#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 6.81 0.02 1.61 0.15 -1.26 -4.98 113.70 116.05 2dun s SER 2 Ca 0.00 -2.68 -0.27 0.00 0.70 0.00 0.00 55.95 53.70 2dun s SER 2 Cb 0.00 -2.25 0.06 0.00 -1.71 0.00 0.00 66.02 62.12 2dun s SER 2 CO 0.00 -0.64 0.61 -0.44 1.20 0.00 0.00 173.24 173.97 2dun s SER 3 N 2.37 -0.57 -0.25 5.45 0.01 -1.26 -5.04 113.70 114.41 2dun s SER 3 Ca 0.23 0.42 -0.02 0.00 1.31 0.00 0.00 55.95 57.89 2dun s SER 3 Cb -0.09 0.53 0.06 0.00 0.21 0.00 0.00 66.02 66.73 2dun s SER 3 CO -0.09 -0.70 2.48 0.61 0.41 0.00 0.00 173.24 175.95 2dun n GLY 4 N 0.55 3.70 3.23 3.44 0.00 -1.26 -4.85 105.19 110.00 2dun n GLY 4 Ca -0.19 -1.13 -0.33 0.00 0.00 0.00 0.00 46.02 44.38 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 0.85 3.45 -0.29 1.61 0.01 -1.26 -5.09 113.70 112.97 2dun s SER 5 Ca 0.39 -0.52 -0.16 0.00 1.31 0.00 0.00 55.95 56.96 2dun s SER 5 Cb 0.25 -1.52 0.17 0.00 0.21 0.00 0.00 66.02 65.13 2dun s SER 5 CO -0.06 0.08 1.10 -0.94 0.41 0.00 0.00 173.24 173.83 2dun s SER 6 N 0.81 -0.32 0.00 2.44 1.04 -1.26 -5.10 113.70 111.32 2dun s SER 6 Ca -0.06 0.51 0.00 0.00 0.48 0.00 0.00 55.95 56.88 2dun s SER 6 Cb -0.15 1.11 0.00 0.00 0.10 0.00 0.00 66.02 67.08 2dun s SER 6 CO -0.01 -0.08 0.22 0.61 0.98 0.00 0.00 173.24 174.96 2dun n GLY 7 N 3.39 -0.24 3.63 7.32 0.00 -1.26 -4.84 105.19 113.20 2dun n GLY 7 Ca -0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.41 2dun n GLY 7 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dun n SER 8 N -1.01 1.81 -4.53 1.61 2.88 -1.26 -4.91 113.62 108.21 2dun n SER 8 Ca 0.00 1.15 -0.34 0.00 -1.33 0.00 0.00 58.87 58.35 2dun n SER 8 Cb 0.00 -1.38 0.11 0.00 -0.75 0.00 0.00 64.21 62.19 2dun n SER 8 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 2dun n THR 9 N 0.05 1.18 -0.25 2.46 5.66 -1.26 -4.89 114.28 117.23 2dun n THR 9 Ca 0.08 -0.24 -0.02 0.00 -3.05 0.00 0.00 64.05 60.81 2dun n THR 9 Cb 0.36 -0.86 0.10 0.00 -1.55 0.00 0.00 70.33 68.37 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 -1.02 0.78 -3.00 1.09 3.08 -1.91 -3.33 114.38 110.06 2dun h ARG 10 Ca -0.45 -0.05 -0.62 0.00 0.07 0.00 0.00 59.98 58.94 2dun h ARG 10 Cb 1.31 -0.18 -0.40 0.00 0.08 0.00 0.00 29.97 30.78 2dun h ARG 10 CO 0.41 0.52 -0.72 -0.06 -1.07 0.00 0.00 179.97 179.05 2dun s PHE 11 N -6.10 2.37 0.15 3.04 0.08 -1.11 -4.96 117.98 111.45 2dun s PHE 11 Ca -0.13 -2.71 -0.11 0.00 0.12 0.00 0.00 56.93 54.11 2dun s PHE 11 Cb 0.16 -2.09 -0.03 0.00 -0.57 0.00 0.00 43.02 40.49 2dun s PHE 11 CO 0.77 -0.74 1.48 -1.00 -0.10 0.00 0.00 175.22 175.63 2dun h PRO 12 N 6.33 0.93 -0.44 0.24 0.13 -1.87 -3.07 132.00 134.24 2dun h PRO 12 Ca 0.04 -0.49 0.13 0.00 -0.87 0.00 0.00 66.00 64.80 2dun h PRO 12 Cb 0.89 0.02 -0.02 0.00 0.13 0.00 0.00 31.00 32.02 2dun h PRO 12 CO 0.55 1.15 0.34 0.78 -0.23 0.00 0.00 178.00 180.59 2dun h GLY 13 N 0.78 0.00 -7.33 1.56 0.00 -1.94 -3.37 103.07 92.77 2dun h GLY 13 Ca 0.06 0.00 -0.68 0.00 0.00 0.00 0.00 47.33 46.71 2dun h GLY 13 CO 0.10 0.00 -0.14 0.14 0.00 0.00 0.00 176.54 176.63 2dun s VAL 14 N -4.94 5.04 -0.28 4.60 1.01 -1.16 -4.96 120.40 119.70 2dun s VAL 14 Ca -0.05 -0.22 -0.03 0.00 0.00 0.00 0.00 61.98 61.67 2dun s VAL 14 Cb 0.19 -4.06 0.03 0.00 0.00 0.00 0.00 36.38 32.54 2dun s VAL 14 CO 0.69 -0.43 0.01 0.00 0.00 0.00 0.00 175.10 175.36 2dun s ALA 15 N 2.27 2.86 -0.16 5.51 0.00 -1.26 -4.02 121.76 126.96 2dun s ALA 15 Ca 0.14 -1.58 -0.08 0.00 0.00 0.00 0.00 51.96 50.45 2dun s ALA 15 Cb -0.16 -1.94 -0.04 0.00 0.00 0.00 0.00 23.12 20.98 2dun s ALA 15 CO 0.14 -1.03 0.12 0.42 0.00 0.00 0.00 175.76 175.42 2dun s ILE 16 N 1.36 5.34 -0.07 0.00 1.01 -1.08 -1.11 121.20 126.65 2dun s ILE 16 Ca -0.01 0.16 0.02 0.00 0.00 0.00 0.00 60.65 60.82 2dun s ILE 16 Cb -0.18 -3.38 0.01 0.00 0.01 0.00 0.00 42.46 38.93 2dun s ILE 16 CO -0.01 0.53 -0.13 -0.47 0.00 0.00 0.00 174.94 174.86 2dun s TYR 17 N -0.33 1.57 0.43 3.97 6.14 -0.69 -2.74 117.35 125.70 2dun s TYR 17 Ca 0.11 -0.60 0.02 0.00 0.64 0.00 0.00 57.07 57.24 2dun s TYR 17 Cb -0.12 -1.14 -0.00 0.00 0.42 0.00 0.00 41.96 41.12 2dun s TYR 17 CO 0.01 -0.30 0.62 -0.51 0.64 0.00 0.00 175.55 176.01 2dun s LEU 18 N 0.67 3.70 0.54 6.97 1.43 -1.26 -3.11 118.68 127.61 2dun s LEU 18 Ca -0.14 0.09 0.01 0.00 -1.03 0.00 0.00 54.13 53.06 2dun s LEU 18 Cb -0.16 -2.99 0.03 0.00 0.03 0.00 0.00 46.19 43.09 2dun s LEU 18 CO 0.04 -0.68 0.76 -0.69 0.23 0.00 0.00 176.35 176.01 2dun s VAL 19 N -2.47 2.90 0.00 -1.59 1.01 -1.26 -5.00 120.40 114.00 2dun s VAL 19 Ca 0.49 -0.63 0.00 0.00 0.00 0.00 0.00 61.98 61.84 2dun s VAL 19 Cb -0.10 -3.09 0.00 0.00 0.00 0.00 0.00 36.38 33.19 2dun s VAL 19 CO 0.36 -0.06 0.00 -0.62 0.00 0.00 0.00 175.10 174.78 2dun n GLU 20 N -2.30 0.00 0.10 2.72 -0.58 -1.26 -4.37 120.64 114.94 2dun n GLU 20 Ca 0.07 0.09 -0.12 0.00 -0.42 0.00 0.00 57.16 56.78 2dun n GLU 20 Cb 0.59 -0.57 -0.08 0.00 -0.57 0.00 0.00 31.44 30.81 2dun n GLU 20 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 2dun h PRO 21 N 0.00 -0.28 -0.76 3.49 0.13 -1.98 0.40 132.00 133.00 2dun h PRO 21 Ca 0.00 0.02 0.13 0.00 -0.87 0.00 0.00 66.00 65.28 2dun h PRO 21 Cb 0.00 0.06 -0.13 0.00 0.13 0.00 0.00 31.00 31.07 2dun h PRO 21 CO 0.00 0.10 -0.27 0.54 -0.23 0.00 0.00 178.00 178.14 2dun n ARG 22 N -5.02 -0.15 -0.00 0.86 5.12 -1.26 -3.53 116.66 112.68 2dun n ARG 22 Ca -0.09 1.17 -0.00 0.00 -1.93 0.00 0.00 57.85 57.01 2dun n ARG 22 Cb 0.26 -1.74 -0.00 0.00 -1.16 0.00 0.00 32.46 29.82 2dun n ARG 22 CO 0.00 0.00 0.00 -1.33 -1.93 0.00 0.00 177.63 174.37 2dun n MET 23 N -5.15 0.01 0.00 5.56 2.81 -1.24 -4.82 117.12 114.28 2dun n MET 23 Ca 0.09 0.03 0.00 0.00 -1.81 0.00 0.00 57.70 56.01 2dun n MET 23 Cb 0.32 -0.53 0.00 0.00 -0.71 0.00 0.00 33.22 32.30 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 1.52 3.81 0.26 3.03 0.00 0.14 -4.86 105.19 109.09 2dun n GLY 24 Ca -0.00 -0.28 0.01 0.00 0.00 0.00 0.00 46.02 45.75 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 0.02 0.20 1.61 2.43 -1.82 0.73 114.38 117.55 2dun h ARG 25 Ca 0.00 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 2dun h ARG 25 Cb 0.00 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 2dun h ARG 25 CO 0.00 0.01 -0.10 0.77 -1.51 0.00 0.00 179.97 179.15 2dun h SER 26 N 0.02 -0.23 -1.06 -3.80 0.02 -1.94 -3.13 113.55 103.43 2dun h SER 26 Ca 0.34 -0.29 0.33 0.00 -0.84 0.00 0.00 61.79 61.32 2dun h SER 26 Cb 0.53 0.06 -0.14 0.00 0.14 0.00 0.00 62.40 62.99 2dun h SER 26 CO -0.68 0.23 0.63 -0.09 -1.14 0.00 0.00 176.83 175.78 2dun h ARG 27 N -0.76 0.29 0.29 3.45 9.65 -1.73 -1.82 114.38 123.76 2dun h ARG 27 Ca -0.03 -0.02 -0.01 0.00 -1.10 0.00 0.00 59.98 58.82 2dun h ARG 27 Cb 0.51 -0.07 0.00 0.00 -1.39 0.00 0.00 29.97 29.02 2dun h ARG 27 CO 0.05 0.19 -0.14 0.00 2.80 0.00 0.00 179.97 182.87 2dun h ARG 28 N 0.30 -0.38 -0.91 0.20 2.47 -0.85 -2.90 114.38 112.32 2dun h ARG 28 Ca 0.73 0.03 0.35 0.00 -1.26 0.00 0.00 59.98 59.83 2dun h ARG 28 Cb 1.79 0.09 -0.13 0.00 -1.65 0.00 0.00 29.97 30.06 2dun h ARG 28 CO -0.53 -0.25 0.53 0.00 0.56 0.00 0.00 179.97 180.27 2dun n ALA 29 N -2.21 0.92 0.07 0.04 0.00 -0.71 0.93 120.51 119.55 2dun n ALA 29 Ca -0.05 0.77 -0.12 0.00 0.00 0.00 0.00 53.44 54.05 2dun n ALA 29 Cb 0.15 -0.83 -0.05 0.00 0.00 0.00 0.00 19.45 18.73 2dun n ALA 29 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 2dun h PHE 30 N 0.00 -0.68 0.01 0.00 3.04 -1.28 -2.89 116.94 115.14 2dun h PHE 30 Ca 0.69 0.02 -0.12 0.00 3.98 0.00 0.00 57.97 62.54 2dun h PHE 30 Cb 1.96 0.30 0.01 0.00 2.56 0.00 0.00 35.95 40.78 2dun h PHE 30 CO -0.01 -0.35 -0.46 -0.07 -2.02 0.00 0.00 178.31 175.41 2dun h LEU 31 N -0.41 0.39 -0.71 0.59 3.38 0.56 -3.14 115.31 115.96 2dun h LEU 31 Ca 0.05 -0.79 0.20 0.00 0.09 0.00 0.00 57.88 57.44 2dun h LEU 31 Cb 0.48 -0.12 -0.13 0.00 0.09 0.00 0.00 40.66 40.98 2dun h LEU 31 CO -0.20 1.13 0.04 0.41 0.09 0.00 0.00 178.44 179.90 2dun n THR 32 N -4.34 -0.30 0.08 0.22 -1.04 0.48 0.21 114.28 109.60 2dun n THR 32 Ca -0.10 1.55 -0.13 0.00 -2.04 0.00 0.00 64.05 63.32 2dun n THR 32 Cb 0.61 -2.28 -0.13 0.00 -1.82 0.00 0.00 70.33 66.71 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 0.21 0.97 3.41 0.00 -1.60 -3.16 103.07 102.90 2dun h GLY 33 Ca 0.44 -0.53 -0.04 0.00 0.00 0.00 0.00 47.33 47.20 2dun h GLY 33 CO -0.66 0.47 -0.36 -2.00 0.00 0.00 0.00 176.54 173.99 2dun h LEU 34 N 0.05 -0.85 -0.35 3.11 5.85 0.26 -1.92 115.31 121.45 2dun h LEU 34 Ca -0.11 0.02 0.06 0.00 0.84 0.00 0.00 57.88 58.69 2dun h LEU 34 Cb 1.92 0.22 -0.06 0.00 0.37 0.00 0.00 40.66 43.11 2dun h LEU 34 CO 0.18 -0.58 0.00 0.00 -0.34 0.00 0.00 178.44 177.70 2dun h ALA 35 N -0.82 0.32 -0.77 1.25 0.00 -1.08 -1.76 119.26 116.41 2dun h ALA 35 Ca -0.10 0.10 0.14 0.00 0.00 0.00 0.00 54.91 55.05 2dun h ALA 35 Cb 0.78 0.17 -0.09 0.00 0.00 0.00 0.00 17.79 18.64 2dun h ALA 35 CO 0.17 -0.40 0.33 0.00 0.00 0.00 0.00 179.25 179.35 2dun h ARG 36 N 0.10 0.46 0.00 0.00 3.08 -1.50 0.41 114.38 116.93 2dun h ARG 36 Ca 0.17 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.18 2dun h ARG 36 Cb 0.23 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.18 2dun h ARG 36 CO -0.29 0.31 -0.05 1.03 -1.07 0.00 0.00 179.97 179.90 2dun h SER 37 N 0.48 0.00 0.00 7.04 0.87 -0.49 -2.99 113.55 118.46 2dun h SER 37 Ca 0.42 0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.93 2dun h SER 37 Cb 0.63 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.58 2dun h SER 37 CO -0.39 0.05 -0.29 0.11 -0.53 0.00 0.00 176.83 175.78 2dun h LYS 38 N 0.00 0.00 0.00 2.24 1.79 0.06 -3.49 116.57 117.17 2dun h LYS 38 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2dun h LYS 38 Cb 0.16 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.81 2dun h LYS 38 CO 0.01 0.69 0.00 0.41 -1.08 0.00 0.00 179.45 179.48 2dun n GLY 39 N 1.61 0.00 3.03 3.86 0.00 -0.12 -4.89 105.19 108.68 2dun n GLY 39 Ca -0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.62 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 1.95 -0.30 1.61 0.08 -1.06 -2.77 117.98 117.49 2dun s PHE 40 Ca 0.00 -0.96 -0.29 0.00 0.12 0.00 0.00 56.93 55.80 2dun s PHE 40 Cb 0.00 -1.43 -0.01 0.00 -0.57 0.00 0.00 43.02 41.01 2dun s PHE 40 CO 0.00 -0.51 1.45 0.50 -0.10 0.00 0.00 175.22 176.55 2dun s ARG 41 N 1.14 3.77 -0.19 0.44 3.52 -1.26 -3.38 118.95 123.00 2dun s ARG 41 Ca -0.03 1.30 -0.17 0.00 -0.13 0.00 0.00 55.73 56.70 2dun s ARG 41 Cb -0.14 -3.98 -0.04 0.00 -1.56 0.00 0.00 34.95 29.23 2dun s ARG 41 CO -0.04 -1.32 0.43 0.08 -0.81 0.00 0.00 175.30 173.65 2dun s VAL 42 N 5.00 5.18 -0.09 7.11 1.01 -1.26 -2.64 120.40 134.72 2dun s VAL 42 Ca 0.63 0.79 -0.22 0.00 0.00 0.00 0.00 61.98 63.18 2dun s VAL 42 Cb -0.19 -3.76 -0.04 0.00 0.00 0.00 0.00 36.38 32.40 2dun s VAL 42 CO 0.28 0.25 0.64 -0.76 0.00 0.00 0.00 175.10 175.51 2dun s LEU 43 N 1.26 4.30 -0.04 3.92 1.43 -1.11 -4.99 118.68 123.45 2dun s LEU 43 Ca 0.21 1.07 -0.21 0.00 -1.03 0.00 0.00 54.13 54.17 2dun s LEU 43 Cb -0.15 -2.97 -0.15 0.00 0.03 0.00 0.00 46.19 42.95 2dun s LEU 43 CO 0.08 -0.10 0.91 -2.24 0.23 0.00 0.00 176.35 175.24 2dun h ASP 44 N 6.79 -0.28 -3.58 2.29 2.03 -1.97 -3.42 116.42 118.28 2dun h ASP 44 Ca -0.40 -0.24 -0.67 0.00 -0.73 0.00 0.00 57.03 54.98 2dun h ASP 44 Cb 1.19 0.07 -0.17 0.00 -0.83 0.00 0.00 39.33 39.59 2dun h ASP 44 CO 0.76 0.21 -0.70 0.00 -1.03 0.00 0.00 179.24 178.48 2dun s ALA 45 N -3.99 3.03 0.07 4.15 0.00 -1.26 -5.01 121.76 118.75 2dun s ALA 45 Ca -0.12 -1.05 -0.37 0.00 0.00 0.00 0.00 51.96 50.42 2dun s ALA 45 Cb 0.01 -1.11 -0.17 0.00 0.00 0.00 0.00 23.12 21.85 2dun s ALA 45 CO 0.45 0.62 1.36 0.00 0.00 0.00 0.00 175.76 178.19 2dun s SER 47 N 0.63 -0.13 0.17 0.00 1.04 -1.26 -5.06 113.70 109.09 2dun s SER 47 Ca 0.85 -0.67 -0.16 0.00 0.48 0.00 0.00 55.95 56.45 2dun s SER 47 Cb -0.95 0.53 0.12 0.00 0.10 0.00 0.00 66.02 65.81 2dun s SER 47 CO 0.47 -1.01 1.69 0.28 0.98 0.00 0.00 173.24 175.65 2dun h SER 48 N 2.33 -0.24 -0.80 7.02 0.02 -1.98 -1.75 113.55 118.14 2dun h SER 48 Ca -0.29 0.11 0.25 0.00 -0.84 0.00 0.00 61.79 61.01 2dun h SER 48 Cb 1.25 0.20 -0.15 0.00 0.14 0.00 0.00 62.40 63.84 2dun h SER 48 CO 0.41 -0.08 0.12 -0.62 -1.14 0.00 0.00 176.83 175.52 2dun n GLU 49 N -5.24 -0.06 -1.03 3.45 1.02 -1.26 -4.43 120.64 113.09 2dun n GLU 49 Ca 0.03 1.17 -0.42 0.00 -0.02 0.00 0.00 57.16 57.92 2dun n GLU 49 Cb 0.22 -1.92 -0.10 0.00 -0.02 0.00 0.00 31.44 29.62 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 -3.04 0.19 -0.06 0.62 0.00 -0.66 -4.58 120.51 112.97 2dun n ALA 50 Ca 0.22 0.04 -0.05 0.00 0.00 0.00 0.00 53.44 53.64 2dun n ALA 50 Cb 0.72 -1.66 -0.11 0.00 0.00 0.00 0.00 19.45 18.40 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 5.29 0.81 -4.12 0.00 -2.24 -0.26 -4.31 114.28 109.44 2dun n THR 51 Ca 0.45 -0.55 -0.19 0.00 -2.27 0.00 0.00 64.05 61.50 2dun n THR 51 Cb -0.01 -0.53 -0.16 0.00 -2.10 0.00 0.00 70.33 67.53 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 -2.42 0.65 -0.15 4.78 3.76 -0.86 -2.23 115.29 118.80 2dun s HIS 52 Ca -0.07 -0.16 -0.02 0.00 -0.15 0.00 0.00 55.06 54.67 2dun s HIS 52 Cb 0.05 -0.60 -0.02 0.00 1.11 0.00 0.00 32.58 33.12 2dun s HIS 52 CO 0.57 -0.17 -0.08 0.08 -0.85 0.00 0.00 174.74 174.29 2dun s VAL 53 N 0.89 3.41 -0.10 -0.90 1.01 0.68 -1.71 120.40 123.68 2dun s VAL 53 Ca -0.11 -0.52 -0.04 0.00 0.00 0.00 0.00 61.98 61.31 2dun s VAL 53 Cb -0.14 -2.48 -0.04 0.00 0.00 0.00 0.00 36.38 33.73 2dun s VAL 53 CO -0.00 0.50 0.05 -0.69 0.00 0.00 0.00 175.10 174.96 2dun s VAL 54 N 0.55 4.73 0.04 2.92 1.01 -1.18 0.41 120.40 128.88 2dun s VAL 54 Ca -0.06 -0.09 -0.04 0.00 0.00 0.00 0.00 61.98 61.80 2dun s VAL 54 Cb -0.15 -3.02 -0.02 0.00 0.00 0.00 0.00 36.38 33.19 2dun s VAL 54 CO 0.03 0.61 0.05 -0.04 0.00 0.00 0.00 175.10 175.75 2dun s MET 55 N -0.89 0.54 0.13 2.72 -1.94 -0.95 -4.19 119.30 114.71 2dun s MET 55 Ca 0.13 -0.81 0.09 0.00 -1.71 0.00 0.00 55.69 53.40 2dun s MET 55 Cb -0.12 0.20 -0.04 0.00 2.01 0.00 0.00 34.83 36.89 2dun s MET 55 CO 0.03 -0.12 -0.21 -2.00 -0.01 0.00 0.00 175.02 172.70 2dun s GLU 56 N -2.62 1.23 -1.19 2.03 2.12 -1.26 -1.52 118.70 117.50 2dun s GLU 56 Ca -0.05 -1.28 -0.12 0.00 0.36 0.00 0.00 54.97 53.88 2dun s GLU 56 Cb -0.01 -1.49 0.12 0.00 0.26 0.00 0.00 34.13 33.00 2dun s GLU 56 CO -0.05 0.34 0.42 0.39 -0.54 0.00 0.00 175.26 175.81 2dun n GLU 57 N 0.80 -2.35 -4.66 4.30 1.02 -1.26 -4.88 120.64 113.61 2dun n GLU 57 Ca -0.17 0.23 -0.34 0.00 -0.02 0.00 0.00 57.16 56.87 2dun n GLU 57 Cb 0.54 -4.85 -0.11 0.00 -0.02 0.00 0.00 31.44 27.00 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 -2.82 3.58 0.71 2.62 2.01 -1.26 -5.12 115.64 115.36 2dun s THR 58 Ca 0.47 -0.55 -0.11 0.00 0.31 0.00 0.00 61.69 61.80 2dun s THR 58 Cb -0.26 -2.46 0.02 0.00 0.01 0.00 0.00 72.50 69.80 2dun s THR 58 CO 0.57 0.58 1.09 -0.44 -0.69 0.00 0.00 174.62 175.73 2dun s SER 59 N -0.85 5.38 0.34 3.53 0.01 -1.26 -4.92 113.70 115.93 2dun s SER 59 Ca 0.13 1.21 0.02 0.00 1.31 0.00 0.00 55.95 58.62 2dun s SER 59 Cb -0.11 -2.02 0.61 0.00 0.21 0.00 0.00 66.02 64.71 2dun s SER 59 CO 0.02 -1.39 1.96 0.00 0.41 0.00 0.00 173.24 174.23 2dun h ALA 60 N -0.69 1.47 0.01 1.44 0.00 -1.91 -2.54 119.26 117.04 2dun h ALA 60 Ca -0.45 -0.10 -0.26 0.00 0.00 0.00 0.00 54.91 54.10 2dun h ALA 60 Cb 1.25 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.77 2dun h ALA 60 CO 0.63 0.43 -1.44 1.05 0.00 0.00 0.00 179.25 179.92 2dun h GLU 61 N 0.76 0.01 -0.88 0.00 4.11 -1.88 -2.79 114.58 113.90 2dun h GLU 61 Ca 0.19 -0.02 0.05 0.00 0.07 0.00 0.00 59.36 59.65 2dun h GLU 61 Cb 0.05 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.25 2dun h GLU 61 CO -0.03 0.71 0.56 0.93 0.07 0.00 0.00 179.01 181.25 2dun h GLU 62 N 0.00 1.01 0.13 1.06 4.39 -1.83 -2.59 114.58 116.75 2dun h GLU 62 Ca -0.18 -0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.45 2dun h GLU 62 Cb 1.92 -0.23 0.00 0.00 -0.10 0.00 0.00 28.75 30.35 2dun h GLU 62 CO 0.10 0.67 -0.06 0.00 -1.16 0.00 0.00 179.01 178.56 2dun h ALA 63 N 1.39 -0.17 -0.75 3.43 0.00 -1.60 -1.77 119.26 119.79 2dun h ALA 63 Ca 0.37 -0.04 0.20 0.00 0.00 0.00 0.00 54.91 55.44 2dun h ALA 63 Cb 0.11 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 2dun h ALA 63 CO -0.15 -0.59 0.53 0.28 0.00 0.00 0.00 179.25 179.31 2dun h VAL 64 N -0.18 0.67 0.00 0.00 2.07 -1.61 0.35 116.25 117.55 2dun h VAL 64 Ca -0.02 -0.04 -0.16 0.00 0.82 0.00 0.00 66.70 67.31 2dun h VAL 64 Cb 0.14 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 2dun h VAL 64 CO 0.03 0.02 -0.75 -1.28 0.02 0.00 0.00 177.57 175.61 2dun h SER 65 N 0.11 0.00 1.58 0.57 0.87 -1.05 -2.37 113.55 113.26 2dun h SER 65 Ca 0.36 0.00 -0.07 0.00 -1.23 0.00 0.00 61.79 60.85 2dun h SER 65 Cb 1.28 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.22 2dun h SER 65 CO -0.04 0.75 -0.43 -0.25 -0.53 0.00 0.00 176.83 176.33 2dun h TRP 66 N 0.00 0.00 0.03 2.24 7.01 0.44 -3.29 115.95 122.39 2dun h TRP 66 Ca -0.01 0.00 -0.28 0.00 2.11 0.00 0.00 58.89 60.71 2dun h TRP 66 Cb 1.49 0.00 -0.03 0.00 -2.10 0.00 0.00 29.16 28.52 2dun h TRP 66 CO 0.00 0.34 -1.52 -0.56 -2.79 0.00 0.00 178.44 173.91 2dun h GLN 67 N 0.00 0.07 -0.85 2.65 3.07 -1.01 -3.35 115.11 115.69 2dun h GLN 67 Ca -0.01 -0.13 0.19 0.00 0.09 0.00 0.00 58.65 58.80 2dun h GLN 67 Cb 1.27 0.05 -0.12 0.00 0.08 0.00 0.00 27.48 28.76 2dun h GLN 67 CO 0.04 0.80 0.35 0.93 0.09 0.00 0.00 178.83 181.05 2dun h GLU 68 N 0.02 0.40 -0.38 0.06 5.08 -1.49 0.49 114.58 118.76 2dun h GLU 68 Ca -0.22 -0.02 0.10 0.00 -1.00 0.00 0.00 59.36 58.22 2dun h GLU 68 Cb 1.96 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 31.10 2dun h GLU 68 CO 0.11 0.26 0.27 0.00 -1.00 0.00 0.00 179.01 178.66 2dun h ARG 69 N 0.41 0.06 0.00 2.33 2.47 -1.71 -2.58 114.38 115.37 2dun h ARG 69 Ca 0.51 -0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.23 2dun h ARG 69 Cb 0.91 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 29.21 2dun h ARG 69 CO -0.49 0.04 0.00 0.54 0.56 0.00 0.00 179.97 180.62 2dun n ARG 70 N -4.44 0.00 -0.09 0.04 5.12 0.17 -2.76 116.66 114.71 2dun n ARG 70 Ca 0.06 0.45 0.25 0.00 -1.93 0.00 0.00 57.85 56.68 2dun n ARG 70 Cb 0.41 -1.37 0.58 0.00 -1.16 0.00 0.00 32.46 30.93 2dun n ARG 70 CO 0.00 0.00 0.00 0.52 -1.93 0.00 0.00 177.63 176.22 2dun h MET 71 N 0.00 0.00 -0.70 5.56 2.86 -1.49 0.89 114.93 122.05 2dun h MET 71 Ca 0.00 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.57 2dun h MET 71 Cb 0.00 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.63 2dun h MET 71 CO 0.00 0.00 0.16 0.00 1.06 0.00 0.00 176.91 178.13 2dun h ALA 72 N 0.97 0.97 -0.17 6.32 0.00 -1.27 -3.13 119.26 122.95 2dun h ALA 72 Ca 0.37 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2dun h ALA 72 Cb 2.13 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 19.65 2dun h ALA 72 CO -0.00 0.66 0.00 0.00 0.00 0.00 0.00 179.25 179.91 2dun n ALA 73 N -2.46 2.11 -2.24 0.00 0.00 0.24 -5.03 120.51 113.13 2dun n ALA 73 Ca 0.05 -1.05 -0.29 0.00 0.00 0.00 0.00 53.44 52.15 2dun n ALA 73 Cb 0.26 -0.22 -0.02 0.00 0.00 0.00 0.00 19.45 19.48 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 -0.97 3.39 0.51 0.00 0.00 0.23 -5.06 121.76 119.85 2dun s ALA 74 Ca 0.11 -0.34 -0.21 0.00 0.00 0.00 0.00 51.96 51.53 2dun s ALA 74 Cb 0.06 -2.63 -0.07 0.00 0.00 0.00 0.00 23.12 20.48 2dun s ALA 74 CO 0.08 -0.11 1.14 -1.25 0.00 0.00 0.00 175.76 175.62 2dun s PRO 75 N -4.14 3.54 -0.01 0.00 0.04 -1.26 -4.90 135.00 128.27 2dun s PRO 75 Ca 0.49 1.68 -0.30 0.00 0.04 0.00 0.00 61.00 62.91 2dun s PRO 75 Cb -0.10 -2.19 -0.06 0.00 0.04 0.00 0.00 34.50 32.20 2dun s PRO 75 CO 0.36 -0.71 1.46 -1.25 0.04 0.00 0.00 177.00 176.89 2dun s PRO 76 N -3.02 4.26 0.00 0.56 0.04 -1.26 -3.10 135.00 132.47 2dun s PRO 76 Ca 0.69 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.75 2dun s PRO 76 Cb -0.26 -3.64 0.00 0.00 0.04 0.00 0.00 34.50 30.64 2dun s PRO 76 CO 0.30 -0.64 0.00 0.41 0.04 0.00 0.00 177.00 177.11 2dun n GLY 77 N 3.75 2.88 3.72 0.56 0.00 -1.26 -5.06 105.19 109.78 2dun n GLY 77 Ca 0.14 -0.88 -0.42 0.00 0.00 0.00 0.00 46.02 44.86 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 1.00 4.20 0.36 0.00 2.01 -1.26 -4.95 115.64 117.00 2dun s THR 79 Ca 0.73 2.04 -0.27 0.00 0.31 0.00 0.00 61.69 64.50 2dun s THR 79 Cb -0.50 -4.30 -0.09 0.00 0.01 0.00 0.00 72.50 67.62 2dun s THR 79 CO 0.34 0.46 1.21 -2.16 -0.69 0.00 0.00 174.62 173.79 2dun s PRO 80 N -0.93 4.23 0.89 4.92 0.04 -1.26 -5.02 135.00 137.87 2dun s PRO 80 Ca 0.42 1.97 -0.11 0.00 0.04 0.00 0.00 61.00 63.31 2dun s PRO 80 Cb -0.25 -2.88 0.13 0.00 0.04 0.00 0.00 34.50 31.53 2dun s PRO 80 CO 0.31 -0.20 1.09 -1.25 0.04 0.00 0.00 177.00 176.99 2dun s PRO 81 N -2.00 1.30 -0.12 0.56 0.04 -1.26 -5.01 135.00 128.50 2dun s PRO 81 Ca 0.53 0.83 -0.21 0.00 0.04 0.00 0.00 61.00 62.19 2dun s PRO 81 Cb -0.34 -1.81 -0.04 0.00 0.04 0.00 0.00 34.50 32.35 2dun s PRO 81 CO 0.44 -2.22 0.60 0.00 0.04 0.00 0.00 177.00 175.86 2dun s ALA 82 N -2.93 3.44 -0.86 8.56 0.00 -0.95 -4.87 121.76 124.16 2dun s ALA 82 Ca 0.63 -0.10 -0.23 0.00 0.00 0.00 0.00 51.96 52.27 2dun s ALA 82 Cb -0.18 -2.84 0.07 0.00 0.00 0.00 0.00 23.12 20.17 2dun s ALA 82 CO 0.57 -0.19 1.22 -0.51 0.00 0.00 0.00 175.76 176.85 2dun s LEU 83 N 1.05 4.02 0.45 0.00 1.43 -1.26 -0.23 118.68 124.13 2dun s LEU 83 Ca 0.31 -1.29 0.08 0.00 -1.03 0.00 0.00 54.13 52.20 2dun s LEU 83 Cb -0.16 -2.49 0.02 0.00 0.03 0.00 0.00 46.19 43.59 2dun s LEU 83 CO 0.13 -1.45 0.61 -0.76 0.23 0.00 0.00 176.35 175.11 2dun s LEU 84 N 4.35 3.56 0.13 1.79 1.43 0.17 0.10 118.68 130.21 2dun s LEU 84 Ca 0.35 -0.47 0.04 0.00 -1.03 0.00 0.00 54.13 53.02 2dun s LEU 84 Cb -0.07 -2.51 -0.04 0.00 0.03 0.00 0.00 46.19 43.61 2dun s LEU 84 CO -0.00 -0.87 0.11 -0.62 0.23 0.00 0.00 176.35 175.20 2dun s ASP 85 N -4.40 5.52 0.60 2.29 2.15 -0.92 -2.25 116.67 119.66 2dun s ASP 85 Ca 0.56 -0.08 0.28 0.00 0.43 0.00 0.00 52.55 53.74 2dun s ASP 85 Cb -0.09 -1.46 1.26 0.00 -0.30 0.00 0.00 42.92 42.33 2dun s ASP 85 CO 0.34 0.11 1.65 -0.29 -0.17 0.00 0.00 175.17 176.81 2dun h ILE 86 N 2.26 0.19 -0.83 4.11 6.09 -1.63 0.28 117.51 127.98 2dun h ILE 86 Ca -0.47 0.00 0.17 0.00 -1.37 0.00 0.00 64.86 63.19 2dun h ILE 86 Cb 1.19 0.36 -0.06 0.00 0.47 0.00 0.00 36.82 38.78 2dun h ILE 86 CO 0.64 0.00 0.55 0.28 -3.07 0.00 0.00 178.15 176.55 2dun h SER 87 N 0.00 0.44 0.00 2.19 0.02 -1.93 -0.63 113.55 113.63 2dun h SER 87 Ca 0.33 0.03 -0.23 0.00 -0.84 0.00 0.00 61.79 61.08 2dun h SER 87 Cb 1.91 -0.05 0.02 0.00 0.14 0.00 0.00 62.40 64.42 2dun h SER 87 CO -0.00 0.21 -0.91 -0.25 -1.14 0.00 0.00 176.83 174.73 2dun h TRP 88 N 0.45 0.91 0.69 3.45 7.01 -0.84 -3.17 115.95 124.45 2dun h TRP 88 Ca 0.42 -0.50 -0.03 0.00 2.11 0.00 0.00 58.89 60.89 2dun h TRP 88 Cb 0.95 -0.10 -0.00 0.00 -2.10 0.00 0.00 29.16 27.91 2dun h TRP 88 CO -0.00 1.33 -0.42 1.25 -2.79 0.00 0.00 178.44 177.81 2dun h LEU 89 N 0.23 -1.04 -0.69 0.65 5.85 -1.23 -2.02 115.31 117.06 2dun h LEU 89 Ca -0.11 0.06 0.11 0.00 0.84 0.00 0.00 57.88 58.77 2dun h LEU 89 Cb 1.58 0.30 -0.12 0.00 0.37 0.00 0.00 40.66 42.79 2dun h LEU 89 CO 0.18 -0.64 -0.39 0.71 -0.34 0.00 0.00 178.44 177.95 2dun h THR 90 N -1.03 0.10 -0.55 1.05 1.35 -1.40 0.10 112.91 112.53 2dun h THR 90 Ca -0.09 0.00 0.11 0.00 -0.55 0.00 0.00 66.41 65.88 2dun h THR 90 Cb 0.82 0.10 -0.10 0.00 -1.73 0.00 0.00 68.15 67.25 2dun h THR 90 CO 0.10 0.00 -0.06 -0.33 -0.25 0.00 0.00 175.52 174.98 2dun h GLU 91 N -0.14 0.06 -0.87 4.72 4.39 -1.51 0.82 114.58 122.05 2dun h GLU 91 Ca 0.24 -0.00 0.05 0.00 0.34 0.00 0.00 59.36 59.98 2dun h GLU 91 Cb 0.56 -0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 29.14 2dun h GLU 91 CO -0.76 0.04 0.55 0.77 -1.16 0.00 0.00 179.01 178.45 2dun h SER 92 N 0.06 0.90 -0.56 1.42 0.02 -0.11 -0.34 113.55 114.93 2dun h SER 92 Ca 0.27 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 61.17 2dun h SER 92 Cb 0.43 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.76 2dun h SER 92 CO -0.51 0.60 0.11 -0.07 -1.14 0.00 0.00 176.83 175.81 2dun h LEU 93 N 1.04 0.88 -0.05 5.07 3.38 0.59 0.28 115.31 126.50 2dun h LEU 93 Ca 0.36 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2dun h LEU 93 Cb 0.08 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.60 2dun h LEU 93 CO -0.14 0.90 0.00 0.61 0.09 0.00 0.00 178.44 179.90 2dun n GLY 94 N -0.58 -1.30 0.00 0.83 0.00 0.09 -2.87 105.19 101.37 2dun n GLY 94 Ca 0.02 -0.06 0.07 0.00 0.00 0.00 0.00 46.02 46.05 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 -1.54 3.18 0.00 4.61 0.00 -0.20 -4.98 120.51 121.58 2dun n ALA 95 Ca 0.05 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.13 2dun n ALA 95 Cb 0.27 -0.50 0.00 0.00 0.00 0.00 0.00 19.45 19.23 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 1.50 2.44 3.14 0.00 0.00 0.92 -4.95 105.19 108.24 2dun n GLY 96 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 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 0.74 -0.40 1.61 -2.07 -1.13 -4.72 119.66 113.69 2dun s GLN 97 Ca 0.00 -0.98 -0.28 0.00 -1.82 0.00 0.00 55.36 52.28 2dun s GLN 97 Cb 0.00 -0.53 -0.01 0.00 -1.09 0.00 0.00 33.01 31.38 2dun s GLN 97 CO 0.00 0.10 1.73 -1.25 -1.32 0.00 0.00 175.29 174.55 2dun s PRO 98 N -2.16 3.26 0.60 9.60 0.04 -1.26 -4.46 135.00 140.63 2dun s PRO 98 Ca -0.01 1.18 -0.17 0.00 0.04 0.00 0.00 61.00 62.04 2dun s PRO 98 Cb -0.07 -4.20 -0.03 0.00 0.04 0.00 0.00 34.50 30.25 2dun s PRO 98 CO 0.01 -1.95 1.10 0.14 0.04 0.00 0.00 177.00 176.33 2dun s VAL 99 N 6.97 3.38 -0.90 -0.36 -7.23 -1.26 -4.91 120.40 116.09 2dun s VAL 99 Ca 0.74 0.71 -0.25 0.00 -1.81 0.00 0.00 61.98 61.37 2dun s VAL 99 Cb -0.19 -3.23 -0.05 0.00 0.56 0.00 0.00 36.38 33.47 2dun s VAL 99 CO 0.31 -0.33 1.95 -2.16 -0.31 0.00 0.00 175.10 174.56 2dun s PRO 100 N -3.82 2.56 0.07 4.82 0.04 -1.26 -4.92 135.00 132.48 2dun s PRO 100 Ca 0.68 -0.28 -0.31 0.00 0.04 0.00 0.00 61.00 61.12 2dun s PRO 100 Cb -0.20 -5.06 -0.17 0.00 0.04 0.00 0.00 34.50 29.11 2dun s PRO 100 CO 0.35 -3.37 0.76 1.55 0.04 0.00 0.00 177.00 176.33 2dun n VAL 101 N 7.87 0.66 -3.34 -0.36 3.14 -1.26 -4.95 118.33 120.09 2dun n VAL 101 Ca 0.40 -0.17 -0.20 0.00 -2.96 0.00 0.00 64.34 61.42 2dun n VAL 101 Cb 0.47 0.00 -0.01 0.00 -1.06 0.00 0.00 33.84 33.24 2dun n VAL 101 CO 0.00 0.00 0.00 -1.61 -6.46 0.00 0.00 176.83 168.76 2dun s GLU 102 N -0.33 2.62 0.28 1.45 2.02 -1.26 -5.00 118.70 118.48 2dun s GLU 102 Ca 0.71 -1.45 -0.02 0.00 0.02 0.00 0.00 54.97 54.24 2dun s GLU 102 Cb -1.01 -2.52 0.44 0.00 0.10 0.00 0.00 34.13 31.14 2dun s GLU 102 CO 0.50 -0.27 1.89 0.00 0.02 0.00 0.00 175.26 177.40 2dun h ARG 104 N 1.14 1.18 -0.65 0.00 2.47 -2.01 -1.91 114.38 114.61 2dun h ARG 104 Ca 0.42 -0.07 -0.03 0.00 -1.26 0.00 0.00 59.98 59.03 2dun h ARG 104 Cb 0.16 -0.27 -0.03 0.00 -1.65 0.00 0.00 29.97 28.18 2dun h ARG 104 CO -0.16 0.78 0.28 0.45 0.56 0.00 0.00 179.97 181.88 2dun h HIS 105 N 1.22 0.93 -4.00 3.04 3.86 -1.70 -3.43 115.15 115.07 2dun h HIS 105 Ca 0.37 -0.05 -0.54 0.00 -1.16 0.00 0.00 60.37 59.00 2dun h HIS 105 Cb -0.02 -0.29 0.11 0.00 1.06 0.00 0.00 27.41 28.27 2dun h HIS 105 CO -0.01 0.70 0.65 1.03 0.86 0.00 0.00 177.93 181.16 2dun s ARG 106 N -5.47 3.57 -0.37 2.45 0.52 -0.72 -2.15 118.95 116.77 2dun s ARG 106 Ca -0.10 2.28 -0.02 0.00 -0.52 0.00 0.00 55.73 57.36 2dun s ARG 106 Cb 0.16 -2.54 0.09 0.00 0.52 0.00 0.00 34.95 33.19 2dun s ARG 106 CO 0.80 -0.86 0.14 -0.51 0.02 0.00 0.00 175.30 174.89 2dun s LEU 107 N -2.93 4.83 0.04 2.53 1.43 0.29 -4.93 118.68 119.93 2dun s LEU 107 Ca 0.64 -1.80 -0.12 0.00 -1.03 0.00 0.00 54.13 51.81 2dun s LEU 107 Cb -0.41 -1.79 0.01 0.00 0.03 0.00 0.00 46.19 44.04 2dun s LEU 107 CO 0.51 -0.45 0.26 -0.70 0.23 0.00 0.00 176.35 176.20 2dun s GLU 108 N 1.17 0.75 0.32 1.70 2.12 -1.05 -4.40 118.70 119.31 2dun s GLU 108 Ca 0.05 -0.52 0.07 0.00 0.36 0.00 0.00 54.97 54.92 2dun s GLU 108 Cb -0.22 0.32 -0.06 0.00 0.26 0.00 0.00 34.13 34.43 2dun s GLU 108 CO -0.03 -0.23 -0.03 0.54 -0.54 0.00 0.00 175.26 174.96 2dun s VAL 109 N -2.44 1.75 -0.30 3.70 0.11 -1.24 -4.59 120.40 117.39 2dun s VAL 109 Ca -0.06 -2.10 -0.12 0.00 -2.93 0.00 0.00 61.98 56.77 2dun s VAL 109 Cb -0.01 -2.65 0.18 0.00 -1.53 0.00 0.00 36.38 32.36 2dun s VAL 109 CO -0.03 -0.17 1.01 0.00 -3.33 0.00 0.00 175.10 172.58 2dun s ALA 110 N -2.92 -3.31 -0.38 1.54 0.00 -1.26 -5.03 121.76 110.40 2dun s ALA 110 Ca 0.32 1.50 -0.01 0.00 0.00 0.00 0.00 51.96 53.77 2dun s ALA 110 Cb 0.05 -2.45 -0.01 0.00 0.00 0.00 0.00 23.12 20.71 2dun s ALA 110 CO 0.15 -1.42 0.34 0.41 0.00 0.00 0.00 175.76 175.24 2dun n GLY 111 N 5.44 -0.40 3.68 0.00 0.00 -1.26 -4.96 105.19 107.69 2dun n GLY 111 Ca -0.07 0.09 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 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 -3.26 4.24 -0.11 1.61 0.04 -1.26 -4.92 135.00 131.34 2dun s PRO 112 Ca 0.09 2.02 -0.40 0.00 0.04 0.00 0.00 61.00 62.75 2dun s PRO 112 Cb -0.01 -3.70 -0.18 0.00 0.04 0.00 0.00 34.50 30.65 2dun s PRO 112 CO 0.32 -0.67 1.40 0.54 0.04 0.00 0.00 177.00 178.63 2dun n ARG 113 N 5.96 0.64 -0.47 4.56 1.74 -1.26 -4.85 116.66 122.98 2dun n ARG 113 Ca 0.14 0.23 0.06 0.00 -0.77 0.00 0.00 57.85 57.51 2dun n ARG 113 Cb 0.43 -1.82 0.22 0.00 -1.02 0.00 0.00 32.46 30.27 2dun n ARG 113 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 2dun n LYS 114 N 3.11 2.29 -1.56 5.56 0.00 -1.26 -4.99 118.16 121.31 2dun n LYS 114 Ca 0.23 -2.89 -0.00 0.00 0.00 0.00 0.00 58.31 55.64 2dun n LYS 114 Cb 0.11 -1.77 0.00 0.00 0.00 0.00 0.00 35.03 33.37 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 -0.87 -0.57 3.27 3.14 0.00 -1.26 -5.07 105.19 103.84 2dun n GLY 115 Ca 0.23 -0.10 -0.28 0.00 0.00 0.00 0.00 46.02 45.87 2dun n GLY 115 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dun n PRO 116 N -0.71 -3.01 -4.33 1.61 -0.04 -1.26 -5.09 135.00 122.17 2dun n PRO 116 Ca 0.00 -1.63 -0.20 0.00 -0.04 0.00 0.00 63.50 61.63 2dun n PRO 116 Cb 0.21 -1.53 -0.11 0.00 -0.04 0.00 0.00 33.50 32.03 2dun n PRO 116 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 2dun s LEU 117 N 0.00 2.48 0.02 1.53 0.05 -1.26 -5.10 118.68 116.40 2dun s LEU 117 Ca 0.66 -0.92 -0.30 0.00 0.05 0.00 0.00 54.13 53.62 2dun s LEU 117 Cb -0.07 -0.74 -0.07 0.00 -2.05 0.00 0.00 46.19 43.26 2dun s LEU 117 CO 0.51 -0.10 1.68 -0.94 -0.55 0.00 0.00 176.35 176.95 2dun s SER 118 N -2.91 6.62 0.01 1.48 1.04 -1.26 -4.92 113.70 113.77 2dun s SER 118 Ca 0.18 2.40 -0.23 0.00 0.48 0.00 0.00 55.95 58.78 2dun s SER 118 Cb -0.04 -2.55 -0.17 0.00 0.10 0.00 0.00 66.02 63.37 2dun s SER 118 CO 0.06 -0.92 1.31 1.55 0.98 0.00 0.00 173.24 176.23 2dun h PRO 119 N 9.05 0.20 -1.60 4.02 0.13 -2.07 -3.47 132.00 138.26 2dun h PRO 119 Ca -0.42 -0.11 -0.30 0.00 -0.87 0.00 0.00 66.00 64.30 2dun h PRO 119 Cb 1.20 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.28 2dun h PRO 119 CO 0.94 0.63 -0.34 0.00 -0.23 0.00 0.00 178.00 179.00 2dun n ALA 120 N -2.39 -0.36 -2.26 -0.56 0.00 -1.26 -5.00 120.51 108.68 2dun n ALA 120 Ca -0.07 0.17 -0.24 0.00 0.00 0.00 0.00 53.44 53.30 2dun n ALA 120 Cb 0.31 -1.68 0.02 0.00 0.00 0.00 0.00 19.45 18.11 2dun n ALA 120 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 177.50 179.17 2dun s TRP 121 N -2.67 1.50 0.00 0.00 1.48 -1.26 -5.14 118.94 112.85 2dun s TRP 121 Ca 0.00 -0.81 0.08 0.00 -1.06 0.00 0.00 56.10 54.32 2dun s TRP 121 Cb 0.00 -2.02 -0.02 0.00 -1.16 0.00 0.00 33.47 30.26 2dun s TRP 121 CO 0.00 -0.76 -0.26 -1.64 -4.06 0.00 0.00 176.95 170.23 2dun s MET 122 N -4.44 1.96 1.23 3.25 -1.94 -1.26 -5.14 119.30 112.96 2dun s MET 122 Ca 0.45 -0.98 -0.20 0.00 -1.71 0.00 0.00 55.69 53.25 2dun s MET 122 Cb -0.04 -1.98 0.30 0.00 2.01 0.00 0.00 34.83 35.12 2dun s MET 122 CO 0.28 0.53 1.11 -1.25 -0.01 0.00 0.00 175.02 175.68 2dun s PRO 123 N -0.83 -1.42 0.29 2.03 0.04 -1.26 -4.90 135.00 128.96 2dun s PRO 123 Ca 0.10 -0.13 0.04 0.00 0.04 0.00 0.00 61.00 61.05 2dun s PRO 123 Cb -0.10 -1.58 0.46 0.00 0.04 0.00 0.00 34.50 33.32 2dun s PRO 123 CO 0.00 -3.83 1.73 0.00 0.04 0.00 0.00 177.00 174.94 2dun h ALA 124 N -2.66 1.14 -0.38 8.56 0.00 -2.01 -2.57 119.26 121.33 2dun h ALA 124 Ca -0.44 -0.36 -0.14 0.00 0.00 0.00 0.00 54.91 53.98 2dun h ALA 124 Cb 1.29 -0.11 -0.08 0.00 0.00 0.00 0.00 17.79 18.89 2dun h ALA 124 CO 0.31 0.55 0.17 2.48 0.00 0.00 0.00 179.25 182.76 2dun n TYR 125 N -4.10 1.23 -1.42 0.00 4.11 -1.26 -4.39 117.16 111.33 2dun n TYR 125 Ca -0.01 -0.78 -0.32 0.00 -0.00 0.00 0.00 57.90 56.79 2dun n TYR 125 Cb 0.42 -0.45 0.05 0.00 -0.00 0.00 0.00 39.34 39.35 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 -0.02 6.19 -3.68 -3.48 0.00 -0.97 -4.92 120.51 113.63 2dun n ALA 126 Ca 0.21 -3.26 -0.04 0.00 0.00 0.00 0.00 53.44 50.35 2dun n ALA 126 Cb 0.89 -1.81 -0.01 0.00 0.00 0.00 0.00 19.45 18.52 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 -2.83 -0.26 -0.20 0.00 1.04 -1.26 -5.16 113.70 105.04 2dun s SER 128 Ca 0.11 -0.59 -0.27 0.00 0.48 0.00 0.00 55.95 55.67 2dun s SER 128 Cb -0.00 0.67 0.08 0.00 0.10 0.00 0.00 66.02 66.86 2dun s SER 128 CO -0.01 -1.23 0.75 -0.83 0.98 0.00 0.00 173.24 172.90 2dun s GLY 129 N -2.92 -0.51 0.18 7.32 0.00 -1.26 -5.15 107.32 104.99 2dun s GLY 129 Ca 0.12 1.86 -0.30 0.00 0.00 0.00 0.00 44.72 46.40 2dun s GLY 129 CO 0.04 1.47 1.31 2.56 0.00 0.00 0.00 173.10 178.48 2dun s PRO 130 N -0.21 4.38 -0.14 2.90 0.04 -1.26 -5.03 135.00 135.69 2dun s PRO 130 Ca -0.03 2.04 -0.04 0.00 0.04 0.00 0.00 61.00 63.01 2dun s PRO 130 Cb -0.03 -3.21 0.07 0.00 0.04 0.00 0.00 34.50 31.36 2dun s PRO 130 CO 0.03 -0.28 0.19 -1.54 0.04 0.00 0.00 177.00 175.45 2dun s SER 131 N 0.48 0.99 0.06 6.66 1.04 -1.26 -5.15 113.70 116.53 2dun s SER 131 Ca 0.58 0.13 0.01 0.00 0.48 0.00 0.00 55.95 57.15 2dun s SER 131 Cb -0.36 0.34 -0.03 0.00 0.10 0.00 0.00 66.02 66.07 2dun s SER 131 CO 0.36 -0.28 -0.06 -0.44 0.98 0.00 0.00 173.24 173.81 2dun s SER 132 N 2.31 0.82 0.00 7.02 0.01 -1.26 -5.36 113.70 117.24 2dun s SER 132 Ca 0.04 -0.80 0.00 0.00 1.31 0.00 0.00 55.95 56.50 2dun s SER 132 Cb -0.13 0.10 0.00 0.00 0.21 0.00 0.00 66.02 66.19 2dun s SER 132 CO -0.08 -0.39 0.00 0.61 0.41 0.00 0.00 173.24 173.79