#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 4.53 1.08 1.61 0.15 -1.26 -5.11 113.70 114.69 2dun s SER 2 Ca 0.00 -1.54 -0.18 0.00 0.70 0.00 0.00 55.95 54.93 2dun s SER 2 Cb 0.00 -1.57 0.11 0.00 -1.71 0.00 0.00 66.02 62.85 2dun s SER 2 CO 0.00 -0.23 0.01 -1.54 1.20 0.00 0.00 173.24 172.68 2dun n SER 3 N 4.40 -2.70 0.00 5.45 3.41 -1.26 -5.04 113.62 117.88 2dun n SER 3 Ca -0.11 -0.24 0.00 0.00 -0.26 0.00 0.00 58.87 58.27 2dun n SER 3 Cb 0.42 -0.85 0.00 0.00 -0.26 0.00 0.00 64.21 63.52 2dun n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dun n GLY 4 N 2.30 5.30 3.80 5.00 0.00 -1.26 -5.16 105.19 115.17 2dun n GLY 4 Ca 0.03 -1.43 -0.25 0.00 0.00 0.00 0.00 46.02 44.37 2dun n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dun s SER 5 N 1.00 5.49 0.72 1.61 0.15 -1.26 -5.09 113.70 116.31 2dun s SER 5 Ca 0.00 -0.18 -0.16 0.00 0.70 0.00 0.00 55.95 56.31 2dun s SER 5 Cb 0.00 -1.41 -0.02 0.00 -1.71 0.00 0.00 66.02 62.88 2dun s SER 5 CO 0.00 0.04 0.72 -1.54 1.20 0.00 0.00 173.24 173.66 2dun n SER 6 N -0.59 -0.45 0.00 5.45 3.41 -1.26 -2.80 113.62 117.37 2dun n SER 6 Ca -0.08 0.63 0.00 0.00 -0.26 0.00 0.00 58.87 59.16 2dun n SER 6 Cb 0.56 -1.30 0.00 0.00 -0.26 0.00 0.00 64.21 63.21 2dun n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dun n GLY 7 N 1.41 2.22 3.52 5.00 0.00 -1.26 -4.94 105.19 111.14 2dun n GLY 7 Ca 0.11 -0.39 -0.42 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 6.24 0.07 1.61 1.04 -1.12 -4.91 113.70 116.63 2dun s SER 8 Ca 0.00 -0.50 0.03 0.00 0.48 0.00 0.00 55.95 55.96 2dun s SER 8 Cb 0.00 -2.50 -0.03 0.00 0.10 0.00 0.00 66.02 63.59 2dun s SER 8 CO 0.00 -1.57 -0.09 0.28 0.98 0.00 0.00 173.24 172.84 2dun s THR 9 N 4.84 0.74 0.24 2.02 -1.32 -1.26 -4.65 115.64 116.25 2dun s THR 9 Ca 0.32 -1.37 -0.06 0.00 -1.21 0.00 0.00 61.69 59.37 2dun s THR 9 Cb -0.11 -1.01 0.23 0.00 -1.51 0.00 0.00 72.50 70.10 2dun s THR 9 CO 0.16 -0.47 1.69 0.03 -2.21 0.00 0.00 174.62 173.82 2dun h ARG 10 N 4.03 0.25 -2.87 7.08 3.08 -1.94 -3.29 114.38 120.73 2dun h ARG 10 Ca -0.37 -0.02 -0.61 0.00 0.07 0.00 0.00 59.98 59.06 2dun h ARG 10 Cb 1.19 -0.06 -0.40 0.00 0.08 0.00 0.00 29.97 30.79 2dun h ARG 10 CO 0.47 0.17 -0.76 -0.06 -1.07 0.00 0.00 179.97 178.72 2dun s PHE 11 N -6.06 2.00 -2.00 3.04 0.08 -1.25 -4.95 117.98 108.84 2dun s PHE 11 Ca -0.13 -2.51 0.11 0.00 0.12 0.00 0.00 56.93 54.53 2dun s PHE 11 Cb 0.21 -1.79 0.65 0.00 -0.57 0.00 0.00 43.02 41.52 2dun s PHE 11 CO 0.75 -0.76 1.08 -0.35 -0.10 0.00 0.00 175.22 175.85 2dun n PRO 12 N 3.20 0.49 -1.08 0.24 -0.04 -1.24 -2.81 135.00 133.75 2dun n PRO 12 Ca 0.14 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.48 2dun n PRO 12 Cb 0.37 -1.35 0.16 0.00 -0.04 0.00 0.00 33.50 32.64 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 -0.02 5.20 2.94 0.55 0.00 -1.26 -4.91 105.19 107.69 2dun n GLY 13 Ca 0.08 -1.54 -0.11 0.00 0.00 0.00 0.00 46.02 44.45 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 -3.62 -0.53 -0.09 1.61 1.01 -1.12 -5.07 120.40 112.59 2dun s VAL 14 Ca 0.49 -0.00 0.03 0.00 0.00 0.00 0.00 61.98 62.49 2dun s VAL 14 Cb 0.43 -0.72 -0.02 0.00 0.00 0.00 0.00 36.38 36.07 2dun s VAL 14 CO 0.01 -0.08 -0.17 0.00 0.00 0.00 0.00 175.10 174.85 2dun s ALA 15 N 2.49 2.49 0.16 5.51 0.00 -1.26 -3.58 121.76 127.57 2dun s ALA 15 Ca 0.08 -0.96 0.10 0.00 0.00 0.00 0.00 51.96 51.18 2dun s ALA 15 Cb -0.15 -0.98 -0.04 0.00 0.00 0.00 0.00 23.12 21.95 2dun s ALA 15 CO -0.14 0.38 -0.19 0.42 0.00 0.00 0.00 175.76 176.23 2dun s ILE 16 N -0.09 2.67 0.17 0.00 1.01 -1.09 -0.51 121.20 123.36 2dun s ILE 16 Ca -0.03 -1.75 0.04 0.00 0.00 0.00 0.00 60.65 58.91 2dun s ILE 16 Cb -0.14 -2.26 -0.05 0.00 0.01 0.00 0.00 42.46 40.02 2dun s ILE 16 CO 0.04 -0.02 -0.08 -0.47 0.00 0.00 0.00 174.94 174.40 2dun s TYR 17 N -1.43 1.35 0.05 3.97 5.04 -0.48 -2.25 117.35 123.60 2dun s TYR 17 Ca 0.20 -0.78 0.04 0.00 -2.44 0.00 0.00 57.07 54.08 2dun s TYR 17 Cb -0.09 -0.71 -0.02 0.00 0.35 0.00 0.00 41.96 41.49 2dun s TYR 17 CO 0.11 0.08 -0.11 -0.51 -1.34 0.00 0.00 175.55 173.77 2dun s LEU 18 N -3.21 2.23 -0.15 6.97 1.43 -1.26 -0.29 118.68 124.41 2dun s LEU 18 Ca 0.19 -0.52 -0.12 0.00 -1.03 0.00 0.00 54.13 52.65 2dun s LEU 18 Cb 0.03 -0.36 -0.05 0.00 0.03 0.00 0.00 46.19 45.84 2dun s LEU 18 CO 0.03 -0.10 0.24 -0.69 0.23 0.00 0.00 176.35 176.05 2dun s VAL 19 N -1.16 5.33 -0.01 -1.59 1.01 -1.25 -5.01 120.40 117.72 2dun s VAL 19 Ca -0.05 0.44 -0.23 0.00 0.00 0.00 0.00 61.98 62.14 2dun s VAL 19 Cb -0.09 -3.56 -0.15 0.00 0.00 0.00 0.00 36.38 32.57 2dun s VAL 19 CO 0.01 0.46 1.08 -0.33 0.00 0.00 0.00 175.10 176.32 2dun h GLU 20 N 6.19 -0.45 0.00 2.72 5.08 -1.98 0.10 114.58 126.24 2dun h GLU 20 Ca -0.44 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 57.95 2dun h GLU 20 Cb 1.18 0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.53 2dun h GLU 20 CO 0.71 -0.13 0.00 -0.35 -1.00 0.00 0.00 179.01 178.24 2dun n PRO 21 N -5.13 0.49 0.03 2.33 -0.04 -1.26 -1.92 135.00 129.49 2dun n PRO 21 Ca -0.09 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.37 2dun n PRO 21 Cb 0.27 -1.07 0.00 0.00 -0.04 0.00 0.00 33.50 32.67 2dun n PRO 21 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 2dun n ARG 22 N -0.57 0.00 0.12 0.54 3.00 -1.14 -4.90 116.66 113.71 2dun n ARG 22 Ca 0.02 0.00 -0.11 0.00 -0.00 0.00 0.00 57.85 57.76 2dun n ARG 22 Cb 0.01 -0.27 -0.07 0.00 0.00 0.00 0.00 32.46 32.13 2dun n ARG 22 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.63 178.15 2dun h MET 23 N 0.00 -0.36 0.00 -0.14 2.86 -0.86 -3.45 114.93 112.97 2dun h MET 23 Ca 0.00 0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 2dun h MET 23 Cb 0.00 0.08 0.00 0.00 0.06 0.00 0.00 31.60 31.74 2dun h MET 23 CO 0.00 -0.04 0.00 0.41 1.06 0.00 0.00 176.91 178.34 2dun n GLY 24 N 0.33 0.97 0.14 8.32 0.00 -0.81 -4.60 105.19 109.55 2dun n GLY 24 Ca -0.08 -2.06 -0.18 0.00 0.00 0.00 0.00 46.02 43.70 2dun n GLY 24 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2dun h ARG 25 N 7.01 0.44 0.00 1.61 0.11 -1.94 -3.26 114.38 118.35 2dun h ARG 25 Ca 0.00 -0.49 -0.14 0.00 0.10 0.00 0.00 59.98 59.44 2dun h ARG 25 Cb 0.00 0.15 -0.02 0.00 1.11 0.00 0.00 29.97 31.21 2dun h ARG 25 CO 0.00 1.15 -0.85 0.77 0.10 0.00 0.00 179.97 181.14 2dun h SER 26 N -0.07 0.00 -0.66 0.08 0.02 -1.98 -3.39 113.55 107.56 2dun h SER 26 Ca -0.09 -0.50 0.06 0.00 -0.84 0.00 0.00 61.79 60.42 2dun h SER 26 Cb 1.41 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 63.87 2dun h SER 26 CO 0.14 1.24 -0.39 -1.14 -1.14 0.00 0.00 176.83 175.54 2dun n ARG 27 N -4.51 -0.29 -0.29 3.45 3.00 -1.26 -0.69 116.66 116.07 2dun n ARG 27 Ca -0.23 1.30 -0.04 0.00 -0.00 0.00 0.00 57.85 58.88 2dun n ARG 27 Cb 0.55 -1.92 -0.02 0.00 0.00 0.00 0.00 32.46 31.07 2dun n ARG 27 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.63 180.52 2dun n ARG 28 N -4.49 -0.24 -0.17 -0.14 1.85 -1.23 0.12 116.66 112.36 2dun n ARG 28 Ca 0.01 1.11 -0.08 0.00 -1.00 0.00 0.00 57.85 57.89 2dun n ARG 28 Cb 0.17 -1.63 0.01 0.00 -1.05 0.00 0.00 32.46 29.96 2dun n ARG 28 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2dun h ALA 29 N 0.69 0.65 -0.75 2.89 0.00 -1.13 0.73 119.26 122.34 2dun h ALA 29 Ca 0.19 -0.15 0.17 0.00 0.00 0.00 0.00 54.91 55.12 2dun h ALA 29 Cb 0.37 -0.19 -0.13 0.00 0.00 0.00 0.00 17.79 17.84 2dun h ALA 29 CO -0.70 0.26 0.06 0.35 0.00 0.00 0.00 179.25 179.22 2dun h PHE 30 N 0.66 0.05 0.08 0.00 3.04 0.33 -0.63 116.94 120.47 2dun h PHE 30 Ca 0.17 0.05 -0.12 0.00 3.98 0.00 0.00 57.97 62.05 2dun h PHE 30 Cb 0.20 0.10 0.01 0.00 2.56 0.00 0.00 35.95 38.82 2dun h PHE 30 CO 0.01 -0.20 -0.51 -0.07 -2.02 0.00 0.00 178.31 175.51 2dun h LEU 31 N 0.14 0.31 -0.68 0.59 3.38 -1.01 -3.11 115.31 114.93 2dun h LEU 31 Ca 0.42 -0.93 0.09 0.00 0.09 0.00 0.00 57.88 57.55 2dun h LEU 31 Cb 0.75 -0.10 -0.11 0.00 0.09 0.00 0.00 40.66 41.29 2dun h LEU 31 CO -0.63 1.22 -0.49 0.74 0.09 0.00 0.00 178.44 179.38 2dun h THR 32 N -0.54 0.04 -0.56 0.22 2.02 -0.09 0.31 112.91 114.31 2dun h THR 32 Ca -0.08 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.06 2dun h THR 32 Cb 1.37 0.04 -0.03 0.00 -1.74 0.00 0.00 68.15 67.79 2dun h THR 32 CO 0.10 0.00 0.21 1.23 0.37 0.00 0.00 175.52 177.42 2dun h GLY 33 N -0.19 0.88 0.91 2.16 0.00 -1.29 -1.99 103.07 103.55 2dun h GLY 33 Ca 0.17 -0.45 -0.04 0.00 0.00 0.00 0.00 47.33 47.01 2dun h GLY 33 CO -0.76 0.43 -0.41 -2.00 0.00 0.00 0.00 176.54 173.80 2dun h LEU 34 N 0.80 -0.97 -0.64 3.11 5.85 -0.67 -2.53 115.31 120.25 2dun h LEU 34 Ca 0.19 0.03 0.11 0.00 0.84 0.00 0.00 57.88 59.04 2dun h LEU 34 Cb 0.18 0.25 -0.08 0.00 0.37 0.00 0.00 40.66 41.39 2dun h LEU 34 CO -0.02 -0.64 0.23 0.00 -0.34 0.00 0.00 178.44 177.68 2dun h ALA 35 N -1.20 0.84 -0.48 1.25 0.00 -0.51 -1.80 119.26 117.36 2dun h ALA 35 Ca -0.12 0.10 0.10 0.00 0.00 0.00 0.00 54.91 54.98 2dun h ALA 35 Cb 0.89 0.08 -0.09 0.00 0.00 0.00 0.00 17.79 18.66 2dun h ALA 35 CO 0.19 -0.20 -0.10 0.00 0.00 0.00 0.00 179.25 179.14 2dun h ARG 36 N 0.40 0.02 -0.16 0.00 3.08 -1.30 0.22 114.38 116.64 2dun h ARG 36 Ca 0.33 -0.00 0.03 0.00 0.07 0.00 0.00 59.98 60.41 2dun h ARG 36 Cb 0.44 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.48 2dun h ARG 36 CO -0.34 0.01 0.11 1.03 -1.07 0.00 0.00 179.97 179.71 2dun h SER 37 N 0.02 0.07 0.27 7.04 0.87 -0.89 -2.86 113.55 118.06 2dun h SER 37 Ca 0.23 -0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.78 2dun h SER 37 Cb 0.36 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.30 2dun h SER 37 CO -0.48 0.04 -0.13 0.11 -0.53 0.00 0.00 176.83 175.84 2dun h LYS 38 N 0.08 -0.34 0.00 2.24 1.79 -0.29 -3.48 116.57 116.56 2dun h LYS 38 Ca 0.07 0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.57 2dun h LYS 38 Cb 0.20 0.08 0.00 0.00 -1.58 0.00 0.00 32.23 30.93 2dun h LYS 38 CO -0.01 -0.03 0.00 0.41 -1.08 0.00 0.00 179.45 178.74 2dun n GLY 39 N 0.48 0.00 3.11 3.86 0.00 -0.22 -4.92 105.19 107.49 2dun n GLY 39 Ca -0.07 0.00 -0.28 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 2.02 -0.50 1.61 0.08 -1.08 -3.86 117.98 116.26 2dun s PHE 40 Ca 0.00 -0.84 -0.27 0.00 0.12 0.00 0.00 56.93 55.94 2dun s PHE 40 Cb 0.00 -1.41 0.03 0.00 -0.57 0.00 0.00 43.02 41.07 2dun s PHE 40 CO 0.00 -0.39 1.04 0.50 -0.10 0.00 0.00 175.22 176.27 2dun s ARG 41 N 0.62 3.56 -0.09 0.44 3.52 -1.24 -3.71 118.95 122.06 2dun s ARG 41 Ca -0.14 0.24 -0.12 0.00 -0.13 0.00 0.00 55.73 55.58 2dun s ARG 41 Cb -0.16 -3.95 -0.05 0.00 -1.56 0.00 0.00 34.95 29.22 2dun s ARG 41 CO 0.04 -1.39 0.28 0.08 -0.81 0.00 0.00 175.30 173.50 2dun s VAL 42 N 4.20 5.28 -0.11 7.11 1.01 -1.26 -2.67 120.40 133.96 2dun s VAL 42 Ca 0.41 0.53 -0.15 0.00 0.00 0.00 0.00 61.98 62.76 2dun s VAL 42 Cb -0.09 -3.58 -0.05 0.00 0.00 0.00 0.00 36.38 32.67 2dun s VAL 42 CO 0.27 0.54 0.36 -0.76 0.00 0.00 0.00 175.10 175.51 2dun s LEU 43 N -0.59 4.32 0.17 3.92 1.43 -0.96 -4.96 118.68 122.01 2dun s LEU 43 Ca 0.18 0.70 -0.05 0.00 -1.03 0.00 0.00 54.13 53.93 2dun s LEU 43 Cb -0.14 -2.50 0.04 0.00 0.03 0.00 0.00 46.19 43.63 2dun s LEU 43 CO 0.07 0.14 1.46 -0.78 0.23 0.00 0.00 176.35 177.47 2dun h ASP 44 N 6.13 0.69 -2.36 2.29 3.58 -1.98 -3.44 116.42 121.33 2dun h ASP 44 Ca -0.44 -0.39 -0.56 0.00 0.42 0.00 0.00 57.03 56.05 2dun h ASP 44 Cb 1.18 -0.20 -0.13 0.00 1.72 0.00 0.00 39.33 41.90 2dun h ASP 44 CO 0.71 1.13 -0.63 0.00 -2.88 0.00 0.00 179.24 177.57 2dun s ALA 45 N -3.93 2.76 0.32 -0.78 0.00 -1.26 -5.03 121.76 113.84 2dun s ALA 45 Ca -0.08 -2.12 -0.28 0.00 0.00 0.00 0.00 51.96 49.48 2dun s ALA 45 Cb 0.11 0.25 -0.09 0.00 0.00 0.00 0.00 23.12 23.38 2dun s ALA 45 CO 0.86 -0.11 1.14 0.00 0.00 0.00 0.00 175.76 177.64 2dun n SER 47 N 0.78 -1.62 0.14 0.00 3.41 -1.26 -5.03 113.62 110.04 2dun n SER 47 Ca 0.01 -1.99 0.01 0.00 -0.26 0.00 0.00 58.87 56.63 2dun n SER 47 Cb 0.45 2.66 0.12 0.00 -0.26 0.00 0.00 64.21 67.18 2dun n SER 47 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2dun h SER 48 N 1.59 0.00 -0.45 4.04 4.64 -1.95 -3.17 113.55 118.25 2dun h SER 48 Ca -0.24 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.09 2dun h SER 48 Cb 0.98 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.05 2dun h SER 48 CO 0.32 0.59 0.30 -0.33 -0.87 0.00 0.00 176.83 176.83 2dun h GLU 49 N 0.00 0.58 -5.74 4.77 3.07 -1.97 -3.41 114.58 111.88 2dun h GLU 49 Ca -0.01 -0.03 -0.59 0.00 -0.50 0.00 0.00 59.36 58.23 2dun h GLU 49 Cb 1.26 -0.13 -0.02 0.00 -0.84 0.00 0.00 28.75 29.02 2dun h GLU 49 CO 0.08 0.38 1.53 0.00 -1.40 0.00 0.00 179.01 179.60 2dun n ALA 50 N -2.47 0.94 -0.05 3.43 0.00 -1.20 -4.41 120.51 116.75 2dun n ALA 50 Ca 0.04 -0.33 -0.06 0.00 0.00 0.00 0.00 53.44 53.09 2dun n ALA 50 Cb 0.07 -2.70 -0.15 0.00 0.00 0.00 0.00 19.45 16.67 2dun n ALA 50 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2dun n THR 51 N 7.50 1.27 -4.14 0.00 -2.24 -0.90 -4.38 114.28 111.38 2dun n THR 51 Ca 0.43 -0.78 -0.13 0.00 -2.27 0.00 0.00 64.05 61.30 2dun n THR 51 Cb 0.29 -0.58 -0.11 0.00 -2.10 0.00 0.00 70.33 67.83 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 -2.69 0.89 -0.03 4.78 3.76 0.34 -1.63 115.29 120.71 2dun s HIS 52 Ca -0.08 -0.69 0.02 0.00 -0.15 0.00 0.00 55.06 54.17 2dun s HIS 52 Cb 0.08 -0.51 0.01 0.00 1.11 0.00 0.00 32.58 33.27 2dun s HIS 52 CO 0.83 -0.07 -0.09 0.08 -0.85 0.00 0.00 174.74 174.64 2dun s VAL 53 N -2.50 0.77 -0.21 -0.90 1.01 -0.91 -1.38 120.40 116.29 2dun s VAL 53 Ca 0.03 -0.34 -0.09 0.00 0.00 0.00 0.00 61.98 61.58 2dun s VAL 53 Cb -0.02 -0.70 -0.04 0.00 0.00 0.00 0.00 36.38 35.62 2dun s VAL 53 CO -0.01 0.25 0.10 -0.69 0.00 0.00 0.00 175.10 174.74 2dun s VAL 54 N 0.29 4.98 0.02 2.92 1.01 0.60 -2.48 120.40 127.74 2dun s VAL 54 Ca -0.05 0.04 0.02 0.00 0.00 0.00 0.00 61.98 62.00 2dun s VAL 54 Cb -0.09 -3.28 -0.02 0.00 0.00 0.00 0.00 36.38 32.99 2dun s VAL 54 CO 0.01 0.42 -0.07 -0.04 0.00 0.00 0.00 175.10 175.41 2dun s MET 55 N 0.66 0.52 0.24 2.72 -1.94 -1.22 -3.94 119.30 116.35 2dun s MET 55 Ca 0.05 -0.55 0.10 0.00 -1.71 0.00 0.00 55.69 53.59 2dun s MET 55 Cb -0.13 -0.38 -0.05 0.00 2.01 0.00 0.00 34.83 36.28 2dun s MET 55 CO 0.01 0.09 -0.11 -1.21 -0.01 0.00 0.00 175.02 173.79 2dun s GLU 56 N -1.01 1.97 -0.26 2.03 0.41 -1.26 -2.35 118.70 118.23 2dun s GLU 56 Ca -0.05 -1.51 0.00 0.00 -0.41 0.00 0.00 54.97 53.01 2dun s GLU 56 Cb -0.07 -2.01 0.00 0.00 -1.78 0.00 0.00 34.13 30.28 2dun s GLU 56 CO 0.00 0.37 0.00 0.39 -0.49 0.00 0.00 175.26 175.54 2dun n GLU 57 N -0.48 -2.33 -3.84 1.61 4.71 -1.26 -4.87 120.64 114.18 2dun n GLU 57 Ca -0.08 0.15 -0.36 0.00 -0.01 0.00 0.00 57.16 56.86 2dun n GLU 57 Cb 0.58 -4.54 -0.13 0.00 -1.01 0.00 0.00 31.44 26.34 2dun n GLU 57 CO 0.00 0.00 0.00 0.99 0.09 0.00 0.00 177.13 178.21 2dun s THR 58 N -1.89 3.58 0.88 2.62 2.01 -1.26 -5.10 115.64 116.48 2dun s THR 58 Ca 0.00 -0.69 -0.12 0.00 0.31 0.00 0.00 61.69 61.19 2dun s THR 58 Cb 0.00 -2.78 0.12 0.00 0.01 0.00 0.00 72.50 69.85 2dun s THR 58 CO 0.00 0.21 1.09 -0.44 -0.69 0.00 0.00 174.62 174.79 2dun s SER 59 N 1.46 3.61 0.15 3.53 0.01 -1.26 -4.73 113.70 116.47 2dun s SER 59 Ca 0.03 1.43 -0.19 0.00 1.31 0.00 0.00 55.95 58.53 2dun s SER 59 Cb -0.16 -2.11 0.04 0.00 0.21 0.00 0.00 66.02 64.00 2dun s SER 59 CO -0.00 -2.54 1.67 0.00 0.41 0.00 0.00 173.24 172.78 2dun h ALA 60 N -1.48 0.16 -0.06 1.44 0.00 -1.86 -0.48 119.26 116.98 2dun h ALA 60 Ca -0.49 0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.47 2dun h ALA 60 Cb 1.28 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 19.34 2dun h ALA 60 CO 0.56 -0.49 -0.28 1.05 0.00 0.00 0.00 179.25 180.09 2dun h GLU 61 N -0.04 0.10 0.25 0.00 4.11 -1.79 -3.09 114.58 114.11 2dun h GLU 61 Ca 0.15 -0.03 -0.01 0.00 0.07 0.00 0.00 59.36 59.54 2dun h GLU 61 Cb 0.27 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.51 2dun h GLU 61 CO -0.33 0.37 -0.12 0.93 0.07 0.00 0.00 179.01 179.93 2dun h GLU 62 N 0.09 -0.32 -0.56 1.06 5.08 -1.49 -3.15 114.58 115.29 2dun h GLU 62 Ca 0.01 0.02 0.10 0.00 -1.00 0.00 0.00 59.36 58.49 2dun h GLU 62 Cb 0.54 0.07 -0.11 0.00 0.50 0.00 0.00 28.75 29.76 2dun h GLU 62 CO 0.04 -0.07 -0.34 0.00 -1.00 0.00 0.00 179.01 177.64 2dun h ALA 63 N 0.15 -0.09 -1.06 3.43 0.00 -1.07 0.24 119.26 120.86 2dun h ALA 63 Ca -0.03 0.15 0.30 0.00 0.00 0.00 0.00 54.91 55.33 2dun h ALA 63 Cb 0.40 0.78 -0.12 0.00 0.00 0.00 0.00 17.79 18.85 2dun h ALA 63 CO 0.06 -0.70 0.65 0.28 0.00 0.00 0.00 179.25 179.54 2dun h VAL 64 N -0.18 0.41 0.63 0.00 2.07 -1.54 -0.42 116.25 117.21 2dun h VAL 64 Ca 0.22 -0.13 -0.03 0.00 0.82 0.00 0.00 66.70 67.58 2dun h VAL 64 Cb 0.55 -0.01 0.01 0.00 -1.52 0.00 0.00 31.29 30.32 2dun h VAL 64 CO -0.65 0.07 -0.30 -1.28 0.02 0.00 0.00 177.57 175.42 2dun h SER 65 N 0.38 -0.71 0.02 0.57 0.87 -0.49 -0.20 113.55 113.98 2dun h SER 65 Ca 0.68 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 61.26 2dun h SER 65 Cb 1.64 0.18 0.00 0.00 -0.44 0.00 0.00 62.40 63.78 2dun h SER 65 CO -0.45 -0.49 0.00 -0.25 -0.53 0.00 0.00 176.83 175.11 2dun h TRP 66 N -0.87 0.00 0.07 2.24 7.01 -0.87 -2.14 115.95 121.39 2dun h TRP 66 Ca -0.09 0.00 -0.20 0.00 2.11 0.00 0.00 58.89 60.71 2dun h TRP 66 Cb 0.66 0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 27.71 2dun h TRP 66 CO -0.03 0.00 -1.03 0.37 -2.79 0.00 0.00 178.44 174.96 2dun h GLN 67 N 0.00 0.15 -0.87 2.65 5.75 -0.47 -3.36 115.11 118.96 2dun h GLN 67 Ca 0.00 -0.26 0.23 0.00 -0.15 0.00 0.00 58.65 58.47 2dun h GLN 67 Cb 0.01 0.10 -0.13 0.00 1.07 0.00 0.00 27.48 28.52 2dun h GLN 67 CO 0.00 1.12 0.29 0.93 -2.65 0.00 0.00 178.83 178.52 2dun h GLU 68 N -0.59 0.27 -0.97 1.69 4.39 -0.36 0.42 114.58 119.41 2dun h GLU 68 Ca -0.23 -0.02 0.13 0.00 0.34 0.00 0.00 59.36 59.58 2dun h GLU 68 Cb 1.50 -0.06 -0.08 0.00 -0.10 0.00 0.00 28.75 30.01 2dun h GLU 68 CO 0.00 0.18 0.62 0.00 -1.16 0.00 0.00 179.01 178.64 2dun h ARG 69 N 0.28 0.89 0.49 2.33 2.47 -1.69 -1.66 114.38 117.47 2dun h ARG 69 Ca 0.55 -0.05 -0.02 0.00 -1.26 0.00 0.00 59.98 59.19 2dun h ARG 69 Cb 1.08 -0.20 0.00 0.00 -1.65 0.00 0.00 29.97 29.20 2dun h ARG 69 CO -0.60 0.59 -0.23 0.00 0.56 0.00 0.00 179.97 180.28 2dun h ARG 70 N 0.91 -0.63 -0.08 0.04 2.47 -0.34 -1.90 114.38 114.84 2dun h ARG 70 Ca 0.49 0.04 0.02 0.00 -1.26 0.00 0.00 59.98 59.27 2dun h ARG 70 Cb 0.55 0.14 -0.00 0.00 -1.65 0.00 0.00 29.97 29.01 2dun h ARG 70 CO -0.25 -0.42 0.61 0.52 0.56 0.00 0.00 179.97 180.99 2dun h MET 71 N -0.97 0.00 0.01 0.04 2.86 -1.21 0.68 114.93 116.33 2dun h MET 71 Ca -0.07 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.48 2dun h MET 71 Cb 0.50 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.15 2dun h MET 71 CO 0.11 0.00 -0.49 0.00 1.06 0.00 0.00 176.91 177.59 2dun h ALA 72 N 0.85 0.09 -0.51 6.32 0.00 -1.15 -3.34 119.26 121.52 2dun h ALA 72 Ca 0.04 -0.76 -0.06 0.00 0.00 0.00 0.00 54.91 54.13 2dun h ALA 72 Cb 1.26 0.26 -0.04 0.00 0.00 0.00 0.00 17.79 19.27 2dun h ALA 72 CO -0.00 0.27 0.08 0.00 0.00 0.00 0.00 179.25 179.60 2dun n ALA 73 N -2.88 3.83 -2.89 0.00 0.00 0.48 -4.93 120.51 114.11 2dun n ALA 73 Ca -0.18 -1.65 -0.30 0.00 0.00 0.00 0.00 53.44 51.32 2dun n ALA 73 Cb 0.57 -1.14 -0.04 0.00 0.00 0.00 0.00 19.45 18.84 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 -2.44 3.90 0.66 0.00 0.00 0.21 -5.00 121.76 119.08 2dun s ALA 74 Ca 0.44 -0.93 -0.15 0.00 0.00 0.00 0.00 51.96 51.32 2dun s ALA 74 Cb 0.34 -1.73 -0.00 0.00 0.00 0.00 0.00 23.12 21.73 2dun s ALA 74 CO 0.12 0.73 1.11 -1.25 0.00 0.00 0.00 175.76 176.48 2dun s PRO 75 N -2.68 2.80 0.24 0.00 0.04 -1.26 -4.96 135.00 129.17 2dun s PRO 75 Ca 0.34 1.39 -0.30 0.00 0.04 0.00 0.00 61.00 62.47 2dun s PRO 75 Cb -0.12 -1.95 -0.09 0.00 0.04 0.00 0.00 34.50 32.38 2dun s PRO 75 CO 0.27 -1.25 1.27 -1.25 0.04 0.00 0.00 177.00 176.08 2dun s PRO 76 N -4.10 4.42 0.00 0.56 0.04 -1.26 -2.85 135.00 131.81 2dun s PRO 76 Ca 0.67 2.05 0.00 0.00 0.04 0.00 0.00 61.00 63.75 2dun s PRO 76 Cb -0.20 -3.17 0.00 0.00 0.04 0.00 0.00 34.50 31.17 2dun s PRO 76 CO 0.42 -0.16 0.00 0.41 0.04 0.00 0.00 177.00 177.70 2dun n GLY 77 N 1.83 1.20 3.79 0.56 0.00 -1.26 -5.04 105.19 106.27 2dun n GLY 77 Ca 0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 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 -1.32 5.14 0.43 0.00 2.01 -1.26 -4.99 115.64 115.65 2dun s THR 79 Ca 0.40 0.09 -0.24 0.00 0.31 0.00 0.00 61.69 62.24 2dun s THR 79 Cb -0.21 -3.30 -0.08 0.00 0.01 0.00 0.00 72.50 68.92 2dun s THR 79 CO 0.24 0.49 1.18 -2.16 -0.69 0.00 0.00 174.62 173.68 2dun s PRO 80 N 0.02 3.92 1.09 4.92 0.04 -1.26 -5.03 135.00 138.70 2dun s PRO 80 Ca 0.08 1.83 -0.15 0.00 0.04 0.00 0.00 61.00 62.80 2dun s PRO 80 Cb -0.12 -2.56 0.23 0.00 0.04 0.00 0.00 34.50 32.09 2dun s PRO 80 CO 0.00 -0.44 1.10 -1.25 0.04 0.00 0.00 177.00 176.45 2dun s PRO 81 N -2.47 -0.31 -0.29 0.56 0.04 -1.26 -5.00 135.00 126.27 2dun s PRO 81 Ca 0.60 0.26 -0.18 0.00 0.04 0.00 0.00 61.00 61.72 2dun s PRO 81 Cb -0.30 -1.67 -0.02 0.00 0.04 0.00 0.00 34.50 32.54 2dun s PRO 81 CO 0.38 -3.17 0.51 0.00 0.04 0.00 0.00 177.00 174.76 2dun s ALA 82 N -2.98 3.55 -0.56 8.56 0.00 -0.65 -4.95 121.76 124.73 2dun s ALA 82 Ca 0.68 -0.75 -0.28 0.00 0.00 0.00 0.00 51.96 51.61 2dun s ALA 82 Cb -0.15 -2.93 0.02 0.00 0.00 0.00 0.00 23.12 20.05 2dun s ALA 82 CO 0.57 -0.91 1.37 -0.51 0.00 0.00 0.00 175.76 176.28 2dun s LEU 83 N 2.35 3.41 0.46 0.00 1.43 -1.26 -2.14 118.68 122.94 2dun s LEU 83 Ca 0.20 0.26 0.05 0.00 -1.03 0.00 0.00 54.13 53.62 2dun s LEU 83 Cb -0.15 -3.09 -0.03 0.00 0.03 0.00 0.00 46.19 42.95 2dun s LEU 83 CO 0.11 -1.66 0.16 -0.76 0.23 0.00 0.00 176.35 174.43 2dun s LEU 84 N 5.83 2.81 0.22 1.79 1.43 -1.03 -1.23 118.68 128.49 2dun s LEU 84 Ca 0.51 -1.29 0.06 0.00 -1.03 0.00 0.00 54.13 52.38 2dun s LEU 84 Cb -0.10 -1.15 -0.04 0.00 0.03 0.00 0.00 46.19 44.93 2dun s LEU 84 CO 0.25 -0.71 0.16 -0.62 0.23 0.00 0.00 176.35 175.66 2dun s ASP 85 N -3.94 5.48 0.52 2.29 2.15 -1.22 -3.37 116.67 118.57 2dun s ASP 85 Ca 0.30 -0.22 0.31 0.00 0.43 0.00 0.00 52.55 53.38 2dun s ASP 85 Cb 0.03 -1.39 1.45 0.00 -0.30 0.00 0.00 42.92 42.71 2dun s ASP 85 CO 0.17 0.01 1.86 -0.29 -0.17 0.00 0.00 175.17 176.75 2dun h ILE 86 N 1.74 0.52 -0.54 4.11 6.09 -1.84 0.24 117.51 127.84 2dun h ILE 86 Ca -0.48 -0.02 0.16 0.00 -1.37 0.00 0.00 64.86 63.15 2dun h ILE 86 Cb 1.22 0.47 -0.02 0.00 0.47 0.00 0.00 36.82 38.96 2dun h ILE 86 CO 0.62 0.01 0.48 -1.28 -3.07 0.00 0.00 178.15 174.91 2dun h SER 87 N 0.05 0.00 0.05 2.19 0.87 -1.94 -1.25 113.55 113.52 2dun h SER 87 Ca 0.47 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 61.03 2dun h SER 87 Cb 1.80 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.76 2dun h SER 87 CO -0.03 0.00 -0.03 -0.25 -0.53 0.00 0.00 176.83 175.99 2dun h TRP 88 N 0.00 -0.07 0.17 2.24 7.01 -0.90 -3.08 115.95 121.32 2dun h TRP 88 Ca 0.26 -0.00 0.01 0.00 2.11 0.00 0.00 58.89 61.27 2dun h TRP 88 Cb 1.22 0.02 -0.04 0.00 -2.10 0.00 0.00 29.16 28.26 2dun h TRP 88 CO 0.00 0.56 -0.41 1.25 -2.79 0.00 0.00 178.44 177.04 2dun h LEU 89 N -0.85 -1.19 -0.79 0.65 5.85 -1.35 -0.85 115.31 116.77 2dun h LEU 89 Ca -0.01 0.13 0.19 0.00 0.84 0.00 0.00 57.88 59.03 2dun h LEU 89 Cb 0.65 0.44 -0.12 0.00 0.37 0.00 0.00 40.66 42.00 2dun h LEU 89 CO 0.01 -0.50 0.15 0.71 -0.34 0.00 0.00 178.44 178.48 2dun h THR 90 N -0.68 0.41 -0.20 1.05 1.35 -1.49 0.60 112.91 113.95 2dun h THR 90 Ca 0.01 -0.07 -0.04 0.00 -0.55 0.00 0.00 66.41 65.76 2dun h THR 90 Cb 0.69 0.18 -0.01 0.00 -1.73 0.00 0.00 68.15 67.27 2dun h THR 90 CO -0.21 0.04 -0.06 -0.33 -0.25 0.00 0.00 175.52 174.71 2dun h GLU 91 N 0.21 0.30 0.01 4.72 5.08 -1.30 -1.22 114.58 122.39 2dun h GLU 91 Ca 0.46 -0.06 -0.20 0.00 -1.00 0.00 0.00 59.36 58.56 2dun h GLU 91 Cb 0.84 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.01 2dun h GLU 91 CO -0.59 0.38 -0.93 0.77 -1.00 0.00 0.00 179.01 177.64 2dun h SER 92 N 0.30 0.05 0.08 1.42 0.02 0.14 -2.97 113.55 112.59 2dun h SER 92 Ca 0.06 -0.05 -0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2dun h SER 92 Cb 0.30 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.82 2dun h SER 92 CO 0.01 0.95 -0.04 -0.07 -1.14 0.00 0.00 176.83 176.54 2dun h LEU 93 N 0.02 -0.09 -0.86 5.07 3.38 0.12 -0.12 115.31 122.83 2dun h LEU 93 Ca -0.02 -0.48 0.00 0.00 0.09 0.00 0.00 57.88 57.47 2dun h LEU 93 Cb 1.62 0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.39 2dun h LEU 93 CO 0.13 0.47 0.00 0.61 0.09 0.00 0.00 178.44 179.74 2dun n GLY 94 N 0.49 -1.06 0.01 0.83 0.00 -0.51 -1.77 105.19 103.18 2dun n GLY 94 Ca -0.08 0.11 0.10 0.00 0.00 0.00 0.00 46.02 46.14 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 -1.74 3.22 0.00 4.61 0.00 -1.12 -4.97 120.51 120.51 2dun n ALA 95 Ca 0.01 -0.50 0.00 0.00 0.00 0.00 0.00 53.44 52.95 2dun n ALA 95 Cb 0.14 -0.70 0.00 0.00 0.00 0.00 0.00 19.45 18.89 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 1.38 2.81 3.15 0.00 0.00 -0.09 -4.96 105.19 107.48 2dun n GLY 96 Ca -0.02 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.84 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 0.77 -0.39 1.61 -2.07 -1.04 -4.59 119.66 113.95 2dun s GLN 97 Ca 0.00 -0.98 -0.28 0.00 -1.82 0.00 0.00 55.36 52.27 2dun s GLN 97 Cb 0.00 -0.62 -0.01 0.00 -1.09 0.00 0.00 33.01 31.29 2dun s GLN 97 CO 0.00 0.12 1.73 -1.25 -1.32 0.00 0.00 175.29 174.57 2dun s PRO 98 N -2.06 3.27 0.52 9.60 0.04 -1.26 -4.40 135.00 140.71 2dun s PRO 98 Ca -0.01 1.19 -0.19 0.00 0.04 0.00 0.00 61.00 62.03 2dun s PRO 98 Cb -0.08 -4.19 -0.07 0.00 0.04 0.00 0.00 34.50 30.20 2dun s PRO 98 CO 0.01 -1.93 1.06 0.14 0.04 0.00 0.00 177.00 176.31 2dun s VAL 99 N 6.92 3.70 -0.19 -0.36 -7.23 -1.26 -4.97 120.40 117.01 2dun s VAL 99 Ca 0.74 0.99 -0.29 0.00 -1.81 0.00 0.00 61.98 61.61 2dun s VAL 99 Cb -0.19 -3.41 -0.03 0.00 0.56 0.00 0.00 36.38 33.31 2dun s VAL 99 CO 0.31 -0.29 1.59 -2.16 -0.31 0.00 0.00 175.10 174.24 2dun s PRO 100 N -3.45 3.89 0.49 4.82 0.04 -1.26 -4.95 135.00 134.58 2dun s PRO 100 Ca 0.67 1.73 -0.14 0.00 0.04 0.00 0.00 61.00 63.30 2dun s PRO 100 Cb -0.17 -4.00 -0.12 0.00 0.04 0.00 0.00 34.50 30.24 2dun s PRO 100 CO 0.25 -1.18 -0.22 0.28 0.04 0.00 0.00 177.00 176.17 2dun n VAL 101 N 6.19 0.00 -4.59 -0.36 0.31 -1.26 -4.99 118.33 113.63 2dun n VAL 101 Ca 0.18 -0.40 -0.28 0.00 -0.01 0.00 0.00 64.34 63.84 2dun n VAL 101 Cb 0.45 0.00 -0.09 0.00 -0.91 0.00 0.00 33.84 33.29 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 -0.98 1.97 0.33 5.55 0.41 -1.26 -5.02 118.70 119.70 2dun s GLU 102 Ca 0.42 -2.20 0.07 0.00 -0.41 0.00 0.00 54.97 52.85 2dun s GLU 102 Cb -0.34 -1.06 0.56 0.00 -1.78 0.00 0.00 34.13 31.52 2dun s GLU 102 CO 0.56 -0.35 1.79 0.00 -0.49 0.00 0.00 175.26 176.76 2dun h ARG 104 N 0.27 0.00 0.10 0.00 0.11 -2.02 -3.29 114.38 109.54 2dun h ARG 104 Ca 0.04 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.12 2dun h ARG 104 Cb 0.61 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.69 2dun h ARG 104 CO 0.04 0.35 -0.05 0.45 0.10 0.00 0.00 179.97 180.87 2dun h HIS 105 N 0.00 -0.12 -1.09 4.08 3.86 -1.84 -3.45 115.15 116.58 2dun h HIS 105 Ca -0.00 -0.00 -0.86 0.00 -1.16 0.00 0.00 60.37 58.35 2dun h HIS 105 Cb 1.03 0.04 0.01 0.00 1.06 0.00 0.00 27.41 29.55 2dun h HIS 105 CO 0.00 0.39 0.73 0.54 0.86 0.00 0.00 177.93 180.45 2dun n ARG 106 N -4.83 0.20 -2.85 2.45 1.74 -0.96 -3.44 116.66 108.97 2dun n ARG 106 Ca -0.07 0.07 -0.43 0.00 -0.77 0.00 0.00 57.85 56.65 2dun n ARG 106 Cb 0.28 -1.61 0.01 0.00 -1.02 0.00 0.00 32.46 30.12 2dun n ARG 106 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2dun n LEU 107 N 4.24 6.53 -4.24 0.55 4.77 -0.37 -4.90 117.00 123.59 2dun n LEU 107 Ca 0.30 -5.11 -0.21 0.00 -0.03 0.00 0.00 56.01 50.96 2dun n LEU 107 Cb -0.03 -1.31 -0.12 0.00 -2.33 0.00 0.00 43.42 39.63 2dun n LEU 107 CO 0.88 1.65 -0.48 -0.70 -1.33 0.00 0.00 177.39 177.41 2dun s GLU 108 N -2.22 1.01 0.36 3.23 2.12 -1.22 -3.92 118.70 118.07 2dun s GLU 108 Ca 0.33 -1.11 0.07 0.00 0.36 0.00 0.00 54.97 54.62 2dun s GLU 108 Cb 0.06 -1.11 -0.07 0.00 0.26 0.00 0.00 34.13 33.28 2dun s GLU 108 CO 0.08 0.25 -0.02 0.54 -0.54 0.00 0.00 175.26 175.57 2dun s VAL 109 N -1.41 1.88 -0.30 3.70 0.11 -1.26 -4.52 120.40 118.62 2dun s VAL 109 Ca 0.04 -2.06 -0.16 0.00 -2.93 0.00 0.00 61.98 56.86 2dun s VAL 109 Cb -0.09 -2.82 0.18 0.00 -1.53 0.00 0.00 36.38 32.13 2dun s VAL 109 CO 0.03 -0.08 1.15 0.00 -3.33 0.00 0.00 175.10 172.87 2dun s ALA 110 N -2.82 -2.68 -0.84 1.54 0.00 -1.26 -4.99 121.76 110.71 2dun s ALA 110 Ca 0.34 2.02 -0.03 0.00 0.00 0.00 0.00 51.96 54.28 2dun s ALA 110 Cb 0.07 -1.98 -0.04 0.00 0.00 0.00 0.00 23.12 21.18 2dun s ALA 110 CO 0.16 -0.52 0.75 0.41 0.00 0.00 0.00 175.76 176.57 2dun n GLY 111 N 3.75 -1.04 3.71 0.00 0.00 -1.26 -4.94 105.19 105.41 2dun n GLY 111 Ca -0.15 0.47 -0.42 0.00 0.00 0.00 0.00 46.02 45.92 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 -3.77 4.33 0.24 1.61 0.04 -1.26 -5.03 135.00 131.16 2dun s PRO 112 Ca 0.26 2.03 0.01 0.00 0.04 0.00 0.00 61.00 63.34 2dun s PRO 112 Cb -0.03 -3.29 -0.05 0.00 0.04 0.00 0.00 34.50 31.16 2dun s PRO 112 CO 0.67 -0.43 0.07 -0.98 0.04 0.00 0.00 177.00 176.37 2dun s ARG 113 N 1.24 1.35 -0.18 4.56 1.04 -1.26 -5.17 118.95 120.52 2dun s ARG 113 Ca 0.64 -1.71 -0.30 0.00 -1.04 0.00 0.00 55.73 53.32 2dun s ARG 113 Cb -0.35 -0.28 0.13 0.00 -2.04 0.00 0.00 34.95 32.41 2dun s ARG 113 CO 0.30 -0.25 1.02 0.21 -0.04 0.00 0.00 175.30 176.54 2dun s LYS 114 N -4.00 0.55 0.35 3.89 2.47 -1.26 -5.14 119.74 116.60 2dun s LYS 114 Ca 0.35 0.18 0.00 0.00 -1.56 0.00 0.00 55.97 54.94 2dun s LYS 114 Cb 0.07 0.26 0.00 0.00 -1.46 0.00 0.00 37.83 36.70 2dun s LYS 114 CO 0.11 -0.16 0.00 0.41 0.16 0.00 0.00 175.35 175.87 2dun n GLY 115 N 0.87 -4.76 3.60 5.54 0.00 -1.26 -4.98 105.19 104.20 2dun n GLY 115 Ca -0.10 -0.55 -0.30 0.00 0.00 0.00 0.00 46.02 45.07 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 -2.67 -1.05 0.03 1.61 0.04 -1.26 -5.09 135.00 126.60 2dun s PRO 116 Ca 0.00 -0.01 -0.05 0.00 0.04 0.00 0.00 61.00 60.98 2dun s PRO 116 Cb 0.00 -1.61 -0.01 0.00 0.04 0.00 0.00 34.50 32.92 2dun s PRO 116 CO 0.00 -3.61 0.09 -0.48 0.04 0.00 0.00 177.00 173.04 2dun s LEU 117 N -6.89 1.83 -0.08 -3.56 0.05 -1.26 -5.17 118.68 103.60 2dun s LEU 117 Ca 0.70 -0.48 -0.20 0.00 0.05 0.00 0.00 54.13 54.21 2dun s LEU 117 Cb -0.11 0.54 0.04 0.00 -2.05 0.00 0.00 46.19 44.62 2dun s LEU 117 CO 0.56 -0.46 0.46 -0.44 -0.55 0.00 0.00 176.35 175.92 2dun s SER 118 N -1.93 -0.42 0.07 1.48 0.01 -1.26 -5.07 113.70 106.59 2dun s SER 118 Ca -0.08 0.56 -0.18 0.00 1.31 0.00 0.00 55.95 57.56 2dun s SER 118 Cb -0.03 0.61 -0.11 0.00 0.21 0.00 0.00 66.02 66.69 2dun s SER 118 CO -0.03 -0.39 1.38 1.55 0.41 0.00 0.00 173.24 176.16 2dun h PRO 119 N 4.19 0.53 -2.94 12.44 0.13 -2.09 -3.48 132.00 140.78 2dun h PRO 119 Ca -0.28 -0.28 0.04 0.00 -0.87 0.00 0.00 66.00 64.61 2dun h PRO 119 Cb 1.17 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.28 2dun h PRO 119 CO 0.33 0.86 0.28 0.00 -0.23 0.00 0.00 178.00 179.24 2dun s ALA 120 N -4.34 -1.05 -0.06 -0.56 0.00 -1.26 -5.17 121.76 109.33 2dun s ALA 120 Ca -0.13 -0.48 0.03 0.00 0.00 0.00 0.00 51.96 51.37 2dun s ALA 120 Cb 0.07 0.76 -0.03 0.00 0.00 0.00 0.00 23.12 23.92 2dun s ALA 120 CO 0.79 -1.02 -0.11 -0.46 0.00 0.00 0.00 175.76 174.96 2dun s TRP 121 N -3.10 2.79 -0.04 0.00 -0.11 -1.26 -5.12 118.94 112.10 2dun s TRP 121 Ca 0.13 -0.09 -0.04 0.00 1.22 0.00 0.00 56.10 57.33 2dun s TRP 121 Cb -0.05 -1.66 0.01 0.00 -1.50 0.00 0.00 33.47 30.27 2dun s TRP 121 CO 0.09 0.24 0.10 0.00 -4.62 0.00 0.00 176.95 172.76 2dun s MET 122 N -0.77 0.14 1.20 5.86 0.23 -1.26 -5.17 119.30 119.53 2dun s MET 122 Ca 0.12 0.10 -0.20 0.00 -1.03 0.00 0.00 55.69 54.68 2dun s MET 122 Cb -0.11 0.07 0.30 0.00 -1.53 0.00 0.00 34.83 33.56 2dun s MET 122 CO 0.01 -0.02 1.06 -0.35 -2.03 0.00 0.00 175.02 173.69 2dun n PRO 123 N 2.93 -3.10 -0.01 3.16 -0.04 -1.26 -5.02 135.00 131.65 2dun n PRO 123 Ca -0.13 -1.70 0.02 0.00 -0.04 0.00 0.00 63.50 61.65 2dun n PRO 123 Cb 0.59 -1.60 -0.07 0.00 -0.04 0.00 0.00 33.50 32.39 2dun n PRO 123 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2dun n ALA 124 N -4.83 2.19 1.83 0.55 0.00 -1.26 -4.47 120.51 114.52 2dun n ALA 124 Ca -0.20 -0.28 0.14 0.00 0.00 0.00 0.00 53.44 53.10 2dun n ALA 124 Cb 0.57 -0.20 0.75 0.00 0.00 0.00 0.00 19.45 20.57 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 -1.92 0.01 -3.66 0.00 4.11 -1.26 -4.42 117.16 110.04 2dun n TYR 125 Ca -0.04 -0.01 -0.29 0.00 -0.00 0.00 0.00 57.90 57.56 2dun n TYR 125 Cb 0.35 0.00 -0.12 0.00 -0.00 0.00 0.00 39.34 39.57 2dun n TYR 125 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 2dun s ALA 126 N -1.99 2.04 -0.08 -3.48 0.00 -1.26 -5.10 121.76 111.88 2dun s ALA 126 Ca 0.42 -2.59 0.01 0.00 0.00 0.00 0.00 51.96 49.80 2dun s ALA 126 Cb 0.20 -1.84 -0.02 0.00 0.00 0.00 0.00 23.12 21.46 2dun s ALA 126 CO 0.33 -2.06 -0.11 0.00 0.00 0.00 0.00 175.76 173.92 2dun h SER 128 N 5.74 0.18 -3.95 0.00 0.87 -1.99 -3.48 113.55 110.91 2dun h SER 128 Ca -0.41 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.14 2dun h SER 128 Cb 1.18 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 63.09 2dun h SER 128 CO 0.53 0.18 -0.70 0.61 -0.53 0.00 0.00 176.83 176.92 2dun n GLY 129 N -1.37 -3.92 3.66 5.77 0.00 -1.26 -4.79 105.19 103.27 2dun n GLY 129 Ca -0.01 -0.91 -0.43 0.00 0.00 0.00 0.00 46.02 44.67 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 -4.76 4.18 -1.29 1.61 0.04 -1.26 -4.93 135.00 128.59 2dun s PRO 130 Ca 0.00 1.99 -0.17 0.00 0.04 0.00 0.00 61.00 62.86 2dun s PRO 130 Cb 0.00 -3.92 0.09 0.00 0.04 0.00 0.00 34.50 30.72 2dun s PRO 130 CO 0.00 -0.82 1.69 0.45 0.04 0.00 0.00 177.00 178.36 2dun n SER 131 N 7.02 4.98 -4.34 6.66 2.88 -1.26 -4.42 113.62 125.13 2dun n SER 131 Ca 0.16 -2.93 -0.38 0.00 -1.33 0.00 0.00 58.87 54.39 2dun n SER 131 Cb 0.44 -1.71 -0.05 0.00 -0.75 0.00 0.00 64.21 62.13 2dun n SER 131 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2dun n SER 132 N 7.78 -2.35 0.00 -3.46 3.41 -1.26 -5.34 113.62 112.40 2dun n SER 132 Ca 0.47 -1.12 0.00 0.00 -0.26 0.00 0.00 58.87 57.96 2dun n SER 132 Cb 0.45 -2.26 0.00 0.00 -0.26 0.00 0.00 64.21 62.14 2dun n SER 132 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49