#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 1.50 -4.32 1.61 7.64 -1.26 -4.91 113.62 113.89 2dun n SER 2 Ca 0.00 0.23 -0.46 0.00 1.01 0.00 0.00 58.87 59.65 2dun n SER 2 Cb 0.00 -0.53 -0.04 0.00 -1.01 0.00 0.00 64.21 62.63 2dun n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dun s SER 3 N -5.93 6.48 0.58 6.43 0.15 -1.26 -4.96 113.70 115.19 2dun s SER 3 Ca -0.14 -2.24 0.00 0.00 0.70 0.00 0.00 55.95 54.26 2dun s SER 3 Cb 0.02 -2.21 0.00 0.00 -1.71 0.00 0.00 66.02 62.12 2dun s SER 3 CO 0.21 -0.71 0.00 0.61 1.20 0.00 0.00 173.24 174.55 2dun n GLY 4 N 4.61 -3.71 0.65 9.45 0.00 -1.26 -5.00 105.19 109.93 2dun n GLY 4 Ca -0.00 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.20 2dun n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dun n SER 5 N -2.95 1.04 -4.24 1.61 2.88 -1.26 -4.93 113.62 105.77 2dun n SER 5 Ca -0.02 0.00 -0.22 0.00 -1.33 0.00 0.00 58.87 57.30 2dun n SER 5 Cb 0.51 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.84 2dun n SER 5 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2dun s SER 6 N -4.10 2.24 0.00 -3.46 0.01 -1.26 -5.11 113.70 102.02 2dun s SER 6 Ca 0.00 -0.63 0.00 0.00 1.31 0.00 0.00 55.95 56.63 2dun s SER 6 Cb 0.00 -0.12 0.00 0.00 0.21 0.00 0.00 66.02 66.11 2dun s SER 6 CO 0.00 0.04 0.00 0.61 0.41 0.00 0.00 173.24 174.30 2dun n GLY 7 N 1.30 3.18 3.15 3.44 0.00 -1.26 -5.15 105.19 109.86 2dun n GLY 7 Ca -0.19 -0.18 -0.31 0.00 0.00 0.00 0.00 46.02 45.33 2dun n GLY 7 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dun s SER 8 N 0.00 2.93 -0.28 1.61 1.04 -1.26 -5.09 113.70 112.64 2dun s SER 8 Ca 0.00 -0.55 -0.25 0.00 0.48 0.00 0.00 55.95 55.63 2dun s SER 8 Cb 0.00 -1.34 0.13 0.00 0.10 0.00 0.00 66.02 64.90 2dun s SER 8 CO 0.00 0.08 1.06 0.28 0.98 0.00 0.00 173.24 175.64 2dun s THR 9 N 0.73 0.00 0.20 2.02 -1.32 -1.26 -5.02 115.64 111.00 2dun s THR 9 Ca -0.10 0.00 -0.18 0.00 -1.21 0.00 0.00 61.69 60.20 2dun s THR 9 Cb -0.16 -1.00 0.18 0.00 -1.51 0.00 0.00 72.50 70.01 2dun s THR 9 CO 0.01 0.00 1.59 0.03 -2.21 0.00 0.00 174.62 174.03 2dun h ARG 10 N 4.11 -0.10 -3.29 7.08 3.08 -1.91 -3.25 114.38 120.10 2dun h ARG 10 Ca -0.28 0.01 -0.63 0.00 0.07 0.00 0.00 59.98 59.14 2dun h ARG 10 Cb 1.18 0.02 -0.41 0.00 0.08 0.00 0.00 29.97 30.84 2dun h ARG 10 CO 0.11 -0.07 -0.65 -0.06 -1.07 0.00 0.00 179.97 178.23 2dun s PHE 11 N -6.04 2.93 0.06 3.04 0.08 -0.99 -4.96 117.98 112.10 2dun s PHE 11 Ca -0.14 -3.02 -0.19 0.00 0.12 0.00 0.00 56.93 53.69 2dun s PHE 11 Cb 0.18 -2.62 -0.13 0.00 -0.57 0.00 0.00 43.02 39.88 2dun s PHE 11 CO 0.71 -0.75 1.36 -1.00 -0.10 0.00 0.00 175.22 175.45 2dun h PRO 12 N 6.53 0.45 -0.94 0.24 0.13 -1.85 -3.18 132.00 133.37 2dun h PRO 12 Ca -0.06 -0.24 0.19 0.00 -0.87 0.00 0.00 66.00 65.02 2dun h PRO 12 Cb 0.90 0.01 -0.08 0.00 0.13 0.00 0.00 31.00 31.95 2dun h PRO 12 CO 0.65 0.81 0.60 0.78 -0.23 0.00 0.00 178.00 180.61 2dun h GLY 13 N 0.11 1.23 -7.04 1.56 0.00 -1.93 -3.36 103.07 93.64 2dun h GLY 13 Ca 0.03 -0.27 -0.57 0.00 0.00 0.00 0.00 47.33 46.52 2dun h GLY 13 CO 0.05 -0.00 0.82 0.14 0.00 0.00 0.00 176.54 177.55 2dun s VAL 14 N -5.62 4.15 -0.20 4.60 1.01 -1.20 -4.89 120.40 118.25 2dun s VAL 14 Ca -0.09 0.63 -0.03 0.00 0.00 0.00 0.00 61.98 62.49 2dun s VAL 14 Cb 0.23 -4.67 -0.01 0.00 0.00 0.00 0.00 36.38 31.94 2dun s VAL 14 CO 0.79 -1.28 -0.07 0.00 0.00 0.00 0.00 175.10 174.54 2dun s ALA 15 N 4.60 2.76 -0.11 5.51 0.00 -1.26 -4.00 121.76 129.26 2dun s ALA 15 Ca 0.38 -1.09 -0.02 0.00 0.00 0.00 0.00 51.96 51.22 2dun s ALA 15 Cb -0.09 -1.56 -0.03 0.00 0.00 0.00 0.00 23.12 21.43 2dun s ALA 15 CO 0.22 -0.24 -0.02 0.42 0.00 0.00 0.00 175.76 176.14 2dun s ILE 16 N 1.16 4.07 -0.18 0.00 1.01 -1.20 -0.14 121.20 125.91 2dun s ILE 16 Ca 0.02 -0.32 -0.02 0.00 0.00 0.00 0.00 60.65 60.33 2dun s ILE 16 Cb -0.14 -2.73 -0.00 0.00 0.01 0.00 0.00 42.46 39.59 2dun s ILE 16 CO -0.02 0.55 -0.11 -0.47 0.00 0.00 0.00 174.94 174.90 2dun s TYR 17 N -0.34 2.87 -0.25 3.97 6.14 -0.99 -3.07 117.35 125.68 2dun s TYR 17 Ca 0.06 -1.02 -0.22 0.00 0.64 0.00 0.00 57.07 56.53 2dun s TYR 17 Cb -0.12 -1.98 -0.01 0.00 0.42 0.00 0.00 41.96 40.26 2dun s TYR 17 CO 0.02 -0.51 0.72 -0.51 0.64 0.00 0.00 175.55 175.91 2dun s LEU 18 N 1.09 4.07 -0.43 6.97 1.43 -1.26 -2.94 118.68 127.62 2dun s LEU 18 Ca 0.00 0.85 -0.28 0.00 -1.03 0.00 0.00 54.13 53.68 2dun s LEU 18 Cb -0.15 -3.01 -0.01 0.00 0.03 0.00 0.00 46.19 43.06 2dun s LEU 18 CO -0.03 -0.44 1.70 -0.69 0.23 0.00 0.00 176.35 177.12 2dun s VAL 19 N 2.66 3.57 0.15 -1.59 1.01 -1.25 -4.89 120.40 120.06 2dun s VAL 19 Ca 0.30 0.53 -0.30 0.00 0.00 0.00 0.00 61.98 62.51 2dun s VAL 19 Cb -0.15 -3.90 -0.07 0.00 0.00 0.00 0.00 36.38 32.26 2dun s VAL 19 CO 0.08 -0.66 1.49 -0.62 0.00 0.00 0.00 175.10 175.39 2dun n GLU 20 N 8.54 -0.42 -2.26 2.72 1.02 -1.26 -4.19 120.64 124.79 2dun n GLU 20 Ca 0.20 1.46 -0.36 0.00 -0.02 0.00 0.00 57.16 58.44 2dun n GLU 20 Cb 0.48 -2.15 -0.01 0.00 -0.02 0.00 0.00 31.44 29.75 2dun n GLU 20 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2dun s PRO 21 N -5.46 3.64 -1.25 3.49 0.04 -1.26 -3.69 135.00 130.51 2dun s PRO 21 Ca -0.12 1.73 -0.01 0.00 0.04 0.00 0.00 61.00 62.64 2dun s PRO 21 Cb 0.11 -2.29 -0.01 0.00 0.04 0.00 0.00 34.50 32.35 2dun s PRO 21 CO 0.60 -0.64 0.81 0.54 0.04 0.00 0.00 177.00 178.34 2dun n ARG 22 N -0.73 -5.09 0.00 4.56 1.74 -1.26 -4.89 116.66 110.99 2dun n ARG 22 Ca 0.09 0.70 0.00 0.00 -0.77 0.00 0.00 57.85 57.86 2dun n ARG 22 Cb 0.49 -5.38 0.00 0.00 -1.02 0.00 0.00 32.46 26.55 2dun n ARG 22 CO 0.00 0.00 0.00 -0.12 -1.52 0.00 0.00 177.63 175.99 2dun n MET 23 N -4.16 0.00 0.00 5.56 1.56 -1.24 -3.92 117.12 114.92 2dun n MET 23 Ca -0.27 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.16 2dun n MET 23 Cb 0.67 -0.55 0.00 0.00 2.15 0.00 0.00 33.22 35.49 2dun n MET 23 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 2dun n GLY 24 N 2.25 1.32 0.04 -5.12 0.00 -1.26 -4.33 105.19 98.08 2dun n GLY 24 Ca 0.00 -2.19 -0.02 0.00 0.00 0.00 0.00 46.02 43.81 2dun n GLY 24 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2dun h ARG 25 N 0.00 0.00 0.04 1.61 2.43 -2.01 -3.39 114.38 113.05 2dun h ARG 25 Ca 0.00 0.00 -0.21 0.00 -0.81 0.00 0.00 59.98 58.96 2dun h ARG 25 Cb 0.00 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 2dun h ARG 25 CO 0.00 0.00 -1.12 0.77 -1.51 0.00 0.00 179.97 178.11 2dun h SER 26 N -0.59 0.12 -0.73 -3.80 0.02 -2.01 -3.39 113.55 103.18 2dun h SER 26 Ca 0.00 -0.71 0.09 0.00 -0.84 0.00 0.00 61.79 60.33 2dun h SER 26 Cb 0.18 -0.04 -0.11 0.00 0.14 0.00 0.00 62.40 62.57 2dun h SER 26 CO 0.00 1.46 -0.34 -1.14 -1.14 0.00 0.00 176.83 175.67 2dun n ARG 27 N -4.28 -0.23 -0.32 3.45 3.00 -1.26 0.53 116.66 117.55 2dun n ARG 27 Ca -0.26 1.11 -0.05 0.00 -0.00 0.00 0.00 57.85 58.65 2dun n ARG 27 Cb 0.72 -1.64 0.00 0.00 0.00 0.00 0.00 32.46 31.54 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 -0.07 0.12 -0.14 2.43 -1.75 -0.70 114.38 114.27 2dun h ARG 28 Ca 0.20 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.37 2dun h ARG 28 Cb 0.38 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.95 2dun h ARG 28 CO -0.71 -0.05 -0.06 0.00 -1.51 0.00 0.00 179.97 177.65 2dun h ALA 29 N 1.04 -0.16 -0.96 2.80 0.00 -0.13 -2.49 119.26 119.36 2dun h ALA 29 Ca 0.27 -0.19 0.37 0.00 0.00 0.00 0.00 54.91 55.36 2dun h ALA 29 Cb 0.56 0.06 -0.18 0.00 0.00 0.00 0.00 17.79 18.23 2dun h ALA 29 CO -0.87 -0.40 0.40 0.34 0.00 0.00 0.00 179.25 178.72 2dun n PHE 30 N -4.99 1.00 -0.04 0.00 7.35 0.58 0.16 117.46 121.53 2dun n PHE 30 Ca -0.09 1.14 -0.14 0.00 -0.76 0.00 0.00 57.45 57.61 2dun n PHE 30 Cb 0.23 -1.46 -0.11 0.00 0.35 0.00 0.00 39.48 38.48 2dun n PHE 30 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 2dun h LEU 31 N 0.00 0.05 -0.98 -2.13 3.38 -1.11 -2.59 115.31 111.93 2dun h LEU 31 Ca 0.76 -0.76 0.14 0.00 0.09 0.00 0.00 57.88 58.11 2dun h LEU 31 Cb 1.93 -0.02 -0.15 0.00 0.09 0.00 0.00 40.66 42.52 2dun h LEU 31 CO -0.78 0.81 -0.42 0.41 0.09 0.00 0.00 178.44 178.55 2dun n THR 32 N -4.67 -0.54 -0.06 0.22 -1.04 0.12 0.09 114.28 108.40 2dun n THR 32 Ca -0.09 2.30 -0.13 0.00 -2.04 0.00 0.00 64.05 64.08 2dun n THR 32 Cb 0.40 -3.00 -0.07 0.00 -1.82 0.00 0.00 70.33 65.84 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 0.49 0.23 3.41 0.00 -1.52 -3.02 103.07 102.66 2dun h GLY 33 Ca 0.31 -0.53 -0.00 0.00 0.00 0.00 0.00 47.33 47.11 2dun h GLY 33 CO -0.96 0.48 -0.34 -2.00 0.00 0.00 0.00 176.54 173.72 2dun h LEU 34 N 0.10 -0.97 -0.42 3.11 5.85 -0.55 -2.09 115.31 120.33 2dun h LEU 34 Ca 0.02 0.09 0.04 0.00 0.84 0.00 0.00 57.88 58.88 2dun h LEU 34 Cb 0.77 0.34 -0.07 0.00 0.37 0.00 0.00 40.66 42.07 2dun h LEU 34 CO 0.05 -0.41 -0.43 0.00 -0.34 0.00 0.00 178.44 177.31 2dun h ALA 35 N -1.07 -0.61 -0.97 1.25 0.00 -0.46 0.89 119.26 118.28 2dun h ALA 35 Ca -0.03 0.02 0.29 0.00 0.00 0.00 0.00 54.91 55.19 2dun h ALA 35 Cb 0.55 1.09 -0.18 0.00 0.00 0.00 0.00 17.79 19.25 2dun h ALA 35 CO -0.10 -0.85 0.14 0.00 0.00 0.00 0.00 179.25 178.45 2dun h ARG 36 N -0.24 0.04 -0.60 0.00 3.08 -1.44 0.86 114.38 116.09 2dun h ARG 36 Ca 0.07 -0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.08 2dun h ARG 36 Cb 0.42 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.44 2dun h ARG 36 CO -0.52 0.03 0.23 0.77 -1.07 0.00 0.00 179.97 179.40 2dun h SER 37 N 0.04 0.84 -0.15 7.04 0.02 -0.16 -3.04 113.55 118.14 2dun h SER 37 Ca 0.63 -0.18 -0.01 0.00 -0.84 0.00 0.00 61.79 61.40 2dun h SER 37 Cb 1.38 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.69 2dun h SER 37 CO -0.85 0.79 0.07 0.11 -1.14 0.00 0.00 176.83 175.80 2dun h LYS 38 N 0.83 0.22 0.00 3.45 1.79 0.20 -3.47 116.57 119.59 2dun h LYS 38 Ca 0.20 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.63 2dun h LYS 38 Cb 0.22 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 30.84 2dun h LYS 38 CO -0.01 0.28 0.00 0.41 -1.08 0.00 0.00 179.45 179.05 2dun n GLY 39 N -0.78 0.00 3.12 3.86 0.00 0.10 -4.89 105.19 106.60 2dun n GLY 39 Ca -0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.66 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 2.49 -0.19 1.61 0.08 -1.08 -2.34 117.98 118.55 2dun s PHE 40 Ca 0.00 -1.30 -0.29 0.00 0.12 0.00 0.00 56.93 55.46 2dun s PHE 40 Cb 0.00 -1.73 -0.02 0.00 -0.57 0.00 0.00 43.02 40.70 2dun s PHE 40 CO 0.00 -0.62 1.44 0.50 -0.10 0.00 0.00 175.22 176.44 2dun s ARG 41 N 1.00 4.03 -0.22 0.44 3.52 -1.26 -3.13 118.95 123.33 2dun s ARG 41 Ca -0.04 1.66 -0.21 0.00 -0.13 0.00 0.00 55.73 57.01 2dun s ARG 41 Cb -0.15 -3.91 -0.02 0.00 -1.56 0.00 0.00 34.95 29.31 2dun s ARG 41 CO -0.05 -0.99 0.64 0.08 -0.81 0.00 0.00 175.30 174.17 2dun s VAL 42 N 4.28 5.00 0.03 7.11 1.01 -1.26 -3.27 120.40 133.30 2dun s VAL 42 Ca 0.63 1.19 -0.23 0.00 0.00 0.00 0.00 61.98 63.57 2dun s VAL 42 Cb -0.23 -3.95 -0.06 0.00 0.00 0.00 0.00 36.38 32.14 2dun s VAL 42 CO 0.23 0.08 0.69 -0.76 0.00 0.00 0.00 175.10 175.34 2dun s LEU 43 N 2.12 4.44 -0.05 3.92 1.43 -1.17 -5.00 118.68 124.36 2dun s LEU 43 Ca 0.28 1.34 -0.07 0.00 -1.03 0.00 0.00 54.13 54.65 2dun s LEU 43 Cb -0.16 -3.10 -0.04 0.00 0.03 0.00 0.00 46.19 42.93 2dun s LEU 43 CO 0.10 0.07 0.32 0.44 0.23 0.00 0.00 176.35 177.51 2dun h ASP 44 N 5.57 -0.20 0.00 2.29 5.19 -1.96 -3.42 116.42 123.88 2dun h ASP 44 Ca -0.45 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 55.97 2dun h ASP 44 Cb 1.20 0.05 0.00 0.00 0.18 0.00 0.00 39.33 40.77 2dun h ASP 44 CO 0.70 0.16 0.00 0.00 -3.12 0.00 0.00 179.24 176.98 2dun n ALA 45 N -2.60 1.87 -3.35 3.45 0.00 -1.26 -4.99 120.51 113.63 2dun n ALA 45 Ca -0.03 -0.03 0.02 0.00 0.00 0.00 0.00 53.44 53.40 2dun n ALA 45 Cb 0.10 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.51 2dun n ALA 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dun n SER 47 N 4.96 3.31 -2.39 0.00 7.64 -1.26 -4.94 113.62 120.94 2dun n SER 47 Ca -0.08 -3.32 -0.09 0.00 1.01 0.00 0.00 58.87 56.39 2dun n SER 47 Cb 0.53 -0.40 -0.01 0.00 -1.01 0.00 0.00 64.21 63.32 2dun n SER 47 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2dun n SER 48 N -0.68 -3.14 -0.03 6.43 2.88 -1.26 -4.74 113.62 113.09 2dun n SER 48 Ca 0.29 0.27 -0.03 0.00 -1.33 0.00 0.00 58.87 58.07 2dun n SER 48 Cb 0.89 -2.72 -0.04 0.00 -0.75 0.00 0.00 64.21 61.59 2dun n SER 48 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2dun n GLU 49 N -2.67 3.14 -1.45 -1.46 1.02 -1.26 -4.73 120.64 113.23 2dun n GLU 49 Ca -0.11 -0.00 -0.56 0.00 -0.02 0.00 0.00 57.16 56.47 2dun n GLU 49 Cb 0.57 -1.13 -0.08 0.00 -0.02 0.00 0.00 31.44 30.77 2dun n GLU 49 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2dun n ALA 50 N -2.19 -1.22 0.00 0.62 0.00 -1.26 -4.31 120.51 112.15 2dun n ALA 50 Ca -0.08 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.78 2dun n ALA 50 Cb 0.67 -1.59 0.00 0.00 0.00 0.00 0.00 19.45 18.53 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 3.23 0.00 -3.80 0.00 -2.24 0.80 -4.02 114.28 108.26 2dun n THR 51 Ca 0.25 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.76 2dun n THR 51 Cb -0.04 -0.66 -0.16 0.00 -2.10 0.00 0.00 70.33 67.36 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 -1.67 1.30 -0.09 4.78 3.76 -0.62 0.86 115.29 123.62 2dun s HIS 52 Ca 0.00 -0.94 -0.15 0.00 -0.15 0.00 0.00 55.06 53.81 2dun s HIS 52 Cb 0.00 -1.13 -0.05 0.00 1.11 0.00 0.00 32.58 32.51 2dun s HIS 52 CO 0.00 -0.60 0.39 0.08 -0.85 0.00 0.00 174.74 173.75 2dun s VAL 53 N 1.76 5.18 -0.16 -0.90 1.01 -0.97 -2.35 120.40 123.98 2dun s VAL 53 Ca -0.01 0.76 -0.07 0.00 0.00 0.00 0.00 61.98 62.67 2dun s VAL 53 Cb -0.16 -3.71 -0.04 0.00 0.00 0.00 0.00 36.38 32.47 2dun s VAL 53 CO -0.07 0.45 0.05 -0.69 0.00 0.00 0.00 175.10 174.84 2dun s VAL 54 N -0.09 4.74 0.02 2.92 1.01 -1.15 -0.45 120.40 127.39 2dun s VAL 54 Ca 0.22 -0.06 0.03 0.00 0.00 0.00 0.00 61.98 62.17 2dun s VAL 54 Cb -0.15 -3.11 -0.01 0.00 0.00 0.00 0.00 36.38 33.11 2dun s VAL 54 CO 0.09 0.49 -0.08 -0.04 0.00 0.00 0.00 175.10 175.56 2dun s MET 55 N 0.11 0.60 -0.00 2.72 -1.94 -1.20 -3.85 119.30 115.75 2dun s MET 55 Ca 0.05 -0.49 0.02 0.00 -1.71 0.00 0.00 55.69 53.56 2dun s MET 55 Cb -0.12 -0.53 -0.03 0.00 2.01 0.00 0.00 34.83 36.16 2dun s MET 55 CO 0.01 0.13 -0.04 -1.21 -0.01 0.00 0.00 175.02 173.89 2dun s GLU 56 N -0.77 2.64 -1.28 2.03 2.02 -1.25 -0.12 118.70 121.98 2dun s GLU 56 Ca -0.01 -0.67 -0.16 0.00 0.02 0.00 0.00 54.97 54.14 2dun s GLU 56 Cb -0.06 -2.56 0.16 0.00 0.10 0.00 0.00 34.13 31.77 2dun s GLU 56 CO 0.00 0.61 0.41 -0.85 0.02 0.00 0.00 175.26 175.45 2dun n GLU 57 N 1.54 -0.89 -4.14 1.61 0.28 -1.26 -4.85 120.64 112.93 2dun n GLU 57 Ca -0.15 0.09 -0.35 0.00 -0.16 0.00 0.00 57.16 56.59 2dun n GLU 57 Cb 0.53 -3.37 -0.09 0.00 1.43 0.00 0.00 31.44 29.94 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 -2.54 4.77 1.03 3.84 2.01 -1.26 -5.10 115.64 118.38 2dun s THR 58 Ca 0.57 -0.06 -0.13 0.00 0.31 0.00 0.00 61.69 62.37 2dun s THR 58 Cb -0.33 -3.06 0.20 0.00 0.01 0.00 0.00 72.50 69.32 2dun s THR 58 CO 0.70 0.57 1.10 -0.44 -0.69 0.00 0.00 174.62 175.86 2dun s SER 59 N -0.62 2.40 0.17 3.53 0.01 -1.26 -4.93 113.70 113.00 2dun s SER 59 Ca 0.11 1.11 -0.08 0.00 1.31 0.00 0.00 55.95 58.41 2dun s SER 59 Cb -0.12 -1.75 0.05 0.00 0.21 0.00 0.00 66.02 64.41 2dun s SER 59 CO 0.02 -3.26 1.53 0.00 0.41 0.00 0.00 173.24 171.94 2dun h ALA 60 N -1.98 0.68 0.01 1.44 0.00 -1.94 -3.13 119.26 114.34 2dun h ALA 60 Ca -0.54 -0.44 -0.24 0.00 0.00 0.00 0.00 54.91 53.69 2dun h ALA 60 Cb 1.33 -0.13 0.02 0.00 0.00 0.00 0.00 17.79 19.01 2dun h ALA 60 CO 0.56 0.67 -0.93 1.05 0.00 0.00 0.00 179.25 180.60 2dun h GLU 61 N 0.70 0.62 -0.97 0.00 4.11 -1.89 -2.45 114.58 114.71 2dun h GLU 61 Ca 0.07 -0.68 0.25 0.00 0.07 0.00 0.00 59.36 59.07 2dun h GLU 61 Cb 0.92 0.19 -0.06 0.00 0.50 0.00 0.00 28.75 30.30 2dun h GLU 61 CO 0.08 1.27 0.65 0.93 0.07 0.00 0.00 179.01 182.02 2dun h GLU 62 N 0.25 0.26 0.00 1.06 5.08 -1.93 0.42 114.58 119.72 2dun h GLU 62 Ca -0.12 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.23 2dun h GLU 62 Cb 1.60 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.79 2dun h GLU 62 CO 0.18 0.17 0.00 0.00 -1.00 0.00 0.00 179.01 178.37 2dun n ALA 63 N -2.58 -0.12 -0.26 3.43 0.00 -1.18 -0.64 120.51 119.16 2dun n ALA 63 Ca 0.21 0.00 0.33 0.00 0.00 0.00 0.00 53.44 53.98 2dun n ALA 63 Cb 0.86 0.00 0.74 0.00 0.00 0.00 0.00 19.45 21.05 2dun n ALA 63 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 2dun h VAL 64 N 0.00 0.45 0.17 0.00 3.04 -1.48 0.35 116.25 118.77 2dun h VAL 64 Ca 0.00 0.00 -0.31 0.00 -1.01 0.00 0.00 66.70 65.38 2dun h VAL 64 Cb 0.00 0.46 0.01 0.00 -2.01 0.00 0.00 31.29 29.75 2dun h VAL 64 CO 0.00 0.00 -1.46 -1.28 -1.01 0.00 0.00 177.57 173.82 2dun h SER 65 N 0.00 0.55 0.70 3.17 0.87 -0.26 -3.15 113.55 115.42 2dun h SER 65 Ca 0.51 -0.66 -0.05 0.00 -1.23 0.00 0.00 61.79 60.36 2dun h SER 65 Cb 2.05 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 63.83 2dun h SER 65 CO -0.01 1.53 -0.24 -0.25 -0.53 0.00 0.00 176.83 177.34 2dun h TRP 66 N 0.10 0.00 0.00 2.24 7.01 0.20 -2.73 115.95 122.76 2dun h TRP 66 Ca -0.23 0.00 -0.18 0.00 2.11 0.00 0.00 58.89 60.60 2dun h TRP 66 Cb 2.06 0.00 -0.03 0.00 -2.10 0.00 0.00 29.16 29.09 2dun h TRP 66 CO 0.09 0.24 -0.84 -0.56 -2.79 0.00 0.00 178.44 174.57 2dun h GLN 67 N 0.00 0.00 -0.84 2.65 3.07 -1.04 -3.29 115.11 115.66 2dun h GLN 67 Ca -0.00 0.00 0.13 0.00 0.09 0.00 0.00 58.65 58.86 2dun h GLN 67 Cb 0.65 0.00 -0.09 0.00 0.08 0.00 0.00 27.48 28.13 2dun h GLN 67 CO 0.03 0.84 0.45 0.93 0.09 0.00 0.00 178.83 181.18 2dun h GLU 68 N 0.00 0.68 -0.24 0.06 4.39 -1.44 -2.11 114.58 115.92 2dun h GLU 68 Ca -0.01 -0.04 0.06 0.00 0.34 0.00 0.00 59.36 59.71 2dun h GLU 68 Cb 1.62 -0.15 -0.07 0.00 -0.10 0.00 0.00 28.75 30.04 2dun h GLU 68 CO 0.11 0.45 -0.35 0.00 -1.16 0.00 0.00 179.01 178.06 2dun h ARG 69 N 0.70 -0.35 0.68 2.33 2.47 -1.67 -1.02 114.38 117.52 2dun h ARG 69 Ca 0.44 0.02 -0.03 0.00 -1.26 0.00 0.00 59.98 59.15 2dun h ARG 69 Cb 0.54 0.08 0.00 0.00 -1.65 0.00 0.00 29.97 28.94 2dun h ARG 69 CO -0.31 -0.23 -0.37 0.00 0.56 0.00 0.00 179.97 179.61 2dun h ARG 70 N -0.36 -0.94 -1.70 0.04 3.08 -1.59 -1.63 114.38 111.29 2dun h ARG 70 Ca 0.12 0.06 0.52 0.00 0.07 0.00 0.00 59.98 60.75 2dun h ARG 70 Cb 0.56 0.21 -0.10 0.00 0.08 0.00 0.00 29.97 30.72 2dun h ARG 70 CO -0.44 -0.62 1.18 0.52 -1.07 0.00 0.00 179.97 179.54 2dun h MET 71 N -0.97 0.02 0.07 0.04 2.86 -1.22 1.33 114.93 117.05 2dun h MET 71 Ca -0.09 -0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.54 2dun h MET 71 Cb 0.76 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.42 2dun h MET 71 CO 0.12 0.01 -0.04 0.00 1.06 0.00 0.00 176.91 178.06 2dun h ALA 72 N 1.26 -0.10 -0.94 6.32 0.00 -0.62 -3.30 119.26 121.88 2dun h ALA 72 Ca 0.88 -0.29 -0.49 0.00 0.00 0.00 0.00 54.91 55.01 2dun h ALA 72 Cb 3.29 0.04 -0.29 0.00 0.00 0.00 0.00 17.79 20.83 2dun h ALA 72 CO -0.17 -0.19 0.62 0.00 0.00 0.00 0.00 179.25 179.51 2dun n ALA 73 N -2.55 5.44 -2.92 0.00 0.00 0.14 -4.96 120.51 115.67 2dun n ALA 73 Ca -0.08 -2.74 -0.28 0.00 0.00 0.00 0.00 53.44 50.34 2dun n ALA 73 Cb 0.30 -1.43 -0.03 0.00 0.00 0.00 0.00 19.45 18.29 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 -3.11 3.98 0.69 0.00 0.00 0.41 -4.95 121.76 118.77 2dun s ALA 74 Ca 0.54 -0.94 -0.14 0.00 0.00 0.00 0.00 51.96 51.42 2dun s ALA 74 Cb 0.45 -1.81 0.02 0.00 0.00 0.00 0.00 23.12 21.77 2dun s ALA 74 CO 0.10 0.66 1.10 -1.25 0.00 0.00 0.00 175.76 176.37 2dun s PRO 75 N -2.93 2.65 0.02 0.00 0.04 -1.26 -4.97 135.00 128.55 2dun s PRO 75 Ca 0.35 1.33 -0.30 0.00 0.04 0.00 0.00 61.00 62.41 2dun s PRO 75 Cb -0.12 -1.94 -0.06 0.00 0.04 0.00 0.00 34.50 32.42 2dun s PRO 75 CO 0.28 -1.36 1.43 -1.25 0.04 0.00 0.00 177.00 176.14 2dun s PRO 76 N -4.33 4.28 0.00 0.56 0.04 -1.26 -3.10 135.00 131.19 2dun s PRO 76 Ca 0.65 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.71 2dun s PRO 76 Cb -0.20 -3.53 0.00 0.00 0.04 0.00 0.00 34.50 30.81 2dun s PRO 76 CO 0.46 -0.57 0.00 0.41 0.04 0.00 0.00 177.00 177.33 2dun n GLY 77 N 3.66 2.45 3.58 0.56 0.00 -1.26 -5.07 105.19 109.12 2dun n GLY 77 Ca 0.13 -0.61 -0.49 0.00 0.00 0.00 0.00 46.02 45.05 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 -0.05 4.98 -0.22 0.00 2.01 -1.26 -5.03 115.64 116.07 2dun s THR 79 Ca 0.75 0.97 -0.29 0.00 0.31 0.00 0.00 61.69 63.43 2dun s THR 79 Cb -0.86 -3.79 -0.03 0.00 0.01 0.00 0.00 72.50 67.83 2dun s THR 79 CO 0.51 0.52 1.60 -2.16 -0.69 0.00 0.00 174.62 174.40 2dun s PRO 80 N -0.71 3.81 0.37 4.92 0.04 -1.26 -4.90 135.00 137.27 2dun s PRO 80 Ca 0.26 1.66 -0.27 0.00 0.04 0.00 0.00 61.00 62.69 2dun s PRO 80 Cb -0.17 -4.03 -0.09 0.00 0.04 0.00 0.00 34.50 30.25 2dun s PRO 80 CO 0.14 -1.27 1.20 -1.25 0.04 0.00 0.00 177.00 175.86 2dun s PRO 81 N 4.64 4.20 -0.39 0.56 0.04 -1.26 -4.96 135.00 137.84 2dun s PRO 81 Ca 0.71 1.95 -0.29 0.00 0.04 0.00 0.00 61.00 63.41 2dun s PRO 81 Cb -0.25 -2.85 0.00 0.00 0.04 0.00 0.00 34.50 31.45 2dun s PRO 81 CO 0.29 -0.23 1.50 0.00 0.04 0.00 0.00 177.00 178.60 2dun s ALA 82 N -1.30 3.02 -0.18 8.56 0.00 0.25 -4.80 121.76 127.31 2dun s ALA 82 Ca 0.53 -0.05 -0.29 0.00 0.00 0.00 0.00 51.96 52.16 2dun s ALA 82 Cb -0.34 -3.95 -0.04 0.00 0.00 0.00 0.00 23.12 18.79 2dun s ALA 82 CO 0.43 -2.43 1.74 -0.51 0.00 0.00 0.00 175.76 174.99 2dun s LEU 83 N 5.74 3.93 0.50 0.00 1.43 -1.26 -2.28 118.68 126.73 2dun s LEU 83 Ca 0.66 1.82 0.04 0.00 -1.03 0.00 0.00 54.13 55.62 2dun s LEU 83 Cb -0.16 -3.53 -0.01 0.00 0.03 0.00 0.00 46.19 42.52 2dun s LEU 83 CO 0.33 -1.30 0.17 -0.76 0.23 0.00 0.00 176.35 175.01 2dun s LEU 84 N 5.43 2.62 0.08 1.79 1.43 0.41 -2.73 118.68 127.70 2dun s LEU 84 Ca 0.77 -1.39 0.03 0.00 -1.03 0.00 0.00 54.13 52.51 2dun s LEU 84 Cb -0.29 -1.03 -0.04 0.00 0.03 0.00 0.00 46.19 44.87 2dun s LEU 84 CO 0.31 -0.85 0.07 -0.62 0.23 0.00 0.00 176.35 175.50 2dun s ASP 85 N -4.00 5.48 0.32 2.29 2.15 -1.13 -3.21 116.67 118.57 2dun s ASP 85 Ca 0.23 -0.03 0.08 0.00 0.43 0.00 0.00 52.55 53.27 2dun s ASP 85 Cb 0.01 -1.46 0.90 0.00 -0.30 0.00 0.00 42.92 42.08 2dun s ASP 85 CO 0.14 0.17 1.64 -0.29 -0.17 0.00 0.00 175.17 176.65 2dun h ILE 86 N 2.58 0.24 -0.98 4.11 -0.00 -0.86 0.19 117.51 122.79 2dun h ILE 86 Ca -0.47 -0.07 0.31 0.00 -0.00 0.00 0.00 64.86 64.63 2dun h ILE 86 Cb 1.16 0.02 -0.18 0.00 -0.00 0.00 0.00 36.82 37.83 2dun h ILE 86 CO 0.65 0.04 0.22 -1.28 -0.00 0.00 0.00 178.15 177.77 2dun h SER 87 N 0.20 -0.16 0.13 2.19 0.87 -1.95 0.27 113.55 115.10 2dun h SER 87 Ca 0.65 0.26 0.02 0.00 -1.23 0.00 0.00 61.79 61.48 2dun h SER 87 Cb 1.43 0.39 -0.03 0.00 -0.44 0.00 0.00 62.40 63.74 2dun h SER 87 CO -0.69 -0.35 -0.25 -0.25 -0.53 0.00 0.00 176.83 174.77 2dun h TRP 88 N 0.04 -0.66 -0.13 2.24 7.01 -1.01 -2.04 115.95 121.40 2dun h TRP 88 Ca 0.67 0.01 0.02 0.00 2.11 0.00 0.00 58.89 61.70 2dun h TRP 88 Cb 1.52 0.28 -0.04 0.00 -2.10 0.00 0.00 29.16 28.82 2dun h TRP 88 CO -0.32 -0.35 -0.28 1.25 -2.79 0.00 0.00 178.44 175.95 2dun h LEU 89 N -0.46 -0.92 -0.96 0.65 5.85 -0.57 0.37 115.31 119.27 2dun h LEU 89 Ca 0.03 0.12 0.29 0.00 0.84 0.00 0.00 57.88 59.15 2dun h LEU 89 Cb 0.48 0.37 -0.15 0.00 0.37 0.00 0.00 40.66 41.73 2dun h LEU 89 CO -0.13 -0.23 0.42 0.71 -0.34 0.00 0.00 178.44 178.87 2dun h THR 90 N -0.26 0.29 -0.75 1.05 1.35 -1.41 0.58 112.91 113.76 2dun h THR 90 Ca 0.03 -0.09 -0.04 0.00 -0.55 0.00 0.00 66.41 65.75 2dun h THR 90 Cb 0.33 0.00 -0.03 0.00 -1.73 0.00 0.00 68.15 66.72 2dun h THR 90 CO -0.26 0.05 0.30 -0.33 -0.25 0.00 0.00 175.52 175.02 2dun h GLU 91 N 0.27 1.12 0.18 4.72 5.08 -0.36 -1.48 114.58 124.10 2dun h GLU 91 Ca 0.66 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 58.81 2dun h GLU 91 Cb 1.45 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.52 2dun h GLU 91 CO -0.64 0.91 -0.08 0.77 -1.00 0.00 0.00 179.01 178.97 2dun h SER 92 N 1.08 -0.20 -0.03 1.42 0.02 0.21 -2.57 113.55 113.48 2dun h SER 92 Ca 0.25 -0.21 0.03 0.00 -0.84 0.00 0.00 61.79 61.03 2dun h SER 92 Cb 0.21 0.05 -0.04 0.00 0.14 0.00 0.00 62.40 62.76 2dun h SER 92 CO -0.02 0.10 -0.22 -0.07 -1.14 0.00 0.00 176.83 175.49 2dun h LEU 93 N -0.52 -0.64 -1.79 5.07 3.38 -1.05 0.77 115.31 120.53 2dun h LEU 93 Ca -0.02 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2dun h LEU 93 Cb 0.40 0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.42 2dun h LEU 93 CO 0.04 -0.28 0.03 1.23 0.09 0.00 0.00 178.44 179.55 2dun h GLY 94 N -0.33 0.00 0.00 0.83 0.00 -1.29 0.31 103.07 102.59 2dun h GLY 94 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.40 2dun h GLY 94 CO -0.22 0.00 -1.01 0.00 0.00 0.00 0.00 176.54 175.31 2dun n ALA 95 N -1.84 3.52 -0.27 3.60 0.00 0.07 -4.97 120.51 120.62 2dun n ALA 95 Ca -0.02 -0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.02 2dun n ALA 95 Cb 0.07 -0.54 0.00 0.00 0.00 0.00 0.00 19.45 18.99 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 1.44 1.64 3.12 0.00 0.00 0.25 -4.95 105.19 106.68 2dun n GLY 96 Ca 0.01 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.10 0.68 -0.38 1.61 -2.07 -1.07 -4.73 119.66 113.61 2dun s GLN 97 Ca 0.00 -0.95 -0.28 0.00 -1.82 0.00 0.00 55.36 52.31 2dun s GLN 97 Cb 0.00 -0.41 -0.01 0.00 -1.09 0.00 0.00 33.01 31.50 2dun s GLN 97 CO 0.00 0.07 1.71 -1.25 -1.32 0.00 0.00 175.29 174.50 2dun s PRO 98 N -2.16 3.32 0.57 9.60 0.04 -1.26 -4.42 135.00 140.69 2dun s PRO 98 Ca -0.03 1.23 -0.17 0.00 0.04 0.00 0.00 61.00 62.07 2dun s PRO 98 Cb -0.06 -4.18 -0.05 0.00 0.04 0.00 0.00 34.50 30.25 2dun s PRO 98 CO -0.00 -1.87 1.07 0.14 0.04 0.00 0.00 177.00 176.38 2dun s VAL 99 N 6.76 3.62 0.12 -0.36 -7.23 -1.26 -4.99 120.40 117.06 2dun s VAL 99 Ca 0.74 0.87 -0.31 0.00 -1.81 0.00 0.00 61.98 61.47 2dun s VAL 99 Cb -0.19 -3.35 -0.08 0.00 0.56 0.00 0.00 36.38 33.32 2dun s VAL 99 CO 0.32 -0.36 1.35 -2.16 -0.31 0.00 0.00 175.10 173.95 2dun s PRO 100 N -3.72 4.34 0.52 4.82 0.04 -1.26 -4.97 135.00 134.77 2dun s PRO 100 Ca 0.67 2.03 -0.21 0.00 0.04 0.00 0.00 61.00 63.52 2dun s PRO 100 Cb -0.18 -3.25 -0.07 0.00 0.04 0.00 0.00 34.50 31.04 2dun s PRO 100 CO 0.31 -0.39 1.12 0.28 0.04 0.00 0.00 177.00 178.37 2dun n VAL 101 N 3.75 3.31 -4.52 -0.36 0.31 -1.26 -5.02 118.33 114.55 2dun n VAL 101 Ca 0.10 -0.50 -0.25 0.00 -0.01 0.00 0.00 64.34 63.69 2dun n VAL 101 Cb 0.43 -1.34 -0.09 0.00 -0.91 0.00 0.00 33.84 31.92 2dun n VAL 101 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 2dun s GLU 102 N -2.56 1.83 0.13 5.55 -1.05 -1.26 -5.02 118.70 116.32 2dun s GLU 102 Ca 0.70 -2.08 -0.22 0.00 -0.15 0.00 0.00 54.97 53.22 2dun s GLU 102 Cb -0.46 -0.89 -0.04 0.00 -0.44 0.00 0.00 34.13 32.31 2dun s GLU 102 CO 0.51 -0.31 1.68 0.00 0.95 0.00 0.00 175.26 178.10 2dun h ARG 104 N -0.14 1.03 0.06 0.00 2.43 -2.02 -2.45 114.38 113.29 2dun h ARG 104 Ca 0.08 -0.06 0.01 0.00 -0.81 0.00 0.00 59.98 59.20 2dun h ARG 104 Cb 0.26 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 29.56 2dun h ARG 104 CO -0.20 0.68 -0.09 0.45 -1.51 0.00 0.00 179.97 179.30 2dun h HIS 105 N 1.06 -0.24 -2.86 2.20 3.86 -1.76 -3.44 115.15 113.97 2dun h HIS 105 Ca 0.43 0.00 -0.58 0.00 -1.16 0.00 0.00 60.37 59.07 2dun h HIS 105 Cb 0.26 0.10 0.18 0.00 1.06 0.00 0.00 27.41 29.01 2dun h HIS 105 CO -0.01 -0.14 -0.57 0.54 0.86 0.00 0.00 177.93 178.60 2dun n ARG 106 N -5.21 0.34 -3.76 2.45 1.74 -0.77 -2.82 116.66 108.63 2dun n ARG 106 Ca -0.07 0.14 -0.27 0.00 -0.77 0.00 0.00 57.85 56.88 2dun n ARG 106 Cb 0.14 -1.61 -0.17 0.00 -1.02 0.00 0.00 32.46 29.80 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 1.38 1.22 0.21 0.55 1.43 -1.11 -4.89 118.68 117.47 2dun s LEU 107 Ca 0.65 -0.73 -0.22 0.00 -1.03 0.00 0.00 54.13 52.79 2dun s LEU 107 Cb -0.41 -0.63 0.05 0.00 0.03 0.00 0.00 46.19 45.23 2dun s LEU 107 CO 0.58 -0.28 0.67 -0.70 0.23 0.00 0.00 176.35 176.85 2dun s GLU 108 N 1.83 1.49 0.23 1.70 2.12 -0.93 -3.69 118.70 121.45 2dun s GLU 108 Ca -0.00 -0.69 0.01 0.00 0.36 0.00 0.00 54.97 54.65 2dun s GLU 108 Cb -0.16 0.59 -0.05 0.00 0.26 0.00 0.00 34.13 34.77 2dun s GLU 108 CO -0.07 -0.67 0.07 0.54 -0.54 0.00 0.00 175.26 174.59 2dun s VAL 109 N -3.80 0.55 -0.29 3.70 0.11 -1.26 -4.35 120.40 115.07 2dun s VAL 109 Ca 0.06 -1.99 -0.23 0.00 -2.93 0.00 0.00 61.98 56.88 2dun s VAL 109 Cb -0.03 -2.49 0.17 0.00 -1.53 0.00 0.00 36.38 32.50 2dun s VAL 109 CO -0.04 -0.13 1.27 0.00 -3.33 0.00 0.00 175.10 172.88 2dun s ALA 110 N -3.75 -2.23 -0.96 1.54 0.00 -1.26 -5.03 121.76 110.07 2dun s ALA 110 Ca 0.34 1.82 -0.10 0.00 0.00 0.00 0.00 51.96 54.02 2dun s ALA 110 Cb 0.07 -1.72 -0.01 0.00 0.00 0.00 0.00 23.12 21.47 2dun s ALA 110 CO 0.11 -0.18 0.73 0.41 0.00 0.00 0.00 175.76 176.83 2dun n GLY 111 N 2.13 -1.14 3.67 0.00 0.00 -1.26 -4.87 105.19 103.72 2dun n GLY 111 Ca -0.12 0.50 -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 -4.87 4.22 0.21 1.61 0.04 -1.26 -5.02 135.00 129.94 2dun s PRO 112 Ca 0.24 2.02 0.09 0.00 0.04 0.00 0.00 61.00 63.39 2dun s PRO 112 Cb -0.08 -3.80 -0.05 0.00 0.04 0.00 0.00 34.50 30.61 2dun s PRO 112 CO 0.83 -0.74 -0.17 1.03 0.04 0.00 0.00 177.00 178.00 2dun s ARG 113 N 3.40 1.42 -0.25 4.56 0.52 -1.26 -5.04 118.95 122.30 2dun s ARG 113 Ca 0.67 -1.59 0.13 0.00 -0.52 0.00 0.00 55.73 54.42 2dun s ARG 113 Cb -0.30 -1.38 0.63 0.00 0.52 0.00 0.00 34.95 34.42 2dun s ARG 113 CO 0.25 0.25 1.59 1.17 0.02 0.00 0.00 175.30 178.59 2dun n LYS 114 N -0.25 3.24 0.00 3.54 3.00 -1.26 -4.86 118.16 121.57 2dun n LYS 114 Ca -0.09 -3.01 0.00 0.00 -0.00 0.00 0.00 58.31 55.21 2dun n LYS 114 Cb 0.59 -2.01 0.00 0.00 0.00 0.00 0.00 35.03 33.61 2dun n LYS 114 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2dun n GLY 115 N -0.37 0.55 3.63 3.14 0.00 -1.26 -5.17 105.19 105.72 2dun n GLY 115 Ca 0.30 0.02 -0.29 0.00 0.00 0.00 0.00 46.02 46.05 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 0.00 -0.38 -0.04 1.61 0.04 -1.26 -5.08 135.00 129.89 2dun s PRO 116 Ca 0.00 0.24 0.00 0.00 0.04 0.00 0.00 61.00 61.28 2dun s PRO 116 Cb 0.00 -1.67 0.03 0.00 0.04 0.00 0.00 34.50 32.90 2dun s PRO 116 CO 0.00 -3.22 -0.00 -0.48 0.04 0.00 0.00 177.00 173.34 2dun s LEU 117 N -6.70 1.11 0.02 -3.56 0.05 -1.26 -5.15 118.68 103.19 2dun s LEU 117 Ca 0.68 -0.04 0.06 0.00 0.05 0.00 0.00 54.13 54.87 2dun s LEU 117 Cb -0.15 -0.27 -0.02 0.00 -2.05 0.00 0.00 46.19 43.70 2dun s LEU 117 CO 0.57 -0.10 -0.17 -0.94 -0.55 0.00 0.00 176.35 175.15 2dun s SER 118 N 1.11 2.01 -0.02 1.48 1.04 -1.26 -5.06 113.70 113.00 2dun s SER 118 Ca -0.08 -0.40 -0.26 0.00 0.48 0.00 0.00 55.95 55.69 2dun s SER 118 Cb -0.14 -0.18 -0.20 0.00 0.10 0.00 0.00 66.02 65.60 2dun s SER 118 CO -0.02 0.15 1.26 1.55 0.98 0.00 0.00 173.24 177.16 2dun h PRO 119 N 5.29 -0.01 -2.11 4.02 0.13 -2.09 -3.48 132.00 133.74 2dun h PRO 119 Ca -0.38 0.00 0.22 0.00 -0.87 0.00 0.00 66.00 64.96 2dun h PRO 119 Cb 1.16 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.20 2dun h PRO 119 CO 0.46 0.48 0.58 0.00 -0.23 0.00 0.00 178.00 179.28 2dun s ALA 120 N -4.26 -1.80 0.05 -0.56 0.00 -1.26 -5.17 121.76 108.76 2dun s ALA 120 Ca -0.16 0.25 0.00 0.00 0.00 0.00 0.00 51.96 52.06 2dun s ALA 120 Cb 0.02 0.57 -0.04 0.00 0.00 0.00 0.00 23.12 23.67 2dun s ALA 120 CO 0.67 -1.05 0.17 -0.46 0.00 0.00 0.00 175.76 175.09 2dun s TRP 121 N -3.03 3.43 -0.24 0.00 -0.11 -1.26 -5.11 118.94 112.62 2dun s TRP 121 Ca 0.13 0.22 -0.13 0.00 1.22 0.00 0.00 56.10 57.54 2dun s TRP 121 Cb 0.00 -1.73 0.08 0.00 -1.50 0.00 0.00 33.47 30.32 2dun s TRP 121 CO 0.01 0.58 0.58 -1.64 -4.62 0.00 0.00 176.95 171.86 2dun s MET 122 N -2.38 0.58 0.88 5.86 -1.94 -1.26 -5.17 119.30 115.88 2dun s MET 122 Ca 0.32 1.09 -0.11 0.00 -1.71 0.00 0.00 55.69 55.27 2dun s MET 122 Cb -0.13 0.14 0.12 0.00 2.01 0.00 0.00 34.83 36.98 2dun s MET 122 CO 0.25 -0.16 1.09 -1.25 -0.01 0.00 0.00 175.02 174.94 2dun s PRO 123 N 1.69 1.36 0.33 2.03 0.04 -1.26 -4.87 135.00 134.31 2dun s PRO 123 Ca -0.09 0.85 0.11 0.00 0.04 0.00 0.00 61.00 61.91 2dun s PRO 123 Cb -0.07 -1.82 0.92 0.00 0.04 0.00 0.00 34.50 33.57 2dun s PRO 123 CO -0.17 -2.18 1.72 0.00 0.04 0.00 0.00 177.00 176.41 2dun h ALA 124 N -1.51 1.83 -0.15 8.56 0.00 -2.08 0.89 119.26 126.80 2dun h ALA 124 Ca -0.49 0.13 -0.13 0.00 0.00 0.00 0.00 54.91 54.42 2dun h ALA 124 Cb 1.28 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 19.05 2dun h ALA 124 CO 0.54 -0.32 0.09 2.48 0.00 0.00 0.00 179.25 182.04 2dun n TYR 125 N -4.89 0.49 -3.92 0.00 4.11 -1.26 -4.73 117.16 106.95 2dun n TYR 125 Ca 0.27 -1.36 -0.33 0.00 -0.00 0.00 0.00 57.90 56.48 2dun n TYR 125 Cb 0.78 -0.78 -0.14 0.00 -0.00 0.00 0.00 39.34 39.20 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 -0.46 3.01 -0.64 -3.48 0.00 0.30 -5.04 121.76 115.44 2dun s ALA 126 Ca 0.18 -2.56 -0.05 0.00 0.00 0.00 0.00 51.96 49.53 2dun s ALA 126 Cb 0.12 -2.15 0.17 0.00 0.00 0.00 0.00 23.12 21.26 2dun s ALA 126 CO -0.01 -1.74 0.48 0.00 0.00 0.00 0.00 175.76 174.49 2dun s SER 128 N 1.11 -0.49 0.00 0.00 0.15 -1.26 -5.17 113.70 108.04 2dun s SER 128 Ca 0.16 0.79 0.00 0.00 0.70 0.00 0.00 55.95 57.60 2dun s SER 128 Cb -0.19 0.74 0.00 0.00 -1.71 0.00 0.00 66.02 64.87 2dun s SER 128 CO -0.04 -0.27 0.00 0.61 1.20 0.00 0.00 173.24 174.74 2dun n GLY 129 N 1.69 1.76 3.68 9.45 0.00 -1.26 -5.17 105.19 115.34 2dun n GLY 129 Ca -0.13 0.19 -0.29 0.00 0.00 0.00 0.00 46.02 45.80 2dun n GLY 129 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dun s PRO 130 N -0.24 0.53 -0.00 1.61 0.04 -1.26 -5.09 135.00 130.59 2dun s PRO 130 Ca 0.00 0.57 -0.21 0.00 0.04 0.00 0.00 61.00 61.40 2dun s PRO 130 Cb 0.00 -1.74 0.04 0.00 0.04 0.00 0.00 34.50 32.84 2dun s PRO 130 CO 0.00 -2.68 0.46 -1.54 0.04 0.00 0.00 177.00 173.29 2dun s SER 131 N -3.44 -0.37 -0.14 6.66 1.04 -1.26 -5.09 113.70 111.10 2dun s SER 131 Ca 0.65 0.24 -0.09 0.00 0.48 0.00 0.00 55.95 57.23 2dun s SER 131 Cb -0.19 0.42 -0.03 0.00 0.10 0.00 0.00 66.02 66.33 2dun s SER 131 CO 0.58 -0.58 -0.15 -1.28 0.98 0.00 0.00 173.24 172.78 2dun h SER 132 N 3.27 0.00 0.00 7.02 0.87 -2.11 -3.58 113.55 119.02 2dun h SER 132 Ca -0.29 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.25 2dun h SER 132 Cb 1.18 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.14 2dun h SER 132 CO 0.41 0.75 0.00 0.61 -0.53 0.00 0.00 176.83 178.07