#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ucd n ASP 2 N 0.00 0.29 -3.56 5.98 5.68 0.49 -4.90 116.55 120.53 1ucd n ASP 2 Ca 0.00 -0.65 -0.05 0.00 -0.50 0.00 0.00 54.79 53.60 1ucd n ASP 2 Cb 0.00 0.70 -0.00 0.00 -1.14 0.00 0.00 41.12 40.68 1ucd n ASP 2 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 1ucd s SER 3 N -0.70 -0.12 0.07 -1.12 1.04 -1.18 -2.72 113.70 108.97 1ucd s SER 3 Ca 0.00 -0.62 0.05 0.00 0.48 0.00 0.00 55.95 55.87 1ucd s SER 3 Cb 0.00 0.59 -0.03 0.00 0.10 0.00 0.00 66.02 66.68 1ucd s SER 3 CO 0.00 -1.13 -0.15 -0.36 0.98 0.00 0.00 173.24 172.59 1ucd s PHE 4 N -3.01 1.25 -0.30 5.02 0.40 0.80 0.11 117.98 122.25 1ucd s PHE 4 Ca 0.15 -0.43 -0.03 0.00 -0.60 0.00 0.00 56.93 56.01 1ucd s PHE 4 Cb -0.03 -0.71 0.04 0.00 0.51 0.00 0.00 43.02 42.83 1ucd s PHE 4 CO 0.05 0.06 0.02 -1.58 0.70 0.00 0.00 175.22 174.47 1ucd s TRP 5 N -1.17 3.23 -0.53 0.36 0.52 -0.14 -0.99 118.94 120.23 1ucd s TRP 5 Ca -0.01 -1.70 -0.20 0.00 0.02 0.00 0.00 56.10 54.21 1ucd s TRP 5 Cb -0.09 -2.14 0.06 0.00 -1.15 0.00 0.00 33.47 30.14 1ucd s TRP 5 CO 0.02 -0.77 0.70 0.12 0.02 0.00 0.00 176.95 177.04 1ucd s PHE 6 N 1.30 2.99 -0.31 -1.98 5.36 0.59 -0.07 117.98 125.86 1ucd s PHE 6 Ca -0.04 -0.50 -0.12 0.00 -0.96 0.00 0.00 56.93 55.31 1ucd s PHE 6 Cb -0.19 -3.70 -0.03 0.00 -0.34 0.00 0.00 43.02 38.75 1ucd s PHE 6 CO -0.00 -1.13 0.24 0.08 -1.46 0.00 0.00 175.22 172.94 1ucd s VAL 7 N 2.90 5.28 0.07 3.12 1.01 0.46 -0.99 120.40 132.25 1ucd s VAL 7 Ca 0.17 0.04 0.04 0.00 0.00 0.00 0.00 61.98 62.23 1ucd s VAL 7 Cb -0.19 -3.64 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 1ucd s VAL 7 CO 0.12 0.11 0.04 -1.10 0.00 0.00 0.00 175.10 174.27 1ucd s GLN 8 N 1.79 2.72 0.13 2.72 -0.21 -0.39 0.05 119.66 126.47 1ucd s GLN 8 Ca 0.08 -0.75 0.09 0.00 0.02 0.00 0.00 55.36 54.80 1ucd s GLN 8 Cb -0.17 -2.64 -0.04 0.00 1.00 0.00 0.00 33.01 31.17 1ucd s GLN 8 CO 0.11 0.56 -0.23 1.14 -2.12 0.00 0.00 175.29 174.75 1ucd s GLN 9 N -2.26 1.27 -0.54 2.91 -2.07 0.12 -1.02 119.66 118.07 1ucd s GLN 9 Ca 0.27 -1.29 -0.19 0.00 -1.82 0.00 0.00 55.36 52.33 1ucd s GLN 9 Cb -0.12 -1.57 0.08 0.00 -1.09 0.00 0.00 33.01 30.31 1ucd s GLN 9 CO 0.19 0.36 0.63 -0.46 -1.32 0.00 0.00 175.29 174.69 1ucd s TRP 10 N -1.33 3.06 0.24 9.60 -0.11 0.20 -1.43 118.94 129.16 1ucd s TRP 10 Ca 0.12 -0.76 -0.11 0.00 1.22 0.00 0.00 56.10 56.56 1ucd s TRP 10 Cb -0.09 -3.69 0.32 0.00 -1.50 0.00 0.00 33.47 28.51 1ucd s TRP 10 CO 0.06 -1.11 1.60 -1.35 -4.62 0.00 0.00 176.95 171.53 1ucd h PRO 11 N 9.04 0.00 -0.91 5.86 0.11 -1.75 -1.28 132.00 143.08 1ucd h PRO 11 Ca -0.28 -0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.85 1ucd h PRO 11 Cb 1.09 -0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.15 1ucd h PRO 11 CO 1.01 0.00 0.59 -1.35 -0.21 0.00 0.00 178.00 178.05 1ucd h PRO 12 N 0.00 1.14 -0.30 1.05 0.11 -1.56 0.05 132.00 132.50 1ucd h PRO 12 Ca 0.37 -0.07 -0.05 0.00 0.11 0.00 0.00 66.00 66.36 1ucd h PRO 12 Cb 0.56 -0.26 -0.01 0.00 0.11 0.00 0.00 31.00 31.41 1ucd h PRO 12 CO -0.78 0.76 -0.01 0.00 -0.21 0.00 0.00 178.00 177.76 1ucd h ALA 13 N 1.36 0.40 -0.60 -0.75 0.00 -1.61 0.24 119.26 118.29 1ucd h ALA 13 Ca 0.35 -0.24 0.02 0.00 0.00 0.00 0.00 54.91 55.04 1ucd h ALA 13 Cb -0.06 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.59 1ucd h ALA 13 CO -0.10 0.15 0.38 0.28 0.00 0.00 0.00 179.25 179.96 1ucd h VAL 14 N 0.32 1.10 0.00 0.00 2.07 -0.92 -1.52 116.25 117.29 1ucd h VAL 14 Ca 0.08 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.34 1ucd h VAL 14 Cb 0.44 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 30.49 1ucd h VAL 14 CO 0.02 0.14 0.00 0.00 0.02 0.00 0.00 177.57 177.74 1ucd h SER 16 N 0.00 0.00 0.69 0.00 4.64 0.56 -0.76 113.55 118.67 1ucd h SER 16 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ucd h SER 16 Cb 0.67 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.76 1ucd h SER 16 CO 0.00 0.00 -0.40 0.49 -0.87 0.00 0.00 176.83 176.05 1ucd n PHE 17 N -2.61 0.11 -3.00 4.77 3.01 -1.15 -4.53 117.46 114.06 1ucd n PHE 17 Ca -0.00 0.03 -0.44 0.00 1.01 0.00 0.00 57.45 58.05 1ucd n PHE 17 Cb 0.17 -0.38 -0.03 0.00 -0.01 0.00 0.00 39.48 39.23 1ucd n PHE 17 CO 0.00 0.00 0.00 -0.65 1.01 0.00 0.00 176.76 177.12 1ucd s GLN 18 N -3.03 3.39 0.05 -1.08 -1.52 -0.29 -4.87 119.66 112.30 1ucd s GLN 18 Ca 0.11 -1.57 0.17 0.00 -1.95 0.00 0.00 55.36 52.12 1ucd s GLN 18 Cb 0.17 -4.59 0.71 0.00 -0.22 0.00 0.00 33.01 29.08 1ucd s GLN 18 CO 0.66 -1.68 1.53 1.63 -0.25 0.00 0.00 175.29 177.18 1ucd n LYS 19 N 6.43 0.04 -3.85 2.91 4.76 -1.26 -4.78 118.16 122.41 1ucd n LYS 19 Ca 0.10 0.28 -0.10 0.00 -2.87 0.00 0.00 58.31 55.72 1ucd n LYS 19 Cb 0.47 -1.58 -0.08 0.00 -1.84 0.00 0.00 35.03 32.00 1ucd n LYS 19 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1ucd s SER 20 N -3.26 0.05 0.00 4.39 1.04 -1.26 -5.14 113.70 109.52 1ucd s SER 20 Ca 0.07 -0.42 0.00 0.00 0.48 0.00 0.00 55.95 56.08 1ucd s SER 20 Cb 0.10 0.30 0.00 0.00 0.10 0.00 0.00 66.02 66.51 1ucd s SER 20 CO 0.30 -0.59 0.00 0.61 0.98 0.00 0.00 173.24 174.54 1ucd n GLY 21 N 0.56 -1.67 3.79 7.32 0.00 -1.26 -4.95 105.19 108.99 1ucd n GLY 21 Ca -0.18 -1.54 -0.34 0.00 0.00 0.00 0.00 46.02 43.96 1ucd n GLY 21 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ucd s SER 22 N -4.44 5.70 -0.29 1.61 1.04 -1.26 -5.04 113.70 111.02 1ucd s SER 22 Ca 0.00 1.98 0.04 0.00 0.48 0.00 0.00 55.95 58.44 1ucd s SER 22 Cb 0.00 -2.56 0.20 0.00 0.10 0.00 0.00 66.02 63.76 1ucd s SER 22 CO 0.00 -1.23 0.65 0.00 0.98 0.00 0.00 173.24 173.64 1ucd h PRO 24 N 7.88 0.18 -0.08 0.00 0.11 -1.71 -1.16 132.00 137.23 1ucd h PRO 24 Ca -0.02 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 66.10 1ucd h PRO 24 Cb 1.19 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 1ucd h PRO 24 CO 0.12 0.12 0.09 0.78 -0.21 0.00 0.00 178.00 178.89 1ucd h GLY 25 N 0.19 0.00 1.71 -0.55 0.00 -1.18 -2.10 103.07 101.13 1ucd h GLY 25 Ca 0.57 0.00 0.04 0.00 0.00 0.00 0.00 47.33 47.94 1ucd h GLY 25 CO -0.15 0.00 0.11 1.76 0.00 0.00 0.00 176.54 178.26 1ucd h SER 26 N 0.00 0.00 -0.46 0.19 0.02 -1.39 -1.76 113.55 110.16 1ucd h SER 26 Ca 0.04 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1ucd h SER 26 Cb 0.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.75 1ucd h SER 26 CO -0.00 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.30 1ucd n GLY 27 N -1.53 3.06 3.08 -3.77 0.00 -0.79 -4.76 105.19 100.48 1ucd n GLY 27 Ca 0.00 -0.73 -0.35 0.00 0.00 0.00 0.00 46.02 44.94 1ucd n GLY 27 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ucd s LEU 28 N -1.74 5.11 -1.30 0.99 2.96 -0.72 -4.99 118.68 118.99 1ucd s LEU 28 Ca 0.39 -2.59 -0.07 0.00 -0.22 0.00 0.00 54.13 51.64 1ucd s LEU 28 Cb 0.26 -1.81 0.00 0.00 0.50 0.00 0.00 46.19 45.14 1ucd s LEU 28 CO 0.18 -0.41 2.73 0.54 -1.32 0.00 0.00 176.35 178.08 1ucd n ARG 29 N 3.81 3.92 -3.66 1.98 5.12 -1.26 -4.18 116.66 122.39 1ucd n ARG 29 Ca 0.04 -2.71 -0.14 0.00 -1.93 0.00 0.00 57.85 53.11 1ucd n ARG 29 Cb 0.38 -2.63 -0.08 0.00 -1.16 0.00 0.00 32.46 28.98 1ucd n ARG 29 CO 0.00 0.00 0.00 -0.08 -1.93 0.00 0.00 177.63 175.62 1ucd s THR 30 N 0.28 0.01 0.25 0.55 -1.32 -1.26 -5.12 115.64 109.02 1ucd s THR 30 Ca 0.62 -0.05 -0.30 0.00 -1.21 0.00 0.00 61.69 60.75 1ucd s THR 30 Cb 0.21 -0.82 -0.09 0.00 -1.51 0.00 0.00 72.50 70.28 1ucd s THR 30 CO -0.08 -0.03 1.28 -0.36 -2.21 0.00 0.00 174.62 173.22 1ucd s PHE 31 N -0.13 3.23 0.31 9.09 0.40 -1.26 -4.33 117.98 125.28 1ucd s PHE 31 Ca -0.03 1.34 0.06 0.00 -0.60 0.00 0.00 56.93 57.70 1ucd s PHE 31 Cb -0.03 -3.59 -0.06 0.00 0.51 0.00 0.00 43.02 39.84 1ucd s PHE 31 CO 0.03 -1.72 -0.02 0.95 0.70 0.00 0.00 175.22 175.16 1ucd s THR 32 N -0.47 1.55 -0.01 0.64 -4.23 -0.52 -4.92 115.64 107.68 1ucd s THR 32 Ca 0.53 -2.07 -0.30 0.00 -1.18 0.00 0.00 61.69 58.66 1ucd s THR 32 Cb -0.37 -2.61 -0.03 0.00 1.34 0.00 0.00 72.50 70.82 1ucd s THR 32 CO 0.44 -0.18 1.07 -0.63 -0.54 0.00 0.00 174.62 174.78 1ucd s ILE 33 N -3.06 4.56 -0.19 2.99 1.01 0.97 0.11 121.20 127.59 1ucd s ILE 33 Ca 0.32 1.84 -0.16 0.00 0.00 0.00 0.00 60.65 62.66 1ucd s ILE 33 Cb 0.06 -4.18 -0.12 0.00 0.01 0.00 0.00 42.46 38.23 1ucd s ILE 33 CO 0.14 0.10 -0.01 1.57 0.00 0.00 0.00 174.94 176.74 1ucd n HIS 34 N 4.23 0.86 -3.73 3.97 -0.00 0.11 -4.67 115.22 115.99 1ucd n HIS 34 Ca 0.08 0.37 0.01 0.00 -0.00 0.00 0.00 57.72 58.19 1ucd n HIS 34 Cb 0.49 -0.93 0.00 0.00 -0.00 0.00 0.00 29.99 29.54 1ucd n HIS 34 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.34 176.54 1ucd s GLY 35 N -4.66 -0.31 -0.28 1.57 0.00 -0.91 -4.96 107.32 97.77 1ucd s GLY 35 Ca -0.24 0.46 0.01 0.00 0.00 0.00 0.00 44.72 44.94 1ucd s GLY 35 CO 0.43 1.64 -0.06 -2.27 0.00 0.00 0.00 173.10 172.84 1ucd s LEU 36 N -3.21 3.65 -0.34 0.66 2.96 -1.26 -0.41 118.68 120.72 1ucd s LEU 36 Ca 0.18 -1.32 -0.08 0.00 -0.22 0.00 0.00 54.13 52.70 1ucd s LEU 36 Cb 0.03 -1.63 0.03 0.00 0.50 0.00 0.00 46.19 45.12 1ucd s LEU 36 CO -0.02 -0.22 0.13 0.26 -1.32 0.00 0.00 176.35 175.18 1ucd s TRP 37 N 1.18 3.24 0.49 5.38 0.51 0.89 -4.42 118.94 126.21 1ucd s TRP 37 Ca -0.07 -1.22 -0.23 0.00 -2.12 0.00 0.00 56.10 52.46 1ucd s TRP 37 Cb -0.20 -2.33 -0.07 0.00 -0.81 0.00 0.00 33.47 30.07 1ucd s TRP 37 CO -0.03 -0.68 1.32 -2.14 -0.51 0.00 0.00 176.95 174.90 1ucd s PRO 38 N 1.46 3.50 0.23 4.98 0.02 -1.26 -0.97 135.00 142.97 1ucd s PRO 38 Ca 0.00 2.15 0.09 0.00 0.02 0.00 0.00 61.00 63.27 1ucd s PRO 38 Cb -0.19 -2.44 -0.05 0.00 0.02 0.00 0.00 34.50 31.84 1ucd s PRO 38 CO 0.04 -0.87 -0.17 -0.65 -0.33 0.00 0.00 177.00 175.02 1ucd s GLN 39 N -2.67 1.45 -0.16 5.54 -1.52 0.12 -1.10 119.66 121.31 1ucd s GLN 39 Ca 0.66 -1.64 -0.06 0.00 -1.95 0.00 0.00 55.36 52.37 1ucd s GLN 39 Cb -0.38 -1.37 0.08 0.00 -0.22 0.00 0.00 33.01 31.12 1ucd s GLN 39 CO 0.47 0.24 0.34 -1.14 -0.25 0.00 0.00 175.29 174.95 1ucd s GLN 40 N -3.52 0.24 -1.41 2.91 2.00 0.11 -0.38 119.66 119.61 1ucd s GLN 40 Ca 0.25 0.89 -0.01 0.00 -2.00 0.00 0.00 55.36 54.49 1ucd s GLN 40 Cb -0.03 0.15 0.01 0.00 0.80 0.00 0.00 33.01 33.94 1ucd s GLN 40 CO 0.10 -0.27 0.44 0.43 -0.50 0.00 0.00 175.29 175.49 1ucd n SER 41 N 5.35 -0.45 -0.31 6.67 7.64 -1.26 -1.58 113.62 129.67 1ucd n SER 41 Ca -0.08 -1.00 -0.04 0.00 1.01 0.00 0.00 58.87 58.77 1ucd n SER 41 Cb 0.50 -3.10 -0.02 0.00 -1.01 0.00 0.00 64.21 60.58 1ucd n SER 41 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ucd n GLY 42 N -1.95 0.69 3.00 0.23 0.00 -1.26 -5.02 105.19 100.87 1ucd n GLY 42 Ca -0.30 -0.53 -0.09 0.00 0.00 0.00 0.00 46.02 45.10 1ucd n GLY 42 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1ucd s THR 43 N -2.06 0.12 0.11 2.61 -1.32 -0.61 -5.13 115.64 109.35 1ucd s THR 43 Ca 0.00 -0.97 -0.30 0.00 -1.21 0.00 0.00 61.69 59.21 1ucd s THR 43 Cb 0.00 -0.37 -0.06 0.00 -1.51 0.00 0.00 72.50 70.55 1ucd s THR 43 CO 0.00 -0.53 1.16 -0.55 -2.21 0.00 0.00 174.62 172.49 1ucd s SER 44 N -1.58 7.14 -0.27 8.08 0.15 -1.26 0.07 113.70 126.04 1ucd s SER 44 Ca -0.14 2.06 -0.14 0.00 0.70 0.00 0.00 55.95 58.42 1ucd s SER 44 Cb -0.08 -2.59 -0.04 0.00 -1.71 0.00 0.00 66.02 61.60 1ucd s SER 44 CO -0.02 -0.38 0.35 -0.76 1.20 0.00 0.00 173.24 173.64 1ucd s LEU 45 N 0.46 4.04 0.15 3.45 1.43 -0.26 -4.88 118.68 123.07 1ucd s LEU 45 Ca 0.55 0.27 0.05 0.00 -1.03 0.00 0.00 54.13 53.97 1ucd s LEU 45 Cb -0.30 -2.39 -0.04 0.00 0.03 0.00 0.00 46.19 43.49 1ucd s LEU 45 CO 0.32 -0.16 -0.11 0.42 0.23 0.00 0.00 176.35 177.05 1ucd s THR 46 N 1.98 1.27 -1.40 5.49 -4.23 -1.26 -4.52 115.64 112.97 1ucd s THR 46 Ca 0.14 -2.02 -0.03 0.00 -1.18 0.00 0.00 61.69 58.60 1ucd s THR 46 Cb -0.16 -1.82 0.00 0.00 1.34 0.00 0.00 72.50 71.87 1ucd s THR 46 CO 0.10 -0.67 0.39 0.59 -0.54 0.00 0.00 174.62 174.49 1ucd n ASN 47 N -0.10 -0.59 -4.82 3.99 3.02 0.82 -4.95 115.26 112.63 1ucd n ASN 47 Ca -0.11 -1.06 -0.33 0.00 -0.03 0.00 0.00 54.58 53.05 1ucd n ASN 47 Cb 0.60 -2.83 -0.07 0.00 -0.61 0.00 0.00 39.78 36.87 1ucd n ASN 47 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ucd s PRO 49 N -3.07 4.21 0.00 0.00 0.02 -1.26 -4.71 135.00 130.19 1ucd s PRO 49 Ca 0.60 2.24 0.00 0.00 0.02 0.00 0.00 61.00 63.86 1ucd s PRO 49 Cb -0.10 -3.70 0.00 0.00 0.02 0.00 0.00 34.50 30.72 1ucd s PRO 49 CO 0.14 -0.74 0.00 0.41 -0.33 0.00 0.00 177.00 176.49 1ucd n GLY 50 N 3.97 2.15 3.77 0.52 0.00 -1.26 -4.93 105.19 109.41 1ucd n GLY 50 Ca 0.16 -1.00 -0.39 0.00 0.00 0.00 0.00 46.02 44.79 1ucd n GLY 50 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ucd s SER 51 N -0.71 6.63 0.69 1.61 0.01 -1.26 -4.99 113.70 115.68 1ucd s SER 51 Ca 0.00 2.37 -0.15 0.00 1.31 0.00 0.00 55.95 59.48 1ucd s SER 51 Cb 0.00 -2.62 0.02 0.00 0.21 0.00 0.00 66.02 63.63 1ucd s SER 51 CO 0.00 -0.60 1.15 -2.84 0.41 0.00 0.00 173.24 171.36 1ucd s PRO 52 N -2.16 2.49 0.29 12.44 0.02 -1.26 -4.90 135.00 141.92 1ucd s PRO 52 Ca 0.55 1.56 -0.30 0.00 0.02 0.00 0.00 61.00 62.83 1ucd s PRO 52 Cb -0.32 -1.90 -0.11 0.00 0.02 0.00 0.00 34.50 32.19 1ucd s PRO 52 CO 0.40 -1.52 1.58 0.12 -0.33 0.00 0.00 177.00 177.25 1ucd s PHE 53 N -2.18 2.78 -0.27 6.54 5.36 -1.26 -4.97 117.98 123.98 1ucd s PHE 53 Ca 0.70 0.81 0.00 0.00 -0.96 0.00 0.00 56.93 57.48 1ucd s PHE 53 Cb -0.24 -4.04 0.08 0.00 -0.34 0.00 0.00 43.02 38.48 1ucd s PHE 53 CO 0.43 -3.49 0.04 0.34 -1.46 0.00 0.00 175.22 171.08 1ucd s ASP 54 N 0.49 3.91 0.52 6.13 -1.08 -1.26 -5.00 116.67 120.37 1ucd s ASP 54 Ca 0.63 -1.45 0.20 0.00 -0.52 0.00 0.00 52.55 51.41 1ucd s ASP 54 Cb -0.47 -1.03 1.31 0.00 -1.46 0.00 0.00 42.92 41.27 1ucd s ASP 54 CO 0.47 -0.34 2.06 -0.29 0.52 0.00 0.00 175.17 177.60 1ucd h ILE 55 N 6.56 0.87 0.00 4.11 6.09 -2.00 -1.50 117.51 131.64 1ucd h ILE 55 Ca -0.14 -0.01 -0.02 0.00 -1.37 0.00 0.00 64.86 63.32 1ucd h ILE 55 Cb 1.05 0.83 -0.00 0.00 0.47 0.00 0.00 36.82 39.17 1ucd h ILE 55 CO 0.44 0.01 -0.08 0.71 -3.07 0.00 0.00 178.15 176.16 1ucd h THR 56 N 0.04 0.32 0.00 2.19 1.35 -2.02 -2.46 112.91 112.32 1ucd h THR 56 Ca 0.14 -0.51 0.00 0.00 -0.55 0.00 0.00 66.41 65.49 1ucd h THR 56 Cb 0.51 1.38 0.00 0.00 -1.73 0.00 0.00 68.15 68.32 1ucd h THR 56 CO -0.01 0.08 0.00 0.29 -0.25 0.00 0.00 175.52 175.63 1ucd n LYS 57 N -3.37 0.22 -0.31 4.72 5.02 -0.57 -3.36 118.16 120.52 1ucd n LYS 57 Ca -0.01 0.38 0.07 0.00 -2.02 0.00 0.00 58.31 56.73 1ucd n LYS 57 Cb 0.25 -1.87 0.12 0.00 -0.02 0.00 0.00 35.03 33.51 1ucd n LYS 57 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 1ucd n ILE 58 N -2.28 1.52 0.04 -0.18 -5.35 -0.93 -4.43 119.36 107.74 1ucd n ILE 58 Ca 0.03 -1.98 0.03 0.00 -0.27 0.00 0.00 62.75 60.57 1ucd n ILE 58 Cb 0.28 -0.05 0.42 0.00 -1.74 0.00 0.00 39.64 38.56 1ucd n ILE 58 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 1ucd h SER 59 N 0.22 0.40 0.70 7.28 4.64 -1.56 0.11 113.55 125.34 1ucd h SER 59 Ca -0.01 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 1ucd h SER 59 Cb 1.12 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.10 1ucd h SER 59 CO 0.01 0.35 0.00 0.00 -0.87 0.00 0.00 176.83 176.32 1ucd n HIS 60 N -4.43 0.61 0.29 4.77 1.44 -1.26 -2.31 115.22 114.33 1ucd n HIS 60 Ca 0.02 0.24 0.03 0.00 -2.01 0.00 0.00 57.72 56.00 1ucd n HIS 60 Cb 0.12 -0.88 0.01 0.00 0.12 0.00 0.00 29.99 29.35 1ucd n HIS 60 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 1ucd n LEU 61 N -2.05 1.12 -0.19 2.39 4.77 -0.35 -4.79 117.00 117.90 1ucd n LEU 61 Ca 0.03 -0.82 -0.03 0.00 -0.03 0.00 0.00 56.01 55.16 1ucd n LEU 61 Cb 0.22 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.35 1ucd n LEU 61 CO 0.19 0.23 0.70 -0.61 -1.33 0.00 0.00 177.39 176.57 1ucd h GLN 62 N 0.87 -0.07 -0.61 3.23 4.15 -0.62 0.24 115.11 122.30 1ucd h GLN 62 Ca 0.00 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.41 1ucd h GLN 62 Cb 0.24 0.02 -0.03 0.00 0.21 0.00 0.00 27.48 27.92 1ucd h GLN 62 CO 0.00 -0.05 0.34 1.03 -1.93 0.00 0.00 178.83 178.22 1ucd h SER 63 N -0.08 0.77 -0.49 -0.69 0.87 -1.87 0.02 113.55 112.08 1ucd h SER 63 Ca 0.27 -0.09 -0.05 0.00 -1.23 0.00 0.00 61.79 60.69 1ucd h SER 63 Cb 0.49 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.24 1ucd h SER 63 CO -0.63 0.64 0.11 1.56 -0.53 0.00 0.00 176.83 177.98 1ucd h GLN 64 N 0.83 0.80 -0.26 2.24 4.20 -1.66 -2.75 115.11 118.51 1ucd h GLN 64 Ca 0.22 -0.19 -0.05 0.00 0.06 0.00 0.00 58.65 58.68 1ucd h GLN 64 Cb 0.04 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.70 1ucd h GLN 64 CO -0.04 0.77 -0.05 -0.07 -0.67 0.00 0.00 178.83 178.78 1ucd h LEU 65 N 0.68 0.38 -1.50 1.46 3.38 -0.15 0.29 115.31 119.85 1ucd h LEU 65 Ca 0.15 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 1ucd h LEU 65 Cb 0.34 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1ucd h LEU 65 CO 0.00 0.48 0.02 0.78 0.09 0.00 0.00 178.44 179.82 1ucd h ASN 66 N 0.39 0.31 0.11 -0.43 2.35 -0.71 0.52 115.58 118.13 1ucd h ASN 66 Ca 0.08 -0.04 -0.33 0.00 -0.55 0.00 0.00 56.30 55.46 1ucd h ASN 66 Cb 0.34 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.62 1ucd h ASN 66 CO 0.01 0.35 -1.76 0.74 -1.65 0.00 0.00 177.43 175.13 1ucd h THR 67 N 0.34 0.77 0.00 2.81 2.02 -1.22 -3.34 112.91 114.30 1ucd h THR 67 Ca 0.08 -2.35 -0.14 0.00 0.77 0.00 0.00 66.41 64.78 1ucd h THR 67 Cb 0.20 2.53 -0.02 0.00 -1.74 0.00 0.00 68.15 69.11 1ucd h THR 67 CO 0.00 0.78 -1.30 -0.07 0.37 0.00 0.00 175.52 175.30 1ucd h LEU 68 N -0.15 0.00 -4.86 2.58 3.38 -0.40 -3.40 115.31 112.47 1ucd h LEU 68 Ca -0.38 0.00 -0.47 0.00 0.09 0.00 0.00 57.88 57.12 1ucd h LEU 68 Cb 1.89 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 42.23 1ucd h LEU 68 CO 0.05 0.48 -0.99 1.87 0.09 0.00 0.00 178.44 179.94 1ucd n TRP 69 N -2.87 2.15 -1.83 1.13 -0.00 0.18 -0.02 117.44 116.19 1ucd n TRP 69 Ca -0.08 -3.02 -0.32 0.00 -0.00 0.00 0.00 57.50 54.09 1ucd n TRP 69 Cb 0.79 -0.26 0.03 0.00 -0.00 0.00 0.00 31.31 31.86 1ucd n TRP 69 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 177.69 176.44 1ucd s PRO 70 N -3.28 3.15 -0.37 5.87 0.04 -1.18 -4.73 135.00 134.50 1ucd s PRO 70 Ca 0.37 1.08 -0.26 0.00 0.04 0.00 0.00 61.00 62.22 1ucd s PRO 70 Cb 0.42 -2.01 0.02 0.00 0.04 0.00 0.00 34.50 32.97 1ucd s PRO 70 CO -0.07 -0.94 0.96 1.21 0.04 0.00 0.00 177.00 178.20 1ucd s ASN 71 N -3.28 6.70 0.00 6.66 3.84 -1.26 -4.89 114.94 122.72 1ucd s ASN 71 Ca 0.61 0.62 0.27 0.00 0.21 0.00 0.00 52.86 54.57 1ucd s ASN 71 Cb -0.15 -2.48 0.84 0.00 -0.55 0.00 0.00 41.25 38.91 1ucd s ASN 71 CO 0.45 -0.89 1.65 1.33 -2.79 0.00 0.00 177.10 176.85 1ucd n VAL 72 N 6.02 0.00 -0.02 -5.21 0.24 -1.26 -3.91 118.33 114.20 1ucd n VAL 72 Ca 0.08 -0.00 -0.10 0.00 -2.04 0.00 0.00 64.34 62.28 1ucd n VAL 72 Cb 0.48 -0.07 -0.14 0.00 -1.47 0.00 0.00 33.84 32.64 1ucd n VAL 72 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 1ucd h LEU 73 N 0.03 0.04 -7.18 1.34 3.38 -1.93 0.37 115.31 111.38 1ucd h LEU 73 Ca 0.00 -0.09 -0.05 0.00 0.09 0.00 0.00 57.88 57.82 1ucd h LEU 73 Cb 0.49 -0.01 -0.15 0.00 0.09 0.00 0.00 40.66 41.08 1ucd h LEU 73 CO 0.00 1.08 0.06 0.00 0.09 0.00 0.00 178.44 179.68 1ucd s ARG 74 N -2.60 1.08 -1.08 1.13 1.70 -1.25 -4.44 118.95 113.50 1ucd s ARG 74 Ca -0.06 -0.31 -0.10 0.00 -0.47 0.00 0.00 55.73 54.79 1ucd s ARG 74 Cb 0.08 0.50 -0.07 0.00 -0.57 0.00 0.00 34.95 34.88 1ucd s ARG 74 CO 0.82 -0.41 2.25 0.00 -1.08 0.00 0.00 175.30 176.88 1ucd n ALA 75 N 0.22 5.09 -3.19 7.88 0.00 -1.26 -4.50 120.51 124.75 1ucd n ALA 75 Ca -0.18 -2.68 -0.17 0.00 0.00 0.00 0.00 53.44 50.41 1ucd n ALA 75 Cb 0.61 -3.23 -0.06 0.00 0.00 0.00 0.00 19.45 16.77 1ucd n ALA 75 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1ucd s ASN 76 N 3.43 0.41 0.09 0.00 3.84 -1.26 -5.02 114.94 116.43 1ucd s ASN 76 Ca 0.49 -2.20 -0.19 0.00 0.21 0.00 0.00 52.86 51.17 1ucd s ASN 76 Cb 0.13 0.61 -0.07 0.00 -0.55 0.00 0.00 41.25 41.36 1ucd s ASN 76 CO -0.02 -0.16 1.60 0.78 -2.79 0.00 0.00 177.10 176.51 1ucd h ASN 77 N 5.87 0.37 -0.81 -4.21 2.35 -1.89 -3.17 115.58 114.09 1ucd h ASN 77 Ca 0.14 -0.22 0.11 0.00 -0.55 0.00 0.00 56.30 55.78 1ucd h ASN 77 Cb 1.02 -0.10 -0.08 0.00 0.05 0.00 0.00 38.32 39.21 1ucd h ASN 77 CO 0.21 0.49 0.44 1.56 -1.65 0.00 0.00 177.43 178.47 1ucd h GLN 78 N 0.23 0.69 -0.99 0.81 4.20 -1.95 0.23 115.11 118.33 1ucd h GLN 78 Ca 0.08 -0.04 0.02 0.00 0.06 0.00 0.00 58.65 58.76 1ucd h GLN 78 Cb 0.26 -0.16 -0.05 0.00 0.30 0.00 0.00 27.48 27.83 1ucd h GLN 78 CO -0.00 0.46 0.65 0.37 -0.67 0.00 0.00 178.83 179.64 1ucd h GLN 79 N 0.71 1.27 -0.16 1.46 4.15 -1.98 0.19 115.11 120.75 1ucd h GLN 79 Ca 0.41 -0.08 -0.06 0.00 0.77 0.00 0.00 58.65 59.69 1ucd h GLN 79 Cb 0.44 -0.29 -0.00 0.00 0.21 0.00 0.00 27.48 27.84 1ucd h GLN 79 CO -0.28 0.84 -0.15 0.35 -1.93 0.00 0.00 178.83 177.66 1ucd h PHE 80 N 1.31 0.46 -0.62 3.99 3.57 -1.20 -1.06 116.94 123.39 1ucd h PHE 80 Ca 0.37 -0.14 -0.01 0.00 3.53 0.00 0.00 57.97 61.72 1ucd h PHE 80 Cb -0.11 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 38.51 1ucd h PHE 80 CO -0.00 0.76 0.34 -1.49 -2.23 0.00 0.00 178.31 175.69 1ucd h TRP 81 N 0.03 0.85 -0.47 0.41 6.55 -0.59 -0.29 115.95 122.44 1ucd h TRP 81 Ca 0.03 -0.02 -0.01 0.00 0.95 0.00 0.00 58.89 59.84 1ucd h TRP 81 Cb 0.67 -0.27 -0.02 0.00 -0.86 0.00 0.00 29.16 28.68 1ucd h TRP 81 CO 0.08 0.61 0.26 1.03 -1.05 0.00 0.00 178.44 179.37 1ucd h SER 82 N 0.84 0.59 -0.29 -3.49 0.87 -0.60 0.98 113.55 112.45 1ucd h SER 82 Ca 0.22 -0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.69 1ucd h SER 82 Cb 0.04 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 61.84 1ucd h SER 82 CO -0.03 0.51 0.19 -0.74 -0.53 0.00 0.00 176.83 176.23 1ucd h HIS 83 N 0.62 0.37 -0.39 2.24 -0.00 -0.80 -0.11 115.15 117.08 1ucd h HIS 83 Ca 0.17 0.01 -0.08 0.00 -0.00 0.00 0.00 60.37 60.46 1ucd h HIS 83 Cb 0.06 -0.12 -0.02 0.00 -0.00 0.00 0.00 27.41 27.32 1ucd h HIS 83 CO -0.02 0.25 -0.09 0.93 -0.00 0.00 0.00 177.93 179.00 1ucd h GLU 84 N 0.38 0.68 0.08 5.26 4.39 -0.77 0.24 114.58 124.85 1ucd h GLU 84 Ca 0.11 -0.20 -0.00 0.00 0.34 0.00 0.00 59.36 59.60 1ucd h GLU 84 Cb -0.03 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.56 1ucd h GLU 84 CO -0.02 0.76 -0.04 2.35 -1.16 0.00 0.00 179.01 180.89 1ucd h TRP 85 N 0.63 -0.11 -0.46 4.33 2.91 -0.49 0.26 115.95 123.02 1ucd h TRP 85 Ca 0.11 -0.00 -0.02 0.00 1.13 0.00 0.00 58.89 60.12 1ucd h TRP 85 Cb 0.52 0.03 -0.02 0.00 -0.51 0.00 0.00 29.16 29.18 1ucd h TRP 85 CO 0.02 0.20 0.22 1.15 -1.03 0.00 0.00 178.44 179.01 1ucd h THR 86 N -0.42 1.18 0.03 2.65 2.02 -0.88 0.78 112.91 118.27 1ucd h THR 86 Ca -0.01 -0.52 -0.22 0.00 0.77 0.00 0.00 66.41 66.43 1ucd h THR 86 Cb 0.36 0.69 -0.01 0.00 -1.74 0.00 0.00 68.15 67.44 1ucd h THR 86 CO 0.02 0.20 -1.01 0.50 0.37 0.00 0.00 175.52 175.60 1ucd h LYS 87 N 0.59 0.13 0.00 6.66 3.64 -1.00 -3.36 116.57 123.23 1ucd h LYS 87 Ca 0.16 -0.18 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1ucd h LYS 87 Cb 0.12 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 1ucd h LYS 87 CO -0.02 1.03 -0.83 0.72 -2.27 0.00 0.00 179.45 178.07 1ucd n HIS 88 N -3.51 -0.02 -0.31 1.91 8.25 -0.00 -0.12 115.22 121.42 1ucd n HIS 88 Ca -0.03 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.54 1ucd n HIS 88 Cb 0.91 0.03 0.34 0.00 1.12 0.00 0.00 29.99 32.39 1ucd n HIS 88 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1ucd h GLY 89 N 0.00 1.41 1.69 -1.41 0.00 -0.20 -0.08 103.07 104.48 1ucd h GLY 89 Ca 0.00 -0.34 0.04 0.00 0.00 0.00 0.00 47.33 47.03 1ucd h GLY 89 CO 0.00 0.08 0.11 -0.91 0.00 0.00 0.00 176.54 175.82 1ucd h THR 90 N 0.77 0.83 0.00 4.70 1.35 -1.15 -1.32 112.91 118.09 1ucd h THR 90 Ca 0.49 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.35 1ucd h THR 90 Cb 0.72 0.92 0.00 0.00 -1.73 0.00 0.00 68.15 68.06 1ucd h THR 90 CO -0.25 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.02 1ucd n SER 92 N -1.45 1.78 0.16 0.00 3.41 -0.53 -4.50 113.62 112.48 1ucd n SER 92 Ca 0.05 -2.16 0.12 0.00 -0.26 0.00 0.00 58.87 56.62 1ucd n SER 92 Cb 0.20 -0.12 0.56 0.00 -0.26 0.00 0.00 64.21 64.60 1ucd n SER 92 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1ucd h GLU 93 N 0.00 0.00 -0.25 4.33 4.81 -1.07 0.66 114.58 123.06 1ucd h GLU 93 Ca 0.00 0.00 0.02 0.00 -0.13 0.00 0.00 59.36 59.25 1ucd h GLU 93 Cb 0.72 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.09 1ucd h GLU 93 CO 0.00 0.00 0.17 0.66 -0.73 0.00 0.00 179.01 179.11 1ucd h SER 94 N 0.00 0.22 0.00 1.04 4.64 -1.85 -3.26 113.55 114.34 1ucd h SER 94 Ca 0.00 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ucd h SER 94 Cb 0.23 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 1ucd h SER 94 CO 0.00 0.16 -0.50 0.35 -0.87 0.00 0.00 176.83 175.97 1ucd n THR 95 N -4.50 0.00 -3.93 2.95 -2.24 -0.89 -4.98 114.28 100.70 1ucd n THR 95 Ca 0.01 -0.15 -0.30 0.00 -2.27 0.00 0.00 64.05 61.34 1ucd n THR 95 Cb 0.13 0.62 -0.15 0.00 -2.10 0.00 0.00 70.33 68.82 1ucd n THR 95 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 1ucd s PHE 96 N -1.29 2.52 1.06 4.78 0.40 0.17 -5.05 117.98 120.56 1ucd s PHE 96 Ca 0.00 -1.94 -0.13 0.00 -0.60 0.00 0.00 56.93 54.25 1ucd s PHE 96 Cb 0.00 -1.79 0.22 0.00 0.51 0.00 0.00 43.02 41.95 1ucd s PHE 96 CO 0.00 -0.81 1.09 0.54 0.70 0.00 0.00 175.22 176.73 1ucd s ASN 97 N 1.35 2.12 0.21 1.36 2.20 -1.26 -3.76 114.94 117.15 1ucd s ASN 97 Ca -0.01 1.11 -0.11 0.00 -0.94 0.00 0.00 52.86 52.90 1ucd s ASN 97 Cb -0.19 -1.73 0.27 0.00 -2.00 0.00 0.00 41.25 37.60 1ucd s ASN 97 CO -0.09 -3.44 1.68 -0.61 -2.94 0.00 0.00 177.10 171.70 1ucd h GLN 98 N -2.10 0.14 -0.61 3.55 4.15 -1.94 0.11 115.11 118.41 1ucd h GLN 98 Ca -0.54 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 58.87 1ucd h GLN 98 Cb 1.33 -0.03 -0.03 0.00 0.21 0.00 0.00 27.48 28.96 1ucd h GLN 98 CO 0.54 0.09 0.39 0.00 -1.93 0.00 0.00 178.83 177.92 1ucd h ALA 99 N 1.51 0.77 -0.23 3.38 0.00 -1.91 -1.44 119.26 121.34 1ucd h ALA 99 Ca 0.30 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 55.06 1ucd h ALA 99 Cb 0.47 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1ucd h ALA 99 CO -0.47 0.22 -0.27 0.00 0.00 0.00 0.00 179.25 178.73 1ucd h ALA 100 N 1.21 1.11 0.02 0.00 0.00 -1.64 -1.15 119.26 118.80 1ucd h ALA 100 Ca 0.22 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 1ucd h ALA 100 Cb -0.06 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1ucd h ALA 100 CO -0.04 0.56 -0.01 -0.92 0.00 0.00 0.00 179.25 178.83 1ucd h TYR 101 N 0.39 -0.02 -0.08 0.00 3.20 -0.36 0.10 116.97 120.21 1ucd h TYR 101 Ca 0.06 -0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.84 1ucd h TYR 101 Cb 0.68 0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.95 1ucd h TYR 101 CO 0.02 0.24 -0.34 0.74 -1.64 0.00 0.00 178.16 177.19 1ucd h PHE 102 N -0.28 0.18 -0.52 -3.82 -1.00 -1.20 -1.93 116.94 108.37 1ucd h PHE 102 Ca -0.00 -0.04 -0.11 0.00 2.81 0.00 0.00 57.97 60.62 1ucd h PHE 102 Cb 0.27 -0.04 -0.02 0.00 3.61 0.00 0.00 35.95 39.77 1ucd h PHE 102 CO 0.01 0.48 -0.12 -0.22 -1.61 0.00 0.00 178.31 176.86 1ucd h LYS 103 N 0.14 0.99 -0.20 1.51 1.63 -1.00 -1.10 116.57 118.54 1ucd h LYS 103 Ca 0.02 -0.37 0.03 0.00 -0.85 0.00 0.00 60.65 59.48 1ucd h LYS 103 Cb 0.67 -0.06 -0.03 0.00 -0.60 0.00 0.00 32.23 32.21 1ucd h LYS 103 CO 0.05 1.04 0.02 -0.07 -3.45 0.00 0.00 179.45 177.05 1ucd h LEU 104 N 0.88 -0.02 -0.66 5.20 3.38 -0.24 0.85 115.31 124.70 1ucd h LEU 104 Ca 0.14 0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.16 1ucd h LEU 104 Cb 0.68 0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.45 1ucd h LEU 104 CO 0.05 0.02 0.43 0.00 0.09 0.00 0.00 178.44 179.02 1ucd h ALA 105 N 1.15 0.85 -0.15 1.53 0.00 -1.11 0.23 119.26 121.76 1ucd h ALA 105 Ca 0.09 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1ucd h ALA 105 Cb 0.10 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1ucd h ALA 105 CO -0.13 0.23 0.07 0.28 0.00 0.00 0.00 179.25 179.69 1ucd h VAL 106 N 0.86 1.13 -0.68 0.00 2.07 -0.77 -0.04 116.25 118.83 1ucd h VAL 106 Ca 0.25 -0.39 -0.03 0.00 0.82 0.00 0.00 66.70 67.35 1ucd h VAL 106 Cb -0.05 1.12 -0.03 0.00 -1.52 0.00 0.00 31.29 30.81 1ucd h VAL 106 CO -0.07 0.12 0.29 0.44 0.02 0.00 0.00 177.57 178.37 1ucd h ASP 107 N 0.10 0.92 -0.53 0.57 3.32 -0.47 -0.24 116.42 120.09 1ucd h ASP 107 Ca 0.05 -0.16 -0.00 0.00 0.02 0.00 0.00 57.03 56.94 1ucd h ASP 107 Cb 0.13 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.42 1ucd h ASP 107 CO -0.01 0.83 0.32 0.24 -1.72 0.00 0.00 179.24 178.90 1ucd h MET 108 N 0.96 0.72 -0.58 3.56 2.86 -0.37 -0.82 114.93 121.26 1ucd h MET 108 Ca 0.23 -0.07 -0.02 0.00 -2.06 0.00 0.00 59.70 57.79 1ucd h MET 108 Cb 0.18 -0.15 -0.03 0.00 0.06 0.00 0.00 31.60 31.66 1ucd h MET 108 CO -0.02 0.53 0.31 -0.09 1.06 0.00 0.00 176.91 178.69 1ucd h ARG 109 N 0.72 0.82 0.00 1.72 9.65 -0.57 -0.39 114.38 126.33 1ucd h ARG 109 Ca 0.19 -0.11 0.00 0.00 -1.10 0.00 0.00 59.98 58.97 1ucd h ARG 109 Cb -0.01 -0.16 0.00 0.00 -1.39 0.00 0.00 29.97 28.41 1ucd h ARG 109 CO -0.04 0.64 0.00 0.09 2.80 0.00 0.00 179.97 183.47 1ucd n ASN 110 N -4.57 0.61 -0.51 -3.80 3.02 -0.14 -2.50 115.26 107.37 1ucd n ASN 110 Ca 0.04 0.65 0.05 0.00 -0.03 0.00 0.00 54.58 55.29 1ucd n ASN 110 Cb 0.10 -0.78 0.10 0.00 -0.61 0.00 0.00 39.78 38.59 1ucd n ASN 110 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1ucd n ASN 111 N -2.18 2.45 -3.40 6.41 3.02 -0.36 -4.74 115.26 116.47 1ucd n ASN 111 Ca 0.02 -1.77 -0.26 0.00 -0.03 0.00 0.00 54.58 52.53 1ucd n ASN 111 Cb 0.22 -0.13 -0.09 0.00 -0.61 0.00 0.00 39.78 39.17 1ucd n ASN 111 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ucd n TYR 112 N 0.48 0.20 -2.77 3.10 9.36 -0.24 -5.04 117.16 122.26 1ucd n TYR 112 Ca 0.09 -3.59 -0.43 0.00 3.32 0.00 0.00 57.90 57.29 1ucd n TYR 112 Cb 0.35 -0.11 -0.03 0.00 -0.63 0.00 0.00 39.34 38.92 1ucd n TYR 112 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 1ucd s ASP 113 N -0.74 6.35 0.03 2.98 -1.08 -1.26 -4.85 116.67 118.11 1ucd s ASP 113 Ca 0.33 -1.26 -0.25 0.00 -0.52 0.00 0.00 52.55 50.85 1ucd s ASP 113 Cb 0.08 -2.46 -0.18 0.00 -1.46 0.00 0.00 42.92 38.90 1ucd s ASP 113 CO -0.15 -1.42 1.49 0.40 0.52 0.00 0.00 175.17 176.00 1ucd h ILE 114 N 6.09 1.13 -0.65 4.11 2.04 -1.97 -1.74 117.51 126.53 1ucd h ILE 114 Ca -0.08 -0.56 0.02 0.00 1.00 0.00 0.00 64.86 65.24 1ucd h ILE 114 Cb 1.04 1.50 -0.04 0.00 -0.74 0.00 0.00 36.82 38.59 1ucd h ILE 114 CO 1.22 0.14 0.42 0.40 0.00 0.00 0.00 178.15 180.33 1ucd h ILE 115 N -0.30 1.12 -0.30 -0.67 1.08 -1.98 0.01 117.51 116.47 1ucd h ILE 115 Ca -0.01 -0.29 -0.01 0.00 -0.39 0.00 0.00 64.86 64.17 1ucd h ILE 115 Cb 0.27 0.22 -0.02 0.00 -3.07 0.00 0.00 36.82 34.23 1ucd h ILE 115 CO 0.01 0.15 0.14 1.23 -0.69 0.00 0.00 178.15 178.99 1ucd h GLY 116 N 0.83 0.44 1.92 5.37 0.00 -1.96 0.16 103.07 109.84 1ucd h GLY 116 Ca 0.25 -0.19 -0.19 0.00 0.00 0.00 0.00 47.33 47.20 1ucd h GLY 116 CO -0.08 0.18 -0.88 0.00 0.00 0.00 0.00 176.54 175.77 1ucd h ALA 117 N 1.74 0.55 0.00 3.60 0.00 -0.32 -3.32 119.26 121.51 1ucd h ALA 117 Ca 0.11 -0.77 -0.22 0.00 0.00 0.00 0.00 54.91 54.03 1ucd h ALA 117 Cb 0.06 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 1ucd h ALA 117 CO -0.01 1.02 -1.38 -0.07 0.00 0.00 0.00 179.25 178.81 1ucd h LEU 118 N 0.03 0.00 -0.43 0.00 3.38 -0.38 -3.39 115.31 114.52 1ucd h LEU 118 Ca -0.02 0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.03 1ucd h LEU 118 Cb 1.53 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 42.20 1ucd h LEU 118 CO 0.12 0.81 -0.13 -0.09 0.09 0.00 0.00 178.44 179.25 1ucd h ARG 119 N 0.00 -0.03 -0.23 1.13 2.43 -0.81 -0.72 114.38 116.16 1ucd h ARG 119 Ca -0.17 0.00 0.07 0.00 -0.81 0.00 0.00 59.98 59.06 1ucd h ARG 119 Cb 1.77 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 31.32 1ucd h ARG 119 CO 0.08 -0.02 0.29 -1.35 -1.51 0.00 0.00 179.97 177.46 1ucd h PRO 120 N -0.03 0.00 -0.68 0.20 0.11 -1.76 0.22 132.00 130.06 1ucd h PRO 120 Ca 0.21 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.32 1ucd h PRO 120 Cb 0.35 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.46 1ucd h PRO 120 CO -0.46 0.00 0.00 0.72 -0.21 0.00 0.00 178.00 178.05 1ucd n HIS 121 N -3.63 0.97 -2.92 0.65 8.25 -0.40 -4.92 115.22 113.22 1ucd n HIS 121 Ca 0.03 -0.51 -0.19 0.00 -0.26 0.00 0.00 57.72 56.78 1ucd n HIS 121 Cb 0.42 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.50 1ucd n HIS 121 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ucd n ALA 122 N 1.45 -0.92 -0.87 -1.41 0.00 0.78 -4.83 120.51 114.70 1ucd n ALA 122 Ca 0.23 0.14 0.08 0.00 0.00 0.00 0.00 53.44 53.89 1ucd n ALA 122 Cb 0.63 -2.55 0.35 0.00 0.00 0.00 0.00 19.45 17.87 1ucd n ALA 122 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ucd n ALA 123 N -3.00 3.45 -1.29 0.00 0.00 -0.48 -4.99 120.51 114.20 1ucd n ALA 123 Ca -0.10 -1.98 -0.29 0.00 0.00 0.00 0.00 53.44 51.08 1ucd n ALA 123 Cb 0.59 -0.96 0.17 0.00 0.00 0.00 0.00 19.45 19.26 1ucd n ALA 123 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1ucd s GLY 124 N -1.17 1.57 0.13 0.00 0.00 -1.26 -4.86 107.32 101.73 1ucd s GLY 124 Ca 0.49 -0.52 -0.31 0.00 0.00 0.00 0.00 44.72 44.38 1ucd s GLY 124 CO 0.15 0.12 1.49 2.56 0.00 0.00 0.00 173.10 177.41 1ucd s PRO 125 N -5.15 4.26 0.00 2.90 0.04 -1.26 -4.85 135.00 130.95 1ucd s PRO 125 Ca 0.66 2.21 0.00 0.00 0.04 0.00 0.00 61.00 63.91 1ucd s PRO 125 Cb -0.16 -3.26 0.00 0.00 0.04 0.00 0.00 34.50 31.12 1ucd s PRO 125 CO 0.56 -0.54 0.56 0.27 0.04 0.00 0.00 177.00 177.89 1ucd n ASN 126 N 4.18 0.00 -0.21 6.66 6.94 -0.27 -5.00 115.26 127.57 1ucd n ASN 126 Ca 0.13 -1.32 -0.03 0.00 -0.02 0.00 0.00 54.58 53.34 1ucd n ASN 126 Cb 0.41 -0.06 -0.01 0.00 -2.36 0.00 0.00 39.78 37.75 1ucd n ASN 126 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1ucd n GLY 127 N 0.00 0.51 3.84 4.83 0.00 -1.15 -5.00 105.19 108.22 1ucd n GLY 127 Ca 0.00 -0.17 -0.21 0.00 0.00 0.00 0.00 46.02 45.63 1ucd n GLY 127 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ucd s ARG 128 N -1.44 2.62 0.11 1.61 0.52 -1.24 -4.71 118.95 116.42 1ucd s ARG 128 Ca 0.00 -1.40 -0.31 0.00 -0.52 0.00 0.00 55.73 53.50 1ucd s ARG 128 Cb 0.00 -2.41 -0.08 0.00 0.52 0.00 0.00 34.95 32.99 1ucd s ARG 128 CO 0.00 0.01 1.37 0.99 0.02 0.00 0.00 175.30 177.69 1ucd s THR 129 N -2.37 3.40 0.24 0.02 2.01 -1.26 -1.61 115.64 116.08 1ucd s THR 129 Ca 0.43 1.00 0.12 0.00 0.31 0.00 0.00 61.69 63.55 1ucd s THR 129 Cb -0.05 -3.64 -0.05 0.00 0.01 0.00 0.00 72.50 68.77 1ucd s THR 129 CO 0.26 0.08 -0.20 -0.54 -0.69 0.00 0.00 174.62 173.53 1ucd s LYS 130 N 1.12 1.67 -0.19 4.92 -0.14 0.17 -4.94 119.74 122.34 1ucd s LYS 130 Ca 0.64 -1.65 -0.14 0.00 -1.36 0.00 0.00 55.97 53.46 1ucd s LYS 130 Cb -0.36 -1.83 -0.04 0.00 -1.68 0.00 0.00 37.83 33.92 1ucd s LYS 130 CO 0.30 0.36 0.29 0.45 -0.76 0.00 0.00 175.35 175.99 1ucd s SER 131 N -3.19 6.36 0.19 2.83 0.15 -1.26 -1.89 113.70 116.87 1ucd s SER 131 Ca 0.27 0.41 -0.12 0.00 0.70 0.00 0.00 55.95 57.21 1ucd s SER 131 Cb -0.06 -2.18 0.15 0.00 -1.71 0.00 0.00 66.02 62.22 1ucd s SER 131 CO 0.13 0.04 1.79 -0.09 1.20 0.00 0.00 173.24 176.32 1ucd h ARG 132 N 7.06 0.53 -0.58 5.44 2.43 -1.03 -0.66 114.38 127.58 1ucd h ARG 132 Ca -0.39 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 58.74 1ucd h ARG 132 Cb 1.16 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 30.57 1ucd h ARG 132 CO 0.73 0.35 0.32 0.37 -1.51 0.00 0.00 179.97 180.22 1ucd h GLN 133 N 0.55 0.81 -0.09 0.20 4.15 -1.91 -0.41 115.11 118.41 1ucd h GLN 133 Ca 0.24 -0.10 -0.01 0.00 0.77 0.00 0.00 58.65 59.56 1ucd h GLN 133 Cb 0.13 -0.16 -0.00 0.00 0.21 0.00 0.00 27.48 27.66 1ucd h GLN 133 CO -0.16 0.62 0.03 0.00 -1.93 0.00 0.00 178.83 177.40 1ucd h ALA 134 N 1.14 0.12 -0.37 3.38 0.00 -1.79 0.72 119.26 122.45 1ucd h ALA 134 Ca 0.20 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1ucd h ALA 134 Cb 0.05 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1ucd h ALA 134 CO -0.03 -0.29 0.20 0.82 0.00 0.00 0.00 179.25 179.94 1ucd h ILE 135 N -0.02 1.14 -0.70 0.00 1.08 -1.01 0.52 117.51 118.52 1ucd h ILE 135 Ca 0.03 -0.37 -0.02 0.00 -0.39 0.00 0.00 64.86 64.11 1ucd h ILE 135 Cb 0.17 0.72 -0.03 0.00 -3.07 0.00 0.00 36.82 34.61 1ucd h ILE 135 CO -0.00 0.15 0.35 0.11 -0.69 0.00 0.00 178.15 178.07 1ucd h LYS 136 N 0.47 0.99 -0.63 2.37 1.57 -0.99 -1.97 116.57 118.39 1ucd h LYS 136 Ca 0.13 -0.13 -0.06 0.00 -1.87 0.00 0.00 60.65 58.72 1ucd h LYS 136 Cb 0.06 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.15 1ucd h LYS 136 CO -0.02 0.75 0.15 0.78 -0.57 0.00 0.00 179.45 180.54 1ucd h GLY 137 N 1.05 1.08 0.97 3.86 0.00 -0.08 0.24 103.07 110.20 1ucd h GLY 137 Ca 0.25 -0.68 -0.03 0.00 0.00 0.00 0.00 47.33 46.87 1ucd h GLY 137 CO -0.03 0.64 0.20 0.74 0.00 0.00 0.00 176.54 178.08 1ucd h PHE 138 N 0.92 0.76 -0.20 5.60 0.05 -0.50 -0.27 116.94 123.31 1ucd h PHE 138 Ca 0.20 -0.06 -0.15 0.00 3.82 0.00 0.00 57.97 61.78 1ucd h PHE 138 Cb 0.36 -0.23 -0.01 0.00 2.00 0.00 0.00 35.95 38.08 1ucd h PHE 138 CO 0.03 0.63 -0.49 -0.07 -0.18 0.00 0.00 178.31 178.23 1ucd h LEU 139 N 0.66 0.57 -0.70 1.54 3.38 -1.18 -1.30 115.31 118.27 1ucd h LEU 139 Ca 0.17 -0.28 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 1ucd h LEU 139 Cb 0.20 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 1ucd h LEU 139 CO -0.01 0.96 0.33 0.50 0.09 0.00 0.00 178.44 180.30 1ucd h LYS 140 N 0.41 1.02 -0.34 1.13 1.63 -0.22 0.12 116.57 120.32 1ucd h LYS 140 Ca 0.02 -0.16 -0.08 0.00 -0.85 0.00 0.00 60.65 59.59 1ucd h LYS 140 Cb 1.00 -0.18 -0.01 0.00 -0.60 0.00 0.00 32.23 32.44 1ucd h LYS 140 CO 0.09 0.81 -0.08 0.00 -3.45 0.00 0.00 179.45 176.82 1ucd h ALA 141 N 1.16 0.47 -0.18 5.00 0.00 -0.84 0.55 119.26 125.42 1ucd h ALA 141 Ca 0.24 -0.30 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 1ucd h ALA 141 Cb 0.14 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1ucd h ALA 141 CO -0.03 0.32 -0.30 -0.22 0.00 0.00 0.00 179.25 179.02 1ucd h LYS 142 N 0.45 0.52 -0.00 0.00 1.63 -1.02 -3.35 116.57 114.79 1ucd h LYS 142 Ca 0.09 -0.32 0.00 0.00 -0.85 0.00 0.00 60.65 59.57 1ucd h LYS 142 Cb 0.58 0.03 0.00 0.00 -0.60 0.00 0.00 32.23 32.25 1ucd h LYS 142 CO 0.03 0.92 -0.75 1.19 -3.45 0.00 0.00 179.45 177.39 1ucd n PHE 143 N -4.36 0.00 -0.22 1.91 3.01 0.41 -4.99 117.46 113.23 1ucd n PHE 143 Ca -0.06 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.40 1ucd n PHE 143 Cb 0.47 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.94 1ucd n PHE 143 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ucd n GLY 144 N 1.40 1.79 3.02 1.37 0.00 0.19 -5.01 105.19 107.95 1ucd n GLY 144 Ca 0.05 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.96 1ucd n GLY 144 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ucd s LYS 145 N -0.27 0.42 0.23 1.61 -0.14 -1.20 -4.95 119.74 115.44 1ucd s LYS 145 Ca 0.00 -0.69 -0.30 0.00 -1.36 0.00 0.00 55.97 53.62 1ucd s LYS 145 Cb 0.00 -0.09 -0.09 0.00 -1.68 0.00 0.00 37.83 35.97 1ucd s LYS 145 CO 0.00 -0.00 1.15 -0.06 -0.76 0.00 0.00 175.35 175.68 1ucd s PHE 146 N -1.45 3.49 0.66 3.18 0.40 -1.26 -3.65 117.98 119.35 1ucd s PHE 146 Ca -0.13 1.56 -0.02 0.00 -0.60 0.00 0.00 56.93 57.75 1ucd s PHE 146 Cb -0.10 -3.37 0.08 0.00 0.51 0.00 0.00 43.02 40.15 1ucd s PHE 146 CO -0.00 -0.90 0.93 -1.25 0.70 0.00 0.00 175.22 174.70 1ucd s PRO 147 N -0.88 2.07 -0.12 0.24 0.04 -1.26 -0.47 135.00 134.61 1ucd s PRO 147 Ca 0.48 -0.78 -0.03 0.00 0.04 0.00 0.00 61.00 60.72 1ucd s PRO 147 Cb -0.32 -2.33 -0.03 0.00 0.04 0.00 0.00 34.50 31.85 1ucd s PRO 147 CO 0.39 -1.17 -0.02 0.20 0.04 0.00 0.00 177.00 176.45 1ucd s GLY 148 N -4.58 1.78 -0.17 0.56 0.00 0.45 -4.61 107.32 100.76 1ucd s GLY 148 Ca 0.62 -0.81 -0.03 0.00 0.00 0.00 0.00 44.72 44.50 1ucd s GLY 148 CO 0.43 -0.31 -0.06 1.08 0.00 0.00 0.00 173.10 174.23 1ucd s LEU 149 N -0.24 2.98 -0.10 0.66 1.43 -1.26 0.35 118.68 122.51 1ucd s LEU 149 Ca 0.05 -0.28 0.03 0.00 -1.03 0.00 0.00 54.13 52.90 1ucd s LEU 149 Cb -0.13 -1.72 -0.01 0.00 0.03 0.00 0.00 46.19 44.36 1ucd s LEU 149 CO 0.02 0.10 -0.18 -0.13 0.23 0.00 0.00 176.35 176.39 1ucd s ARG 150 N 0.74 3.01 0.25 1.70 0.52 0.02 -0.92 118.95 124.28 1ucd s ARG 150 Ca -0.03 -0.78 0.07 0.00 -0.52 0.00 0.00 55.73 54.48 1ucd s ARG 150 Cb -0.15 -2.42 -0.05 0.00 0.52 0.00 0.00 34.95 32.85 1ucd s ARG 150 CO 0.02 0.30 -0.10 0.00 0.02 0.00 0.00 175.30 175.54 1ucd s ARG 152 N -3.68 0.54 -0.14 0.00 0.52 -0.29 -4.75 118.95 111.14 1ucd s ARG 152 Ca 0.27 -0.32 -0.06 0.00 -0.52 0.00 0.00 55.73 55.10 1ucd s ARG 152 Cb 0.02 -0.49 -0.04 0.00 0.52 0.00 0.00 34.95 34.96 1ucd s ARG 152 CO 0.10 0.13 0.07 0.99 0.02 0.00 0.00 175.30 176.62 1ucd s THR 153 N -0.34 4.93 -0.29 0.02 2.01 -1.26 -0.57 115.64 120.15 1ucd s THR 153 Ca 0.01 0.00 -0.29 0.00 0.31 0.00 0.00 61.69 61.72 1ucd s THR 153 Cb -0.04 -3.16 -0.01 0.00 0.01 0.00 0.00 72.50 69.31 1ucd s THR 153 CO -0.00 0.55 1.38 -0.62 -0.69 0.00 0.00 174.62 175.24 1ucd s ASP 154 N -0.42 6.58 0.49 3.53 -1.08 -0.02 -4.89 116.67 120.87 1ucd s ASP 154 Ca 0.10 1.29 0.20 0.00 -0.52 0.00 0.00 52.55 53.62 1ucd s ASP 154 Cb -0.12 -2.54 1.26 0.00 -1.46 0.00 0.00 42.92 40.06 1ucd s ASP 154 CO 0.02 -1.14 2.00 -0.65 0.52 0.00 0.00 175.17 175.92 1ucd h PRO 155 N 9.71 0.14 0.22 4.34 0.11 -1.96 0.56 132.00 145.13 1ucd h PRO 155 Ca -0.28 -0.01 -0.32 0.00 0.11 0.00 0.00 66.00 65.50 1ucd h PRO 155 Cb 1.11 -0.03 0.03 0.00 0.11 0.00 0.00 31.00 32.22 1ucd h PRO 155 CO 1.03 0.09 -1.42 1.96 -0.21 0.00 0.00 178.00 179.45 1ucd h GLN 156 N 0.14 0.50 0.00 1.05 7.50 -1.98 -3.38 115.11 118.95 1ucd h GLN 156 Ca 0.24 -0.84 0.00 0.00 0.50 0.00 0.00 58.65 58.56 1ucd h GLN 156 Cb 0.77 0.31 0.00 0.00 0.05 0.00 0.00 27.48 28.61 1ucd h GLN 156 CO -0.03 1.40 -1.90 0.25 -1.50 0.00 0.00 178.83 177.04 1ucd n THR 157 N -3.69 0.00 -0.99 -0.54 -2.24 -1.08 -4.97 114.28 100.77 1ucd n THR 157 Ca -0.15 -0.45 0.00 0.00 -2.27 0.00 0.00 64.05 61.18 1ucd n THR 157 Cb 1.08 0.06 0.00 0.00 -2.10 0.00 0.00 70.33 69.38 1ucd n THR 157 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1ucd n LYS 158 N -2.19 -0.53 -2.69 -0.78 4.76 0.19 -4.99 118.16 111.93 1ucd n LYS 158 Ca -0.04 0.13 -0.42 0.00 -2.87 0.00 0.00 58.31 55.12 1ucd n LYS 158 Cb 0.53 -3.54 -0.03 0.00 -1.84 0.00 0.00 35.03 30.14 1ucd n LYS 158 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1ucd s VAL 159 N -1.82 4.67 -0.09 -0.18 1.01 -1.24 -4.76 120.40 117.99 1ucd s VAL 159 Ca 0.00 2.02 -0.14 0.00 0.00 0.00 0.00 61.98 63.86 1ucd s VAL 159 Cb 0.00 -4.29 -0.05 0.00 0.00 0.00 0.00 36.38 32.04 1ucd s VAL 159 CO 0.00 0.21 0.35 -0.55 0.00 0.00 0.00 175.10 175.11 1ucd s SER 160 N 0.65 6.60 -0.04 3.32 0.15 -1.26 -0.84 113.70 122.28 1ucd s SER 160 Ca 0.51 0.71 0.07 0.00 0.70 0.00 0.00 55.95 57.94 1ucd s SER 160 Cb -0.22 -2.21 -0.01 0.00 -1.71 0.00 0.00 66.02 61.86 1ucd s SER 160 CO 0.29 0.19 -0.24 -0.31 1.20 0.00 0.00 173.24 174.36 1ucd s TYR 161 N -0.17 2.28 0.04 3.44 1.51 0.27 -0.06 117.35 124.66 1ucd s TYR 161 Ca 0.20 -0.57 -0.31 0.00 -1.01 0.00 0.00 57.07 55.39 1ucd s TYR 161 Cb -0.14 -1.49 -0.06 0.00 -0.11 0.00 0.00 41.96 40.16 1ucd s TYR 161 CO 0.08 -0.13 1.36 -1.17 -1.11 0.00 0.00 175.55 174.58 1ucd s LEU 162 N -0.34 4.34 -0.01 -1.29 2.96 -0.42 -1.14 118.68 122.79 1ucd s LEU 162 Ca 0.02 2.16 0.01 0.00 -0.22 0.00 0.00 54.13 56.10 1ucd s LEU 162 Cb -0.12 -3.57 -0.01 0.00 0.50 0.00 0.00 46.19 42.99 1ucd s LEU 162 CO 0.01 -0.66 0.00 1.33 -1.32 0.00 0.00 176.35 175.72 1ucd n VAL 163 N 4.33 0.05 -3.93 1.68 0.24 0.22 -4.81 118.33 116.12 1ucd n VAL 163 Ca 0.12 -0.03 -0.10 0.00 -2.04 0.00 0.00 64.34 62.29 1ucd n VAL 163 Cb 0.44 -0.81 -0.10 0.00 -1.47 0.00 0.00 33.84 31.90 1ucd n VAL 163 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 1ucd s GLN 164 N -2.02 0.48 -0.10 7.34 -0.21 -0.70 -0.63 119.66 123.81 1ucd s GLN 164 Ca -0.00 -0.60 0.02 0.00 0.02 0.00 0.00 55.36 54.79 1ucd s GLN 164 Cb 0.00 0.19 0.02 0.00 1.00 0.00 0.00 33.01 34.22 1ucd s GLN 164 CO 0.03 -0.11 -0.13 0.08 -2.12 0.00 0.00 175.29 173.04 1ucd s VAL 165 N -1.89 1.33 -0.14 1.09 1.01 -0.19 -0.80 120.40 120.81 1ucd s VAL 165 Ca -0.11 -0.54 -0.05 0.00 0.00 0.00 0.00 61.98 61.27 1ucd s VAL 165 Cb -0.06 -1.23 -0.04 0.00 0.00 0.00 0.00 36.38 35.06 1ucd s VAL 165 CO -0.01 0.41 0.04 -0.69 0.00 0.00 0.00 175.10 174.85 1ucd s VAL 166 N 1.01 4.66 -0.20 2.92 1.01 0.16 -1.27 120.40 128.68 1ucd s VAL 166 Ca -0.07 -0.10 -0.03 0.00 0.00 0.00 0.00 61.98 61.78 1ucd s VAL 166 Cb -0.15 -3.04 -0.01 0.00 0.00 0.00 0.00 36.38 33.18 1ucd s VAL 166 CO -0.01 0.53 -0.06 0.00 0.00 0.00 0.00 175.10 175.56 1ucd s ALA 167 N -0.21 2.80 -0.02 5.51 0.00 -0.16 -0.41 121.76 129.26 1ucd s ALA 167 Ca 0.07 -1.11 -0.16 0.00 0.00 0.00 0.00 51.96 50.76 1ucd s ALA 167 Cb -0.12 -1.63 -0.05 0.00 0.00 0.00 0.00 23.12 21.32 1ucd s ALA 167 CO 0.02 -0.30 0.45 0.00 0.00 0.00 0.00 175.76 175.92 1ucd s PHE 169 N -0.64 1.38 1.04 0.00 0.40 -0.16 -0.12 117.98 119.87 1ucd s PHE 169 Ca 0.25 -0.55 -0.15 0.00 -0.60 0.00 0.00 56.93 55.88 1ucd s PHE 169 Cb -0.17 -0.73 0.21 0.00 0.51 0.00 0.00 43.02 42.85 1ucd s PHE 169 CO 0.13 0.13 1.15 0.00 0.70 0.00 0.00 175.22 177.33 1ucd s ALA 170 N -2.06 1.29 0.45 5.36 0.00 0.50 -0.14 121.76 127.16 1ucd s ALA 170 Ca 0.08 -0.75 0.38 0.00 0.00 0.00 0.00 51.96 51.67 1ucd s ALA 170 Cb -0.05 -2.96 2.05 0.00 0.00 0.00 0.00 23.12 22.16 1ucd s ALA 170 CO 0.03 -2.86 2.15 -0.56 0.00 0.00 0.00 175.76 174.52 1ucd h GLN 171 N -1.97 0.00 0.00 0.00 3.07 -1.83 -0.46 115.11 113.92 1ucd h GLN 171 Ca -0.49 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.25 1ucd h GLN 171 Cb 1.30 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.86 1ucd h GLN 171 CO 0.48 0.00 0.00 -0.40 0.09 0.00 0.00 178.83 179.00 1ucd n ASP 172 N -2.85 0.00 -0.30 0.06 5.68 -1.26 -4.87 116.55 113.01 1ucd n ASP 172 Ca -0.03 0.36 -0.04 0.00 -0.50 0.00 0.00 54.79 54.58 1ucd n ASP 172 Cb 0.09 -0.44 -0.02 0.00 -1.14 0.00 0.00 41.12 39.61 1ucd n ASP 172 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ucd n GLY 173 N 0.66 0.57 0.00 6.12 0.00 -0.18 -4.76 105.19 107.60 1ucd n GLY 173 Ca 0.07 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1ucd n GLY 173 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ucd n SER 174 N -0.37 1.99 -4.57 1.61 3.41 -1.26 -4.96 113.62 109.46 1ucd n SER 174 Ca -0.04 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.14 1ucd n SER 174 Cb 0.32 0.20 -0.04 0.00 -0.26 0.00 0.00 64.21 64.44 1ucd n SER 174 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1ucd s THR 175 N -1.39 4.42 0.25 6.66 2.01 -1.26 -4.95 115.64 121.39 1ucd s THR 175 Ca 0.00 0.87 -0.30 0.00 0.31 0.00 0.00 61.69 62.57 1ucd s THR 175 Cb 0.00 -4.46 -0.09 0.00 0.01 0.00 0.00 72.50 67.95 1ucd s THR 175 CO 0.00 -0.85 1.30 -0.22 -0.69 0.00 0.00 174.62 174.16 1ucd s LEU 176 N 3.88 4.43 0.25 4.42 2.96 -1.26 -0.37 118.68 132.99 1ucd s LEU 176 Ca 0.39 2.51 0.04 0.00 -0.22 0.00 0.00 54.13 56.85 1ucd s LEU 176 Cb -0.10 -3.63 -0.05 0.00 0.50 0.00 0.00 46.19 42.92 1ucd s LEU 176 CO 0.27 -0.51 -0.02 0.27 -1.32 0.00 0.00 176.35 175.04 1ucd s ILE 177 N -0.42 1.20 0.27 6.68 -4.36 0.83 -4.85 121.20 120.55 1ucd s ILE 177 Ca 0.53 -2.05 -0.29 0.00 -0.26 0.00 0.00 60.65 58.58 1ucd s ILE 177 Cb -0.38 -2.39 -0.09 0.00 1.25 0.00 0.00 42.46 40.85 1ucd s ILE 177 CO 0.44 -0.31 1.21 -1.81 0.24 0.00 0.00 174.94 174.71 1ucd s ASP 178 N -3.35 7.04 0.44 4.36 1.01 -1.26 -4.04 116.67 120.86 1ucd s ASP 178 Ca 0.29 2.42 -0.02 0.00 0.71 0.00 0.00 52.55 55.95 1ucd s ASP 178 Cb 0.05 -2.63 -0.02 0.00 1.01 0.00 0.00 42.92 41.33 1ucd s ASP 178 CO 0.10 -0.35 0.68 0.00 0.21 0.00 0.00 175.17 175.81 1ucd n THR 180 N -2.08 0.00 -3.62 0.00 -2.24 -1.26 -4.70 114.28 100.37 1ucd n THR 180 Ca -0.01 -0.03 -0.38 0.00 -2.27 0.00 0.00 64.05 61.36 1ucd n THR 180 Cb 0.57 0.53 -0.11 0.00 -2.10 0.00 0.00 70.33 69.21 1ucd n THR 180 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1ucd s ARG 181 N -0.19 3.70 0.19 -0.78 1.81 -1.26 -5.08 118.95 117.35 1ucd s ARG 181 Ca 0.00 -0.48 0.11 0.00 -1.72 0.00 0.00 55.73 53.65 1ucd s ARG 181 Cb 0.00 -3.60 -0.04 0.00 -0.45 0.00 0.00 34.95 30.85 1ucd s ARG 181 CO 0.00 -0.27 -0.24 -0.51 -0.68 0.00 0.00 175.30 173.60 1ucd s ASP 182 N 1.70 3.43 0.00 0.23 1.01 -1.26 -4.25 116.67 117.52 1ucd s ASP 182 Ca 0.06 -0.87 0.09 0.00 0.71 0.00 0.00 52.55 52.55 1ucd s ASP 182 Cb -0.16 -0.25 -0.06 0.00 1.01 0.00 0.00 42.92 43.45 1ucd s ASP 182 CO 0.09 0.12 0.48 0.35 0.21 0.00 0.00 175.17 176.41 1ucd n THR 183 N 0.27 0.00 -2.71 -1.27 -2.24 -0.09 -4.97 114.28 103.27 1ucd n THR 183 Ca -0.13 -0.33 -0.34 0.00 -2.27 0.00 0.00 64.05 60.98 1ucd n THR 183 Cb 0.56 1.04 -0.06 0.00 -2.10 0.00 0.00 70.33 69.78 1ucd n THR 183 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ucd n GLY 185 N -0.19 -0.06 0.27 0.00 0.00 -1.26 -4.95 105.19 99.00 1ucd n GLY 185 Ca 0.06 -1.81 0.06 0.00 0.00 0.00 0.00 46.02 44.34 1ucd n GLY 185 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ucd h ALA 186 N -1.31 1.87 -2.38 4.61 0.00 -1.97 -3.41 119.26 116.67 1ucd h ALA 186 Ca 0.00 -0.02 -0.27 0.00 0.00 0.00 0.00 54.91 54.61 1ucd h ALA 186 Cb 0.00 -0.06 -0.16 0.00 0.00 0.00 0.00 17.79 17.57 1ucd h ALA 186 CO 0.00 0.11 -0.71 -0.80 0.00 0.00 0.00 179.25 177.85 1ucd s ASN 187 N -6.93 1.37 0.06 0.00 0.01 -1.26 -0.52 114.94 107.67 1ucd s ASN 187 Ca -0.06 -0.94 -0.27 0.00 -0.71 0.00 0.00 52.86 50.87 1ucd s ASN 187 Cb 0.17 0.05 0.09 0.00 0.41 0.00 0.00 41.25 41.96 1ucd s ASN 187 CO 0.69 -0.37 0.95 0.72 -1.51 0.00 0.00 177.10 177.58 1ucd s PHE 188 N -3.18 -0.23 0.00 2.20 -0.12 -0.80 -4.84 117.98 111.01 1ucd s PHE 188 Ca 0.11 0.02 -0.19 0.00 -0.05 0.00 0.00 56.93 56.82 1ucd s PHE 188 Cb 0.02 0.58 -0.06 0.00 -0.63 0.00 0.00 43.02 42.94 1ucd s PHE 188 CO -0.02 -0.65 0.55 0.42 -0.05 0.00 0.00 175.22 175.47 1ucd s ILE 189 N -3.15 4.91 0.00 -4.49 1.01 0.91 0.43 121.20 120.82 1ucd s ILE 189 Ca 0.09 1.15 0.00 0.00 0.00 0.00 0.00 60.65 61.89 1ucd s ILE 189 Cb -0.01 -3.88 0.00 0.00 0.01 0.00 0.00 42.46 38.58 1ucd s ILE 189 CO -0.04 0.47 0.00 0.33 0.00 0.00 0.00 174.94 175.70