00 0.00 175.10 174.72 1ub6 s THR 156 N -0.56 0.70 -0.50 3.92 2.01 0.82 -4.94 115.64 117.09 1ub6 s THR 156 Ca 0.09 -0.29 -0.07 0.00 0.31 0.00 0.00 61.69 61.73 1ub6 s THR 156 Cb -0.12 -0.64 0.13 0.00 0.01 0.00 0.00 72.50 71.88 1ub6 s THR 156 CO 0.02 0.23 0.35 0.26 -0.69 0.00 0.00 174.62 174.80 1ub6 s TRP 157 N 0.38 3.48 0.00 4.92 0.52 -1.26 0.19 118.94 127.17 1ub6 s TRP 157 Ca -0.06 -2.11 0.00 0.00 0.02 0.00 0.00 56.10 53.95 1ub6 s TRP 157 Cb -0.10 -3.42 0.00 0.00 -1.15 0.00 0.00 33.47 28.80 1ub6 s TRP 157 CO 0.01 -0.97 0.00 0.09 0.02 0.00 0.00 176.95 176.09 1ub6 n ASN 158 N 4.60 0.00 -0.12 2.95 3.02 -1.13 -2.01 115.26 122.57 1ub6 n ASN 158 Ca -0.03 0.00 -0.02 0.00 -0.03 0.00 0.00 54.58 54.50 1ub6 n ASN 158 Cb 0.41 -2.04 -0.01 0.00 -0.61 0.00 0.00 39.78 37.53 1ub6 n ASN 158 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1ub6 n SER 159 N 0.00 -3.31 -3.05 6.41 7.64 -1.26 -4.96 113.62 115.10 1ub6 n SER 159 Ca 0.00 0.04 -0.19 0.00 1.01 0.00 0.00 58.87 59.73 1ub6 n SER 159 Cb 0.00 -0.94 -0.03 0.00 -1.01 0.00 0.00 64.21 62.23 1ub6 n SER 159 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ub6 n GLY 160 N -2.65 1.85 3.17 0.23 0.00 -0.85 -5.12 105.19 101.83 1ub6 n GLY 160 Ca -0.02 -0.97 -0.29 0.00 0.00 0.00 0.00 46.02 44.75 1ub6 n GLY 160 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ub6 s GLY 161 N -1.26 1.11 0.00 -0.02 0.00 -1.26 -4.96 107.32 100.93 1ub6 s GLY 161 Ca 0.34 -0.81 0.00 0.00 0.00 0.00 0.00 44.72 44.25 1ub6 s GLY 161 CO -0.16 -0.34 0.00 1.44 0.00 0.00 0.00 173.10 174.05 1ub6 n SER 164 N 3.32 4.90 -2.04 1.64 7.64 -1.26 -4.61 113.62 123.21 1ub6 n SER 164 Ca -0.19 0.00 -0.19 0.00 1.01 0.00 0.00 58.87 59.50 1ub6 n SER 164 Cb 0.52 0.85 0.19 0.00 -1.01 0.00 0.00 64.21 64.76 1ub6 n SER 164 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1ub6 n SER 165 N -1.61 3.65 -4.85 6.43 3.41 -1.26 -4.98 113.62 114.41 1ub6 n SER 165 Ca 0.00 -3.60 -0.32 0.00 -0.26 0.00 0.00 58.87 54.69 1ub6 n SER 165 Cb 0.13 -0.80 -0.05 0.00 -0.26 0.00 0.00 64.21 63.24 1ub6 n SER 165 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1ub6 s VAL 166 N -3.26 4.60 -0.35 -3.33 1.01 -1.26 -3.47 120.40 114.33 1ub6 s VAL 166 Ca 0.55 1.06 0.01 0.00 0.00 0.00 0.00 61.98 63.60 1ub6 s VAL 166 Cb 0.46 -3.67 0.14 0.00 0.00 0.00 0.00 36.38 33.32 1ub6 s VAL 166 CO 0.09 -0.43 0.28 -1.00 0.00 0.00 0.00 175.10 174.04 1ub6 s HIS 167 N -2.30 0.21 -0.33 5.22 3.76 0.23 -4.99 115.29 117.09 1ub6 s HIS 167 Ca 0.56 -1.16 -0.20 0.00 -0.15 0.00 0.00 55.06 54.12 1ub6 s HIS 167 Cb -0.10 -0.68 -0.01 0.00 1.11 0.00 0.00 32.58 32.91 1ub6 s HIS 167 CO 0.24 -0.89 0.60 0.99 -0.85 0.00 0.00 174.74 174.82 1ub6 s THR 168 N 1.36 4.95 0.14 1.30 2.01 -1.26 -1.41 115.64 122.72 1ub6 s THR 168 Ca 0.16 0.68 -0.19 0.00 0.31 0.00 0.00 61.69 62.65 1ub6 s THR 168 Cb -0.19 -4.00 -0.07 0.00 0.01 0.00 0.00 72.50 68.25 1ub6 s THR 168 CO -0.05 -0.19 0.63 -0.36 -0.69 0.00 0.00 174.62 173.96 1ub6 s PHE 169 N 2.57 3.74 0.50 4.92 0.08 -0.58 -5.02 117.98 124.19 1ub6 s PHE 169 Ca 0.23 1.30 -0.22 0.00 0.12 0.00 0.00 56.93 58.36 1ub6 s PHE 169 Cb -0.15 -2.53 -0.08 0.00 -0.57 0.00 0.00 43.02 39.69 1ub6 s PHE 169 CO 0.13 0.48 1.10 -2.30 -0.10 0.00 0.00 175.22 174.53 1ub6 n PRO 170 N 1.25 1.38 -2.78 0.24 -0.02 -1.26 -4.28 135.00 129.53 1ub6 n PRO 170 Ca -0.07 0.50 -0.40 0.00 -2.02 0.00 0.00 63.50 61.51 1ub6 n PRO 170 Cb 0.51 -2.23 -0.05 0.00 -0.02 0.00 0.00 33.50 31.70 1ub6 n PRO 170 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ub6 s ALA 171 N -1.34 3.31 -0.06 3.55 0.00 -1.26 -4.75 121.76 121.21 1ub6 s ALA 171 Ca 0.68 0.55 0.02 0.00 0.00 0.00 0.00 51.96 53.21 1ub6 s ALA 171 Cb -0.48 -3.20 -0.03 0.00 0.00 0.00 0.00 23.12 19.41 1ub6 s ALA 171 CO 0.53 0.10 -0.09 -0.51 0.00 0.00 0.00 175.76 175.78 1ub6 s LEU 172 N -0.56 3.02 -0.11 0.00 1.43 -0.37 -4.89 118.68 117.21 1ub6 s LEU 172 Ca 0.43 -0.09 -0.23 0.00 -1.03 0.00 0.00 54.13 53.21 1ub6 s LEU 172 Cb -0.24 -1.65 -0.03 0.00 0.03 0.00 0.00 46.19 44.30 1ub6 s LEU 172 CO 0.30 0.35 0.70 -0.22 0.23 0.00 0.00 176.35 177.71 1ub6 s LEU 173 N -0.84 4.26 -0.09 1.79 2.96 -1.26 -1.27 118.68 124.23 1ub6 s LEU 173 Ca 0.12 1.10 -0.01 0.00 -0.22 0.00 0.00 54.13 55.12 1ub6 s LEU 173 Cb -0.11 -3.05 0.03 0.00 0.50 0.00 0.00 46.19 43.56 1ub6 s LEU 173 CO 0.02 -0.19 0.00 -1.58 -1.32 0.00 0.00 176.35 173.28 1ub6 s GLN 174 N 1.22 0.65 -1.43 1.98 0.74 0.16 -4.82 119.66 118.15 1ub6 s GLN 174 Ca 0.35 0.03 -0.09 0.00 0.05 0.00 0.00 55.36 55.70 1ub6 s GLN 174 Cb -0.17 -1.13 0.06 0.00 1.10 0.00 0.00 33.01 32.86 1ub6 s GLN 174 CO 0.15 -0.34 0.68 0.43 -0.55 0.00 0.00 175.29 175.66 1ub6 n SER 175 N 5.13 -4.79 0.00 6.67 7.64 -1.26 -0.85 113.62 126.16 1ub6 n SER 175 Ca -0.08 -0.47 0.00 0.00 1.01 0.00 0.00 58.87 59.34 1ub6 n SER 175 Cb 0.50 -3.88 0.00 0.00 -1.01 0.00 0.00 64.21 59.82 1ub6 n SER 175 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ub6 n GLY 176 N -1.44 2.44 3.66 0.23 0.00 -1.26 -5.02 105.19 103.80 1ub6 n GLY 176 Ca -0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.68 1ub6 n GLY 176 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ub6 s LEU 177 N 0.00 3.40 0.15 0.99 1.43 -0.03 -4.84 118.68 119.78 1ub6 s LEU 177 Ca 0.00 -0.10 -0.14 0.00 -1.03 0.00 0.00 54.13 52.86 1ub6 s LEU 177 Cb 0.00 -2.01 -0.07 0.00 0.03 0.00 0.00 46.19 44.14 1ub6 s LEU 177 CO 0.00 0.25 0.55 -0.31 0.23 0.00 0.00 176.35 177.07 1ub6 s TYR 178 N -1.13 3.59 -0.03 0.29 2.02 0.19 0.35 117.35 122.63 1ub6 s TYR 178 Ca 0.21 1.06 -0.01 0.00 -0.37 0.00 0.00 57.07 57.95 1ub6 s TYR 178 Cb -0.11 -2.37 0.03 0.00 -0.40 0.00 0.00 41.96 39.11 1ub6 s TYR 178 CO 0.12 0.41 0.06 0.99 -1.57 0.00 0.00 175.55 175.56 1ub6 s THR 179 N -1.49 -0.08 0.05 -0.71 2.01 -0.40 -2.35 115.64 112.67 1ub6 s THR 179 Ca 0.39 0.27 -0.03 0.00 0.31 0.00 0.00 61.69 62.63 1ub6 s THR 179 Cb -0.15 -0.13 -0.03 0.00 0.01 0.00 0.00 72.50 72.21 1ub6 s THR 179 CO 0.19 0.11 0.03 0.00 -0.69 0.00 0.00 174.62 174.27 1ub6 s MET 180 N 1.41 0.61 0.27 4.92 0.23 0.08 -1.23 119.30 125.59 1ub6 s MET 180 Ca -0.05 -1.02 0.06 0.00 -1.03 0.00 0.00 55.69 53.65 1ub6 s MET 180 Cb -0.13 0.23 -0.06 0.00 -1.53 0.00 0.00 34.83 33.34 1ub6 s MET 180 CO -0.04 -0.14 -0.05 -1.54 -2.03 0.00 0.00 175.02 171.23 1ub6 s SER 181 N -2.59 2.59 -0.14 -1.18 1.04 -1.26 -0.75 113.70 111.41 1ub6 s SER 181 Ca 0.02 -1.19 -0.06 0.00 0.48 0.00 0.00 55.95 55.20 1ub6 s SER 181 Cb 0.04 -0.14 0.06 0.00 0.10 0.00 0.00 66.02 66.09 1ub6 s SER 181 CO -0.08 -0.37 0.31 -0.55 0.98 0.00 0.00 173.24 173.53 1ub6 s SER 182 N -3.42 -0.02 0.15 7.02 0.15 -0.79 -1.52 113.70 115.27 1ub6 s SER 182 Ca 0.29 0.69 0.07 0.00 0.70 0.00 0.00 55.95 57.70 1ub6 s SER 182 Cb 0.04 0.75 -0.04 0.00 -1.71 0.00 0.00 66.02 65.06 1ub6 s SER 182 CO 0.11 -0.21 -0.04 -0.94 1.20 0.00 0.00 173.24 173.36 1ub6 s SER 183 N 2.03 4.62 0.11 5.45 1.04 -0.50 -1.00 113.70 125.45 1ub6 s SER 183 Ca -0.03 -0.40 0.01 0.00 0.48 0.00 0.00 55.95 56.01 1ub6 s SER 183 Cb -0.11 -0.94 -0.04 0.00 0.10 0.00 0.00 66.02 65.02 1ub6 s SER 183 CO -0.10 0.12 -0.02 0.54 0.98 0.00 0.00 173.24 174.76 1ub6 s VAL 184 N -1.54 0.47 -0.07 5.02 0.11 0.36 -0.60 120.40 124.15 1ub6 s VAL 184 Ca 0.25 -1.91 -0.04 0.00 -2.93 0.00 0.00 61.98 57.35 1ub6 s VAL 184 Cb -0.10 -1.80 0.03 0.00 -1.53 0.00 0.00 36.38 32.99 1ub6 s VAL 184 CO 0.17 -0.75 0.16 0.42 -3.33 0.00 0.00 175.10 171.76 1ub6 s THR 185 N -3.78 -0.03 0.05 5.04 -4.23 -1.23 -0.41 115.64 111.06 1ub6 s THR 185 Ca 0.15 0.11 -0.14 0.00 -1.18 0.00 0.00 61.69 60.64 1ub6 s THR 185 Cb 0.06 -0.25 0.02 0.00 1.34 0.00 0.00 72.50 73.67 1ub6 s THR 185 CO -0.03 0.04 0.30 0.68 -0.54 0.00 0.00 174.62 175.07 1ub6 s VAL 186 N 0.78 0.09 0.43 2.29 -7.23 -0.99 -4.79 120.40 110.98 1ub6 s VAL 186 Ca -0.06 -0.70 -0.24 0.00 -1.81 0.00 0.00 61.98 59.17 1ub6 s VAL 186 Cb -0.08 -0.97 -0.08 0.00 0.56 0.00 0.00 36.38 35.81 1ub6 s VAL 186 CO -0.04 -0.39 1.15 -2.16 -0.31 0.00 0.00 175.10 173.35 1ub6 s PRO 187 N -2.68 3.92 0.56 4.82 0.04 -1.26 0.41 135.00 140.80 1ub6 s PRO 187 Ca -0.04 1.76 0.28 0.00 0.04 0.00 0.00 61.00 63.04 1ub6 s PRO 187 Cb -0.00 -2.52 1.65 0.00 0.04 0.00 0.00 34.50 33.66 1ub6 s PRO 187 CO -0.04 -0.41 2.18 1.03 0.04 0.00 0.00 177.00 179.80 1ub6 h SER 188 N 2.32 0.00 -0.09 6.66 0.87 -1.34 -1.21 113.55 120.76 1ub6 h SER 188 Ca -0.49 0.00 0.03 0.00 -1.23 0.00 0.00 61.79 60.10 1ub6 h SER 188 Cb 1.24 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.19 1ub6 h SER 188 CO 0.61 0.05 0.26 0.77 -0.53 0.00 0.00 176.83 177.99 1ub6 h SER 189 N 0.00 0.00 0.00 6.23 4.64 -1.91 0.11 113.55 122.62 1ub6 h SER 189 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ub6 h SER 189 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 1ub6 h SER 189 CO 0.01 0.00 0.00 1.07 -0.87 0.00 0.00 176.83 177.04 1ub6 n THR 190 N -3.21 0.00 -0.25 2.95 5.66 -0.53 -4.78 114.28 114.13 1ub6 n THR 190 Ca -0.00 -0.48 0.05 0.00 -3.05 0.00 0.00 64.05 60.57 1ub6 n THR 190 Cb 0.34 1.03 0.16 0.00 -1.55 0.00 0.00 70.33 70.31 1ub6 n THR 190 CO 0.00 0.00 0.00 -0.25 -3.05 0.00 0.00 175.07 171.77 1ub6 h TRP 191 N 0.00 0.02 0.00 1.09 2.91 -0.02 -2.14 115.95 117.81 1ub6 h TRP 191 Ca 0.00 0.05 -0.15 0.00 1.13 0.00 0.00 58.89 59.92 1ub6 h TRP 191 Cb 0.02 0.11 -0.06 0.00 -0.51 0.00 0.00 29.16 28.71 1ub6 h TRP 191 CO 0.00 -0.20 -0.27 -0.35 -1.03 0.00 0.00 178.44 176.58 1ub6 n PRO 192 N -5.30 1.72 -0.90 2.65 -0.04 -1.26 -3.88 135.00 127.99 1ub6 n PRO 192 Ca 0.13 -0.82 0.05 0.00 -0.04 0.00 0.00 63.50 62.83 1ub6 n PRO 192 Cb 0.46 -1.87 0.10 0.00 -0.04 0.00 0.00 33.50 32.15 1ub6 n PRO 192 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1ub6 n SER 193 N 2.46 1.27 -2.42 3.54 7.64 -0.80 -5.09 113.62 120.21 1ub6 n SER 193 Ca 0.35 -2.79 -0.01 0.00 1.01 0.00 0.00 58.87 57.42 1ub6 n SER 193 Cb 0.79 -0.38 -0.01 0.00 -1.01 0.00 0.00 64.21 63.60 1ub6 n SER 193 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1ub6 n THR 195 N -0.35-13.27 -3.83 0.44 -2.24 -1.25 -5.01 114.28 88.77 1ub6 n THR 195 Ca 0.11 3.07 -0.36 0.00 -2.27 0.00 0.00 64.05 64.61 1ub6 n THR 195 Cb 0.87 -6.19 -0.13 0.00 -2.10 0.00 0.00 70.33 62.78 1ub6 n THR 195 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1ub6 s VAL 196 N -0.61 3.83 -0.04 2.28 1.01 -1.26 -5.04 120.40 120.57 1ub6 s VAL 196 Ca -0.07 -0.34 0.03 0.00 0.00 0.00 0.00 61.98 61.59 1ub6 s VAL 196 Cb 0.00 -2.77 0.01 0.00 0.00 0.00 0.00 36.38 33.62 1ub6 s VAL 196 CO 0.20 0.38 -0.11 0.28 0.00 0.00 0.00 175.10 175.85 1ub6 s THR 197 N 1.55 0.94 -0.15 3.92 -1.32 -1.26 -0.04 115.64 119.27 1ub6 s THR 197 Ca 0.06 -0.42 -0.05 0.00 -1.21 0.00 0.00 61.69 60.06 1ub6 s THR 197 Cb -0.15 -0.84 -0.04 0.00 -1.51 0.00 0.00 72.50 69.97 1ub6 s THR 197 CO 0.00 0.29 0.04 0.00 -2.21 0.00 0.00 174.62 172.74 1ub6 s SER 199 N -0.05 5.12 -0.30 0.00 0.15 0.51 -2.23 113.70 116.88 1ub6 s SER 199 Ca 0.05 -1.24 -0.15 0.00 0.70 0.00 0.00 55.95 55.30 1ub6 s SER 199 Cb -0.12 -1.79 -0.02 0.00 -1.71 0.00 0.00 66.02 62.37 1ub6 s SER 199 CO 0.01 -0.31 0.38 -0.69 1.20 0.00 0.00 173.24 173.84 1ub6 s VAL 200 N 1.32 5.16 -0.05 4.45 1.01 0.10 -0.13 120.40 132.26 1ub6 s VAL 200 Ca -0.03 0.36 -0.01 0.00 0.00 0.00 0.00 61.98 62.30 1ub6 s VAL 200 Cb -0.20 -3.77 -0.03 0.00 0.00 0.00 0.00 36.38 32.38 1ub6 s VAL 200 CO 0.01 0.03 0.02 0.00 0.00 0.00 0.00 175.10 175.15 1ub6 s ALA 201 N 2.09 3.35 -0.45 5.51 0.00 0.85 -0.45 121.76 132.66 1ub6 s ALA 201 Ca 0.14 -0.86 0.07 0.00 0.00 0.00 0.00 51.96 51.31 1ub6 s ALA 201 Cb -0.16 -1.47 0.23 0.00 0.00 0.00 0.00 23.12 21.73 1ub6 s ALA 201 CO 0.11 0.62 0.68 1.58 0.00 0.00 0.00 175.76 178.75 1ub6 n HIS 202 N 1.75 -1.99 -0.32 0.00 -0.00 -0.17 -1.22 115.22 113.27 1ub6 n HIS 202 Ca -0.17 -2.58 0.15 0.00 -0.00 0.00 0.00 57.72 55.12 1ub6 n HIS 202 Cb 0.53 0.68 0.30 0.00 -0.00 0.00 0.00 29.99 31.49 1ub6 n HIS 202 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1ub6 h PRO 203 N 4.23 0.05 0.00 1.57 0.13 -1.80 0.22 132.00 136.39 1ub6 h PRO 203 Ca -0.01 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 1ub6 h PRO 203 Cb 0.97 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.08 1ub6 h PRO 203 CO 0.36 0.03 0.02 0.00 -0.23 0.00 0.00 178.00 178.18 1ub6 n ALA 204 N -2.98 1.18 -0.13 -0.56 0.00 -1.26 0.10 120.51 116.87 1ub6 n ALA 204 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.67 1ub6 n ALA 204 Cb 0.75 -0.89 0.00 0.00 0.00 0.00 0.00 19.45 19.32 1ub6 n ALA 204 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1ub6 n SER 205 N -1.11 0.21 -2.20 0.00 2.88 0.71 -4.92 113.62 109.19 1ub6 n SER 205 Ca 0.00 -0.55 -0.20 0.00 -1.33 0.00 0.00 58.87 56.80 1ub6 n SER 205 Cb 0.02 0.41 -0.01 0.00 -0.75 0.00 0.00 64.21 63.88 1ub6 n SER 205 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ub6 n GLY 206 N 0.41 -0.31 3.46 0.46 0.00 0.28 -4.94 105.19 104.55 1ub6 n GLY 206 Ca 0.00 -0.06 -0.29 0.00 0.00 0.00 0.00 46.02 45.67 1ub6 n GLY 206 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ub6 s THR 207 N -2.97 2.69 -0.20 2.61 2.01 -1.17 -4.98 115.64 113.63 1ub6 s THR 207 Ca 0.00 -1.59 -0.04 0.00 0.31 0.00 0.00 61.69 60.37 1ub6 s THR 207 Cb 0.00 -2.23 0.10 0.00 0.01 0.00 0.00 72.50 70.37 1ub6 s THR 207 CO 0.00 0.08 0.25 -0.89 -0.69 0.00 0.00 174.62 173.38 1ub6 s THR 208 N -1.16 -0.39 -0.11 -0.82 2.01 -1.26 -1.00 115.64 112.92 1ub6 s THR 208 Ca 0.17 -0.04 -0.01 0.00 0.31 0.00 0.00 61.69 62.12 1ub6 s THR 208 Cb -0.10 -0.66 -0.03 0.00 0.01 0.00 0.00 72.50 71.72 1ub6 s THR 208 CO 0.09 -0.14 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.14 1ub6 s VAL 209 N 2.38 3.79 -0.08 3.82 1.01 0.40 -4.94 120.40 126.78 1ub6 s VAL 209 Ca 0.07 -0.42 0.02 0.00 0.00 0.00 0.00 61.98 61.64 1ub6 s VAL 209 Cb -0.15 -2.60 0.02 0.00 0.00 0.00 0.00 36.38 33.65 1ub6 s VAL 209 CO -0.12 0.56 -0.12 -1.81 0.00 0.00 0.00 175.10 173.61 1ub6 s ASP 210 N -0.32 1.91 -0.10 3.32 1.11 -1.26 0.01 116.67 121.34 1ub6 s ASP 210 Ca 0.05 -0.31 -0.00 0.00 0.18 0.00 0.00 52.55 52.46 1ub6 s ASP 210 Cb -0.12 -0.86 0.02 0.00 1.07 0.00 0.00 42.92 43.03 1ub6 s ASP 210 CO 0.02 0.01 -0.07 -0.54 1.18 0.00 0.00 175.17 175.77 1ub6 s LYS 211 N 0.88 1.41 -0.28 8.23 1.02 -0.95 -4.99 119.74 125.06 1ub6 s LYS 211 Ca -0.10 -0.22 -0.23 0.00 0.02 0.00 0.00 55.97 55.44 1ub6 s LYS 211 Cb -0.15 -1.46 -0.01 0.00 -0.52 0.00 0.00 37.83 35.69 1ub6 s LYS 211 CO 0.01 -0.23 0.75 0.15 -0.92 0.00 0.00 175.35 175.11 1ub6 s LYS 212 N 1.58 4.03 0.34 1.68 1.02 -1.26 -2.37 119.74 124.76 1ub6 s LYS 212 Ca 0.02 0.62 -0.29 0.00 0.02 0.00 0.00 55.97 56.34 1ub6 s LYS 212 Cb -0.13 -3.70 -0.10 0.00 -0.52 0.00 0.00 37.83 33.38 1ub6 s LYS 212 CO -0.06 -0.58 1.33 -0.51 -0.92 0.00 0.00 175.35 174.60 1ub6 s LEU 213 N 2.81 4.41 0.00 3.17 1.02 0.94 -4.96 118.68 126.06 1ub6 s LEU 213 Ca 0.31 2.73 0.00 0.00 0.02 0.00 0.00 54.13 57.19 1ub6 s LEU 213 Cb -0.15 -3.66 0.00 0.00 0.02 0.00 0.00 46.19 42.40 1ub6 s LEU 213 CO 0.11 -0.58 0.00 -0.62 0.02 0.00 0.00 176.35 175.27