#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dun s SER 2 N 0.00 5.35 -0.35 1.61 0.15 -1.26 -5.05 113.70 114.16 2dun s SER 2 Ca 0.00 -0.90 0.03 0.00 0.70 0.00 0.00 55.95 55.78 2dun s SER 2 Cb 0.00 -1.92 0.10 0.00 -1.71 0.00 0.00 66.02 62.49 2dun s SER 2 CO 0.00 -0.28 0.07 -0.55 1.20 0.00 0.00 173.24 173.68 2dun s SER 3 N 1.49 4.83 0.42 5.45 0.15 -1.26 -5.11 113.70 119.67 2dun s SER 3 Ca 0.01 -2.11 0.02 0.00 0.70 0.00 0.00 55.95 54.57 2dun s SER 3 Cb -0.18 -1.66 -0.01 0.00 -1.71 0.00 0.00 66.02 62.46 2dun s SER 3 CO 0.04 -0.40 0.62 -0.83 1.20 0.00 0.00 173.24 173.88 2dun s GLY 4 N 1.04 1.56 -0.33 9.45 0.00 -1.26 -4.98 107.32 112.80 2dun s GLY 4 Ca 0.10 -1.13 -0.34 0.00 0.00 0.00 0.00 44.72 43.35 2dun s GLY 4 CO -0.07 -0.98 2.20 1.44 0.00 0.00 0.00 173.10 175.68 2dun n SER 5 N -1.98 2.31 -0.07 1.64 7.64 -1.26 -4.84 113.62 117.06 2dun n SER 5 Ca 0.01 0.37 -0.08 0.00 1.01 0.00 0.00 58.87 60.18 2dun n SER 5 Cb 0.58 -1.31 -0.05 0.00 -1.01 0.00 0.00 64.21 62.42 2dun n SER 5 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 2dun h SER 6 N 12.83 0.00 0.00 6.43 0.87 -1.98 -3.51 113.55 128.20 2dun h SER 6 Ca -0.29 -0.28 0.00 0.00 -1.23 0.00 0.00 61.79 59.99 2dun h SER 6 Cb 1.31 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.27 2dun h SER 6 CO 1.01 0.85 0.00 0.61 -0.53 0.00 0.00 176.83 178.77 2dun n GLY 7 N 1.64 0.05 3.59 5.77 0.00 -1.26 -5.08 105.19 109.90 2dun n GLY 7 Ca -0.10 0.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 2dun n GLY 7 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dun s SER 8 N -4.00 5.79 0.38 1.61 0.15 -1.26 -4.94 113.70 111.43 2dun s SER 8 Ca 0.00 0.98 -0.25 0.00 0.70 0.00 0.00 55.95 57.37 2dun s SER 8 Cb 0.00 -2.53 -0.11 0.00 -1.71 0.00 0.00 66.02 61.67 2dun s SER 8 CO 0.00 -1.85 1.05 1.07 1.20 0.00 0.00 173.24 174.71 2dun n THR 9 N 7.32 2.29 -0.19 6.45 5.66 -1.26 -4.87 114.28 129.68 2dun n THR 9 Ca 0.21 -0.50 -0.00 0.00 -3.05 0.00 0.00 64.05 60.71 2dun n THR 9 Cb 0.48 -1.18 0.09 0.00 -1.55 0.00 0.00 70.33 68.18 2dun n THR 9 CO 0.00 0.00 0.00 0.03 -3.05 0.00 0.00 175.07 172.05 2dun h ARG 10 N 1.76 0.24 -3.11 1.09 3.08 -1.92 -3.27 114.38 112.24 2dun h ARG 10 Ca -0.44 -0.01 -0.62 0.00 0.07 0.00 0.00 59.98 58.98 2dun h ARG 10 Cb 1.33 -0.05 -0.41 0.00 0.08 0.00 0.00 29.97 30.91 2dun h ARG 10 CO 0.58 0.16 -0.63 -0.06 -1.07 0.00 0.00 179.97 178.95 2dun s PHE 11 N -6.12 3.17 -1.06 3.04 0.08 -1.06 -4.92 117.98 111.11 2dun s PHE 11 Ca -0.13 -3.15 0.14 0.00 0.12 0.00 0.00 56.93 53.91 2dun s PHE 11 Cb 0.17 -2.55 0.62 0.00 -0.57 0.00 0.00 43.02 40.69 2dun s PHE 11 CO 0.74 -0.64 1.45 -0.35 -0.10 0.00 0.00 175.22 176.31 2dun n PRO 12 N 2.47 0.03 -1.10 0.24 -0.04 -1.24 -2.75 135.00 132.61 2dun n PRO 12 Ca 0.15 0.24 -0.18 0.00 -0.04 0.00 0.00 63.50 63.67 2dun n PRO 12 Cb 0.35 -1.50 0.19 0.00 -0.04 0.00 0.00 33.50 32.50 2dun n PRO 12 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2dun n GLY 13 N -0.04 4.12 3.01 0.55 0.00 -1.26 -4.84 105.19 106.73 2dun n GLY 13 Ca 0.04 -0.99 -0.13 0.00 0.00 0.00 0.00 46.02 44.94 2dun n GLY 13 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dun s VAL 14 N -2.99 -0.43 -0.21 1.61 1.01 -1.11 -5.12 120.40 113.15 2dun s VAL 14 Ca 0.52 0.25 0.01 0.00 0.00 0.00 0.00 61.98 62.77 2dun s VAL 14 Cb 0.44 -0.48 0.03 0.00 0.00 0.00 0.00 36.38 36.37 2dun s VAL 14 CO 0.11 0.10 -0.16 0.00 0.00 0.00 0.00 175.10 175.15 2dun s ALA 15 N 2.43 2.45 -0.08 5.51 0.00 -1.26 -3.23 121.76 127.57 2dun s ALA 15 Ca 0.01 -1.42 -0.01 0.00 0.00 0.00 0.00 51.96 50.55 2dun s ALA 15 Cb -0.12 -1.36 -0.03 0.00 0.00 0.00 0.00 23.12 21.60 2dun s ALA 15 CO -0.09 -0.66 -0.01 0.42 0.00 0.00 0.00 175.76 175.41 2dun s ILE 16 N 1.23 4.19 -0.14 0.00 1.01 -0.19 -0.58 121.20 126.72 2dun s ILE 16 Ca 0.00 -0.29 0.02 0.00 0.00 0.00 0.00 60.65 60.38 2dun s ILE 16 Cb -0.16 -2.75 0.01 0.00 0.01 0.00 0.00 42.46 39.57 2dun s ILE 16 CO -0.10 0.60 -0.21 -0.47 0.00 0.00 0.00 174.94 174.77 2dun s TYR 17 N -0.85 2.59 -0.18 3.97 6.14 -0.67 -2.52 117.35 125.84 2dun s TYR 17 Ca 0.13 -1.33 -0.12 0.00 0.64 0.00 0.00 57.07 56.39 2dun s TYR 17 Cb -0.11 -1.78 -0.05 0.00 0.42 0.00 0.00 41.96 40.44 2dun s TYR 17 CO 0.02 -0.62 0.21 -0.51 0.64 0.00 0.00 175.55 175.29 2dun s LEU 18 N 0.89 4.23 0.61 6.97 1.43 -1.26 -1.95 118.68 129.59 2dun s LEU 18 Ca -0.06 0.38 -0.19 0.00 -1.03 0.00 0.00 54.13 53.23 2dun s LEU 18 Cb -0.15 -2.23 -0.03 0.00 0.03 0.00 0.00 46.19 43.81 2dun s LEU 18 CO -0.03 0.15 1.26 -0.69 0.23 0.00 0.00 176.35 177.27 2dun s VAL 19 N 0.36 2.34 -0.01 -1.59 1.01 -1.24 -5.00 120.40 116.27 2dun s VAL 19 Ca 0.12 0.22 -0.01 0.00 0.00 0.00 0.00 61.98 62.31 2dun s VAL 19 Cb -0.12 -3.09 -0.00 0.00 0.00 0.00 0.00 36.38 33.17 2dun s VAL 19 CO 0.01 -0.04 -0.01 -0.33 0.00 0.00 0.00 175.10 174.73 2dun h GLU 20 N 0.85 0.00 0.10 2.72 4.39 -1.96 -3.37 114.58 117.31 2dun h GLU 20 Ca -0.51 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.19 2dun h GLU 20 Cb 1.31 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.96 2dun h GLU 20 CO 0.55 0.00 -0.05 -1.00 -1.16 0.00 0.00 179.01 177.35 2dun h PRO 21 N -0.11 -0.13 -0.65 2.33 0.13 -1.94 1.91 132.00 133.52 2dun h PRO 21 Ca 0.00 0.01 0.19 0.00 -0.87 0.00 0.00 66.00 65.33 2dun h PRO 21 Cb 0.04 0.03 -0.03 0.00 0.13 0.00 0.00 31.00 31.18 2dun h PRO 21 CO 0.00 0.30 0.84 -0.09 -0.23 0.00 0.00 178.00 178.82 2dun h ARG 22 N -0.62 0.00 0.00 0.86 9.65 -1.97 -3.24 114.38 119.05 2dun h ARG 22 Ca -0.01 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.87 2dun h ARG 22 Cb 0.50 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.08 2dun h ARG 22 CO 0.02 0.00 -0.01 -1.33 2.80 0.00 0.00 179.97 181.45 2dun n MET 23 N -3.36 0.01 0.00 0.20 2.81 -1.17 -4.61 117.12 111.00 2dun n MET 23 Ca 0.14 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.03 2dun n MET 23 Cb 1.06 -0.13 0.00 0.00 -0.71 0.00 0.00 33.22 33.44 2dun n MET 23 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2dun n GLY 24 N 3.30 1.62 0.09 3.03 0.00 0.65 -4.82 105.19 109.05 2dun n GLY 24 Ca -0.00 -1.71 -0.09 0.00 0.00 0.00 0.00 46.02 44.22 2dun n GLY 24 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2dun h ARG 25 N 0.00 -0.08 0.42 1.61 3.08 -1.94 -3.07 114.38 114.40 2dun h ARG 25 Ca 0.00 0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.04 2dun h ARG 25 Cb 0.00 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.07 2dun h ARG 25 CO 0.00 0.41 -0.20 0.77 -1.07 0.00 0.00 179.97 179.88 2dun h SER 26 N -0.95 -0.47 -1.10 7.04 0.02 -1.96 -2.24 113.55 113.89 2dun h SER 26 Ca -0.01 -0.08 0.33 0.00 -0.84 0.00 0.00 61.79 61.19 2dun h SER 26 Cb 0.53 0.12 -0.13 0.00 0.14 0.00 0.00 62.40 63.07 2dun h SER 26 CO 0.01 -0.05 0.68 -0.09 -1.14 0.00 0.00 176.83 176.24 2dun h ARG 27 N -1.05 0.28 0.42 3.45 9.65 -1.88 -0.76 114.38 124.50 2dun h ARG 27 Ca -0.06 -0.02 -0.02 0.00 -1.10 0.00 0.00 59.98 58.78 2dun h ARG 27 Cb 0.53 -0.06 0.00 0.00 -1.39 0.00 0.00 29.97 29.05 2dun h ARG 27 CO 0.09 0.19 -0.20 -0.09 2.80 0.00 0.00 179.97 182.76 2dun h ARG 28 N 0.29 -0.55 -0.92 0.20 2.43 -1.52 -3.26 114.38 111.06 2dun h ARG 28 Ca 0.71 0.04 0.23 0.00 -0.81 0.00 0.00 59.98 60.15 2dun h ARG 28 Cb 1.85 0.12 -0.17 0.00 -0.42 0.00 0.00 29.97 31.36 2dun h ARG 28 CO -0.46 -0.27 -0.01 0.00 -1.51 0.00 0.00 179.97 177.72 2dun h ALA 29 N -0.84 0.99 -0.26 2.80 0.00 -0.53 0.85 119.26 122.27 2dun h ALA 29 Ca -0.06 0.31 0.03 0.00 0.00 0.00 0.00 54.91 55.19 2dun h ALA 29 Cb 0.53 0.56 -0.04 0.00 0.00 0.00 0.00 17.79 18.84 2dun h ALA 29 CO 0.10 -0.50 -0.26 0.35 0.00 0.00 0.00 179.25 178.93 2dun h PHE 30 N 0.04 -0.82 -0.41 0.00 3.04 -1.39 -1.02 116.94 116.38 2dun h PHE 30 Ca 0.53 0.04 -0.01 0.00 3.98 0.00 0.00 57.97 62.51 2dun h PHE 30 Cb 1.01 0.39 -0.02 0.00 2.56 0.00 0.00 35.95 39.89 2dun h PHE 30 CO -0.51 -0.21 0.23 -0.07 -2.02 0.00 0.00 178.31 175.73 2dun h LEU 31 N -0.14 0.51 -0.72 0.59 3.38 -1.32 -2.64 115.31 114.97 2dun h LEU 31 Ca 0.04 -0.08 0.07 0.00 0.09 0.00 0.00 57.88 58.00 2dun h LEU 31 Cb 0.26 -0.13 -0.09 0.00 0.09 0.00 0.00 40.66 40.79 2dun h LEU 31 CO -0.32 0.44 -0.45 0.74 0.09 0.00 0.00 178.44 178.94 2dun h THR 32 N 0.53 0.00 -0.05 0.22 2.02 -0.07 0.17 112.91 115.73 2dun h THR 32 Ca 0.14 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.33 2dun h THR 32 Cb 0.05 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.45 2dun h THR 32 CO -0.02 0.00 0.01 1.23 0.37 0.00 0.00 175.52 177.11 2dun h GLY 33 N -0.04 0.05 -0.24 2.16 0.00 -1.18 -2.91 103.07 100.92 2dun h GLY 33 Ca 0.12 -0.01 0.05 0.00 0.00 0.00 0.00 47.33 47.49 2dun h GLY 33 CO -0.70 0.01 -0.50 -2.00 0.00 0.00 0.00 176.54 173.35 2dun h LEU 34 N 0.04 -1.62 -0.20 3.11 5.85 -0.82 -2.52 115.31 119.15 2dun h LEU 34 Ca 0.02 0.22 0.02 0.00 0.84 0.00 0.00 57.88 58.98 2dun h LEU 34 Cb 0.01 0.67 -0.04 0.00 0.37 0.00 0.00 40.66 41.67 2dun h LEU 34 CO -0.02 -0.42 -0.27 0.00 -0.34 0.00 0.00 178.44 177.38 2dun h ALA 35 N 0.05 -0.54 -0.99 1.25 0.00 -0.65 0.13 119.26 118.50 2dun h ALA 35 Ca 0.08 -0.00 0.39 0.00 0.00 0.00 0.00 54.91 55.38 2dun h ALA 35 Cb 0.62 0.91 -0.15 0.00 0.00 0.00 0.00 17.79 19.18 2dun h ALA 35 CO -0.52 -0.67 0.58 0.54 0.00 0.00 0.00 179.25 179.18 2dun n ARG 36 N -4.01 -0.05 -0.04 0.00 1.74 -1.02 0.16 116.66 113.44 2dun n ARG 36 Ca -0.02 1.17 -0.14 0.00 -0.77 0.00 0.00 57.85 58.09 2dun n ARG 36 Cb 0.17 -2.18 -0.08 0.00 -1.02 0.00 0.00 32.46 29.35 2dun n ARG 36 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2dun h SER 37 N 0.00 0.40 -0.80 0.55 0.87 -0.40 -3.24 113.55 110.93 2dun h SER 37 Ca 0.76 -0.59 0.03 0.00 -1.23 0.00 0.00 61.79 60.76 2dun h SER 37 Cb 2.16 -0.12 -0.05 0.00 -0.44 0.00 0.00 62.40 63.95 2dun h SER 37 CO -0.58 0.92 0.51 0.11 -0.53 0.00 0.00 176.83 177.26 2dun h LYS 38 N -0.10 0.96 0.00 2.24 1.79 0.29 -3.46 116.57 118.30 2dun h LYS 38 Ca -0.00 -0.06 0.00 0.00 -2.18 0.00 0.00 60.65 58.41 2dun h LYS 38 Cb 0.87 -0.22 0.00 0.00 -1.58 0.00 0.00 32.23 31.31 2dun h LYS 38 CO 0.06 0.64 0.00 0.41 -1.08 0.00 0.00 179.45 179.47 2dun n GLY 39 N -1.32 0.87 3.64 3.86 0.00 0.02 -4.88 105.19 107.39 2dun n GLY 39 Ca 0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 2dun n GLY 39 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dun s PHE 40 N -0.87 3.00 -0.34 1.61 0.08 -1.13 -2.56 117.98 117.78 2dun s PHE 40 Ca 0.00 0.04 -0.21 0.00 0.12 0.00 0.00 56.93 56.88 2dun s PHE 40 Cb 0.00 -1.66 -0.00 0.00 -0.57 0.00 0.00 43.02 40.79 2dun s PHE 40 CO 0.00 0.42 0.65 0.50 -0.10 0.00 0.00 175.22 176.69 2dun s ARG 41 N -1.41 3.77 -0.18 0.44 3.52 -1.20 -3.62 118.95 120.28 2dun s ARG 41 Ca 0.18 0.18 -0.09 0.00 -0.13 0.00 0.00 55.73 55.87 2dun s ARG 41 Cb -0.11 -3.78 -0.05 0.00 -1.56 0.00 0.00 34.95 29.45 2dun s ARG 41 CO 0.08 -0.68 0.14 0.08 -0.81 0.00 0.00 175.30 174.10 2dun s VAL 42 N 2.72 5.43 0.17 7.11 1.01 -1.26 -1.02 120.40 134.55 2dun s VAL 42 Ca 0.26 0.21 -0.09 0.00 0.00 0.00 0.00 61.98 62.35 2dun s VAL 42 Cb -0.14 -3.46 -0.07 0.00 0.00 0.00 0.00 36.38 32.71 2dun s VAL 42 CO 0.14 0.49 0.48 -0.76 0.00 0.00 0.00 175.10 175.45 2dun s LEU 43 N -0.01 4.25 -0.11 3.92 1.43 -1.05 -4.98 118.68 122.13 2dun s LEU 43 Ca 0.10 0.85 -0.16 0.00 -1.03 0.00 0.00 54.13 53.89 2dun s LEU 43 Cb -0.11 -3.39 -0.27 0.00 0.03 0.00 0.00 46.19 42.45 2dun s LEU 43 CO -0.00 0.03 0.54 -0.78 0.23 0.00 0.00 176.35 176.37 2dun h ASP 44 N 3.01 0.36 -4.30 2.29 1.82 -1.98 -3.44 116.42 114.18 2dun h ASP 44 Ca -0.47 -0.84 -0.36 0.00 -0.39 0.00 0.00 57.03 54.96 2dun h ASP 44 Cb 1.18 -0.12 -0.14 0.00 0.68 0.00 0.00 39.33 40.93 2dun h ASP 44 CO 0.69 1.61 -0.62 0.00 -1.61 0.00 0.00 179.24 179.31 2dun s ALA 45 N -2.47 1.78 0.49 -0.78 0.00 -1.26 -5.08 121.76 114.44 2dun s ALA 45 Ca -0.20 -1.86 -0.22 0.00 0.00 0.00 0.00 51.96 49.68 2dun s ALA 45 Cb 0.04 0.92 -0.09 0.00 0.00 0.00 0.00 23.12 23.99 2dun s ALA 45 CO 0.76 -0.41 0.88 0.00 0.00 0.00 0.00 175.76 176.98 2dun n SER 47 N 0.24 -1.30 0.05 0.00 3.41 -1.26 -5.01 113.62 109.74 2dun n SER 47 Ca 0.11 -1.52 0.13 0.00 -0.26 0.00 0.00 58.87 57.33 2dun n SER 47 Cb 0.43 2.08 0.45 0.00 -0.26 0.00 0.00 64.21 66.90 2dun n SER 47 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2dun n SER 48 N -1.09 0.43 0.11 4.04 3.41 -1.26 -3.47 113.62 115.78 2dun n SER 48 Ca 0.01 0.40 -0.03 0.00 -0.26 0.00 0.00 58.87 58.99 2dun n SER 48 Cb 0.51 -0.45 0.19 0.00 -0.26 0.00 0.00 64.21 64.20 2dun n SER 48 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2dun h GLU 49 N 0.00 0.17 -5.76 4.33 5.08 -1.96 -3.44 114.58 113.00 2dun h GLU 49 Ca 0.00 -0.10 -0.66 0.00 -1.00 0.00 0.00 59.36 57.60 2dun h GLU 49 Cb 0.62 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.83 2dun h GLU 49 CO 0.00 0.65 1.47 0.00 -1.00 0.00 0.00 179.01 180.13 2dun n ALA 50 N -2.46 0.56 -0.02 3.43 0.00 -1.23 -4.26 120.51 116.53 2dun n ALA 50 Ca -0.02 -0.07 -0.01 0.00 0.00 0.00 0.00 53.44 53.34 2dun n ALA 50 Cb 0.55 -2.36 -0.05 0.00 0.00 0.00 0.00 19.45 17.59 2dun n ALA 50 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2dun n THR 51 N 7.05 0.30 -3.50 0.00 -2.24 0.25 -4.37 114.28 111.77 2dun n THR 51 Ca 0.51 -0.23 -0.19 0.00 -2.27 0.00 0.00 64.05 61.87 2dun n THR 51 Cb 0.11 -0.46 -0.13 0.00 -2.10 0.00 0.00 70.33 67.75 2dun n THR 51 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2dun s HIS 52 N -2.25 -0.24 -0.25 4.78 3.76 -0.76 -2.78 115.29 117.55 2dun s HIS 52 Ca -0.03 0.14 -0.14 0.00 -0.15 0.00 0.00 55.06 54.88 2dun s HIS 52 Cb 0.03 -0.40 -0.04 0.00 1.11 0.00 0.00 32.58 33.27 2dun s HIS 52 CO 0.27 -0.62 0.31 0.08 -0.85 0.00 0.00 174.74 173.93 2dun s VAL 53 N 2.31 5.24 0.03 -0.90 1.01 -0.93 -1.67 120.40 125.49 2dun s VAL 53 Ca 0.07 0.46 -0.13 0.00 0.00 0.00 0.00 61.98 62.38 2dun s VAL 53 Cb -0.16 -3.64 -0.06 0.00 0.00 0.00 0.00 36.38 32.53 2dun s VAL 53 CO -0.13 0.23 0.42 -0.69 0.00 0.00 0.00 175.10 174.92 2dun s VAL 54 N 1.65 5.03 0.15 2.92 1.01 -0.82 0.21 120.40 130.55 2dun s VAL 54 Ca 0.13 0.74 -0.02 0.00 0.00 0.00 0.00 61.98 62.83 2dun s VAL 54 Cb -0.15 -3.70 -0.04 0.00 0.00 0.00 0.00 36.38 32.50 2dun s VAL 54 CO 0.09 0.48 0.10 -0.04 0.00 0.00 0.00 175.10 175.72 2dun s MET 55 N -1.37 1.02 0.03 2.72 -1.94 -1.03 -3.63 119.30 115.10 2dun s MET 55 Ca 0.27 -1.47 0.03 0.00 -1.71 0.00 0.00 55.69 52.82 2dun s MET 55 Cb -0.16 0.26 -0.02 0.00 2.01 0.00 0.00 34.83 36.93 2dun s MET 55 CO 0.15 -0.31 -0.09 -1.21 -0.01 0.00 0.00 175.02 173.55 2dun s GLU 56 N -4.07 0.64 -1.23 2.03 2.02 -1.26 0.41 118.70 117.24 2dun s GLU 56 Ca 0.27 -0.61 -0.14 0.00 0.02 0.00 0.00 54.97 54.52 2dun s GLU 56 Cb 0.07 -0.55 0.13 0.00 0.10 0.00 0.00 34.13 33.88 2dun s GLU 56 CO 0.04 0.13 0.43 -0.85 0.02 0.00 0.00 175.26 175.03 2dun n GLU 57 N 2.01 -2.16 -3.93 1.61 0.28 -1.26 -4.89 120.64 112.29 2dun n GLU 57 Ca -0.18 0.20 -0.35 0.00 -0.16 0.00 0.00 57.16 56.67 2dun n GLU 57 Cb 0.56 -4.81 -0.14 0.00 1.43 0.00 0.00 31.44 28.48 2dun n GLU 57 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 2dun s THR 58 N -2.84 3.29 1.12 3.84 2.01 -1.26 -5.11 115.64 116.69 2dun s THR 58 Ca 0.50 -0.52 -0.17 0.00 0.31 0.00 0.00 61.69 61.81 2dun s THR 58 Cb -0.28 -2.49 0.27 0.00 0.01 0.00 0.00 72.50 70.00 2dun s THR 58 CO 0.61 0.43 0.60 -0.24 -0.69 0.00 0.00 174.62 175.34 2dun n SER 59 N 4.76 -3.49 0.08 3.53 2.88 -1.26 -4.83 113.62 115.29 2dun n SER 59 Ca -0.18 -0.61 -0.05 0.00 -1.33 0.00 0.00 58.87 56.69 2dun n SER 59 Cb 0.51 -0.78 -0.06 0.00 -0.75 0.00 0.00 64.21 63.13 2dun n SER 59 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dun h ALA 60 N -3.13 0.48 0.13 -1.46 0.00 -1.92 -3.26 119.26 110.10 2dun h ALA 60 Ca -0.27 -0.81 -0.33 0.00 0.00 0.00 0.00 54.91 53.49 2dun h ALA 60 Cb 0.93 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 2dun h ALA 60 CO 0.16 1.12 -1.74 1.05 0.00 0.00 0.00 179.25 179.85 2dun h GLU 61 N 0.00 0.27 -0.65 0.00 4.11 -1.89 -2.88 114.58 113.54 2dun h GLU 61 Ca -0.01 -0.47 0.13 0.00 0.07 0.00 0.00 59.36 59.08 2dun h GLU 61 Cb 1.62 0.17 -0.04 0.00 0.50 0.00 0.00 28.75 31.01 2dun h GLU 61 CO 0.12 1.14 0.44 0.93 0.07 0.00 0.00 179.01 181.71 2dun h GLU 62 N 0.07 0.33 0.05 1.06 5.08 -1.91 -0.87 114.58 118.39 2dun h GLU 62 Ca -0.32 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.01 2dun h GLU 62 Cb 2.05 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 31.22 2dun h GLU 62 CO 0.14 0.22 -0.02 0.00 -1.00 0.00 0.00 179.01 178.34 2dun h ALA 63 N 1.68 -0.07 -0.02 3.43 0.00 -1.68 -1.62 119.26 120.99 2dun h ALA 63 Ca 0.31 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2dun h ALA 63 Cb 0.76 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 2dun h ALA 63 CO -0.08 -0.33 -0.06 0.28 0.00 0.00 0.00 179.25 179.06 2dun h VAL 64 N -0.48 1.05 -0.01 0.00 2.07 -1.48 -1.45 116.25 115.96 2dun h VAL 64 Ca -0.01 -0.24 -0.20 0.00 0.82 0.00 0.00 66.70 67.07 2dun h VAL 64 Cb 0.43 1.10 -0.01 0.00 -1.52 0.00 0.00 31.29 31.30 2dun h VAL 64 CO 0.01 0.07 -0.87 -1.28 0.02 0.00 0.00 177.57 175.52 2dun h SER 65 N 0.03 0.33 1.09 0.57 0.87 -1.10 -2.19 113.55 113.15 2dun h SER 65 Ca 0.01 -0.26 -0.09 0.00 -1.23 0.00 0.00 61.79 60.22 2dun h SER 65 Cb 0.12 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 61.96 2dun h SER 65 CO 0.01 1.05 -0.42 -0.25 -0.53 0.00 0.00 176.83 176.68 2dun h TRP 66 N 0.15 0.00 0.00 2.24 7.01 -0.44 -3.07 115.95 121.83 2dun h TRP 66 Ca -0.05 0.00 -0.01 0.00 2.11 0.00 0.00 58.89 60.94 2dun h TRP 66 Cb 1.49 0.00 -0.00 0.00 -2.10 0.00 0.00 29.16 28.54 2dun h TRP 66 CO 0.04 0.42 -0.77 -0.56 -2.79 0.00 0.00 178.44 174.78 2dun h GLN 67 N 0.00 0.00 0.20 2.65 3.07 -1.26 -3.37 115.11 116.41 2dun h GLN 67 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.73 2dun h GLN 67 Cb 1.08 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.64 2dun h GLN 67 CO 0.05 0.03 -0.10 0.93 0.09 0.00 0.00 178.83 179.84 2dun h GLU 68 N 0.00 -0.26 -1.29 0.06 5.08 -1.29 -2.18 114.58 114.70 2dun h GLU 68 Ca -0.01 0.02 0.37 0.00 -1.00 0.00 0.00 59.36 58.74 2dun h GLU 68 Cb 1.05 0.06 -0.07 0.00 0.50 0.00 0.00 28.75 30.29 2dun h GLU 68 CO 0.00 -0.03 0.90 0.00 -1.00 0.00 0.00 179.01 178.89 2dun h ARG 69 N -0.45 0.08 0.09 2.33 2.47 -1.71 -0.40 114.38 116.78 2dun h ARG 69 Ca -0.03 -0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.68 2dun h ARG 69 Cb 0.35 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 28.65 2dun h ARG 69 CO 0.04 0.05 -0.04 0.00 0.56 0.00 0.00 179.97 180.58 2dun h ARG 70 N 0.08 -0.11 -0.20 0.04 3.08 -1.67 -3.27 114.38 112.33 2dun h ARG 70 Ca 0.65 0.01 0.06 0.00 0.07 0.00 0.00 59.98 60.77 2dun h ARG 70 Cb 2.38 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 32.45 2dun h ARG 70 CO -0.11 -0.08 0.69 0.52 -1.07 0.00 0.00 179.97 179.93 2dun h MET 71 N -0.68 0.00 0.00 0.04 2.86 -0.73 0.51 114.93 116.93 2dun h MET 71 Ca -0.01 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.63 2dun h MET 71 Cb 0.09 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.75 2dun h MET 71 CO 0.02 0.00 -0.00 0.00 1.06 0.00 0.00 176.91 177.99 2dun h ALA 72 N 0.82 -0.00 -0.71 6.32 0.00 -1.16 -3.23 119.26 121.29 2dun h ALA 72 Ca 0.10 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2dun h ALA 72 Cb 1.47 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.26 2dun h ALA 72 CO -0.00 -0.26 0.00 0.00 0.00 0.00 0.00 179.25 178.98 2dun n ALA 73 N -2.34 2.48 -1.92 0.00 0.00 0.74 -4.97 120.51 114.50 2dun n ALA 73 Ca -0.08 -1.35 -0.31 0.00 0.00 0.00 0.00 53.44 51.69 2dun n ALA 73 Cb 0.24 -0.92 -0.03 0.00 0.00 0.00 0.00 19.45 18.75 2dun n ALA 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dun s ALA 74 N -1.14 3.13 0.64 0.00 0.00 0.14 -5.05 121.76 119.50 2dun s ALA 74 Ca 0.49 0.06 -0.15 0.00 0.00 0.00 0.00 51.96 52.35 2dun s ALA 74 Cb 0.26 -3.02 -0.01 0.00 0.00 0.00 0.00 23.12 20.36 2dun s ALA 74 CO 0.31 -0.25 1.11 -1.25 0.00 0.00 0.00 175.76 175.68 2dun s PRO 75 N -4.19 2.87 0.25 0.00 0.04 -1.26 -4.96 135.00 127.75 2dun s PRO 75 Ca 0.57 1.41 -0.30 0.00 0.04 0.00 0.00 61.00 62.72 2dun s PRO 75 Cb -0.10 -1.96 -0.09 0.00 0.04 0.00 0.00 34.50 32.39 2dun s PRO 75 CO 0.35 -1.20 1.27 -1.25 0.04 0.00 0.00 177.00 176.21 2dun s PRO 76 N -4.00 4.43 0.00 0.56 0.04 -1.26 -2.99 135.00 131.77 2dun s PRO 76 Ca 0.68 2.05 0.00 0.00 0.04 0.00 0.00 61.00 63.77 2dun s PRO 76 Cb -0.21 -3.16 0.00 0.00 0.04 0.00 0.00 34.50 31.17 2dun s PRO 76 CO 0.40 -0.15 0.00 0.41 0.04 0.00 0.00 177.00 177.70 2dun n GLY 77 N 1.73 3.32 3.69 0.56 0.00 -1.26 -5.03 105.19 108.20 2dun n GLY 77 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 2dun n GLY 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dun s THR 79 N 2.73 3.98 0.08 0.00 2.01 -1.26 -5.00 115.64 118.17 2dun s THR 79 Ca 0.78 1.88 -0.31 0.00 0.31 0.00 0.00 61.69 64.35 2dun s THR 79 Cb -0.44 -4.20 -0.07 0.00 0.01 0.00 0.00 72.50 67.81 2dun s THR 79 CO 0.35 0.40 1.39 -2.16 -0.69 0.00 0.00 174.62 173.91 2dun s PRO 80 N -0.91 4.32 0.26 4.92 0.04 -1.26 -4.99 135.00 137.38 2dun s PRO 80 Ca 0.44 2.03 -0.29 0.00 0.04 0.00 0.00 61.00 63.22 2dun s PRO 80 Cb -0.27 -3.34 -0.09 0.00 0.04 0.00 0.00 34.50 30.83 2dun s PRO 80 CO 0.34 -0.46 1.26 -1.25 0.04 0.00 0.00 177.00 176.93 2dun s PRO 81 N 1.45 4.44 -0.47 0.56 0.04 -1.26 -4.95 135.00 134.81 2dun s PRO 81 Ca 0.64 2.05 -0.28 0.00 0.04 0.00 0.00 61.00 63.45 2dun s PRO 81 Cb -0.35 -3.15 -0.01 0.00 0.04 0.00 0.00 34.50 31.03 2dun s PRO 81 CO 0.29 -0.12 1.68 0.00 0.04 0.00 0.00 177.00 178.89 2dun s ALA 82 N -0.58 2.68 -0.35 8.56 0.00 -1.12 -4.84 121.76 126.11 2dun s ALA 82 Ca 0.51 -0.25 -0.29 0.00 0.00 0.00 0.00 51.96 51.94 2dun s ALA 82 Cb -0.36 -4.10 -0.01 0.00 0.00 0.00 0.00 23.12 18.65 2dun s ALA 82 CO 0.44 -3.01 1.59 -0.51 0.00 0.00 0.00 175.76 174.26 2dun s LEU 83 N 7.12 3.59 0.44 0.00 1.43 -1.26 -2.20 118.68 127.80 2dun s LEU 83 Ca 0.68 1.12 0.07 0.00 -1.03 0.00 0.00 54.13 54.97 2dun s LEU 83 Cb -0.16 -3.53 -0.02 0.00 0.03 0.00 0.00 46.19 42.50 2dun s LEU 83 CO 0.28 -1.51 0.31 -0.76 0.23 0.00 0.00 176.35 174.90 2dun s LEU 84 N 5.95 3.18 0.20 1.79 1.43 0.13 -2.00 118.68 129.36 2dun s LEU 84 Ca 0.70 -0.95 0.06 0.00 -1.03 0.00 0.00 54.13 52.91 2dun s LEU 84 Cb -0.18 -1.69 -0.04 0.00 0.03 0.00 0.00 46.19 44.31 2dun s LEU 84 CO 0.32 -0.68 0.15 -0.62 0.23 0.00 0.00 176.35 175.75 2dun s ASP 85 N -4.07 5.50 0.60 2.29 2.15 -1.24 -2.48 116.67 119.41 2dun s ASP 85 Ca 0.43 -0.18 0.29 0.00 0.43 0.00 0.00 52.55 53.52 2dun s ASP 85 Cb -0.00 -1.41 1.24 0.00 -0.30 0.00 0.00 42.92 42.44 2dun s ASP 85 CO 0.25 0.03 1.60 -0.29 -0.17 0.00 0.00 175.17 176.59 2dun h ILE 86 N 1.86 0.17 -0.82 4.11 6.09 -0.40 0.42 117.51 128.94 2dun h ILE 86 Ca -0.48 0.00 0.03 0.00 -1.37 0.00 0.00 64.86 63.04 2dun h ILE 86 Cb 1.21 0.29 -0.05 0.00 0.47 0.00 0.00 36.82 38.74 2dun h ILE 86 CO 0.62 0.00 0.52 0.28 -3.07 0.00 0.00 178.15 176.50 2dun h SER 87 N 0.00 0.87 -0.60 2.19 0.02 -1.93 -1.07 113.55 113.03 2dun h SER 87 Ca 0.40 -0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 61.29 2dun h SER 87 Cb 2.18 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 64.50 2dun h SER 87 CO -0.00 0.60 0.19 -0.25 -1.14 0.00 0.00 176.83 176.22 2dun h TRP 88 N 1.02 0.96 0.48 3.45 7.01 -0.54 -2.62 115.95 125.72 2dun h TRP 88 Ca 0.33 -0.10 -0.02 0.00 2.11 0.00 0.00 58.89 61.21 2dun h TRP 88 Cb 0.01 -0.28 0.00 0.00 -2.10 0.00 0.00 29.16 26.79 2dun h TRP 88 CO -0.03 0.80 -0.23 1.25 -2.79 0.00 0.00 178.44 177.44 2dun h LEU 89 N 0.85 -0.55 -1.95 0.65 5.85 -1.45 -2.46 115.31 116.25 2dun h LEU 89 Ca 0.19 -0.04 0.19 0.00 0.84 0.00 0.00 57.88 59.06 2dun h LEU 89 Cb 0.29 0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.43 2dun h LEU 89 CO -0.01 -0.31 0.56 0.71 -0.34 0.00 0.00 178.44 179.05 2dun h THR 90 N -0.77 0.46 -0.14 1.05 1.35 -1.19 0.21 112.91 113.88 2dun h THR 90 Ca -0.07 0.00 -0.11 0.00 -0.55 0.00 0.00 66.41 65.68 2dun h THR 90 Cb 0.55 0.59 0.00 0.00 -1.73 0.00 0.00 68.15 67.56 2dun h THR 90 CO 0.11 0.00 -0.35 -0.33 -0.25 0.00 0.00 175.52 174.70 2dun h GLU 91 N 0.00 0.49 -0.10 4.72 4.39 -1.06 -2.26 114.58 120.75 2dun h GLU 91 Ca 0.31 -0.33 -0.21 0.00 0.34 0.00 0.00 59.36 59.46 2dun h GLU 91 Cb 1.42 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 30.12 2dun h GLU 91 CO -0.00 0.95 -0.79 0.77 -1.16 0.00 0.00 179.01 178.78 2dun h SER 92 N 0.10 0.72 -0.36 1.42 0.02 -0.49 -2.26 113.55 112.69 2dun h SER 92 Ca -0.00 -0.49 -0.01 0.00 -0.84 0.00 0.00 61.79 60.45 2dun h SER 92 Cb 0.96 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 63.26 2dun h SER 92 CO 0.08 1.26 0.18 -0.07 -1.14 0.00 0.00 176.83 177.14 2dun h LEU 93 N 0.40 0.47 0.00 5.07 3.38 -0.75 0.86 115.31 124.74 2dun h LEU 93 Ca -0.05 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.80 2dun h LEU 93 Cb 1.40 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 42.03 2dun h LEU 93 CO 0.15 0.46 0.00 0.61 0.09 0.00 0.00 178.44 179.75 2dun n GLY 94 N -0.89 -1.40 0.00 0.83 0.00 -0.85 -3.14 105.19 99.74 2dun n GLY 94 Ca -0.01 -0.10 0.07 0.00 0.00 0.00 0.00 46.02 45.98 2dun n GLY 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dun n ALA 95 N -1.46 3.25 0.00 4.61 0.00 -0.85 -4.98 120.51 121.08 2dun n ALA 95 Ca 0.08 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.15 2dun n ALA 95 Cb 0.30 -0.49 0.00 0.00 0.00 0.00 0.00 19.45 19.26 2dun n ALA 95 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dun n GLY 96 N 1.48 2.97 3.23 0.00 0.00 0.29 -4.96 105.19 108.21 2dun n GLY 96 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.83 2dun n GLY 96 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2dun s GLN 97 N 0.00 0.98 -0.39 1.61 -2.07 -1.08 -4.69 119.66 114.02 2dun s GLN 97 Ca 0.00 -1.13 -0.28 0.00 -1.82 0.00 0.00 55.36 52.13 2dun s GLN 97 Cb 0.00 -1.00 -0.01 0.00 -1.09 0.00 0.00 33.01 30.90 2dun s GLN 97 CO 0.00 0.21 1.72 -1.25 -1.32 0.00 0.00 175.29 174.66 2dun s PRO 98 N -2.16 3.28 0.58 9.60 0.04 -1.26 -4.17 135.00 140.90 2dun s PRO 98 Ca 0.05 1.19 -0.18 0.00 0.04 0.00 0.00 61.00 62.10 2dun s PRO 98 Cb -0.08 -4.19 -0.04 0.00 0.04 0.00 0.00 34.50 30.23 2dun s PRO 98 CO 0.03 -1.93 1.11 0.14 0.04 0.00 0.00 177.00 176.40 2dun s VAL 99 N 6.90 3.28 0.04 -0.36 -7.23 -1.26 -4.97 120.40 116.80 2dun s VAL 99 Ca 0.74 0.72 -0.31 0.00 -1.81 0.00 0.00 61.98 61.33 2dun s VAL 99 Cb -0.19 -3.25 -0.06 0.00 0.56 0.00 0.00 36.38 33.43 2dun s VAL 99 CO 0.31 -0.25 1.42 -2.16 -0.31 0.00 0.00 175.10 174.11 2dun s PRO 100 N -3.57 4.29 0.21 4.82 0.04 -1.26 -4.94 135.00 134.59 2dun s PRO 100 Ca 0.70 2.03 -0.29 0.00 0.04 0.00 0.00 61.00 63.48 2dun s PRO 100 Cb -0.22 -3.47 -0.16 0.00 0.04 0.00 0.00 34.50 30.68 2dun s PRO 100 CO 0.31 -0.54 0.69 0.28 0.04 0.00 0.00 177.00 177.78 2dun n VAL 101 N 4.44 1.83 -4.39 -0.36 0.31 -1.26 -4.97 118.33 113.92 2dun n VAL 101 Ca 0.13 -0.46 -0.24 0.00 -0.01 0.00 0.00 64.34 63.76 2dun n VAL 101 Cb 0.43 -0.25 -0.09 0.00 -0.91 0.00 0.00 33.84 33.03 2dun n VAL 101 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 2dun s GLU 102 N -1.03 1.97 0.58 5.55 0.41 -1.26 -5.00 118.70 119.92 2dun s GLU 102 Ca 0.65 -1.63 0.28 0.00 -0.41 0.00 0.00 54.97 53.86 2dun s GLU 102 Cb -0.90 -1.94 1.61 0.00 -1.78 0.00 0.00 34.13 31.12 2dun s GLU 102 CO 0.57 0.32 2.08 0.00 -0.49 0.00 0.00 175.26 177.74 2dun h ARG 104 N 0.00 0.00 -0.05 0.00 0.11 -2.01 -3.34 114.38 109.09 2dun h ARG 104 Ca 0.10 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.16 2dun h ARG 104 Cb 0.55 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.62 2dun h ARG 104 CO -0.00 0.86 -0.07 0.45 0.10 0.00 0.00 179.97 181.31 2dun h HIS 105 N 0.00 0.17 -1.33 4.08 3.86 -1.26 -3.45 115.15 117.21 2dun h HIS 105 Ca -0.08 -0.05 -0.70 0.00 -1.16 0.00 0.00 60.37 58.38 2dun h HIS 105 Cb 1.83 -0.03 0.08 0.00 1.06 0.00 0.00 27.41 30.35 2dun h HIS 105 CO 0.00 0.62 -0.10 0.54 0.86 0.00 0.00 177.93 179.84 2dun n ARG 106 N -4.72 0.39 -3.97 2.45 1.74 -0.74 -3.65 116.66 108.15 2dun n ARG 106 Ca -0.08 0.14 -0.31 0.00 -0.77 0.00 0.00 57.85 56.83 2dun n ARG 106 Cb 0.31 -1.44 -0.14 0.00 -1.02 0.00 0.00 32.46 30.16 2dun n ARG 106 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2dun s LEU 107 N 1.33 4.69 0.05 0.55 1.43 -0.85 -4.96 118.68 120.91 2dun s LEU 107 Ca 0.74 -2.42 -0.17 0.00 -1.03 0.00 0.00 54.13 51.25 2dun s LEU 107 Cb -1.00 -1.65 0.03 0.00 0.03 0.00 0.00 46.19 43.60 2dun s LEU 107 CO 0.55 -0.35 0.38 -0.70 0.23 0.00 0.00 176.35 176.47 2dun s GLU 108 N 0.54 0.89 0.41 1.70 -6.30 -1.09 -4.39 118.70 110.46 2dun s GLU 108 Ca 0.13 -0.41 0.07 0.00 -2.50 0.00 0.00 54.97 52.26 2dun s GLU 108 Cb -0.21 0.40 -0.07 0.00 0.00 0.00 0.00 34.13 34.24 2dun s GLU 108 CO -0.05 -0.30 0.06 0.54 0.02 0.00 0.00 175.26 175.53 2dun s VAL 109 N -2.53 2.13 -0.30 3.70 0.11 -1.23 -4.62 120.40 117.65 2dun s VAL 109 Ca -0.05 -1.90 -0.14 0.00 -2.93 0.00 0.00 61.98 56.96 2dun s VAL 109 Cb -0.01 -2.98 0.18 0.00 -1.53 0.00 0.00 36.38 32.03 2dun s VAL 109 CO -0.03 -0.01 1.08 0.00 -3.33 0.00 0.00 175.10 172.81 2dun s ALA 110 N -2.67 -3.55 -0.27 1.54 0.00 -1.26 -5.03 121.76 110.53 2dun s ALA 110 Ca 0.37 1.40 -0.01 0.00 0.00 0.00 0.00 51.96 53.72 2dun s ALA 110 Cb 0.08 -2.54 0.00 0.00 0.00 0.00 0.00 23.12 20.66 2dun s ALA 110 CO 0.20 -1.49 0.27 0.41 0.00 0.00 0.00 175.76 175.14 2dun n GLY 111 N 5.46 -0.70 3.73 0.00 0.00 -1.26 -4.98 105.19 107.44 2dun n GLY 111 Ca -0.07 0.11 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 2dun n GLY 111 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dun s PRO 112 N -2.81 4.37 0.50 1.61 0.04 -1.26 -5.02 135.00 132.43 2dun s PRO 112 Ca 0.01 2.04 -0.08 0.00 0.04 0.00 0.00 61.00 63.02 2dun s PRO 112 Cb -0.00 -3.22 -0.04 0.00 0.04 0.00 0.00 34.50 31.28 2dun s PRO 112 CO 0.29 -0.31 0.85 1.03 0.04 0.00 0.00 177.00 178.90 2dun s ARG 113 N 0.32 3.60 -0.08 4.56 1.81 -1.26 -5.09 118.95 122.81 2dun s ARG 113 Ca 0.59 0.39 -0.01 0.00 -1.72 0.00 0.00 55.73 54.97 2dun s ARG 113 Cb -0.36 -2.30 0.03 0.00 -0.45 0.00 0.00 34.95 31.87 2dun s ARG 113 CO 0.35 -0.27 0.01 0.15 -0.68 0.00 0.00 175.30 174.86 2dun s LYS 114 N -4.70 0.60 0.32 3.54 -0.14 -1.26 -5.09 119.74 113.01 2dun s LYS 114 Ca 0.50 0.08 0.00 0.00 -1.36 0.00 0.00 55.97 55.19 2dun s LYS 114 Cb -0.10 -1.04 0.00 0.00 -1.68 0.00 0.00 37.83 35.00 2dun s LYS 114 CO 0.45 -0.33 0.00 0.41 -0.76 0.00 0.00 175.35 175.12 2dun n GLY 115 N 5.14 -2.95 3.58 -3.33 0.00 -1.26 -4.96 105.19 101.41 2dun n GLY 115 Ca -0.07 -1.24 -0.30 0.00 0.00 0.00 0.00 46.02 44.40 2dun n GLY 115 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dun s PRO 116 N -3.58 -1.48 -0.01 1.61 0.04 -1.26 -5.08 135.00 125.24 2dun s PRO 116 Ca 0.00 -0.16 0.02 0.00 0.04 0.00 0.00 61.00 60.90 2dun s PRO 116 Cb 0.00 -1.57 -0.00 0.00 0.04 0.00 0.00 34.50 32.96 2dun s PRO 116 CO 0.00 -3.86 -0.06 -0.48 0.04 0.00 0.00 177.00 172.64 2dun s LEU 117 N -7.01 1.96 0.01 -3.56 0.05 -1.26 -5.15 118.68 103.72 2dun s LEU 117 Ca 0.72 -0.12 0.02 0.00 0.05 0.00 0.00 54.13 54.80 2dun s LEU 117 Cb -0.08 -0.34 -0.01 0.00 -2.05 0.00 0.00 46.19 43.71 2dun s LEU 117 CO 0.56 0.07 -0.07 -0.44 -0.55 0.00 0.00 176.35 175.91 2dun s SER 118 N -0.08 0.85 -0.02 1.48 0.01 -1.26 -5.07 113.70 109.62 2dun s SER 118 Ca 0.01 -0.23 -0.25 0.00 1.31 0.00 0.00 55.95 56.79 2dun s SER 118 Cb -0.03 -0.06 -0.20 0.00 0.21 0.00 0.00 66.02 65.94 2dun s SER 118 CO -0.00 0.02 1.23 1.55 0.41 0.00 0.00 173.24 176.45 2dun h PRO 119 N 5.61 -0.05 0.00 12.44 0.13 -2.09 -3.49 132.00 144.56 2dun h PRO 119 Ca -0.31 0.00 0.13 0.00 -0.87 0.00 0.00 66.00 64.96 2dun h PRO 119 Cb 1.19 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.31 2dun h PRO 119 CO 0.48 0.43 0.45 0.00 -0.23 0.00 0.00 178.00 179.12 2dun n ALA 120 N -2.37 -1.99 -2.72 -0.56 0.00 -1.26 -5.16 120.51 106.45 2dun n ALA 120 Ca -0.08 -0.69 -0.33 0.00 0.00 0.00 0.00 53.44 52.34 2dun n ALA 120 Cb 0.25 0.34 -0.12 0.00 0.00 0.00 0.00 19.45 19.92 2dun n ALA 120 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 2dun s TRP 121 N -3.12 2.89 -0.05 0.00 -0.11 -1.26 -5.11 118.94 112.18 2dun s TRP 121 Ca 0.17 -0.17 -0.02 0.00 1.22 0.00 0.00 56.10 57.30 2dun s TRP 121 Cb -0.02 -1.77 0.04 0.00 -1.50 0.00 0.00 33.47 30.22 2dun s TRP 121 CO 0.03 0.15 0.09 -1.64 -4.62 0.00 0.00 176.95 170.96 2dun s MET 122 N -0.39 0.01 0.70 5.86 -1.94 -1.26 -5.16 119.30 117.13 2dun s MET 122 Ca 0.05 0.32 -0.12 0.00 -1.71 0.00 0.00 55.69 54.23 2dun s MET 122 Cb -0.12 -0.26 0.17 0.00 2.01 0.00 0.00 34.83 36.64 2dun s MET 122 CO 0.02 -0.20 0.63 -0.35 -0.01 0.00 0.00 175.02 175.11 2dun n PRO 123 N 4.44 -2.24 -0.07 2.03 -0.04 -1.26 -5.01 135.00 132.85 2dun n PRO 123 Ca -0.22 -1.00 -0.06 0.00 -0.04 0.00 0.00 63.50 62.18 2dun n PRO 123 Cb 0.51 -0.94 -0.16 0.00 -0.04 0.00 0.00 33.50 32.87 2dun n PRO 123 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2dun n ALA 124 N -4.07 1.74 0.51 0.55 0.00 -1.26 -4.23 120.51 113.75 2dun n ALA 124 Ca -0.12 -1.12 -0.01 0.00 0.00 0.00 0.00 53.44 52.19 2dun n ALA 124 Cb 0.34 -0.36 0.08 0.00 0.00 0.00 0.00 19.45 19.50 2dun n ALA 124 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 2dun n TYR 125 N -2.70 0.58 -2.89 0.00 4.11 -1.26 -4.71 117.16 110.29 2dun n TYR 125 Ca -0.26 -0.38 -0.44 0.00 -0.00 0.00 0.00 57.90 56.82 2dun n TYR 125 Cb 1.04 -0.27 -0.01 0.00 -0.00 0.00 0.00 39.34 40.10 2dun n TYR 125 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 2dun s ALA 126 N -1.23 3.64 -0.15 -3.48 0.00 -1.26 -4.93 121.76 114.34 2dun s ALA 126 Ca 0.13 -3.04 -0.08 0.00 0.00 0.00 0.00 51.96 48.97 2dun s ALA 126 Cb 0.11 -4.15 0.06 0.00 0.00 0.00 0.00 23.12 19.13 2dun s ALA 126 CO 0.03 -2.94 0.37 0.00 0.00 0.00 0.00 175.76 173.23 2dun s SER 128 N 1.43 -0.09 -0.23 0.00 1.04 -1.26 -5.19 113.70 109.39 2dun s SER 128 Ca -0.09 -0.85 -0.29 0.00 0.48 0.00 0.00 55.95 55.20 2dun s SER 128 Cb -0.09 0.67 0.16 0.00 0.10 0.00 0.00 66.02 66.86 2dun s SER 128 CO -0.12 -1.28 1.18 -0.83 0.98 0.00 0.00 173.24 173.17 2dun s GLY 129 N -3.00 -0.06 0.22 7.32 0.00 -1.26 -5.15 107.32 105.39 2dun s GLY 129 Ca 0.18 2.56 -0.30 0.00 0.00 0.00 0.00 44.72 47.16 2dun s GLY 129 CO 0.09 1.26 1.29 2.56 0.00 0.00 0.00 173.10 178.30 2dun s PRO 130 N -0.78 4.40 0.07 2.90 0.04 -1.26 -5.04 135.00 135.33 2dun s PRO 130 Ca 0.04 2.05 0.07 0.00 0.04 0.00 0.00 61.00 63.20 2dun s PRO 130 Cb -0.02 -3.18 -0.04 0.00 0.04 0.00 0.00 34.50 31.30 2dun s PRO 130 CO -0.05 -0.22 -0.15 -1.54 0.04 0.00 0.00 177.00 175.09 2dun s SER 131 N 0.18 4.04 0.29 6.66 1.04 -1.26 -5.13 113.70 119.53 2dun s SER 131 Ca 0.55 -0.42 -0.08 0.00 0.48 0.00 0.00 55.95 56.48 2dun s SER 131 Cb -0.36 -0.69 0.00 0.00 0.10 0.00 0.00 66.02 65.06 2dun s SER 131 CO 0.40 0.22 0.48 -0.94 0.98 0.00 0.00 173.24 174.38 2dun s SER 132 N -1.80 0.34 0.00 7.02 1.04 -1.26 -5.37 113.70 113.67 2dun s SER 132 Ca 0.17 -1.21 0.13 0.00 0.48 0.00 0.00 55.95 55.52 2dun s SER 132 Cb -0.11 0.63 0.75 0.00 0.10 0.00 0.00 66.02 67.39 2dun s SER 132 CO 0.09 -1.23 1.18 0.61 0.98 0.00 0.00 173.24 174.87