#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dun n SER 2 N 0.00 -0.46 -4.82 1.61 3.41 -1.26 -4.89 113.62 107.20 2dun n SER 2 Ca 0.00 0.96 -0.30 0.00 -0.26 0.00 0.00 58.87 59.27 2dun n SER 2 Cb 0.00 -0.78 0.07 0.00 -0.26 0.00 0.00 64.21 63.24 2dun n SER 2 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2dun s SER 3 N -0.37 4.94 0.06 4.04 1.04 -1.26 -4.90 113.70 117.25 2dun s SER 3 Ca 0.66 1.39 0.00 0.00 0.48 0.00 0.00 55.95 58.48 2dun s SER 3 Cb -0.94 -2.19 0.00 0.00 0.10 0.00 0.00 66.02 63.00 2dun s SER 3 CO 0.47 -1.69 0.00 0.61 0.98 0.00 0.00 173.24 173.61 2dun n GLY 4 N -2.19 -2.20 3.63 7.32 0.00 -1.26 -4.82 105.19 105.67 2dun n GLY 4 Ca 0.07 -1.47 -0.37 0.00 0.00 0.00 0.00 46.02 44.25 2dun n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dun s SER 5 N -2.98 6.13 0.13 1.61 0.01 -1.26 -5.00 113.70 112.34 2dun s SER 5 Ca 0.00 0.13 -0.30 0.00 1.31 0.00 0.00 55.95 57.09 2dun s SER 5 Cb 0.00 -2.13 -0.09 0.00 0.21 0.00 0.00 66.02 64.01 2dun s SER 5 CO 0.00 -0.02 1.51 -1.28 0.41 0.00 0.00 173.24 173.86 2dun h SER 6 N 7.87 -1.86 0.00 2.44 0.87 -1.94 -3.45 113.55 117.48 2dun h SER 6 Ca -0.36 0.26 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 2dun h SER 6 Cb 1.18 0.79 0.00 0.00 -0.44 0.00 0.00 62.40 63.92 2dun h SER 6 CO 0.62 -0.31 0.00 0.61 -0.53 0.00 0.00 176.83 177.22 2dun n GLY 7 N -1.30 -0.11 3.07 5.77 0.00 -1.26 -5.15 105.19 106.20 2dun n GLY 7 Ca -0.01 0.29 -0.32 0.00 0.00 0.00 0.00 46.02 45.98 2dun n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dun s SER 8 N 0.00 3.33 0.40 1.61 0.01 -1.26 -5.10 113.70 112.69 2dun s SER 8 Ca 0.00 -0.80 -0.20 0.00 1.31 0.00 0.00 55.95 56.26 2dun s SER 8 Cb 0.00 -1.38 -0.15 0.00 0.21 0.00 0.00 66.02 64.70 2dun s SER 8 CO 0.00 -0.08 0.07 1.07 0.41 0.00 0.00 173.24 174.71 2dun n THR 9 N 4.63 0.57 -0.21 1.44 5.66 -1.26 -4.81 114.28 120.31 2dun n THR 9 Ca -0.18 -0.48 0.01 0.00 -3.05 0.00 0.00 64.05 60.35 2dun n THR 9 Cb 0.48 0.00 0.12 0.00 -1.55 0.00 0.00 70.33 69.38 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 0.29 0.30 -3.19 1.09 3.08 -1.93 -3.24 114.38 110.77 2dun h ARG 10 Ca -0.36 -0.02 -0.64 0.00 0.07 0.00 0.00 59.98 59.03 2dun h ARG 10 Cb 1.40 -0.07 -0.41 0.00 0.08 0.00 0.00 29.97 30.97 2dun h ARG 10 CO 0.45 0.20 -0.51 -0.06 -1.07 0.00 0.00 179.97 178.98 2dun s PHE 11 N -6.09 3.54 -1.10 3.04 0.08 -1.22 -4.91 117.98 111.32 2dun s PHE 11 Ca -0.13 -3.25 0.14 0.00 0.12 0.00 0.00 56.93 53.81 2dun s PHE 11 Cb 0.18 -2.82 0.64 0.00 -0.57 0.00 0.00 43.02 40.45 2dun s PHE 11 CO 0.74 -0.62 1.44 -0.35 -0.10 0.00 0.00 175.22 176.34 2dun n PRO 12 N 2.29 0.05 -1.10 0.24 -0.04 -1.23 -2.65 135.00 132.56 2dun n PRO 12 Ca 0.17 0.23 -0.15 0.00 -0.04 0.00 0.00 63.50 63.71 2dun n PRO 12 Cb 0.35 -1.50 0.23 0.00 -0.04 0.00 0.00 33.50 32.54 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 4.23 2.71 0.55 0.00 -1.26 -4.85 105.19 106.53 2dun n GLY 13 Ca 0.04 -1.07 -0.21 0.00 0.00 0.00 0.00 46.02 44.78 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 -3.18 -0.19 -0.14 1.61 1.01 -1.08 -5.07 120.40 113.36 2dun s VAL 14 Ca 0.55 0.07 0.01 0.00 0.00 0.00 0.00 61.98 62.60 2dun s VAL 14 Cb 0.46 -0.46 -0.01 0.00 0.00 0.00 0.00 36.38 36.36 2dun s VAL 14 CO 0.11 -0.08 -0.15 0.00 0.00 0.00 0.00 175.10 174.97 2dun s ALA 15 N 2.23 2.51 -0.05 5.51 0.00 -1.26 -3.77 121.76 126.93 2dun s ALA 15 Ca 0.04 -0.96 0.05 0.00 0.00 0.00 0.00 51.96 51.09 2dun s ALA 15 Cb -0.14 -1.17 -0.02 0.00 0.00 0.00 0.00 23.12 21.79 2dun s ALA 15 CO -0.08 0.14 -0.21 0.42 0.00 0.00 0.00 175.76 176.02 2dun s ILE 16 N 0.55 2.41 -0.11 0.00 1.01 -1.15 -0.56 121.20 123.35 2dun s ILE 16 Ca -0.10 -0.95 0.03 0.00 0.00 0.00 0.00 60.65 59.63 2dun s ILE 16 Cb -0.16 -1.90 0.00 0.00 0.01 0.00 0.00 42.46 40.42 2dun s ILE 16 CO 0.04 0.58 -0.22 -0.47 0.00 0.00 0.00 174.94 174.87 2dun s TYR 17 N -0.41 2.44 0.01 3.97 6.14 -1.20 -2.85 117.35 125.44 2dun s TYR 17 Ca 0.04 -1.07 -0.15 0.00 0.64 0.00 0.00 57.07 56.54 2dun s TYR 17 Cb -0.12 -1.65 -0.06 0.00 0.42 0.00 0.00 41.96 40.55 2dun s TYR 17 CO 0.02 -0.46 0.42 -0.51 0.64 0.00 0.00 175.55 175.65 2dun s LEU 18 N 0.54 4.48 -0.73 6.97 1.43 -1.26 -2.84 118.68 127.26 2dun s LEU 18 Ca -0.15 0.98 -0.24 0.00 -1.03 0.00 0.00 54.13 53.70 2dun s LEU 18 Cb -0.17 -2.61 0.06 0.00 0.03 0.00 0.00 46.19 43.50 2dun s LEU 18 CO 0.05 0.32 1.10 -0.69 0.23 0.00 0.00 176.35 177.36 2dun s VAL 19 N -1.09 4.16 0.12 -1.59 1.01 -1.26 -4.92 120.40 116.84 2dun s VAL 19 Ca 0.24 -0.27 -0.20 0.00 0.00 0.00 0.00 61.98 61.75 2dun s VAL 19 Cb -0.17 -4.78 -0.00 0.00 0.00 0.00 0.00 36.38 31.42 2dun s VAL 19 CO 0.14 -1.61 1.09 -0.62 0.00 0.00 0.00 175.10 174.11 2dun n GLU 20 N 8.16 -0.28 0.00 2.72 1.02 -1.26 0.58 120.64 131.57 2dun n GLU 20 Ca 0.03 1.08 0.00 0.00 -0.02 0.00 0.00 57.16 58.24 2dun n GLU 20 Cb 0.47 -1.58 0.00 0.00 -0.02 0.00 0.00 31.44 30.31 2dun n GLU 20 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 2dun n PRO 21 N -4.92 0.00 -0.15 3.49 -0.04 -1.26 0.15 135.00 132.27 2dun n PRO 21 Ca 0.03 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.57 2dun n PRO 21 Cb 0.20 -0.26 0.16 0.00 -0.04 0.00 0.00 33.50 33.57 2dun n PRO 21 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2dun n ARG 22 N -0.00 -0.03 0.02 0.54 5.12 -1.23 0.38 116.66 121.46 2dun n ARG 22 Ca 0.00 0.63 -0.02 0.00 -1.93 0.00 0.00 57.85 56.53 2dun n ARG 22 Cb 0.00 -1.04 -0.01 0.00 -1.16 0.00 0.00 32.46 30.25 2dun n ARG 22 CO 0.00 0.00 0.00 1.98 -1.93 0.00 0.00 177.63 177.68 2dun h MET 23 N 0.00 -0.14 0.00 5.56 4.05 0.00 -3.40 114.93 121.00 2dun h MET 23 Ca 0.29 0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.72 2dun h MET 23 Cb 0.66 0.03 0.00 0.00 -0.80 0.00 0.00 31.60 31.50 2dun h MET 23 CO -0.38 -0.09 0.00 0.41 0.23 0.00 0.00 176.91 177.07 2dun n GLY 24 N 1.40 3.39 0.07 1.39 0.00 0.40 -4.74 105.19 107.10 2dun n GLY 24 Ca -0.02 -1.65 -0.14 0.00 0.00 0.00 0.00 46.02 44.21 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 0.01 0.00 1.61 2.47 -1.84 -3.32 114.38 113.31 2dun h ARG 25 Ca 0.00 -0.01 -0.04 0.00 -1.26 0.00 0.00 59.98 58.67 2dun h ARG 25 Cb 0.00 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.32 2dun h ARG 25 CO 0.00 0.99 -0.50 0.77 0.56 0.00 0.00 179.97 181.79 2dun h SER 26 N -0.97 0.00 -0.90 7.04 0.02 -1.94 -3.37 113.55 113.44 2dun h SER 26 Ca -0.00 -0.15 0.36 0.00 -0.84 0.00 0.00 61.79 61.15 2dun h SER 26 Cb 1.00 0.00 -0.14 0.00 0.14 0.00 0.00 62.40 63.40 2dun h SER 26 CO 0.00 0.84 0.51 -1.14 -1.14 0.00 0.00 176.83 175.91 2dun n ARG 27 N -4.62 -0.04 0.26 3.45 3.00 -1.26 0.72 116.66 118.16 2dun n ARG 27 Ca -0.10 1.10 -0.16 0.00 -0.00 0.00 0.00 57.85 58.69 2dun n ARG 27 Cb 0.29 -2.03 -0.08 0.00 0.00 0.00 0.00 32.46 30.65 2dun n ARG 27 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.63 177.54 2dun h ARG 28 N 0.00 -0.73 -0.31 -0.14 2.43 -1.72 -2.92 114.38 110.98 2dun h ARG 28 Ca 0.70 0.05 0.07 0.00 -0.81 0.00 0.00 59.98 59.99 2dun h ARG 28 Cb 1.96 0.17 -0.07 0.00 -0.42 0.00 0.00 29.97 31.61 2dun h ARG 28 CO -0.57 -0.49 -0.15 0.00 -1.51 0.00 0.00 179.97 177.25 2dun h ALA 29 N -0.31 0.10 -0.98 2.80 0.00 0.13 -0.57 119.26 120.43 2dun h ALA 29 Ca -0.04 0.12 0.19 0.00 0.00 0.00 0.00 54.91 55.18 2dun h ALA 29 Cb 0.66 0.36 -0.19 0.00 0.00 0.00 0.00 17.79 18.62 2dun h ALA 29 CO -0.00 -0.54 -0.25 0.35 0.00 0.00 0.00 179.25 178.81 2dun h PHE 30 N -0.10 -0.55 -0.02 0.00 3.57 -1.28 0.64 116.94 119.20 2dun h PHE 30 Ca 0.16 0.09 -0.02 0.00 3.53 0.00 0.00 57.97 61.73 2dun h PHE 30 Cb 0.34 0.40 0.00 0.00 2.79 0.00 0.00 35.95 39.48 2dun h PHE 30 CO -0.35 -0.42 -0.05 -0.07 -2.23 0.00 0.00 178.31 175.19 2dun h LEU 31 N -0.00 0.08 -0.70 0.59 3.38 -1.22 -2.88 115.31 114.56 2dun h LEU 31 Ca 0.46 -0.56 0.07 0.00 0.09 0.00 0.00 57.88 57.94 2dun h LEU 31 Cb 0.71 -0.02 -0.09 0.00 0.09 0.00 0.00 40.66 41.35 2dun h LEU 31 CO -1.01 0.63 -0.40 0.41 0.09 0.00 0.00 178.44 178.16 2dun n THR 32 N -4.75 -0.47 -0.11 0.22 -1.04 0.18 0.19 114.28 108.50 2dun n THR 32 Ca -0.08 1.69 -0.11 0.00 -2.04 0.00 0.00 64.05 63.50 2dun n THR 32 Cb 0.31 -2.11 -0.03 0.00 -1.82 0.00 0.00 70.33 66.68 2dun n THR 32 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 2dun h GLY 33 N 0.00 0.66 0.19 3.41 0.00 -1.53 -2.76 103.07 103.04 2dun h GLY 33 Ca 0.13 -0.54 0.00 0.00 0.00 0.00 0.00 47.33 46.92 2dun h GLY 33 CO -0.66 0.50 -0.38 -2.00 0.00 0.00 0.00 176.54 173.99 2dun h LEU 34 N 0.38 -1.11 -0.34 3.11 5.85 -0.02 -1.22 115.31 121.95 2dun h LEU 34 Ca 0.08 0.11 0.07 0.00 0.84 0.00 0.00 57.88 58.98 2dun h LEU 34 Cb 0.57 0.40 -0.09 0.00 0.37 0.00 0.00 40.66 41.91 2dun h LEU 34 CO 0.03 -0.44 -0.35 0.00 -0.34 0.00 0.00 178.44 177.35 2dun h ALA 35 N -0.93 -0.27 -0.78 1.25 0.00 -0.51 -0.72 119.26 117.30 2dun h ALA 35 Ca -0.02 0.08 0.18 0.00 0.00 0.00 0.00 54.91 55.15 2dun h ALA 35 Cb 0.59 0.72 -0.13 0.00 0.00 0.00 0.00 17.79 18.97 2dun h ALA 35 CO -0.15 -0.77 0.06 0.00 0.00 0.00 0.00 179.25 178.39 2dun h ARG 36 N -0.30 0.13 -0.57 0.00 3.08 -1.25 0.52 114.38 115.99 2dun h ARG 36 Ca 0.15 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.19 2dun h ARG 36 Cb 0.55 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.54 2dun h ARG 36 CO -0.51 0.09 0.37 1.03 -1.07 0.00 0.00 179.97 179.88 2dun h SER 37 N 0.14 0.66 0.46 7.04 0.87 0.09 -3.08 113.55 119.73 2dun h SER 37 Ca 0.44 -0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 60.95 2dun h SER 37 Cb 0.79 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.59 2dun h SER 37 CO -0.65 0.49 -0.22 0.11 -0.53 0.00 0.00 176.83 176.03 2dun h LYS 38 N 0.77 -0.59 0.00 2.24 1.79 0.69 -3.48 116.57 117.99 2dun h LYS 38 Ca 0.21 0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.72 2dun h LYS 38 Cb -0.07 0.14 0.00 0.00 -1.58 0.00 0.00 32.23 30.71 2dun h LYS 38 CO -0.04 -0.33 0.00 0.41 -1.08 0.00 0.00 179.45 178.40 2dun n GLY 39 N 0.02 0.00 3.23 3.86 0.00 -0.11 -4.96 105.19 107.23 2dun n GLY 39 Ca -0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.63 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 0.00 2.27 -0.34 1.61 0.08 -1.10 -3.43 117.98 117.06 2dun s PHE 40 Ca 0.00 -0.70 -0.28 0.00 0.12 0.00 0.00 56.93 56.08 2dun s PHE 40 Cb 0.00 -1.50 0.02 0.00 -0.57 0.00 0.00 43.02 40.97 2dun s PHE 40 CO 0.00 -0.22 1.01 0.50 -0.10 0.00 0.00 175.22 176.41 2dun s ARG 41 N -0.06 3.97 -0.25 0.44 3.52 -1.25 -3.58 118.95 121.74 2dun s ARG 41 Ca -0.05 0.85 -0.16 0.00 -0.13 0.00 0.00 55.73 56.24 2dun s ARG 41 Cb -0.14 -3.77 -0.03 0.00 -1.56 0.00 0.00 34.95 29.45 2dun s ARG 41 CO 0.04 -0.93 0.44 0.08 -0.81 0.00 0.00 175.30 174.12 2dun s VAL 42 N 3.60 5.13 0.15 7.11 1.01 -1.26 -2.93 120.40 133.21 2dun s VAL 42 Ca 0.42 0.74 -0.30 0.00 0.00 0.00 0.00 61.98 62.84 2dun s VAL 42 Cb -0.12 -3.76 -0.07 0.00 0.00 0.00 0.00 36.38 32.43 2dun s VAL 42 CO 0.17 0.14 1.09 -0.76 0.00 0.00 0.00 175.10 175.74 2dun s LEU 43 N 2.06 4.48 0.01 3.92 1.43 -1.13 -4.96 118.68 124.48 2dun s LEU 43 Ca 0.18 2.03 -0.24 0.00 -1.03 0.00 0.00 54.13 55.08 2dun s LEU 43 Cb -0.16 -3.60 -0.17 0.00 0.03 0.00 0.00 46.19 42.29 2dun s LEU 43 CO 0.09 -0.23 1.36 -2.24 0.23 0.00 0.00 176.35 175.57 2dun h ASP 44 N 5.38 0.12 -3.15 2.29 2.03 -1.97 -3.45 116.42 117.67 2dun h ASP 44 Ca -0.44 -0.41 -0.49 0.00 -0.73 0.00 0.00 57.03 54.96 2dun h ASP 44 Cb 1.21 -0.03 -0.14 0.00 -0.83 0.00 0.00 39.33 39.54 2dun h ASP 44 CO 0.73 0.51 -0.59 0.00 -1.03 0.00 0.00 179.24 178.86 2dun s ALA 45 N -4.56 2.51 0.40 4.15 0.00 -1.26 -5.07 121.76 117.93 2dun s ALA 45 Ca -0.15 -1.87 -0.27 0.00 0.00 0.00 0.00 51.96 49.68 2dun s ALA 45 Cb 0.03 0.66 -0.09 0.00 0.00 0.00 0.00 23.12 23.72 2dun s ALA 45 CO 0.70 -0.31 1.35 0.00 0.00 0.00 0.00 175.76 177.49 2dun s SER 47 N -0.59 -0.12 0.45 0.00 1.04 -1.26 -5.02 113.70 108.19 2dun s SER 47 Ca 0.56 -0.19 0.16 0.00 0.48 0.00 0.00 55.95 56.96 2dun s SER 47 Cb -0.40 0.27 1.08 0.00 0.10 0.00 0.00 66.02 67.08 2dun s SER 47 CO 0.52 -0.49 1.97 0.77 0.98 0.00 0.00 173.24 176.99 2dun h SER 48 N 2.00 0.32 -0.79 7.02 4.64 -1.94 -2.09 113.55 122.72 2dun h SER 48 Ca -0.25 0.01 0.18 0.00 -0.47 0.00 0.00 61.79 61.26 2dun h SER 48 Cb 1.21 -0.06 -0.14 0.00 -0.31 0.00 0.00 62.40 63.10 2dun h SER 48 CO 0.27 0.19 -0.04 -0.33 -0.87 0.00 0.00 176.83 176.04 2dun h GLU 49 N 0.35 0.07 -4.10 4.77 4.39 -1.96 -3.41 114.58 114.70 2dun h GLU 49 Ca 0.29 -0.00 -0.46 0.00 0.34 0.00 0.00 59.36 59.53 2dun h GLU 49 Cb 0.67 -0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 29.26 2dun h GLU 49 CO -0.08 0.04 1.19 0.00 -1.16 0.00 0.00 179.01 179.01 2dun n ALA 50 N -3.05 0.20 -0.08 3.43 0.00 -0.79 -4.47 120.51 115.75 2dun n ALA 50 Ca 0.14 -0.06 -0.10 0.00 0.00 0.00 0.00 53.44 53.42 2dun n ALA 50 Cb 0.49 -1.65 -0.11 0.00 0.00 0.00 0.00 19.45 18.17 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 5.35 1.06 -3.73 0.00 -2.24 0.28 -4.51 114.28 110.48 2dun n THR 51 Ca 0.46 -0.55 -0.30 0.00 -2.27 0.00 0.00 64.05 61.39 2dun n THR 51 Cb 0.00 -0.83 -0.15 0.00 -2.10 0.00 0.00 70.33 67.25 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 -2.37 1.60 0.11 4.78 3.76 0.12 -2.55 115.29 120.73 2dun s HIS 52 Ca -0.15 -1.61 -0.24 0.00 -0.15 0.00 0.00 55.06 52.91 2dun s HIS 52 Cb 0.05 -1.61 -0.07 0.00 1.11 0.00 0.00 32.58 32.07 2dun s HIS 52 CO 0.55 -0.84 0.73 0.08 -0.85 0.00 0.00 174.74 174.40 2dun s VAL 53 N 1.66 4.55 -0.05 -0.90 1.01 -0.51 -3.26 120.40 122.90 2dun s VAL 53 Ca 0.08 1.57 0.01 0.00 0.00 0.00 0.00 61.98 63.64 2dun s VAL 53 Cb -0.17 -4.08 -0.03 0.00 0.00 0.00 0.00 36.38 32.10 2dun s VAL 53 CO -0.23 0.49 -0.05 -0.69 0.00 0.00 0.00 175.10 174.62 2dun s VAL 54 N -0.83 3.86 0.00 2.92 1.01 -1.13 0.36 120.40 126.59 2dun s VAL 54 Ca 0.35 -0.51 0.00 0.00 0.00 0.00 0.00 61.98 61.82 2dun s VAL 54 Cb -0.22 -2.63 -0.00 0.00 0.00 0.00 0.00 36.38 33.54 2dun s VAL 54 CO 0.24 0.53 -0.01 -0.04 0.00 0.00 0.00 175.10 175.82 2dun s MET 55 N -1.05 0.07 -0.10 2.72 -1.94 -0.48 -4.05 119.30 114.47 2dun s MET 55 Ca 0.14 -0.04 0.02 0.00 -1.71 0.00 0.00 55.69 54.11 2dun s MET 55 Cb -0.11 -0.06 -0.01 0.00 2.01 0.00 0.00 34.83 36.66 2dun s MET 55 CO 0.04 0.02 -0.19 -2.00 -0.01 0.00 0.00 175.02 172.88 2dun s GLU 56 N -0.05 3.10 -1.39 2.03 2.12 -1.26 -0.41 118.70 122.83 2dun s GLU 56 Ca -0.00 -0.79 -0.08 0.00 0.36 0.00 0.00 54.97 54.46 2dun s GLU 56 Cb -0.01 -2.43 0.03 0.00 0.26 0.00 0.00 34.13 31.99 2dun s GLU 56 CO -0.00 0.25 1.03 0.39 -0.54 0.00 0.00 175.26 176.39 2dun n GLU 57 N 3.37 -6.61 -4.98 4.30 1.02 -1.26 -4.68 120.64 111.80 2dun n GLU 57 Ca -0.18 0.73 -0.32 0.00 -0.02 0.00 0.00 57.16 57.36 2dun n GLU 57 Cb 0.53 -5.67 -0.14 0.00 -0.02 0.00 0.00 31.44 26.14 2dun n GLU 57 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2dun s THR 58 N -3.36 2.81 0.56 2.62 2.01 -1.26 -5.12 115.64 113.90 2dun s THR 58 Ca 0.46 -0.83 -0.16 0.00 0.31 0.00 0.00 61.69 61.47 2dun s THR 58 Cb -0.22 -2.08 -0.06 0.00 0.01 0.00 0.00 72.50 70.16 2dun s THR 58 CO 0.77 0.58 1.02 -0.55 -0.69 0.00 0.00 174.62 175.76 2dun s SER 59 N -0.73 6.18 0.24 3.53 0.15 -1.26 -4.91 113.70 116.90 2dun s SER 59 Ca 0.11 1.69 -0.05 0.00 0.70 0.00 0.00 55.95 58.41 2dun s SER 59 Cb -0.10 -2.52 0.38 0.00 -1.71 0.00 0.00 66.02 62.07 2dun s SER 59 CO 0.00 -0.89 1.81 0.00 1.20 0.00 0.00 173.24 175.36 2dun h ALA 60 N 0.63 1.15 -0.19 5.45 0.00 -1.92 -2.03 119.26 122.35 2dun h ALA 60 Ca -0.47 0.03 -0.18 0.00 0.00 0.00 0.00 54.91 54.29 2dun h ALA 60 Cb 1.20 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.87 2dun h ALA 60 CO 0.59 0.10 -0.60 1.05 0.00 0.00 0.00 179.25 180.39 2dun h GLU 61 N 0.78 0.74 -0.18 0.00 4.11 -1.88 -2.95 114.58 115.20 2dun h GLU 61 Ca 0.39 -0.55 0.05 0.00 0.07 0.00 0.00 59.36 59.33 2dun h GLU 61 Cb 0.35 0.10 -0.07 0.00 0.50 0.00 0.00 28.75 29.62 2dun h GLU 61 CO -0.24 1.17 -0.34 0.93 0.07 0.00 0.00 179.01 180.60 2dun h GLU 62 N 0.46 -0.37 -0.70 1.06 5.08 -1.77 -1.56 114.58 116.78 2dun h GLU 62 Ca -0.02 0.03 0.14 0.00 -1.00 0.00 0.00 59.36 58.50 2dun h GLU 62 Cb 1.23 0.08 -0.13 0.00 0.50 0.00 0.00 28.75 30.43 2dun h GLU 62 CO 0.13 -0.25 -0.24 0.00 -1.00 0.00 0.00 179.01 177.66 2dun h ALA 63 N 0.44 0.32 0.00 3.43 0.00 -1.47 0.92 119.26 122.89 2dun h ALA 63 Ca 0.11 0.25 -0.01 0.00 0.00 0.00 0.00 54.91 55.26 2dun h ALA 63 Cb 0.56 0.64 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 2dun h ALA 63 CO -0.40 -0.50 -0.03 0.28 0.00 0.00 0.00 179.25 178.61 2dun h VAL 64 N -0.05 0.86 0.02 0.00 2.07 -1.42 -0.57 116.25 117.16 2dun h VAL 64 Ca 0.32 -0.10 -0.25 0.00 0.82 0.00 0.00 66.70 67.49 2dun h VAL 64 Cb 0.54 1.06 -0.03 0.00 -1.52 0.00 0.00 31.29 31.34 2dun h VAL 64 CO -0.74 0.03 -1.26 -1.28 0.02 0.00 0.00 177.57 174.33 2dun h SER 65 N 0.00 0.06 1.77 0.57 0.87 0.15 -2.98 113.55 113.98 2dun h SER 65 Ca -0.00 -0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.48 2dun h SER 65 Cb 0.06 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.00 2dun h SER 65 CO 0.00 1.06 0.00 -0.25 -0.53 0.00 0.00 176.83 177.12 2dun h TRP 66 N 0.01 0.00 0.04 2.24 7.01 0.11 -3.22 115.95 122.14 2dun h TRP 66 Ca -0.12 0.00 -0.29 0.00 2.11 0.00 0.00 58.89 60.59 2dun h TRP 66 Cb 1.87 0.00 -0.03 0.00 -2.10 0.00 0.00 29.16 28.90 2dun h TRP 66 CO 0.01 0.00 -1.61 -0.56 -2.79 0.00 0.00 178.44 173.49 2dun h GLN 67 N 0.00 0.09 -0.14 2.65 3.07 -1.20 -3.37 115.11 116.21 2dun h GLN 67 Ca 0.00 -0.16 0.04 0.00 0.09 0.00 0.00 58.65 58.62 2dun h GLN 67 Cb 0.88 0.06 -0.04 0.00 0.08 0.00 0.00 27.48 28.46 2dun h GLN 67 CO 0.00 0.80 -0.09 0.93 0.09 0.00 0.00 178.83 180.55 2dun h GLU 68 N 0.02 -0.09 -0.73 0.06 4.39 -1.53 -2.26 114.58 114.44 2dun h GLU 68 Ca -0.26 0.01 0.24 0.00 0.34 0.00 0.00 59.36 59.69 2dun h GLU 68 Cb 1.98 0.02 -0.13 0.00 -0.10 0.00 0.00 28.75 30.52 2dun h GLU 68 CO 0.11 -0.06 0.17 0.54 -1.16 0.00 0.00 179.01 178.60 2dun n ARG 69 N -5.24 -0.05 0.16 2.33 5.12 -1.25 -0.09 116.66 117.64 2dun n ARG 69 Ca -0.03 1.05 -0.07 0.00 -1.93 0.00 0.00 57.85 56.87 2dun n ARG 69 Cb 0.16 -1.76 -0.03 0.00 -1.16 0.00 0.00 32.46 29.67 2dun n ARG 69 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2dun h ARG 70 N 0.00 -0.45 -1.29 5.56 3.08 -1.64 -3.14 114.38 116.50 2dun h ARG 70 Ca 0.51 0.03 0.37 0.00 0.07 0.00 0.00 59.98 60.97 2dun h ARG 70 Cb 1.20 0.10 -0.05 0.00 0.08 0.00 0.00 29.97 31.31 2dun h ARG 70 CO -0.63 -0.30 0.99 0.52 -1.07 0.00 0.00 179.97 179.48 2dun h MET 71 N -0.95 0.00 0.42 0.04 2.86 -0.53 1.51 114.93 118.27 2dun h MET 71 Ca -0.05 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.57 2dun h MET 71 Cb 0.36 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.02 2dun h MET 71 CO 0.08 0.00 -0.20 0.00 1.06 0.00 0.00 176.91 177.85 2dun h ALA 72 N 1.24 -0.56 -0.47 6.32 0.00 -0.49 -3.29 119.26 122.01 2dun h ALA 72 Ca 0.61 -0.18 -0.28 0.00 0.00 0.00 0.00 54.91 55.06 2dun h ALA 72 Cb 2.58 0.22 -0.17 0.00 0.00 0.00 0.00 17.79 20.41 2dun h ALA 72 CO -0.01 -0.69 -0.11 0.00 0.00 0.00 0.00 179.25 178.45 2dun n ALA 73 N -2.49 4.62 -1.84 0.00 0.00 0.23 -5.03 120.51 116.00 2dun n ALA 73 Ca -0.10 -3.27 -0.32 0.00 0.00 0.00 0.00 53.44 49.75 2dun n ALA 73 Cb 0.29 -0.77 -0.01 0.00 0.00 0.00 0.00 19.45 18.95 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 -3.35 3.06 0.83 0.00 0.00 0.49 -5.00 121.76 117.79 2dun s ALA 74 Ca 0.47 0.05 -0.11 0.00 0.00 0.00 0.00 51.96 52.37 2dun s ALA 74 Cb 0.42 -3.10 0.09 0.00 0.00 0.00 0.00 23.12 20.52 2dun s ALA 74 CO 0.00 -0.51 1.09 -1.25 0.00 0.00 0.00 175.76 175.10 2dun s PRO 75 N -4.65 1.79 -0.04 0.00 0.04 -1.26 -4.97 135.00 125.91 2dun s PRO 75 Ca 0.57 1.01 -0.30 0.00 0.04 0.00 0.00 61.00 62.32 2dun s PRO 75 Cb -0.11 -1.86 -0.05 0.00 0.04 0.00 0.00 34.50 32.53 2dun s PRO 75 CO 0.43 -1.92 1.48 -1.25 0.04 0.00 0.00 177.00 175.78 2dun s PRO 76 N -4.92 4.23 0.00 0.56 0.04 -1.26 -2.53 135.00 131.12 2dun s PRO 76 Ca 0.62 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.68 2dun s PRO 76 Cb -0.17 -3.75 0.00 0.00 0.04 0.00 0.00 34.50 30.62 2dun s PRO 76 CO 0.56 -0.70 0.00 0.41 0.04 0.00 0.00 177.00 177.31 2dun n GLY 77 N 3.83 0.54 3.56 0.56 0.00 -1.26 -5.07 105.19 107.35 2dun n GLY 77 Ca 0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.34 1.73 -0.26 0.00 2.01 -1.26 -5.09 115.64 110.43 2dun s THR 79 Ca 0.65 -0.89 -0.29 0.00 0.31 0.00 0.00 61.69 61.47 2dun s THR 79 Cb -0.25 -1.47 -0.02 0.00 0.01 0.00 0.00 72.50 70.77 2dun s THR 79 CO 0.59 0.49 1.63 -2.16 -0.69 0.00 0.00 174.62 174.49 2dun s PRO 80 N -0.13 3.69 1.17 4.92 0.04 -1.26 -4.97 135.00 138.46 2dun s PRO 80 Ca -0.02 1.55 -0.18 0.00 0.04 0.00 0.00 61.00 62.39 2dun s PRO 80 Cb -0.12 -4.07 0.27 0.00 0.04 0.00 0.00 34.50 30.63 2dun s PRO 80 CO 0.02 -1.43 1.11 -1.25 0.04 0.00 0.00 177.00 175.49 2dun s PRO 81 N 4.89 -1.00 -0.37 0.56 0.04 -1.26 -5.02 135.00 132.84 2dun s PRO 81 Ca 0.72 0.02 -0.10 0.00 0.04 0.00 0.00 61.00 61.69 2dun s PRO 81 Cb -0.23 -1.61 0.04 0.00 0.04 0.00 0.00 34.50 32.73 2dun s PRO 81 CO 0.30 -3.58 0.19 0.00 0.04 0.00 0.00 177.00 173.96 2dun s ALA 82 N -2.99 3.23 -0.44 8.56 0.00 -1.06 -4.98 121.76 124.08 2dun s ALA 82 Ca 0.70 -1.79 -0.28 0.00 0.00 0.00 0.00 51.96 50.59 2dun s ALA 82 Cb -0.11 -2.54 -0.01 0.00 0.00 0.00 0.00 23.12 20.46 2dun s ALA 82 CO 0.56 -1.42 1.70 -0.51 0.00 0.00 0.00 175.76 176.09 2dun s LEU 83 N 1.50 3.46 0.36 0.00 1.43 -1.26 -1.42 118.68 122.75 2dun s LEU 83 Ca 0.01 0.87 0.08 0.00 -1.03 0.00 0.00 54.13 54.06 2dun s LEU 83 Cb -0.20 -3.23 -0.05 0.00 0.03 0.00 0.00 46.19 42.75 2dun s LEU 83 CO 0.05 -1.82 0.13 -0.76 0.23 0.00 0.00 176.35 174.18 2dun s LEU 84 N 7.07 3.16 0.20 1.79 1.43 0.16 -2.35 118.68 130.14 2dun s LEU 84 Ca 0.70 -0.90 0.06 0.00 -1.03 0.00 0.00 54.13 52.96 2dun s LEU 84 Cb -0.17 -1.58 -0.04 0.00 0.03 0.00 0.00 46.19 44.43 2dun s LEU 84 CO 0.29 -0.35 0.15 -0.62 0.23 0.00 0.00 176.35 176.05 2dun s ASP 85 N -3.83 5.45 0.33 2.29 2.15 -1.26 -1.38 116.67 120.42 2dun s ASP 85 Ca 0.38 -0.20 0.10 0.00 0.43 0.00 0.00 52.55 53.26 2dun s ASP 85 Cb -0.00 -1.39 0.98 0.00 -0.30 0.00 0.00 42.92 42.21 2dun s ASP 85 CO 0.22 0.03 1.61 -0.29 -0.17 0.00 0.00 175.17 176.58 2dun h ILE 86 N 1.88 0.16 -0.98 4.11 6.09 -1.09 0.49 117.51 128.17 2dun h ILE 86 Ca -0.48 -0.05 0.31 0.00 -1.37 0.00 0.00 64.86 63.27 2dun h ILE 86 Cb 1.21 0.01 -0.15 0.00 0.47 0.00 0.00 36.82 38.37 2dun h ILE 86 CO 0.62 0.02 0.49 0.28 -3.07 0.00 0.00 178.15 176.49 2dun h SER 87 N 0.13 0.39 0.19 2.19 0.02 -1.95 0.15 113.55 114.67 2dun h SER 87 Ca 0.69 0.20 -0.01 0.00 -0.84 0.00 0.00 61.79 61.82 2dun h SER 87 Cb 1.58 0.18 0.00 0.00 0.14 0.00 0.00 62.40 64.29 2dun h SER 87 CO -0.74 -0.16 -0.09 -0.25 -1.14 0.00 0.00 176.83 174.46 2dun h TRP 88 N 0.28 -0.24 0.17 3.45 7.01 -0.41 -2.54 115.95 123.68 2dun h TRP 88 Ca 0.70 -0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.69 2dun h TRP 88 Cb 1.57 0.08 -0.01 0.00 -2.10 0.00 0.00 29.16 28.70 2dun h TRP 88 CO -0.07 -0.09 -0.17 1.25 -2.79 0.00 0.00 178.44 176.57 2dun h LEU 89 N -0.33 -0.46 -0.90 0.65 5.85 -0.78 -1.36 115.31 117.98 2dun h LEU 89 Ca -0.03 0.04 0.18 0.00 0.84 0.00 0.00 57.88 58.91 2dun h LEU 89 Cb 0.26 0.15 -0.17 0.00 0.37 0.00 0.00 40.66 41.27 2dun h LEU 89 CO 0.04 -0.22 -0.23 0.35 -0.34 0.00 0.00 178.44 178.04 2dun n THR 90 N -3.34 -0.38 -0.37 1.05 -2.24 -0.66 0.19 114.28 108.52 2dun n THR 90 Ca -0.04 2.06 -0.00 0.00 -2.27 0.00 0.00 64.05 63.80 2dun n THR 90 Cb 0.16 -2.85 0.14 0.00 -2.10 0.00 0.00 70.33 65.68 2dun n THR 90 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2dun h GLU 91 N 0.00 1.24 -0.47 -0.78 4.39 -1.19 -0.64 114.58 117.13 2dun h GLU 91 Ca 0.43 -0.07 -0.11 0.00 0.34 0.00 0.00 59.36 59.94 2dun h GLU 91 Cb 0.65 -0.28 -0.02 0.00 -0.10 0.00 0.00 28.75 29.00 2dun h GLU 91 CO -0.92 0.82 -0.14 0.77 -1.16 0.00 0.00 179.01 178.37 2dun h SER 92 N 1.28 0.89 0.12 1.42 0.02 0.32 -2.31 113.55 115.28 2dun h SER 92 Ca 0.39 -0.29 -0.01 0.00 -0.84 0.00 0.00 61.79 61.04 2dun h SER 92 Cb -0.04 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.27 2dun h SER 92 CO -0.11 1.03 -0.06 -0.07 -1.14 0.00 0.00 176.83 176.48 2dun h LEU 93 N 0.78 -0.14 -0.11 5.07 3.38 -0.16 0.20 115.31 124.33 2dun h LEU 93 Ca 0.12 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.82 2dun h LEU 93 Cb 0.67 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.46 2dun h LEU 93 CO 0.05 0.20 0.00 0.61 0.09 0.00 0.00 178.44 179.39 2dun n GLY 94 N -0.26 -0.80 0.00 0.83 0.00 -0.31 -1.64 105.19 103.01 2dun n GLY 94 Ca -0.09 -0.01 0.07 0.00 0.00 0.00 0.00 46.02 46.00 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 -1.53 2.97 0.00 4.61 0.00 -0.87 -4.98 120.51 120.70 2dun n ALA 95 Ca 0.02 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.09 2dun n ALA 95 Cb 0.10 -0.52 0.00 0.00 0.00 0.00 0.00 19.45 19.03 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 1.56 3.00 3.20 0.00 0.00 0.67 -4.96 105.19 108.65 2dun n GLY 96 Ca -0.01 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.82 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 0.89 -0.39 1.61 -2.07 -1.06 -4.60 119.66 114.05 2dun s GLN 97 Ca 0.00 -1.04 -0.28 0.00 -1.82 0.00 0.00 55.36 52.21 2dun s GLN 97 Cb 0.00 -0.89 -0.01 0.00 -1.09 0.00 0.00 33.01 31.02 2dun s GLN 97 CO 0.00 0.19 1.73 -1.25 -1.32 0.00 0.00 175.29 174.64 2dun s PRO 98 N -2.00 3.28 0.50 9.60 0.04 -1.26 -4.41 135.00 140.74 2dun s PRO 98 Ca 0.01 1.20 -0.21 0.00 0.04 0.00 0.00 61.00 62.04 2dun s PRO 98 Cb -0.09 -4.19 -0.07 0.00 0.04 0.00 0.00 34.50 30.19 2dun s PRO 98 CO 0.03 -1.93 1.12 0.14 0.04 0.00 0.00 177.00 176.39 2dun s VAL 99 N 6.91 3.29 -0.02 -0.36 -7.23 -1.26 -4.97 120.40 116.76 2dun s VAL 99 Ca 0.74 0.87 -0.30 0.00 -1.81 0.00 0.00 61.98 61.48 2dun s VAL 99 Cb -0.19 -3.39 -0.05 0.00 0.56 0.00 0.00 36.38 33.31 2dun s VAL 99 CO 0.31 -0.11 1.47 -2.16 -0.31 0.00 0.00 175.10 174.30 2dun s PRO 100 N -3.03 4.25 0.07 4.82 0.04 -1.26 -4.91 135.00 134.98 2dun s PRO 100 Ca 0.68 2.02 -0.25 0.00 0.04 0.00 0.00 61.00 63.48 2dun s PRO 100 Cb -0.24 -3.68 -0.14 0.00 0.04 0.00 0.00 34.50 30.48 2dun s PRO 100 CO 0.28 -0.66 0.59 0.28 0.04 0.00 0.00 177.00 177.53 2dun n VAL 101 N 4.92 0.75 -3.28 -0.36 0.31 -1.26 -4.95 118.33 114.46 2dun n VAL 101 Ca 0.14 -0.19 -0.19 0.00 -0.01 0.00 0.00 64.34 64.09 2dun n VAL 101 Cb 0.43 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.36 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 -0.37 2.60 0.34 5.55 0.41 -1.26 -5.00 118.70 120.97 2dun s GLU 102 Ca 0.58 -1.46 0.05 0.00 -0.41 0.00 0.00 54.97 53.72 2dun s GLU 102 Cb -0.82 -2.55 0.62 0.00 -1.78 0.00 0.00 34.13 29.59 2dun s GLU 102 CO 0.42 -0.35 1.88 0.00 -0.49 0.00 0.00 175.26 176.73 2dun h ARG 104 N 0.50 0.54 0.20 0.00 2.47 -2.01 -3.33 114.38 112.75 2dun h ARG 104 Ca 0.11 -0.66 0.01 0.00 -1.26 0.00 0.00 59.98 58.18 2dun h ARG 104 Cb 0.31 0.21 -0.04 0.00 -1.65 0.00 0.00 29.97 28.80 2dun h ARG 104 CO 0.01 1.27 -0.36 0.45 0.56 0.00 0.00 179.97 181.90 2dun h HIS 105 N 0.27 -0.97 -0.79 3.04 3.86 -1.88 -3.43 115.15 115.24 2dun h HIS 105 Ca -0.14 0.02 -0.65 0.00 -1.16 0.00 0.00 60.37 58.44 2dun h HIS 105 Cb 1.77 0.40 0.03 0.00 1.06 0.00 0.00 27.41 30.67 2dun h HIS 105 CO 0.09 -0.47 0.20 0.54 0.86 0.00 0.00 177.93 179.15 2dun n ARG 106 N -5.45 0.00 -3.63 2.45 1.74 -1.06 -4.02 116.66 106.70 2dun n ARG 106 Ca -0.08 0.00 -0.39 0.00 -0.77 0.00 0.00 57.85 56.61 2dun n ARG 106 Cb 0.35 -1.19 -0.08 0.00 -1.02 0.00 0.00 32.46 30.52 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 0.74 5.59 0.03 0.55 1.43 -0.99 -5.01 118.68 121.02 2dun s LEU 107 Ca 0.76 -2.48 -0.15 0.00 -1.03 0.00 0.00 54.13 51.22 2dun s LEU 107 Cb -1.06 -1.94 0.02 0.00 0.03 0.00 0.00 46.19 43.24 2dun s LEU 107 CO 0.51 -0.51 0.33 -0.70 0.23 0.00 0.00 176.35 176.22 2dun s GLU 108 N 0.49 0.79 0.43 1.70 2.12 -1.12 -4.19 118.70 118.92 2dun s GLU 108 Ca 0.13 -0.38 0.07 0.00 0.36 0.00 0.00 54.97 55.15 2dun s GLU 108 Cb -0.20 0.35 -0.05 0.00 0.26 0.00 0.00 34.13 34.48 2dun s GLU 108 CO -0.04 -0.25 0.11 0.54 -0.54 0.00 0.00 175.26 175.09 2dun s VAL 109 N -2.16 2.06 -0.29 3.70 0.11 -1.25 -4.55 120.40 118.01 2dun s VAL 109 Ca -0.08 -1.82 -0.22 0.00 -2.93 0.00 0.00 61.98 56.93 2dun s VAL 109 Cb -0.02 -2.88 0.17 0.00 -1.53 0.00 0.00 36.38 32.12 2dun s VAL 109 CO -0.01 0.00 1.26 0.00 -3.33 0.00 0.00 175.10 173.02 2dun s ALA 110 N -2.67 -2.27 -0.93 1.54 0.00 -1.26 -5.02 121.76 111.15 2dun s ALA 110 Ca 0.35 1.85 -0.09 0.00 0.00 0.00 0.00 51.96 54.07 2dun s ALA 110 Cb 0.06 -1.74 0.00 0.00 0.00 0.00 0.00 23.12 21.44 2dun s ALA 110 CO 0.19 -0.20 0.69 0.41 0.00 0.00 0.00 175.76 176.85 2dun n GLY 111 N 2.30 -1.17 3.69 0.00 0.00 -1.26 -4.86 105.19 103.89 2dun n GLY 111 Ca -0.13 0.51 -0.42 0.00 0.00 0.00 0.00 46.02 45.97 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 -5.00 4.27 0.07 1.61 0.04 -1.26 -5.02 135.00 129.72 2dun s PRO 112 Ca 0.18 2.02 0.07 0.00 0.04 0.00 0.00 61.00 63.31 2dun s PRO 112 Cb -0.07 -3.56 -0.03 0.00 0.04 0.00 0.00 34.50 30.88 2dun s PRO 112 CO 0.86 -0.59 -0.19 -0.98 0.04 0.00 0.00 177.00 176.14 2dun s ARG 113 N 2.38 1.11 0.12 4.56 1.70 -1.26 -5.15 118.95 122.40 2dun s ARG 113 Ca 0.65 -1.02 0.09 0.00 -0.47 0.00 0.00 55.73 54.99 2dun s ARG 113 Cb -0.33 -1.26 -0.04 0.00 -0.57 0.00 0.00 34.95 32.75 2dun s ARG 113 CO 0.27 0.30 -0.20 0.21 -1.08 0.00 0.00 175.30 174.81 2dun s LYS 114 N -1.59 1.72 0.10 3.89 2.47 -1.26 -5.06 119.74 120.01 2dun s LYS 114 Ca 0.05 -1.20 0.00 0.00 -1.56 0.00 0.00 55.97 53.25 2dun s LYS 114 Cb -0.09 -2.08 0.00 0.00 -1.46 0.00 0.00 37.83 34.20 2dun s LYS 114 CO 0.03 0.48 0.00 0.41 0.16 0.00 0.00 175.35 176.43 2dun n GLY 115 N 0.83 -2.24 3.65 5.54 0.00 -1.26 -4.96 105.19 106.75 2dun n GLY 115 Ca -0.16 -1.41 -0.29 0.00 0.00 0.00 0.00 46.02 44.16 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 -2.48 -0.10 0.11 1.61 0.04 -1.26 -5.08 135.00 127.83 2dun s PRO 116 Ca 0.00 0.34 0.05 0.00 0.04 0.00 0.00 61.00 61.43 2dun s PRO 116 Cb 0.00 -1.69 -0.04 0.00 0.04 0.00 0.00 34.50 32.81 2dun s PRO 116 CO 0.00 -3.05 -0.13 -0.48 0.04 0.00 0.00 177.00 173.39 2dun s LEU 117 N -6.61 2.39 0.23 -3.56 0.05 -1.26 -5.14 118.68 104.78 2dun s LEU 117 Ca 0.67 -0.79 -0.21 0.00 0.05 0.00 0.00 54.13 53.84 2dun s LEU 117 Cb -0.16 -0.46 -0.08 0.00 -2.05 0.00 0.00 46.19 43.43 2dun s LEU 117 CO 0.57 -0.18 0.76 -0.44 -0.55 0.00 0.00 176.35 176.52 2dun s SER 118 N -2.39 7.14 0.03 1.48 0.01 -1.26 -5.00 113.70 113.71 2dun s SER 118 Ca 0.07 1.51 -0.21 0.00 1.31 0.00 0.00 55.95 58.63 2dun s SER 118 Cb -0.05 -2.45 -0.15 0.00 0.21 0.00 0.00 66.02 63.58 2dun s SER 118 CO 0.02 0.03 1.34 1.55 0.41 0.00 0.00 173.24 176.59 2dun h PRO 119 N 3.47 0.32 0.00 12.44 0.13 -2.08 -3.49 132.00 142.79 2dun h PRO 119 Ca -0.48 -0.17 0.20 0.00 -0.87 0.00 0.00 66.00 64.69 2dun h PRO 119 Cb 1.19 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.29 2dun h PRO 119 CO 0.65 0.71 0.60 0.00 -0.23 0.00 0.00 178.00 179.73 2dun n ALA 120 N -2.41 -2.50 -2.83 -0.56 0.00 -1.26 -5.18 120.51 105.77 2dun n ALA 120 Ca -0.06 -0.72 -0.14 0.00 0.00 0.00 0.00 53.44 52.52 2dun n ALA 120 Cb 0.35 0.28 -0.12 0.00 0.00 0.00 0.00 19.45 19.96 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 -2.57 0.63 -0.18 0.00 -0.11 -1.26 -5.16 118.94 110.30 2dun s TRP 121 Ca 0.21 -0.39 -0.21 0.00 1.22 0.00 0.00 56.10 56.93 2dun s TRP 121 Cb -0.01 -0.39 0.05 0.00 -1.50 0.00 0.00 33.47 31.63 2dun s TRP 121 CO 0.02 -0.06 0.56 0.00 -4.62 0.00 0.00 176.95 172.85 2dun s MET 122 N -1.21 0.72 1.22 5.86 0.23 -1.26 -5.18 119.30 119.69 2dun s MET 122 Ca -0.07 0.64 -0.20 0.00 -1.03 0.00 0.00 55.69 55.04 2dun s MET 122 Cb -0.08 0.35 0.30 0.00 -1.53 0.00 0.00 34.83 33.86 2dun s MET 122 CO 0.00 -0.12 1.11 -1.25 -2.03 0.00 0.00 175.02 172.73 2dun s PRO 123 N -0.03 -1.41 -0.13 3.16 0.04 -1.26 -5.01 135.00 130.36 2dun s PRO 123 Ca -0.03 -0.13 -0.02 0.00 0.04 0.00 0.00 61.00 60.86 2dun s PRO 123 Cb -0.04 -1.58 -0.25 0.00 0.04 0.00 0.00 34.50 32.68 2dun s PRO 123 CO 0.02 -3.82 0.32 0.00 0.04 0.00 0.00 177.00 173.56 2dun n ALA 124 N -4.83 1.06 -0.12 8.56 0.00 -1.26 -4.17 120.51 119.75 2dun n ALA 124 Ca 0.14 -0.70 -0.06 0.00 0.00 0.00 0.00 53.44 52.82 2dun n ALA 124 Cb 0.60 -0.61 0.02 0.00 0.00 0.00 0.00 19.45 19.46 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 -3.37 0.61 -0.75 0.00 4.11 -1.26 -4.61 117.16 111.89 2dun n TYR 125 Ca -0.32 -1.12 -0.08 0.00 -0.00 0.00 0.00 57.90 56.39 2dun n TYR 125 Cb 1.04 -0.55 -0.11 0.00 -0.00 0.00 0.00 39.34 39.72 2dun n TYR 125 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 2dun n ALA 126 N 0.66 5.13 -3.22 -3.48 0.00 -1.26 -4.76 120.51 113.57 2dun n ALA 126 Ca 0.12 -1.19 -0.13 0.00 0.00 0.00 0.00 53.44 52.24 2dun n ALA 126 Cb 0.62 -2.02 -0.09 0.00 0.00 0.00 0.00 19.45 17.95 2dun n ALA 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dun s SER 128 N -1.01 -0.15 0.00 0.00 1.04 -1.26 -5.19 113.70 107.13 2dun s SER 128 Ca -0.11 -0.82 0.00 0.00 0.48 0.00 0.00 55.95 55.50 2dun s SER 128 Cb -0.05 0.77 0.00 0.00 0.10 0.00 0.00 66.02 66.85 2dun s SER 128 CO 0.03 -1.47 0.00 0.61 0.98 0.00 0.00 173.24 173.39 2dun n GLY 129 N -0.49 1.97 0.07 7.32 0.00 -1.26 -5.06 105.19 107.75 2dun n GLY 129 Ca -0.06 -0.24 -0.13 0.00 0.00 0.00 0.00 46.02 45.60 2dun n GLY 129 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dun h PRO 130 N 0.00 -0.05 -5.51 1.61 0.13 -2.07 -3.47 132.00 122.64 2dun h PRO 130 Ca 0.00 0.00 -0.39 0.00 -0.87 0.00 0.00 66.00 64.74 2dun h PRO 130 Cb 0.00 0.01 -0.08 0.00 0.13 0.00 0.00 31.00 31.06 2dun h PRO 130 CO 0.00 0.42 -0.58 0.45 -0.23 0.00 0.00 178.00 178.05 2dun n SER 131 N -4.89 -3.84 -4.92 1.44 2.88 -1.26 -4.94 113.62 98.10 2dun n SER 131 Ca -0.08 -0.44 -0.27 0.00 -1.33 0.00 0.00 58.87 56.75 2dun n SER 131 Cb 0.25 -3.17 0.07 0.00 -0.75 0.00 0.00 64.21 60.61 2dun n SER 131 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2dun s SER 132 N -2.77 4.89 0.00 -3.46 1.04 -1.26 -5.36 113.70 106.78 2dun s SER 132 Ca 0.43 0.65 0.00 0.00 0.48 0.00 0.00 55.95 57.50 2dun s SER 132 Cb -0.22 -1.31 0.00 0.00 0.10 0.00 0.00 66.02 64.59 2dun s SER 132 CO 0.52 -1.59 0.00 0.61 0.98 0.00 0.00 173.24 173.76