#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dnh s PRO 6 N 0.00 2.92 0.47 0.00 0.04 -1.26 -4.90 135.00 132.28 3dnh s PRO 6 Ca 0.00 2.11 -0.25 0.00 0.04 0.00 0.00 61.00 62.90 3dnh s PRO 6 Cb 0.00 -2.07 -0.08 0.00 0.04 0.00 0.00 34.50 32.39 3dnh s PRO 6 CO 0.00 -1.32 1.43 -0.35 0.04 0.00 0.00 177.00 176.80 3dnh n PRO 7 N -1.40 2.17 0.21 0.56 -0.04 -1.26 -4.85 135.00 130.38 3dnh n PRO 7 Ca 0.13 0.78 0.09 0.00 -0.04 0.00 0.00 63.50 64.45 3dnh n PRO 7 Cb 0.47 -2.63 0.37 0.00 -0.04 0.00 0.00 33.50 31.67 3dnh n PRO 7 CO 0.00 0.00 0.00 -0.39 -0.04 0.00 0.00 175.50 175.07 3dnh h VAL 8 N 2.15 0.58 -3.70 0.52 -1.51 -1.90 -3.34 116.25 109.04 3dnh h VAL 8 Ca -0.51 -1.29 -0.69 0.00 -1.23 0.00 0.00 66.70 62.98 3dnh h VAL 8 Cb 1.27 1.88 -0.31 0.00 -2.13 0.00 0.00 31.29 32.01 3dnh h VAL 8 CO 0.60 0.25 -0.66 -0.63 -1.23 0.00 0.00 177.57 175.91 3dnh s ILE 9 N -3.52 3.37 0.05 7.19 1.01 -1.26 -5.04 121.20 123.00 3dnh s ILE 9 Ca 0.01 -1.21 -0.30 0.00 0.00 0.00 0.00 60.65 59.15 3dnh s ILE 9 Cb 0.10 -2.90 -0.08 0.00 0.01 0.00 0.00 42.46 39.58 3dnh s ILE 9 CO 0.66 -0.10 1.76 -0.89 0.00 0.00 0.00 174.94 176.37 3dnh s THR 10 N 1.34 3.04 0.44 2.92 2.01 -1.26 -4.97 115.64 119.16 3dnh s THR 10 Ca -0.03 0.33 -0.23 0.00 0.31 0.00 0.00 61.69 62.07 3dnh s THR 10 Cb -0.19 -3.21 -0.10 0.00 0.01 0.00 0.00 72.50 69.00 3dnh s THR 10 CO 0.01 -0.01 0.95 -2.65 -0.69 0.00 0.00 174.62 172.22 3dnh n PRO 11 N 6.37 1.21 -0.36 4.92 -0.02 -1.26 -5.17 135.00 140.70 3dnh n PRO 11 Ca 0.17 0.44 0.26 0.00 -2.02 0.00 0.00 63.50 62.36 3dnh n PRO 11 Cb 0.41 -2.00 0.53 0.00 -0.02 0.00 0.00 33.50 32.41 3dnh n PRO 11 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3dnh h ARG 12 N 1.33 0.30 -7.63 -0.52 2.47 -2.07 -3.55 114.38 104.71 3dnh h ARG 12 Ca -0.45 -0.02 -0.45 0.00 -1.26 0.00 0.00 59.98 57.81 3dnh h ARG 12 Cb 1.35 -0.07 0.14 0.00 -1.65 0.00 0.00 29.97 29.74 3dnh h ARG 12 CO 0.55 0.20 0.35 0.20 0.56 0.00 0.00 179.97 181.83 3dnh s GLY 21 N -4.05 1.66 0.39 0.04 0.00 -1.26 -5.34 107.32 98.74 3dnh s GLY 21 Ca -0.09 -0.86 -0.25 0.00 0.00 0.00 0.00 44.72 43.53 3dnh s GLY 21 CO 0.80 -0.20 1.08 0.00 0.00 0.00 0.00 173.10 174.78 3dnh s ALA 22 N -3.54 3.13 0.48 3.20 0.00 -1.24 -4.95 121.76 118.85 3dnh s ALA 22 Ca 0.68 0.77 -0.08 0.00 0.00 0.00 0.00 51.96 53.33 3dnh s ALA 22 Cb -0.09 -3.30 -0.05 0.00 0.00 0.00 0.00 23.12 19.68 3dnh s ALA 22 CO 0.52 -0.27 0.84 -1.25 0.00 0.00 0.00 175.76 175.60 3dnh s PRO 23 N -2.34 3.65 0.18 0.00 0.05 -1.26 -4.85 135.00 130.43 3dnh s PRO 23 Ca 0.56 0.42 -0.02 0.00 0.05 0.00 0.00 61.00 62.01 3dnh s PRO 23 Cb -0.25 -2.31 0.38 0.00 0.05 0.00 0.00 34.50 32.37 3dnh s PRO 23 CO 0.31 -0.22 0.96 0.34 0.05 0.00 0.00 177.00 178.44 3dnh n PHE 24 N -2.02 0.31 -0.03 0.56 7.35 -1.26 -1.10 117.46 121.26 3dnh n PHE 24 Ca 0.02 0.75 -0.08 0.00 -0.76 0.00 0.00 57.45 57.38 3dnh n PHE 24 Cb 0.54 -0.91 -0.02 0.00 0.35 0.00 0.00 39.48 39.44 3dnh n PHE 24 CO 0.00 0.00 0.00 1.49 -0.76 0.00 0.00 176.76 177.49 3dnh h GLU 25 N 0.00 -0.12 -0.12 -4.13 4.81 -2.00 -0.84 114.58 112.19 3dnh h GLU 25 Ca 0.34 0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.51 3dnh h GLU 25 Cb 0.61 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 30.02 3dnh h GLU 25 CO -0.61 -0.08 -0.16 0.00 -0.73 0.00 0.00 179.01 177.43 3dnh h ALA 26 N 1.01 0.18 -0.77 2.92 0.00 -1.48 -2.45 119.26 118.66 3dnh h ALA 26 Ca 0.11 -0.34 0.04 0.00 0.00 0.00 0.00 54.91 54.72 3dnh h ALA 26 Cb 0.29 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 3dnh h ALA 26 CO -0.27 0.08 0.49 0.28 0.00 0.00 0.00 179.25 179.83 3dnh h VAL 27 N -0.10 1.09 -0.22 0.00 2.07 -1.49 -1.92 116.25 115.69 3dnh h VAL 27 Ca 0.01 -0.32 -0.08 0.00 0.82 0.00 0.00 66.70 67.13 3dnh h VAL 27 Cb 0.72 0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 30.56 3dnh h VAL 27 CO 0.04 0.17 -0.18 -0.09 0.02 0.00 0.00 177.57 177.53 3dnh h ARG 28 N 0.94 0.50 -0.81 1.57 9.65 -0.92 0.27 114.38 125.58 3dnh h ARG 28 Ca 0.32 -0.25 0.00 0.00 -1.10 0.00 0.00 59.98 58.94 3dnh h ARG 28 Cb 0.04 0.00 -0.04 0.00 -1.39 0.00 0.00 29.97 28.59 3dnh h ARG 28 CO -0.12 0.83 0.51 -0.24 2.80 0.00 0.00 179.97 183.75 3dnh h VAL 29 N 0.19 1.22 -0.06 0.20 3.04 -1.46 0.76 116.25 120.14 3dnh h VAL 29 Ca 0.04 -0.44 0.01 0.00 -1.01 0.00 0.00 66.70 65.31 3dnh h VAL 29 Cb 0.72 0.05 -0.01 0.00 -2.01 0.00 0.00 31.29 30.04 3dnh h VAL 29 CO 0.05 0.22 -0.02 0.00 -1.01 0.00 0.00 177.57 176.81 3dnh h ALA 30 N 1.28 0.03 -0.71 3.17 0.00 -1.02 -1.04 119.26 120.97 3dnh h ALA 30 Ca 0.29 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.20 3dnh h ALA 30 Cb -0.09 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 3dnh h ALA 30 CO -0.06 -0.50 0.34 0.00 0.00 0.00 0.00 179.25 179.03 3dnh h ARG 31 N -0.01 1.01 -0.38 0.00 3.08 -0.27 -0.05 114.38 117.76 3dnh h ARG 31 Ca 0.03 -0.14 0.02 0.00 0.07 0.00 0.00 59.98 59.96 3dnh h ARG 31 Cb 0.06 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 29.89 3dnh h ARG 31 CO -0.07 0.78 0.23 -0.44 -1.07 0.00 0.00 179.97 179.40 3dnh h ASP 32 N 1.00 0.37 -0.43 7.04 3.32 -0.64 -0.95 116.42 126.13 3dnh h ASP 32 Ca 0.25 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.28 3dnh h ASP 32 Cb 0.10 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 3dnh h ASP 32 CO -0.03 0.27 0.20 0.58 -1.72 0.00 0.00 179.24 178.53 3dnh h VAL 33 N 0.46 1.18 -0.62 -1.35 2.07 -0.95 -0.44 116.25 116.61 3dnh h VAL 33 Ca 0.15 -0.53 0.09 0.00 0.82 0.00 0.00 66.70 67.23 3dnh h VAL 33 Cb 0.00 0.74 -0.07 0.00 -1.52 0.00 0.00 31.29 30.44 3dnh h VAL 33 CO -0.07 0.20 0.24 0.25 0.02 0.00 0.00 177.57 178.22 3dnh h LEU 34 N 0.55 0.26 0.00 2.57 5.85 -0.64 -2.77 115.31 121.13 3dnh h LEU 34 Ca 0.15 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.94 3dnh h LEU 34 Cb 0.13 0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.21 3dnh h LEU 34 CO -0.02 0.15 -0.51 0.45 -0.34 0.00 0.00 178.44 178.17 3dnh h HIS 35 N 0.43 0.00 0.00 1.25 3.86 -0.74 -3.37 115.15 116.59 3dnh h HIS 35 Ca 0.31 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.52 3dnh h HIS 35 Cb 0.37 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.84 3dnh h HIS 35 CO -0.16 0.00 -0.02 0.25 0.86 0.00 0.00 177.93 178.86 3dnh n THR 36 N -2.24 1.41 -3.66 2.45 -2.24 -0.21 -4.76 114.28 105.02 3dnh n THR 36 Ca 0.03 -1.62 -0.37 0.00 -2.27 0.00 0.00 64.05 59.82 3dnh n THR 36 Cb 0.45 0.11 -0.12 0.00 -2.10 0.00 0.00 70.33 68.67 3dnh n THR 36 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 3dnh s SER 37 N -2.01 5.67 -0.03 3.42 0.01 -1.06 -4.56 113.70 115.14 3dnh s SER 37 Ca 0.18 -0.08 -0.15 0.00 1.31 0.00 0.00 55.95 57.20 3dnh s SER 37 Cb 0.15 -2.04 -0.32 0.00 0.21 0.00 0.00 66.02 64.02 3dnh s SER 37 CO 0.02 -0.04 0.81 0.03 0.41 0.00 0.00 173.24 174.47 3dnh h ARG 38 N 8.26 0.42 -5.54 12.44 3.08 -1.88 -3.42 114.38 127.74 3dnh h ARG 38 Ca -0.36 -0.73 -0.64 0.00 0.07 0.00 0.00 59.98 58.32 3dnh h ARG 38 Cb 1.18 0.27 -0.09 0.00 0.08 0.00 0.00 29.97 31.42 3dnh h ARG 38 CO 0.57 1.35 -0.45 0.99 -1.07 0.00 0.00 179.97 181.36 3dnh s THR 39 N -2.55 5.42 -0.05 2.04 2.01 -1.26 -1.15 115.64 120.10 3dnh s THR 39 Ca -0.13 0.29 0.05 0.00 0.31 0.00 0.00 61.69 62.21 3dnh s THR 39 Cb 0.04 -3.47 -0.01 0.00 0.01 0.00 0.00 72.50 69.07 3dnh s THR 39 CO 0.88 0.54 -0.22 0.00 -0.69 0.00 0.00 174.62 175.13 3dnh s ALA 40 N -0.46 1.88 0.22 7.40 0.00 0.28 -3.96 121.76 127.12 3dnh s ALA 40 Ca 0.14 -0.90 -0.30 0.00 0.00 0.00 0.00 51.96 50.90 3dnh s ALA 40 Cb -0.12 -0.59 -0.08 0.00 0.00 0.00 0.00 23.12 22.33 3dnh s ALA 40 CO 0.03 0.36 1.12 0.00 0.00 0.00 0.00 175.76 177.27 3dnh s ALA 41 N -0.12 3.40 -0.08 0.00 0.00 -0.25 -0.58 121.76 124.13 3dnh s ALA 41 Ca -0.03 0.87 0.02 0.00 0.00 0.00 0.00 51.96 52.83 3dnh s ALA 41 Cb -0.12 -3.35 0.01 0.00 0.00 0.00 0.00 23.12 19.66 3dnh s ALA 41 CO 0.03 -0.22 -0.15 -1.17 0.00 0.00 0.00 175.76 174.25 3dnh s LEU 42 N -0.78 1.72 -0.01 0.00 2.96 -0.53 -1.24 118.68 120.82 3dnh s LEU 42 Ca 0.48 -0.37 0.08 0.00 -0.22 0.00 0.00 54.13 54.10 3dnh s LEU 42 Cb -0.31 -0.98 -0.02 0.00 0.50 0.00 0.00 46.19 45.38 3dnh s LEU 42 CO 0.38 0.05 -0.24 0.00 -1.32 0.00 0.00 176.35 175.21 3dnh s ALA 43 N 0.70 2.27 0.37 5.97 0.00 0.56 -1.26 121.76 130.38 3dnh s ALA 43 Ca -0.13 -1.14 0.03 0.00 0.00 0.00 0.00 51.96 50.72 3dnh s ALA 43 Cb -0.16 -0.60 -0.04 0.00 0.00 0.00 0.00 23.12 22.32 3dnh s ALA 43 CO 0.03 0.54 0.10 0.95 0.00 0.00 0.00 175.76 177.38 3dnh s THR 44 N -0.69 0.77 -0.14 0.00 -4.23 0.19 -2.05 115.64 109.49 3dnh s THR 44 Ca 0.11 -2.00 -0.02 0.00 -1.18 0.00 0.00 61.69 58.60 3dnh s THR 44 Cb -0.10 -2.52 -0.02 0.00 1.34 0.00 0.00 72.50 71.20 3dnh s THR 44 CO 0.00 0.00 -0.09 -0.76 -0.54 0.00 0.00 174.62 173.23 3dnh s LEU 45 N -3.54 2.95 0.18 4.79 1.43 -1.26 -0.83 118.68 122.40 3dnh s LEU 45 Ca 0.29 -0.24 -0.31 0.00 -1.03 0.00 0.00 54.13 52.84 3dnh s LEU 45 Cb 0.05 -1.68 -0.10 0.00 0.03 0.00 0.00 46.19 44.49 3dnh s LEU 45 CO 0.15 0.17 1.52 -0.62 0.23 0.00 0.00 176.35 177.80 3dnh s ASP 46 N 0.33 6.63 0.48 2.29 -1.08 -0.43 -4.73 116.67 120.15 3dnh s ASP 46 Ca -0.08 2.60 0.32 0.00 -0.52 0.00 0.00 52.55 54.87 3dnh s ASP 46 Cb -0.15 -2.60 1.41 0.00 -1.46 0.00 0.00 42.92 40.12 3dnh s ASP 46 CO 0.05 -0.78 1.95 1.55 0.52 0.00 0.00 175.17 178.46 3dnh h PRO 47 N 6.39 0.00 0.00 4.34 0.13 -1.90 -2.97 132.00 137.99 3dnh h PRO 47 Ca -0.43 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.62 3dnh h PRO 47 Cb 1.21 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 3dnh h PRO 47 CO 0.88 0.00 -1.28 1.55 -0.23 0.00 0.00 178.00 178.92 3dnh n VAL 48 N -2.83 0.28 0.15 1.56 3.14 -1.26 -4.77 118.33 114.60 3dnh n VAL 48 Ca 0.00 -0.11 0.04 0.00 -2.96 0.00 0.00 64.34 61.32 3dnh n VAL 48 Cb 0.24 -0.70 0.05 0.00 -1.06 0.00 0.00 33.84 32.37 3dnh n VAL 48 CO 0.00 0.00 0.00 0.77 -6.46 0.00 0.00 176.83 171.14 3dnh h SER 49 N -0.01 0.00 0.00 6.55 4.64 -1.99 -3.47 113.55 119.27 3dnh h SER 49 Ca -0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.21 3dnh h SER 49 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 3dnh h SER 49 CO -0.02 0.40 0.00 0.61 -0.87 0.00 0.00 176.83 176.95 3dnh n GLY 50 N 1.21 2.80 3.75 -0.77 0.00 -1.12 -5.02 105.19 106.04 3dnh n GLY 50 Ca 0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 3dnh n GLY 50 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3dnh s TYR 51 N -3.07 2.37 0.95 1.61 2.02 -1.26 -4.69 117.35 115.28 3dnh s TYR 51 Ca 0.00 1.48 -0.12 0.00 -0.37 0.00 0.00 57.07 58.06 3dnh s TYR 51 Cb 0.00 -3.58 0.16 0.00 -0.40 0.00 0.00 41.96 38.14 3dnh s TYR 51 CO 0.00 -2.42 1.09 -1.25 -1.57 0.00 0.00 175.55 171.40 3dnh s PRO 52 N -3.17 0.84 -0.12 -1.71 0.04 -1.26 -1.32 135.00 128.30 3dnh s PRO 52 Ca 0.75 0.81 -0.05 0.00 0.04 0.00 0.00 61.00 62.55 3dnh s PRO 52 Cb -0.34 -1.76 0.06 0.00 0.04 0.00 0.00 34.50 32.50 3dnh s PRO 52 CO 0.38 -2.53 0.26 -0.47 0.04 0.00 0.00 177.00 174.68 3dnh s TYR 53 N -2.87 -0.40 0.20 0.56 5.04 -0.01 -4.74 117.35 115.13 3dnh s TYR 53 Ca 0.65 0.93 0.07 0.00 -2.44 0.00 0.00 57.07 56.28 3dnh s TYR 53 Cb -0.19 -0.00 -0.04 0.00 0.35 0.00 0.00 41.96 42.08 3dnh s TYR 53 CO 0.58 -0.32 0.05 0.95 -1.34 0.00 0.00 175.55 175.46 3dnh s THR 54 N 2.08 3.90 0.35 4.34 -4.23 -1.26 -0.64 115.64 120.18 3dnh s THR 54 Ca -0.02 -1.44 -0.02 0.00 -1.18 0.00 0.00 61.69 59.03 3dnh s THR 54 Cb -0.11 -3.01 0.01 0.00 1.34 0.00 0.00 72.50 70.73 3dnh s THR 54 CO -0.09 -0.18 0.50 1.07 -0.54 0.00 0.00 174.62 175.38 3dnh n THR 55 N -0.42 0.00 -4.88 3.99 5.66 -0.39 -5.01 114.28 113.24 3dnh n THR 55 Ca -0.09 -1.78 -0.26 0.00 -3.05 0.00 0.00 64.05 58.87 3dnh n THR 55 Cb 0.56 1.10 -0.15 0.00 -1.55 0.00 0.00 70.33 70.29 3dnh n THR 55 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3dnh s ALA 56 N -2.78 1.72 0.28 1.79 0.00 -1.26 -1.45 121.76 120.06 3dnh s ALA 56 Ca 0.29 -0.94 -0.05 0.00 0.00 0.00 0.00 51.96 51.26 3dnh s ALA 56 Cb -0.01 -0.40 -0.01 0.00 0.00 0.00 0.00 23.12 22.70 3dnh s ALA 56 CO 0.21 0.41 0.39 -0.08 0.00 0.00 0.00 175.76 176.69 3dnh s THR 57 N -0.59 0.00 0.18 0.00 -1.32 0.25 -4.97 115.64 109.19 3dnh s THR 57 Ca 0.08 -1.64 -0.20 0.00 -1.21 0.00 0.00 61.69 58.72 3dnh s THR 57 Cb -0.08 -2.46 -0.08 0.00 -1.51 0.00 0.00 72.50 68.37 3dnh s THR 57 CO 0.00 0.00 0.69 0.20 -2.21 0.00 0.00 174.62 173.30 3dnh s ASN 58 N -3.15 7.08 -0.07 8.08 0.01 -1.26 -0.56 114.94 125.07 3dnh s ASN 58 Ca 0.30 1.39 0.00 0.00 -0.71 0.00 0.00 52.86 53.84 3dnh s ASN 58 Cb 0.01 -2.41 -0.03 0.00 0.41 0.00 0.00 41.25 39.23 3dnh s ASN 58 CO 0.15 0.11 -0.05 -0.51 -1.51 0.00 0.00 177.10 175.29 3dnh s ILE 59 N -1.39 3.87 0.26 0.60 1.10 -0.30 -4.42 121.20 120.91 3dnh s ILE 59 Ca 0.39 -0.41 0.10 0.00 -0.51 0.00 0.00 60.65 60.22 3dnh s ILE 59 Cb -0.18 -2.60 -0.04 0.00 0.15 0.00 0.00 42.46 39.79 3dnh s ILE 59 CO 0.21 0.60 -0.08 -0.83 -2.11 0.00 0.00 174.94 172.73 3dnh s GLY 60 N -0.80 1.74 -0.14 1.50 0.00 0.39 -4.84 107.32 105.15 3dnh s GLY 60 Ca 0.12 -1.69 -0.02 0.00 0.00 0.00 0.00 44.72 43.13 3dnh s GLY 60 CO 0.02 -1.76 0.02 -0.42 0.00 0.00 0.00 173.10 170.95 3dnh s ILE 61 N -2.27 0.51 0.79 0.90 -1.09 -1.26 -0.40 121.20 118.38 3dnh s ILE 61 Ca 0.30 -0.30 -0.12 0.00 -2.23 0.00 0.00 60.65 58.29 3dnh s ILE 61 Cb -0.06 -0.86 0.07 0.00 -1.58 0.00 0.00 42.46 40.03 3dnh s ILE 61 CO 0.17 -0.00 1.15 -1.61 -1.23 0.00 0.00 174.94 173.42 3dnh s GLU 62 N 1.89 1.92 0.44 2.79 2.02 0.14 -4.88 118.70 123.01 3dnh s GLU 62 Ca 0.02 1.50 0.17 0.00 0.02 0.00 0.00 54.97 56.68 3dnh s GLU 62 Cb -0.15 -1.83 1.10 0.00 0.10 0.00 0.00 34.13 33.35 3dnh s GLU 62 CO -0.07 -1.95 1.91 -1.35 0.02 0.00 0.00 175.26 173.82 3dnh h PRO 63 N -0.92 0.36 0.00 0.39 0.11 -1.95 1.00 132.00 130.98 3dnh h PRO 63 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3dnh h PRO 63 Cb 1.26 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.29 3dnh h PRO 63 CO 0.48 0.24 0.00 -0.40 -0.21 0.00 0.00 178.00 178.11 3dnh n ASP 64 N -4.47 0.00 0.00 -2.05 3.85 -1.26 -4.58 116.55 108.03 3dnh n ASP 64 Ca 0.15 -1.30 0.00 0.00 -0.71 0.00 0.00 54.79 52.94 3dnh n ASP 64 Cb 0.59 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.36 3dnh n ASP 64 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3dnh n GLY 65 N 0.62 0.65 3.68 6.12 0.00 0.34 -1.09 105.19 115.52 3dnh n GLY 65 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 3dnh n GLY 65 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dnh s THR 66 N -2.36 3.84 0.39 2.61 2.01 -1.24 -4.70 115.64 116.19 3dnh s THR 66 Ca 0.00 1.17 -0.26 0.00 0.31 0.00 0.00 61.69 62.91 3dnh s THR 66 Cb 0.00 -3.75 -0.09 0.00 0.01 0.00 0.00 72.50 68.67 3dnh s THR 66 CO 0.00 -0.03 1.19 -2.84 -0.69 0.00 0.00 174.62 172.25 3dnh s PRO 67 N 2.69 4.09 0.15 4.92 0.02 -1.26 -0.69 135.00 144.93 3dnh s PRO 67 Ca 0.63 1.90 -0.05 0.00 0.02 0.00 0.00 61.00 63.50 3dnh s PRO 67 Cb -0.29 -2.74 -0.03 0.00 0.02 0.00 0.00 34.50 31.46 3dnh s PRO 67 CO 0.25 -0.31 0.17 -0.59 -0.33 0.00 0.00 177.00 176.19 3dnh s PHE 68 N -1.36 0.68 0.17 6.54 -0.12 0.47 -1.35 117.98 123.00 3dnh s PHE 68 Ca 0.56 -1.03 -0.23 0.00 -0.05 0.00 0.00 56.93 56.17 3dnh s PHE 68 Cb -0.32 -0.29 0.06 0.00 -0.63 0.00 0.00 43.02 41.84 3dnh s PHE 68 CO 0.41 -0.63 0.73 -0.59 -0.05 0.00 0.00 175.22 175.09 3dnh s PHE 69 N -4.02 -0.35 -0.04 3.49 -0.12 -0.53 -0.47 117.98 115.94 3dnh s PHE 69 Ca 0.22 0.06 -0.07 0.00 -0.05 0.00 0.00 56.93 57.09 3dnh s PHE 69 Cb 0.05 0.61 -0.05 0.00 -0.63 0.00 0.00 43.02 43.01 3dnh s PHE 69 CO 0.02 -0.92 0.23 0.12 -0.05 0.00 0.00 175.22 174.62 3dnh s PHE 70 N -3.65 3.60 -0.04 3.49 5.36 -1.26 -1.07 117.98 124.41 3dnh s PHE 70 Ca 0.06 0.59 -0.02 0.00 -0.96 0.00 0.00 56.93 56.61 3dnh s PHE 70 Cb -0.03 -2.00 0.03 0.00 -0.34 0.00 0.00 43.02 40.69 3dnh s PHE 70 CO -0.04 0.66 0.10 0.00 -1.46 0.00 0.00 175.22 174.48 3dnh s ALA 71 N -1.18 -0.14 0.27 11.12 0.00 -0.33 -4.90 121.76 126.61 3dnh s ALA 71 Ca 0.23 0.48 -0.29 0.00 0.00 0.00 0.00 51.96 52.37 3dnh s ALA 71 Cb -0.13 -0.33 -0.10 0.00 0.00 0.00 0.00 23.12 22.56 3dnh s ALA 71 CO 0.12 -0.12 1.35 0.00 0.00 0.00 0.00 175.76 177.11 3dnh s ALA 72 N 0.96 3.55 0.42 0.00 0.00 -1.26 -2.62 121.76 122.80 3dnh s ALA 72 Ca -0.08 1.25 0.15 0.00 0.00 0.00 0.00 51.96 53.28 3dnh s ALA 72 Cb -0.10 -3.50 1.02 0.00 0.00 0.00 0.00 23.12 20.53 3dnh s ALA 72 CO -0.04 -0.65 1.91 0.78 0.00 0.00 0.00 175.76 177.76 3dnh h GLY 73 N 4.38 0.77 0.43 0.00 0.00 -0.06 -2.14 103.07 106.45 3dnh h GLY 73 Ca -0.47 -0.20 0.00 0.00 0.00 0.00 0.00 47.33 46.66 3dnh h GLY 73 CO 0.72 0.07 0.00 1.04 0.00 0.00 0.00 176.54 178.37 3dnh n LEU 74 N -4.49 0.00 -4.90 3.11 4.77 -1.26 -4.46 117.00 109.77 3dnh n LEU 74 Ca 0.15 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.84 3dnh n LEU 74 Cb 0.52 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.58 3dnh n LEU 74 CO 0.32 0.00 0.36 0.42 -1.33 0.00 0.00 177.39 177.17 3dnh s THR 75 N -2.00 4.90 0.19 -5.08 -4.23 -0.81 -4.98 115.64 103.63 3dnh s THR 75 Ca 0.17 0.28 -0.11 0.00 -1.18 0.00 0.00 61.69 60.86 3dnh s THR 75 Cb 0.08 -3.78 0.10 0.00 1.34 0.00 0.00 72.50 70.24 3dnh s THR 75 CO 0.13 -0.57 1.75 -0.07 -0.54 0.00 0.00 174.62 175.33 3dnh h LEU 76 N 1.04 0.91 -0.43 4.79 -0.00 -1.89 -0.92 115.31 118.81 3dnh h LEU 76 Ca -0.47 -0.17 -0.09 0.00 -0.00 0.00 0.00 57.88 57.15 3dnh h LEU 76 Cb 1.19 -0.24 -0.01 0.00 -0.00 0.00 0.00 40.66 41.60 3dnh h LEU 76 CO 0.64 0.83 -0.08 1.12 -0.00 0.00 0.00 178.44 180.95 3dnh h HIS 77 N 0.94 0.92 -0.39 1.13 2.07 -1.94 -0.36 115.15 117.52 3dnh h HIS 77 Ca 0.22 -0.19 0.06 0.00 -2.85 0.00 0.00 60.37 57.61 3dnh h HIS 77 Cb 0.20 -0.23 -0.05 0.00 2.57 0.00 0.00 27.41 29.90 3dnh h HIS 77 CO 0.01 0.92 0.09 0.00 -3.07 0.00 0.00 177.93 175.89 3dnh h ALA 78 N 0.87 0.42 0.06 6.11 0.00 -1.79 -2.92 119.26 122.02 3dnh h ALA 78 Ca 0.11 0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.12 3dnh h ALA 78 Cb 0.61 0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.44 3dnh h ALA 78 CO 0.04 -0.31 -0.33 -0.09 0.00 0.00 0.00 179.25 178.55 3dnh h ARG 79 N 0.22 -0.51 -0.64 0.00 1.12 -0.88 -2.17 114.38 111.53 3dnh h ARG 79 Ca 0.18 0.03 0.00 0.00 -1.11 0.00 0.00 59.98 59.09 3dnh h ARG 79 Cb 0.21 0.12 0.00 0.00 -0.01 0.00 0.00 29.97 30.28 3dnh h ARG 79 CO -0.23 -0.34 0.00 0.09 -3.11 0.00 0.00 179.97 176.38 3dnh n ASN 80 N -5.42 0.00 0.00 -3.80 3.02 -0.17 -3.38 115.26 105.50 3dnh n ASN 80 Ca -0.06 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.49 3dnh n ASN 80 Cb 0.33 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.50 3dnh n ASN 80 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3dnh n GLU 82 N 0.47 0.00 -0.01 3.52 1.02 -0.82 -1.57 120.64 123.25 3dnh n GLU 82 Ca 0.00 0.00 -0.16 0.00 -0.02 0.00 0.00 57.16 56.98 3dnh n GLU 82 Cb 0.00 0.00 -0.13 0.00 -0.02 0.00 0.00 31.44 31.29 3dnh n GLU 82 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 3dnh h THR 83 N 0.00 1.59 -3.17 2.62 2.02 -1.86 -3.46 112.91 110.65 3dnh h THR 83 Ca 0.00 -2.20 -0.42 0.00 0.77 0.00 0.00 66.41 64.55 3dnh h THR 83 Cb 0.00 3.01 -0.40 0.00 -1.74 0.00 0.00 68.15 69.02 3dnh h THR 83 CO 0.00 0.60 -0.75 -0.62 0.37 0.00 0.00 175.52 175.13 3dnh s ASP 84 N -6.49 1.85 0.00 4.18 -1.08 -0.61 -5.02 116.67 109.50 3dnh s ASP 84 Ca -0.16 -0.32 0.31 0.00 -0.52 0.00 0.00 52.55 51.86 3dnh s ASP 84 Cb 0.00 -0.22 1.59 0.00 -1.46 0.00 0.00 42.92 42.84 3dnh s ASP 84 CO 0.76 -0.30 2.08 0.00 0.52 0.00 0.00 175.17 178.22 3dnh n ALA 85 N 5.27 2.59 -2.14 3.66 0.00 -1.26 -4.80 120.51 123.83 3dnh n ALA 85 Ca -0.05 -0.19 -0.43 0.00 0.00 0.00 0.00 53.44 52.77 3dnh n ALA 85 Cb 0.49 -1.47 -0.03 0.00 0.00 0.00 0.00 19.45 18.45 3dnh n ALA 85 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3dnh s ARG 86 N -2.36 4.03 0.19 0.00 0.52 -1.26 0.09 118.95 120.15 3dnh s ARG 86 Ca 0.35 1.84 -0.02 0.00 -0.52 0.00 0.00 55.73 57.38 3dnh s ARG 86 Cb 0.21 -3.96 -0.04 0.00 0.52 0.00 0.00 34.95 31.68 3dnh s ARG 86 CO 0.43 -1.01 0.16 0.96 0.02 0.00 0.00 175.30 175.86 3dnh s ILE 87 N 4.41 0.02 0.01 1.52 -4.36 0.34 -4.33 121.20 118.82 3dnh s ILE 87 Ca 0.68 -1.90 0.01 0.00 -0.26 0.00 0.00 60.65 59.18 3dnh s ILE 87 Cb -0.27 -2.37 -0.01 0.00 1.25 0.00 0.00 42.46 41.06 3dnh s ILE 87 CO 0.26 -0.09 -0.04 -0.55 0.24 0.00 0.00 174.94 174.76 3dnh s SER 88 N -3.12 0.45 0.11 4.36 0.15 -0.87 -1.77 113.70 113.01 3dnh s SER 88 Ca 0.34 -0.27 0.07 0.00 0.70 0.00 0.00 55.95 56.78 3dnh s SER 88 Cb 0.06 0.01 -0.04 0.00 -1.71 0.00 0.00 66.02 64.35 3dnh s SER 88 CO 0.10 -0.10 -0.16 0.68 1.20 0.00 0.00 173.24 174.95 3dnh s VAL 89 N -0.70 1.43 -0.09 4.45 -7.23 -0.29 -0.32 120.40 117.65 3dnh s VAL 89 Ca -0.05 -1.58 0.03 0.00 -1.81 0.00 0.00 61.98 58.56 3dnh s VAL 89 Cb -0.05 -1.45 0.01 0.00 0.56 0.00 0.00 36.38 35.44 3dnh s VAL 89 CO -0.00 -0.26 -0.20 -0.89 -0.31 0.00 0.00 175.10 173.45 3dnh s THR 90 N -1.63 1.74 -0.18 5.32 2.01 -0.37 -0.78 115.64 121.74 3dnh s THR 90 Ca 0.06 -0.82 -0.07 0.00 0.31 0.00 0.00 61.69 61.17 3dnh s THR 90 Cb -0.08 -1.53 -0.04 0.00 0.01 0.00 0.00 72.50 70.87 3dnh s THR 90 CO 0.04 0.49 0.04 -0.76 -0.69 0.00 0.00 174.62 173.74 3dnh s LEU 91 N 0.55 3.67 0.04 4.42 1.02 -0.20 -1.09 118.68 127.09 3dnh s LEU 91 Ca -0.15 0.01 -0.27 0.00 0.02 0.00 0.00 54.13 53.74 3dnh s LEU 91 Cb -0.17 -1.93 0.09 0.00 0.02 0.00 0.00 46.19 44.21 3dnh s LEU 91 CO 0.05 0.15 0.77 0.00 0.02 0.00 0.00 176.35 177.34 3dnh s ALA 92 N 0.51 -1.74 -0.88 4.21 0.00 -1.25 -1.03 121.76 121.56 3dnh s ALA 92 Ca 0.02 0.89 -0.09 0.00 0.00 0.00 0.00 51.96 52.78 3dnh s ALA 92 Cb -0.13 0.47 -0.07 0.00 0.00 0.00 0.00 23.12 23.39 3dnh s ALA 92 CO 0.01 -0.66 2.06 -2.30 0.00 0.00 0.00 175.76 174.87 3dnh n PRO 93 N -0.12 1.95 -1.65 0.00 -0.02 -1.26 -4.62 135.00 129.29 3dnh n PRO 93 Ca -0.13 -1.54 -0.49 0.00 -2.02 0.00 0.00 63.50 59.33 3dnh n PRO 93 Cb 0.62 -2.55 -0.05 0.00 -0.02 0.00 0.00 33.50 31.50 3dnh n PRO 93 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3dnh n PHE 94 N 4.91 2.21 -0.23 6.00 3.72 -1.26 -1.83 117.46 130.98 3dnh n PHE 94 Ca 0.45 0.03 0.00 0.00 -0.05 0.00 0.00 57.45 57.88 3dnh n PHE 94 Cb 0.19 -2.65 0.00 0.00 -0.94 0.00 0.00 39.48 36.08 3dnh n PHE 94 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3dnh n GLY 95 N 4.76 0.72 0.02 1.37 0.00 -1.26 -4.93 105.19 105.87 3dnh n GLY 95 Ca 0.26 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.40 3dnh n GLY 95 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3dnh n LYS 96 N -2.00 0.11 -2.58 1.61 0.00 -0.76 -5.03 118.16 109.51 3dnh n LYS 96 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 58.31 58.26 3dnh n LYS 96 Cb 0.00 -1.50 0.00 0.00 0.00 0.00 0.00 35.03 33.53 3dnh n LYS 96 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3dnh n GLY 97 N 1.47 -1.38 3.54 3.14 0.00 -1.26 -5.09 105.19 105.60 3dnh n GLY 97 Ca 0.07 -1.54 -0.54 0.00 0.00 0.00 0.00 46.02 44.01 3dnh n GLY 97 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3dnh n ASP 98 N 3.00 2.15 0.21 1.61 -0.08 -1.26 -4.80 116.55 117.38 3dnh n ASP 98 Ca 0.00 0.72 0.12 0.00 -1.51 0.00 0.00 54.79 54.11 3dnh n ASP 98 Cb 0.00 -1.18 0.69 0.00 2.34 0.00 0.00 41.12 42.96 3dnh n ASP 98 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3dnh h ALA 99 N 9.94 2.05 -0.09 -1.67 0.00 -1.94 -1.23 119.26 126.31 3dnh h ALA 99 Ca -0.34 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.57 3dnh h ALA 99 Cb 1.33 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.13 3dnh h ALA 99 CO 1.00 -0.15 0.00 1.28 0.00 0.00 0.00 179.25 181.39 3dnh n LEU 100 N -4.40 0.95 -0.22 0.00 4.77 -1.26 -3.00 117.00 113.83 3dnh n LEU 100 Ca -0.00 -0.39 0.02 0.00 -0.03 0.00 0.00 56.01 55.61 3dnh n LEU 100 Cb 0.20 -0.06 0.04 0.00 -2.33 0.00 0.00 43.42 41.28 3dnh n LEU 100 CO 0.34 0.20 0.44 0.35 -1.33 0.00 0.00 177.39 177.38 3dnh n THR 101 N -0.16 0.52 -4.29 -5.08 -2.24 -0.47 -5.01 114.28 97.56 3dnh n THR 101 Ca 0.15 -0.76 -0.18 0.00 -2.27 0.00 0.00 64.05 60.99 3dnh n THR 101 Cb 0.22 0.79 -0.11 0.00 -2.10 0.00 0.00 70.33 69.13 3dnh n THR 101 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3dnh s LEU 102 N -0.70 2.46 0.62 3.22 1.43 -1.16 -5.03 118.68 119.52 3dnh s LEU 102 Ca 0.07 -0.90 -0.18 0.00 -1.03 0.00 0.00 54.13 52.10 3dnh s LEU 102 Cb 0.04 -0.62 -0.02 0.00 0.03 0.00 0.00 46.19 45.63 3dnh s LEU 102 CO 0.06 -0.15 1.23 -2.84 0.23 0.00 0.00 176.35 174.88 3dnh s PRO 103 N -3.06 2.76 -0.16 1.29 0.02 -1.24 -4.56 135.00 130.05 3dnh s PRO 103 Ca 0.15 1.87 -0.05 0.00 0.02 0.00 0.00 61.00 62.99 3dnh s PRO 103 Cb -0.03 -1.90 0.06 0.00 0.02 0.00 0.00 34.50 32.65 3dnh s PRO 103 CO 0.04 -1.38 0.08 1.03 -0.33 0.00 0.00 177.00 176.45 3dnh s ARG 104 N -3.43 0.07 -0.30 5.54 3.00 -0.43 -4.31 118.95 119.09 3dnh s ARG 104 Ca 0.78 -0.05 -0.09 0.00 0.00 0.00 0.00 55.73 56.37 3dnh s ARG 104 Cb -0.32 -1.71 -0.01 0.00 0.00 0.00 0.00 34.95 32.91 3dnh s ARG 104 CO 0.36 -0.64 0.14 -1.17 0.00 0.00 0.00 175.30 174.00 3dnh s LEU 105 N 2.13 3.99 -0.13 2.53 2.96 -0.20 -0.43 118.68 129.53 3dnh s LEU 105 Ca 0.02 -0.45 -0.04 0.00 -0.22 0.00 0.00 54.13 53.45 3dnh s LEU 105 Cb -0.16 -1.99 -0.03 0.00 0.50 0.00 0.00 46.19 44.51 3dnh s LEU 105 CO -0.08 -0.16 -0.00 -0.89 -1.32 0.00 0.00 176.35 173.89 3dnh s THR 106 N 1.62 4.22 -0.14 3.68 2.01 0.12 -1.03 115.64 126.12 3dnh s THR 106 Ca 0.05 -0.26 -0.00 0.00 0.31 0.00 0.00 61.69 61.79 3dnh s THR 106 Cb -0.17 -2.83 0.03 0.00 0.01 0.00 0.00 72.50 69.55 3dnh s THR 106 CO 0.06 0.53 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.67 3dnh s LEU 107 N -0.14 1.45 -0.07 4.42 1.43 0.04 -0.93 118.68 124.89 3dnh s LEU 107 Ca 0.04 -0.45 0.02 0.00 -1.03 0.00 0.00 54.13 52.72 3dnh s LEU 107 Cb -0.13 -0.97 -0.02 0.00 0.03 0.00 0.00 46.19 45.10 3dnh s LEU 107 CO 0.02 -0.11 -0.12 -0.69 0.23 0.00 0.00 176.35 175.68 3dnh s VAL 108 N 1.62 3.24 -1.19 -1.59 1.01 -0.13 -1.14 120.40 122.22 3dnh s VAL 108 Ca 0.04 -0.64 0.00 0.00 0.00 0.00 0.00 61.98 61.38 3dnh s VAL 108 Cb -0.13 -2.31 0.00 0.00 0.00 0.00 0.00 36.38 33.94 3dnh s VAL 108 CO -0.09 0.58 0.00 0.61 0.00 0.00 0.00 175.10 176.20 3dnh n GLY 109 N 2.55 -0.66 3.53 4.51 0.00 -0.73 0.58 105.19 114.96 3dnh n GLY 109 Ca -0.18 -0.51 -0.34 0.00 0.00 0.00 0.00 46.02 45.00 3dnh n GLY 109 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dnh s ARG 110 N -0.48 3.13 -0.44 1.61 0.52 -0.75 -0.51 118.95 122.03 3dnh s ARG 110 Ca 0.00 -0.56 -0.24 0.00 -0.52 0.00 0.00 55.73 54.41 3dnh s ARG 110 Cb 0.00 -2.69 0.02 0.00 0.52 0.00 0.00 34.95 32.80 3dnh s ARG 110 CO 0.00 0.47 0.85 0.00 0.02 0.00 0.00 175.30 176.64 3dnh s ALA 111 N -0.28 3.29 -0.30 2.13 0.00 0.11 0.05 121.76 126.76 3dnh s ALA 111 Ca 0.04 -0.84 -0.13 0.00 0.00 0.00 0.00 51.96 51.03 3dnh s ALA 111 Cb -0.13 -3.54 -0.03 0.00 0.00 0.00 0.00 23.12 19.43 3dnh s ALA 111 CO 0.02 -1.91 0.30 -0.51 0.00 0.00 0.00 175.76 173.66 3dnh s ASP 112 N 2.14 6.13 0.23 0.00 1.01 0.67 -4.80 116.67 122.05 3dnh s ASP 112 Ca 0.34 -0.03 -0.31 0.00 0.71 0.00 0.00 52.55 53.25 3dnh s ASP 112 Cb -0.11 -2.17 -0.11 0.00 1.01 0.00 0.00 42.92 41.53 3dnh s ASP 112 CO 0.23 -0.19 1.66 -0.60 0.21 0.00 0.00 175.17 176.48 3dnh s ARG 113 N 1.91 4.14 -0.13 8.23 3.52 -1.26 -0.08 118.95 135.28 3dnh s ARG 113 Ca 0.10 2.56 -0.29 0.00 -0.13 0.00 0.00 55.73 57.97 3dnh s ARG 113 Cb -0.16 -3.07 -0.02 0.00 -1.56 0.00 0.00 34.95 30.14 3dnh s ARG 113 CO 0.11 -0.69 1.25 0.42 -0.81 0.00 0.00 175.30 175.58 3dnh s ILE 114 N 0.81 4.27 0.88 4.11 1.01 0.11 -4.86 121.20 127.53 3dnh s ILE 114 Ca 0.70 1.55 -0.12 0.00 0.00 0.00 0.00 60.65 62.79 3dnh s ILE 114 Cb -0.48 -4.00 0.12 0.00 0.01 0.00 0.00 42.46 38.11 3dnh s ILE 114 CO 0.37 -0.10 1.11 -0.83 0.00 0.00 0.00 174.94 175.49 3dnh s GLY 115 N 1.84 1.60 0.25 6.18 0.00 -1.26 -4.69 107.32 111.24 3dnh s GLY 115 Ca 0.55 -0.33 -0.06 0.00 0.00 0.00 0.00 44.72 44.88 3dnh s GLY 115 CO 0.17 0.18 1.93 -2.55 0.00 0.00 0.00 173.10 172.83 3dnh h PRO 116 N -1.42 1.33 -0.04 2.90 0.11 -2.01 0.54 132.00 133.41 3dnh h PRO 116 Ca -0.50 -0.08 0.01 0.00 0.11 0.00 0.00 66.00 65.54 3dnh h PRO 116 Cb 1.30 -0.30 -0.00 0.00 0.11 0.00 0.00 31.00 32.11 3dnh h PRO 116 CO 0.59 0.88 0.12 0.38 -0.21 0.00 0.00 178.00 179.76 3dnh h ASP 117 N 1.37 0.00 -0.00 -2.05 3.04 -2.03 -3.01 116.42 113.74 3dnh h ASP 117 Ca 0.37 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.16 3dnh h ASP 117 Cb -0.15 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.14 3dnh h ASP 117 CO -0.08 0.00 -0.18 -0.62 -2.04 0.00 0.00 179.24 176.32 3dnh n GLU 118 N -3.29 3.59 -0.19 4.15 1.02 0.09 -4.78 120.64 121.24 3dnh n GLU 118 Ca -0.02 -0.26 -0.05 0.00 -0.02 0.00 0.00 57.16 56.81 3dnh n GLU 118 Cb 0.20 -0.86 0.13 0.00 -0.02 0.00 0.00 31.44 30.88 3dnh n GLU 118 CO 0.00 0.00 0.00 -0.39 1.18 0.00 0.00 177.13 177.92 3dnh h VAL 119 N 0.36 1.24 -0.79 2.62 -1.51 -1.18 -2.74 116.25 114.26 3dnh h VAL 119 Ca 0.00 -0.88 0.12 0.00 -1.23 0.00 0.00 66.70 64.71 3dnh h VAL 119 Cb 0.17 0.59 -0.08 0.00 -2.13 0.00 0.00 31.29 29.83 3dnh h VAL 119 CO 0.00 0.33 0.41 -0.65 -1.23 0.00 0.00 177.57 176.44 3dnh h PRO 120 N 0.93 0.63 -0.09 5.19 0.11 -1.87 0.25 132.00 137.16 3dnh h PRO 120 Ca 0.20 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 66.22 3dnh h PRO 120 Cb 0.32 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 31.29 3dnh h PRO 120 CO -0.00 0.41 -0.14 1.25 -0.21 0.00 0.00 178.00 179.31 3dnh h LEU 121 N 0.65 0.28 -0.76 2.35 5.85 -1.90 -1.66 115.31 120.12 3dnh h LEU 121 Ca 0.41 -0.54 0.13 0.00 0.84 0.00 0.00 57.88 58.72 3dnh h LEU 121 Cb 0.49 -0.08 -0.09 0.00 0.37 0.00 0.00 40.66 41.35 3dnh h LEU 121 CO -0.31 0.77 0.33 0.00 -0.34 0.00 0.00 178.44 178.89 3dnh h ALA 122 N 0.52 1.07 -0.26 1.25 0.00 -1.15 0.11 119.26 120.80 3dnh h ALA 122 Ca 0.01 0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.02 3dnh h ALA 122 Cb 0.71 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 3dnh h ALA 122 CO 0.03 -0.15 0.15 0.82 0.00 0.00 0.00 179.25 180.09 3dnh h ILE 123 N 0.51 1.02 0.32 0.00 1.08 -0.42 -1.38 117.51 118.64 3dnh h ILE 123 Ca 0.40 -0.10 0.00 0.00 -0.39 0.00 0.00 64.86 64.77 3dnh h ILE 123 Cb 0.57 0.69 -0.02 0.00 -3.07 0.00 0.00 36.82 34.98 3dnh h ILE 123 CO -0.36 0.06 -0.35 0.00 -0.69 0.00 0.00 178.15 176.80 3dnh h ALA 124 N 1.12 -0.74 -0.80 1.87 0.00 -0.55 -0.71 119.26 119.45 3dnh h ALA 124 Ca 0.10 -0.11 0.13 0.00 0.00 0.00 0.00 54.91 55.03 3dnh h ALA 124 Cb 0.00 0.52 -0.09 0.00 0.00 0.00 0.00 17.79 18.22 3dnh h ALA 124 CO -0.05 -0.96 0.39 0.00 0.00 0.00 0.00 179.25 178.63 3dnh h ARG 125 N -0.71 0.56 -0.13 0.00 3.08 -0.71 0.69 114.38 117.16 3dnh h ARG 125 Ca -0.02 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 59.97 3dnh h ARG 125 Cb 0.65 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 30.57 3dnh h ARG 125 CO -0.08 0.37 -0.02 -0.92 -1.07 0.00 0.00 179.97 178.25 3dnh h TYR 126 N 0.58 0.28 -0.97 3.04 3.20 -1.03 -2.95 116.97 119.12 3dnh h TYR 126 Ca 0.43 -0.06 0.01 0.00 3.14 0.00 0.00 58.73 62.25 3dnh h TYR 126 Cb 0.58 -0.07 -0.05 0.00 1.54 0.00 0.00 36.73 38.73 3dnh h TYR 126 CO -0.11 0.53 0.64 0.82 -1.64 0.00 0.00 178.16 178.40 3dnh h ILE 127 N -0.05 1.24 -0.95 1.81 1.08 -0.80 0.27 117.51 120.11 3dnh h ILE 127 Ca 0.03 -0.45 0.19 0.00 -0.39 0.00 0.00 64.86 64.25 3dnh h ILE 127 Cb 0.43 -0.18 -0.11 0.00 -3.07 0.00 0.00 36.82 33.89 3dnh h ILE 127 CO 0.01 0.24 0.53 0.00 -0.69 0.00 0.00 178.15 178.24 3dnh h ALA 128 N 1.36 1.55 0.16 1.87 0.00 -0.70 -1.87 119.26 121.64 3dnh h ALA 128 Ca 0.36 0.10 -0.33 0.00 0.00 0.00 0.00 54.91 55.04 3dnh h ALA 128 Cb -0.13 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.65 3dnh h ALA 128 CO -0.09 -0.14 -1.66 -0.09 0.00 0.00 0.00 179.25 177.28 3dnh h ARG 129 N 0.64 0.34 -3.01 0.00 2.43 -1.38 -3.43 114.38 109.98 3dnh h ARG 129 Ca 0.55 -0.59 -0.62 0.00 -0.81 0.00 0.00 59.98 58.52 3dnh h ARG 129 Cb 0.90 0.22 -0.41 0.00 -0.42 0.00 0.00 29.97 30.26 3dnh h ARG 129 CO -0.41 1.24 -0.65 0.71 -1.51 0.00 0.00 179.97 179.35 3dnh s TYR 130 N -2.59 3.05 0.53 2.20 2.02 0.93 -4.95 117.35 118.53 3dnh s TYR 130 Ca -0.13 -3.11 0.21 0.00 -0.37 0.00 0.00 57.07 53.67 3dnh s TYR 130 Cb 0.06 -2.40 1.37 0.00 -0.40 0.00 0.00 41.96 40.59 3dnh s TYR 130 CO 0.86 -0.63 2.09 -1.35 -1.57 0.00 0.00 175.55 174.95 3dnh h PRO 131 N 5.67 0.00 0.00 -1.71 0.11 -1.70 -1.35 132.00 133.02 3dnh h PRO 131 Ca 0.12 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.23 3dnh h PRO 131 Cb 0.81 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.92 3dnh h PRO 131 CO 0.65 0.00 0.00 0.87 -0.21 0.00 0.00 178.00 179.31 3dnh h LYS 132 N 0.00 0.00 0.00 1.05 1.57 -1.93 -2.60 116.57 114.66 3dnh h LYS 132 Ca 0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 3dnh h LYS 132 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.72 3dnh h LYS 132 CO -0.00 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.88 3dnh n ALA 133 N -1.84 1.59 -0.28 3.86 0.00 -0.51 -2.25 120.51 121.08 3dnh n ALA 133 Ca 0.03 -0.04 0.25 0.00 0.00 0.00 0.00 53.44 53.68 3dnh n ALA 133 Cb 0.32 -1.16 0.59 0.00 0.00 0.00 0.00 19.45 19.20 3dnh n ALA 133 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 3dnh h LYS 134 N 0.00 0.25 -0.02 0.00 1.63 -1.64 -0.84 116.57 115.96 3dnh h LYS 134 Ca 0.00 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 3dnh h LYS 134 Cb 0.11 -0.06 0.00 0.00 -0.60 0.00 0.00 32.23 31.68 3dnh h LYS 134 CO 0.00 0.17 0.00 1.28 -3.45 0.00 0.00 179.45 177.45 3dnh n LEU 135 N -4.46 0.39 0.00 5.20 4.77 -0.95 -4.00 117.00 117.94 3dnh n LEU 135 Ca 0.23 -0.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.07 3dnh n LEU 135 Cb 0.91 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.99 3dnh n LEU 135 CO 0.32 0.07 0.11 0.00 -1.33 0.00 0.00 177.39 176.56 3dnh n TYR 136 N -0.65 0.00 0.99 -1.77 4.11 -0.38 -4.89 117.16 114.58 3dnh n TYR 136 Ca 0.20 0.00 0.12 0.00 -0.00 0.00 0.00 57.90 58.22 3dnh n TYR 136 Cb 0.16 0.02 0.09 0.00 -0.00 0.00 0.00 39.34 39.60 3dnh n TYR 136 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.86 178.14 3dnh n LEU 137 N 0.00 2.87 -0.64 -3.48 4.77 -0.85 -4.05 117.00 115.61 3dnh n LEU 137 Ca 0.00 -0.97 0.06 0.00 -0.03 0.00 0.00 56.01 55.07 3dnh n LEU 137 Cb 0.38 0.00 0.20 0.00 -2.33 0.00 0.00 43.42 41.67 3dnh n LEU 137 CO 0.00 0.48 0.35 -1.54 -1.33 0.00 0.00 177.39 175.35 3dnh n SER 138 N 1.18 1.68 -4.86 -1.43 3.41 -1.26 -4.91 113.62 107.42 3dnh n SER 138 Ca 0.13 -3.80 -0.31 0.00 -0.26 0.00 0.00 58.87 54.63 3dnh n SER 138 Cb 0.58 -0.52 -0.02 0.00 -0.26 0.00 0.00 64.21 63.99 3dnh n SER 138 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3dnh s LEU 139 N -3.07 3.59 0.57 1.04 1.43 -1.26 -4.98 118.68 116.01 3dnh s LEU 139 Ca 0.38 1.36 0.28 0.00 -1.03 0.00 0.00 54.13 55.13 3dnh s LEU 139 Cb 0.37 -4.31 1.49 0.00 0.03 0.00 0.00 46.19 43.77 3dnh s LEU 139 CO -0.07 -0.60 1.95 -0.65 0.23 0.00 0.00 176.35 177.20 3dnh h PRO 140 N 0.68 0.00 -0.14 1.29 0.11 -1.96 -2.98 132.00 129.00 3dnh h PRO 140 Ca -0.46 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 3dnh h PRO 140 Cb 1.19 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 3dnh h PRO 140 CO 0.62 0.00 -0.05 -0.40 -0.21 0.00 0.00 178.00 177.96 3dnh n ASP 141 N -3.91 2.91 -4.70 -2.05 3.85 -1.26 -5.00 116.55 106.38 3dnh n ASP 141 Ca 0.09 -3.21 -0.42 0.00 -0.71 0.00 0.00 54.79 50.53 3dnh n ASP 141 Cb 0.63 -0.51 -0.03 0.00 -1.35 0.00 0.00 41.12 39.87 3dnh n ASP 141 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.20 175.30 3dnh s THR 142 N -2.94 2.70 0.01 2.12 2.01 -1.13 0.70 115.64 119.12 3dnh s THR 142 Ca 0.38 0.35 0.01 0.00 0.31 0.00 0.00 61.69 62.74 3dnh s THR 142 Cb 0.33 -3.22 -0.01 0.00 0.01 0.00 0.00 72.50 69.60 3dnh s THR 142 CO 0.04 0.01 -0.04 -0.13 -0.69 0.00 0.00 174.62 173.81 3dnh s ARG 143 N 2.00 0.29 0.05 4.92 0.52 -1.08 -4.86 118.95 120.79 3dnh s ARG 143 Ca 0.74 -0.33 0.05 0.00 -0.52 0.00 0.00 55.73 55.66 3dnh s ARG 143 Cb -0.43 -0.16 -0.02 0.00 0.52 0.00 0.00 34.95 34.86 3dnh s ARG 143 CO 0.33 0.03 -0.13 -0.51 0.02 0.00 0.00 175.30 175.03 3dnh s LEU 144 N -0.66 2.20 0.02 2.53 1.02 -1.26 -1.19 118.68 121.34 3dnh s LEU 144 Ca -0.05 -0.49 0.03 0.00 0.02 0.00 0.00 54.13 53.64 3dnh s LEU 144 Cb -0.05 -0.54 -0.02 0.00 0.02 0.00 0.00 46.19 45.61 3dnh s LEU 144 CO -0.00 -0.01 -0.10 -0.31 0.02 0.00 0.00 176.35 175.95 3dnh s TYR 145 N -0.97 0.84 -0.01 0.29 2.02 -0.23 0.04 117.35 119.33 3dnh s TYR 145 Ca -0.00 -0.29 -0.12 0.00 -0.37 0.00 0.00 57.07 56.29 3dnh s TYR 145 Cb -0.08 -0.51 -0.05 0.00 -0.40 0.00 0.00 41.96 40.91 3dnh s TYR 145 CO 0.01 -0.01 0.34 1.03 -1.57 0.00 0.00 175.55 175.35 3dnh s ARG 146 N -0.84 3.77 -0.19 -0.62 0.52 0.89 -1.46 118.95 121.01 3dnh s ARG 146 Ca -0.01 0.23 -0.22 0.00 -0.52 0.00 0.00 55.73 55.21 3dnh s ARG 146 Cb -0.06 -3.16 -0.02 0.00 0.52 0.00 0.00 34.95 32.22 3dnh s ARG 146 CO 0.00 0.68 0.69 -1.17 0.02 0.00 0.00 175.30 175.53 3dnh s LEU 147 N -1.27 4.15 -0.83 2.53 2.96 -0.46 -0.24 118.68 125.52 3dnh s LEU 147 Ca 0.24 0.93 -0.17 0.00 -0.22 0.00 0.00 54.13 54.90 3dnh s LEU 147 Cb -0.15 -2.99 0.15 0.00 0.50 0.00 0.00 46.19 43.70 3dnh s LEU 147 CO 0.13 -0.32 0.94 -0.60 -1.32 0.00 0.00 176.35 175.17 3dnh s ARG 148 N 2.04 3.48 0.20 1.98 3.52 0.11 -4.46 118.95 125.83 3dnh s ARG 148 Ca 0.31 -1.86 -0.31 0.00 -0.13 0.00 0.00 55.73 53.74 3dnh s ARG 148 Cb -0.16 -4.63 -0.10 0.00 -1.56 0.00 0.00 34.95 28.50 3dnh s ARG 148 CO 0.11 -1.59 1.53 0.99 -0.81 0.00 0.00 175.30 175.53 3dnh s THR 149 N 1.97 2.59 0.00 4.11 2.01 -1.26 -1.81 115.64 123.24 3dnh s THR 149 Ca 0.24 0.45 0.00 0.00 0.31 0.00 0.00 61.69 62.69 3dnh s THR 149 Cb -0.10 -3.29 0.00 0.00 0.01 0.00 0.00 72.50 69.12 3dnh s THR 149 CO -0.06 0.05 0.00 -0.62 -0.69 0.00 0.00 174.62 173.30 3dnh n GLU 150 N 3.31 1.59 -3.88 4.92 1.02 0.20 -4.86 120.64 122.94 3dnh n GLU 150 Ca 0.11 0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 57.14 3dnh n GLU 150 Cb 0.39 -1.00 -0.10 0.00 -0.02 0.00 0.00 31.44 30.71 3dnh n GLU 150 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 3dnh s GLY 151 N -2.38 0.06 -0.02 0.62 0.00 -0.50 -4.74 107.32 100.35 3dnh s GLY 151 Ca 0.00 -0.18 0.01 0.00 0.00 0.00 0.00 44.72 44.55 3dnh s GLY 151 CO 0.00 -0.32 -0.04 0.14 0.00 0.00 0.00 173.10 172.89 3dnh s VAL 152 N -1.49 0.38 -0.02 1.40 1.01 -1.26 -0.96 120.40 119.45 3dnh s VAL 152 Ca -0.14 -0.13 0.02 0.00 0.00 0.00 0.00 61.98 61.73 3dnh s VAL 152 Cb -0.07 -0.37 0.00 0.00 0.00 0.00 0.00 36.38 35.94 3dnh s VAL 152 CO 0.01 0.14 -0.08 -1.58 0.00 0.00 0.00 175.10 173.59 3dnh s GLN 153 N 0.33 0.84 -0.07 2.72 2.00 -0.10 -4.80 119.66 120.58 3dnh s GLN 153 Ca -0.04 -0.27 0.05 0.00 -2.00 0.00 0.00 55.36 53.10 3dnh s GLN 153 Cb -0.07 -0.80 -0.00 0.00 0.80 0.00 0.00 33.01 32.94 3dnh s GLN 153 CO -0.00 0.10 -0.22 -1.50 -0.50 0.00 0.00 175.29 173.17 3dnh s ILE 154 N 0.17 1.85 0.14 -2.34 2.07 -1.26 0.13 121.20 121.96 3dnh s ILE 154 Ca -0.02 -0.93 0.11 0.00 -1.41 0.00 0.00 60.65 58.40 3dnh s ILE 154 Cb -0.08 -1.59 -0.04 0.00 0.13 0.00 0.00 42.46 40.89 3dnh s ILE 154 CO 0.00 0.52 -0.26 0.20 -1.91 0.00 0.00 174.94 173.49 3dnh s ASN 155 N 0.12 3.28 0.00 4.50 0.02 0.42 -5.00 114.94 118.29 3dnh s ASN 155 Ca -0.10 -0.77 0.00 0.00 -1.02 0.00 0.00 52.86 50.97 3dnh s ASN 155 Cb -0.15 -0.22 0.00 0.00 0.02 0.00 0.00 41.25 40.90 3dnh s ASN 155 CO 0.05 0.15 0.00 0.61 0.02 0.00 0.00 177.10 177.94 3dnh n GLY 156 N 0.77 0.16 0.00 0.66 0.00 -1.26 -1.31 105.19 104.21 3dnh n GLY 156 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 3dnh n GLY 156 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3dnh n ASN 164 N 0.00 0.00 -4.69 1.61 2.04 -1.26 -3.64 115.26 109.32 3dnh n ASN 164 Ca 0.00 0.00 -0.42 0.00 -0.44 0.00 0.00 54.58 53.72 3dnh n ASN 164 Cb 0.00 0.00 -0.03 0.00 -2.53 0.00 0.00 39.78 37.22 3dnh n ASN 164 CO 0.00 0.00 0.00 -0.63 -0.44 0.00 0.00 177.26 176.19 3dnh s ILE 165 N 0.00 4.46 0.27 1.53 -1.09 -1.26 -3.60 121.20 121.51 3dnh s ILE 165 Ca 0.00 1.77 0.06 0.00 -2.23 0.00 0.00 60.65 60.25 3dnh s ILE 165 Cb 0.00 -4.13 -0.03 0.00 -1.58 0.00 0.00 42.46 36.72 3dnh s ILE 165 CO 0.00 0.04 0.33 0.42 -1.23 0.00 0.00 174.94 174.49 3dnh s THR 166 N 1.85 4.70 0.32 2.92 -4.23 -1.26 -4.48 115.64 115.46 3dnh s THR 166 Ca 0.53 -1.14 0.09 0.00 -1.18 0.00 0.00 61.69 60.00 3dnh s THR 166 Cb -0.23 -3.61 0.31 0.00 1.34 0.00 0.00 72.50 70.31 3dnh s THR 166 CO 0.22 -0.29 1.74 -0.65 -0.54 0.00 0.00 174.62 175.10 3dnh h PRO 167 N 1.22 0.61 -0.31 3.99 0.11 -1.89 -1.63 132.00 134.10 3dnh h PRO 167 Ca -0.49 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.57 3dnh h PRO 167 Cb 1.24 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 3dnh h PRO 167 CO 0.59 0.40 0.15 0.00 -0.21 0.00 0.00 178.00 178.93 3dnh h ALA 168 N 1.71 1.68 0.00 -0.75 0.00 -1.94 -2.45 119.26 117.51 3dnh h ALA 168 Ca 0.63 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.47 3dnh h ALA 168 Cb 1.15 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 3dnh h ALA 168 CO -0.45 0.26 -0.01 -0.44 0.00 0.00 0.00 179.25 178.61 3dnh h ASP 169 N 0.43 0.00 0.21 0.00 3.32 -1.68 -2.90 116.42 115.79 3dnh h ASP 169 Ca 0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.16 3dnh h ASP 169 Cb 0.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.60 3dnh h ASP 169 CO -0.02 0.01 -0.37 0.18 -1.72 0.00 0.00 179.24 177.33 3dnh n LEU 170 N -4.33 1.16 -4.85 1.55 4.77 -0.92 -4.93 117.00 109.45 3dnh n LEU 170 Ca -0.03 -0.34 -0.34 0.00 -0.03 0.00 0.00 56.01 55.27 3dnh n LEU 170 Cb 0.10 -0.11 -0.06 0.00 -2.33 0.00 0.00 43.42 41.03 3dnh n LEU 170 CO 0.32 0.22 0.30 -0.13 -1.33 0.00 0.00 177.39 176.78 3dnh s ARG 171 N -2.59 4.00 -0.21 3.23 0.52 -1.10 -4.74 118.95 118.07 3dnh s ARG 171 Ca 0.21 0.55 -0.19 0.00 -0.52 0.00 0.00 55.73 55.78 3dnh s ARG 171 Cb 0.19 -2.77 -0.03 0.00 0.52 0.00 0.00 34.95 32.85 3dnh s ARG 171 CO 0.57 0.37 0.54 0.99 0.02 0.00 0.00 175.30 177.79 3dnh s THR 172 N -1.64 5.09 -0.24 0.02 2.01 -0.25 -4.95 115.64 115.67 3dnh s THR 172 Ca 0.44 0.98 -0.29 0.00 0.31 0.00 0.00 61.69 63.13 3dnh s THR 172 Cb -0.14 -3.86 -0.00 0.00 0.01 0.00 0.00 72.50 68.51 3dnh s THR 172 CO 0.20 0.15 1.27 -0.62 -0.69 0.00 0.00 174.62 174.93 3dnh s ASP 173 N 1.22 6.81 0.09 3.53 2.15 -1.26 -4.54 116.67 124.66 3dnh s ASP 173 Ca 0.24 1.42 0.23 0.00 0.43 0.00 0.00 52.55 54.87 3dnh s ASP 173 Cb -0.15 -2.54 0.16 0.00 -0.30 0.00 0.00 42.92 40.08 3dnh s ASP 173 CO 0.10 -0.92 1.14 0.18 -0.17 0.00 0.00 175.17 175.49 3dnh n LEU 174 N 7.12 0.65 -0.19 -1.34 4.77 -1.26 -4.70 117.00 122.05 3dnh n LEU 174 Ca 0.14 0.10 0.11 0.00 -0.03 0.00 0.00 56.01 56.34 3dnh n LEU 174 Cb 0.46 -0.13 0.43 0.00 -2.33 0.00 0.00 43.42 41.85 3dnh n LEU 174 CO 0.59 -0.01 1.21 0.77 -1.33 0.00 0.00 177.39 178.62 3dnh h SER 175 N 0.00 0.54 0.17 -1.43 4.64 -2.03 -1.11 113.55 114.34 3dnh h SER 175 Ca 0.00 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 3dnh h SER 175 Cb 0.76 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.76 3dnh h SER 175 CO 0.00 0.30 -0.02 0.61 -0.87 0.00 0.00 176.83 176.85 3dnh n GLY 176 N -1.47 -0.89 1.25 -0.77 0.00 -1.26 -4.48 105.19 97.56 3dnh n GLY 176 Ca 0.14 -0.24 -0.06 0.00 0.00 0.00 0.00 46.02 45.85 3dnh n GLY 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dnh n ALA 177 N -0.87 4.14 0.19 4.61 0.00 -0.42 -4.83 120.51 123.33 3dnh n ALA 177 Ca 0.20 -3.45 0.04 0.00 0.00 0.00 0.00 53.44 50.22 3dnh n ALA 177 Cb 0.20 -0.36 0.44 0.00 0.00 0.00 0.00 19.45 19.73 3dnh n ALA 177 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 3dnh h GLU 178 N 1.51 0.05 -0.35 0.00 9.09 -1.76 -2.76 114.58 120.36 3dnh h GLU 178 Ca 0.14 -0.01 -0.03 0.00 0.05 0.00 0.00 59.36 59.51 3dnh h GLU 178 Cb 1.25 -0.01 -0.01 0.00 -1.65 0.00 0.00 28.75 28.33 3dnh h GLU 178 CO 0.31 0.27 0.12 1.49 0.05 0.00 0.00 179.01 181.25 3dnh h GLU 179 N 0.05 0.54 -0.54 1.06 4.81 -1.88 0.86 114.58 119.46 3dnh h GLU 179 Ca 0.01 -0.11 0.00 0.00 -0.13 0.00 0.00 59.36 59.13 3dnh h GLU 179 Cb 0.42 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.72 3dnh h GLU 179 CO 0.03 0.55 0.00 -0.11 -0.73 0.00 0.00 179.01 178.75 3dnh n LEU 180 N -4.66 0.03 0.00 1.64 7.94 -1.04 -2.64 117.00 118.26 3dnh n LEU 180 Ca -0.01 -0.01 0.00 0.00 -1.11 0.00 0.00 56.01 54.88 3dnh n LEU 180 Cb 0.16 -0.01 0.00 0.00 0.53 0.00 0.00 43.42 44.10 3dnh n LEU 180 CO 0.37 0.01 0.00 0.00 -1.11 0.00 0.00 177.39 176.66 3dnh n ALA 182 N 0.63 0.00 0.81 1.96 0.00 0.29 0.36 120.51 124.56 3dnh n ALA 182 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.53 3dnh n ALA 182 Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.46 3dnh n ALA 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dnh n ALA 183 N 0.00 3.27 -0.08 0.00 0.00 -1.08 -4.65 120.51 117.96 3dnh n ALA 183 Ca 0.00 -0.58 -0.07 0.00 0.00 0.00 0.00 53.44 52.79 3dnh n ALA 183 Cb 0.00 -0.64 -0.00 0.00 0.00 0.00 0.00 19.45 18.80 3dnh n ALA 183 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dnh h ALA 184 N 3.21 0.34 -0.11 0.00 0.00 -0.38 0.41 119.26 122.73 3dnh h ALA 184 Ca 0.00 0.04 -0.23 0.00 0.00 0.00 0.00 54.91 54.71 3dnh h ALA 184 Cb 0.63 0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.45 3dnh h ALA 184 CO 0.00 -0.30 -0.85 0.93 0.00 0.00 0.00 179.25 179.03 3dnh h GLU 185 N 0.23 0.76 -0.71 0.00 5.08 -1.86 -1.18 114.58 116.90 3dnh h GLU 185 Ca 0.13 -0.68 -0.06 0.00 -1.00 0.00 0.00 59.36 57.76 3dnh h GLU 185 Cb 0.10 0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.48 3dnh h GLU 185 CO -0.14 1.27 0.22 0.77 -1.00 0.00 0.00 179.01 180.14 3dnh h SER 186 N 0.48 1.02 -0.39 1.42 0.02 -1.83 -2.18 113.55 112.09 3dnh h SER 186 Ca -0.08 -0.19 -0.15 0.00 -0.84 0.00 0.00 61.79 60.54 3dnh h SER 186 Cb 1.49 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 63.75 3dnh h SER 186 CO 0.17 0.95 -0.33 -0.08 -1.14 0.00 0.00 176.83 176.40 3dnh h GLU 187 N 1.05 0.93 -0.65 3.45 4.57 -0.71 -0.45 114.58 122.77 3dnh h GLU 187 Ca 0.23 -0.45 -0.08 0.00 -1.18 0.00 0.00 59.36 57.88 3dnh h GLU 187 Cb 0.29 -0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 28.86 3dnh h GLU 187 CO -0.01 1.11 0.11 0.00 -1.18 0.00 0.00 179.01 179.04 3dnh h ALA 188 N 0.84 0.96 -0.10 2.92 0.00 -1.00 -0.04 119.26 122.84 3dnh h ALA 188 Ca 0.08 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 3dnh h ALA 188 Cb 0.91 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 3dnh h ALA 188 CO 0.08 0.65 0.06 1.15 0.00 0.00 0.00 179.25 181.19 3dnh h THR 189 N 1.00 1.06 -0.19 0.00 2.02 -1.20 -0.05 112.91 115.56 3dnh h THR 189 Ca 0.20 -0.16 0.04 0.00 0.77 0.00 0.00 66.41 67.25 3dnh h THR 189 Cb 0.42 1.00 -0.03 0.00 -1.74 0.00 0.00 68.15 67.80 3dnh h THR 189 CO 0.01 0.06 -0.03 -0.09 0.37 0.00 0.00 175.52 175.84 3dnh h ARG 190 N 0.09 0.03 -0.42 6.66 2.43 -0.70 -1.76 114.38 120.69 3dnh h ARG 190 Ca 0.03 -0.00 -0.12 0.00 -0.81 0.00 0.00 59.98 59.08 3dnh h ARG 190 Cb 0.04 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 3dnh h ARG 190 CO -0.01 0.02 -0.22 -0.07 -1.51 0.00 0.00 179.97 178.19 3dnh h LEU 191 N 0.03 0.92 -1.94 3.80 3.38 -0.90 -2.46 115.31 118.14 3dnh h LEU 191 Ca 0.09 -0.41 -0.01 0.00 0.09 0.00 0.00 57.88 57.64 3dnh h LEU 191 Cb 0.13 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 3dnh h LEU 191 CO -0.18 1.13 -0.04 0.78 0.09 0.00 0.00 178.44 180.22 3dnh h ASN 192 N 0.72 0.00 0.91 -0.43 2.35 -0.79 -1.31 115.58 117.02 3dnh h ASN 192 Ca 0.09 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.84 3dnh h ASN 192 Cb 0.78 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.15 3dnh h ASN 192 CO 0.06 0.04 0.00 0.00 -1.65 0.00 0.00 177.43 175.89 3dnh n ALA 193 N -2.52 2.22 -2.58 -0.83 0.00 -0.68 -4.61 120.51 111.51 3dnh n ALA 193 Ca -0.03 -0.09 -0.43 0.00 0.00 0.00 0.00 53.44 52.89 3dnh n ALA 193 Cb 0.13 -1.43 -0.04 0.00 0.00 0.00 0.00 19.45 18.11 3dnh n ALA 193 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3dnh s ILE 194 N -2.99 4.46 0.01 0.00 1.01 -0.50 -4.99 121.20 118.20 3dnh s ILE 194 Ca 0.13 0.99 -0.34 0.00 0.00 0.00 0.00 60.65 61.43 3dnh s ILE 194 Cb 0.17 -4.43 -0.13 0.00 0.01 0.00 0.00 42.46 38.08 3dnh s ILE 194 CO 0.48 -0.76 1.74 1.17 0.00 0.00 0.00 174.94 177.57 3dnh n LYS 195 N 7.15 2.10 -0.55 2.79 4.81 -1.26 -1.69 118.16 131.50 3dnh n LYS 195 Ca 0.08 0.76 0.00 0.00 -0.87 0.00 0.00 58.31 58.28 3dnh n LYS 195 Cb 0.48 -2.57 0.00 0.00 0.02 0.00 0.00 35.03 32.97 3dnh n LYS 195 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3dnh n GLY 196 N 3.94 1.08 0.11 3.14 0.00 -1.26 -4.94 105.19 107.27 3dnh n GLY 196 Ca 0.20 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.06 3dnh n GLY 196 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3dnh h GLU 197 N 3.43 0.27 -0.86 1.61 4.57 -1.60 -2.47 114.58 119.54 3dnh h GLU 197 Ca 0.00 -0.30 -0.02 0.00 -1.18 0.00 0.00 59.36 57.85 3dnh h GLU 197 Cb 0.00 0.09 -0.04 0.00 -0.16 0.00 0.00 28.75 28.64 3dnh h GLU 197 CO 0.00 1.03 0.44 0.00 -1.18 0.00 0.00 179.01 179.30 3dnh h ALA 198 N 0.25 1.10 -0.28 2.92 0.00 -1.79 -2.21 119.26 119.25 3dnh h ALA 198 Ca -0.06 -0.14 -0.14 0.00 0.00 0.00 0.00 54.91 54.57 3dnh h ALA 198 Cb 1.19 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 3dnh h ALA 198 CO 0.08 0.63 -0.39 1.03 0.00 0.00 0.00 179.25 180.60 3dnh h SER 199 N 1.20 0.70 0.53 0.00 0.87 -1.80 0.03 113.55 115.08 3dnh h SER 199 Ca 0.30 -0.31 -0.08 0.00 -1.23 0.00 0.00 61.79 60.46 3dnh h SER 199 Cb 0.07 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 61.82 3dnh h SER 199 CO -0.04 1.01 -0.40 0.08 -0.53 0.00 0.00 176.83 176.94 3dnh h ARG 200 N 0.54 0.00 -0.13 2.24 0.11 -1.31 -1.27 114.38 114.56 3dnh h ARG 200 Ca 0.05 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 60.09 3dnh h ARG 200 Cb 0.92 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.99 3dnh h ARG 200 CO 0.08 0.40 -0.05 -0.07 0.10 0.00 0.00 179.97 180.44 3dnh h LEU 201 N 0.00 0.27 -0.73 0.08 3.38 -1.10 -1.84 115.31 115.38 3dnh h LEU 201 Ca -0.00 -0.39 0.14 0.00 0.09 0.00 0.00 57.88 57.72 3dnh h LEU 201 Cb 0.78 -0.08 -0.09 0.00 0.09 0.00 0.00 40.66 41.36 3dnh h LEU 201 CO 0.05 0.60 0.27 0.00 0.09 0.00 0.00 178.44 179.45 3dnh h ALA 202 N 0.68 1.00 -0.47 1.53 0.00 -0.72 -1.25 119.26 120.04 3dnh h ALA 202 Ca 0.03 0.12 -0.13 0.00 0.00 0.00 0.00 54.91 54.93 3dnh h ALA 202 Cb 0.49 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 3dnh h ALA 202 CO 0.02 -0.22 -0.22 -0.39 0.00 0.00 0.00 179.25 178.43 3dnh h VAL 203 N 0.41 1.27 -0.51 0.00 -1.51 -1.21 0.68 116.25 115.38 3dnh h VAL 203 Ca 0.40 -1.38 0.05 0.00 -1.23 0.00 0.00 66.70 64.54 3dnh h VAL 203 Cb 0.60 1.16 -0.03 0.00 -2.13 0.00 0.00 31.29 30.89 3dnh h VAL 203 CO -0.40 0.48 0.34 -0.07 -1.23 0.00 0.00 177.57 176.68 3dnh h LEU 204 N 0.82 0.42 -1.00 4.19 4.07 -0.90 -0.43 115.31 122.50 3dnh h LEU 204 Ca 0.11 -0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.06 3dnh h LEU 204 Cb 0.80 -0.09 0.00 0.00 1.08 0.00 0.00 40.66 42.45 3dnh h LEU 204 CO 0.07 0.28 0.00 0.00 -1.08 0.00 0.00 178.44 177.71 3dnh h ALA 205 N 1.72 1.00 0.00 1.53 0.00 -0.85 -3.47 119.26 119.19 3dnh h ALA 205 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.13 3dnh h ALA 205 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3dnh h ALA 205 CO -0.06 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.60 3dnh n GLY 206 N 0.21 1.42 3.96 0.00 0.00 -0.17 -4.82 105.19 105.79 3dnh n GLY 206 Ca 0.02 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.83 3dnh n GLY 206 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dnh s ALA 207 N -2.00 3.97 0.53 4.61 0.00 0.19 -4.98 121.76 124.09 3dnh s ALA 207 Ca 0.00 -1.29 -0.21 0.00 0.00 0.00 0.00 51.96 50.46 3dnh s ALA 207 Cb 0.00 -1.69 -0.05 0.00 0.00 0.00 0.00 23.12 21.38 3dnh s ALA 207 CO 0.00 0.18 1.20 -1.59 0.00 0.00 0.00 175.76 175.55 3dnh s LYS 208 N -4.01 3.32 0.18 0.00 0.00 -1.26 -3.82 119.74 114.15 3dnh s LYS 208 Ca 0.36 1.82 -0.31 0.00 0.00 0.00 0.00 55.97 57.85 3dnh s LYS 208 Cb -0.09 -2.14 -0.09 0.00 0.00 0.00 0.00 37.83 35.51 3dnh s LYS 208 CO 0.29 -0.92 1.46 -0.08 0.00 0.00 0.00 175.35 176.10 3dnh s THR 209 N -1.57 2.85 0.00 3.79 -1.32 -1.26 -4.63 115.64 113.49 3dnh s THR 209 Ca 0.71 0.65 0.00 0.00 -1.21 0.00 0.00 61.69 61.84 3dnh s THR 209 Cb -0.30 -3.41 0.00 0.00 -1.51 0.00 0.00 72.50 67.28 3dnh s THR 209 CO 0.34 0.07 0.00 0.61 -2.21 0.00 0.00 174.62 173.43 3dnh n GLY 210 N 3.10 2.08 3.43 6.08 0.00 -1.26 -5.08 105.19 113.53 3dnh n GLY 210 Ca 0.10 -0.44 -0.44 0.00 0.00 0.00 0.00 46.02 45.24 3dnh n GLY 210 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3dnh s ARG 211 N 1.72 4.08 0.18 1.61 3.00 -1.26 -4.65 118.95 123.62 3dnh s ARG 211 Ca 0.00 -2.69 0.01 0.00 -1.00 0.00 0.00 55.73 52.04 3dnh s ARG 211 Cb 0.00 -4.91 -0.04 0.00 0.00 0.00 0.00 34.95 30.00 3dnh s ARG 211 CO 0.00 -1.62 0.34 -1.58 0.00 0.00 0.00 175.30 172.44 3dnh s TRP 212 N 0.88 3.48 -0.00 5.12 0.52 -1.26 -4.16 118.94 123.52 3dnh s TRP 212 Ca 0.38 0.24 0.01 0.00 0.02 0.00 0.00 56.10 56.75 3dnh s TRP 212 Cb -0.05 -1.77 -0.00 0.00 -1.15 0.00 0.00 33.47 30.50 3dnh s TRP 212 CO -0.03 0.44 -0.04 0.15 0.02 0.00 0.00 176.95 177.49 3dnh s LYS 213 N -3.29 0.36 0.15 4.98 1.02 0.50 -4.56 119.74 118.89 3dnh s LYS 213 Ca 0.37 -0.18 -0.31 0.00 0.02 0.00 0.00 55.97 55.86 3dnh s LYS 213 Cb -0.11 -0.33 -0.09 0.00 -0.52 0.00 0.00 37.83 36.77 3dnh s LYS 213 CO 0.29 0.09 1.53 0.42 -0.92 0.00 0.00 175.35 176.76 3dnh s ILE 214 N -0.16 2.80 -0.08 2.17 1.01 -1.26 -0.25 121.20 125.43 3dnh s ILE 214 Ca 0.01 0.56 0.12 0.00 0.00 0.00 0.00 60.65 61.34 3dnh s ILE 214 Cb -0.02 -3.36 -0.17 0.00 0.01 0.00 0.00 42.46 38.92 3dnh s ILE 214 CO -0.00 0.04 0.14 0.35 0.00 0.00 0.00 174.94 175.47 3dnh n THR 215 N 4.01 0.49 -3.64 2.92 -2.24 0.26 -4.89 114.28 111.19 3dnh n THR 215 Ca 0.13 -0.42 -0.10 0.00 -2.27 0.00 0.00 64.05 61.39 3dnh n THR 215 Cb 0.39 -0.32 -0.07 0.00 -2.10 0.00 0.00 70.33 68.24 3dnh n THR 215 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3dnh s SER 216 N -4.07 -0.81 -0.13 3.42 0.15 -1.12 -4.84 113.70 106.31 3dnh s SER 216 Ca -0.05 1.42 -0.01 0.00 0.70 0.00 0.00 55.95 58.00 3dnh s SER 216 Cb 0.06 1.39 -0.02 0.00 -1.71 0.00 0.00 66.02 65.73 3dnh s SER 216 CO 0.51 -0.23 -0.08 -0.63 1.20 0.00 0.00 173.24 174.01 3dnh s ILE 217 N 0.98 3.50 0.30 6.45 1.01 -1.26 -0.94 121.20 131.25 3dnh s ILE 217 Ca -0.05 -0.51 0.03 0.00 0.00 0.00 0.00 60.65 60.12 3dnh s ILE 217 Cb -0.05 -2.49 -0.04 0.00 0.01 0.00 0.00 42.46 39.89 3dnh s ILE 217 CO -0.10 0.53 0.16 1.51 0.00 0.00 0.00 174.94 177.04 3dnh s ASP 218 N 0.12 1.48 0.60 3.58 1.47 -0.39 -4.92 116.67 118.63 3dnh s ASP 218 Ca -0.04 -1.56 0.32 0.00 1.18 0.00 0.00 52.55 52.45 3dnh s ASP 218 Cb -0.14 0.39 1.87 0.00 -0.34 0.00 0.00 42.92 44.70 3dnh s ASP 218 CO 0.04 -0.89 2.23 -0.65 0.68 0.00 0.00 175.17 176.57 3dnh h PRO 219 N 2.23 0.00 0.00 2.11 0.11 -1.87 -2.83 132.00 131.74 3dnh h PRO 219 Ca -0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 3dnh h PRO 219 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3dnh h PRO 219 CO 0.51 0.00 -1.53 -0.25 -0.21 0.00 0.00 178.00 176.52 3dnh n ASP 220 N -3.71 0.44 0.00 -2.05 8.00 -1.26 -0.43 116.55 117.54 3dnh n ASP 220 Ca -0.02 -0.41 0.00 0.00 0.71 0.00 0.00 54.79 55.07 3dnh n ASP 220 Cb 0.14 1.51 0.00 0.00 -0.02 0.00 0.00 41.12 42.75 3dnh n ASP 220 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dnh n GLY 221 N 1.36 -0.91 3.09 0.44 0.00 -1.07 -1.19 105.19 106.91 3dnh n GLY 221 Ca -0.00 -0.98 -0.28 0.00 0.00 0.00 0.00 46.02 44.76 3dnh n GLY 221 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dnh s ILE 222 N -3.00 1.54 -0.04 -0.61 1.01 0.83 -1.26 121.20 119.68 3dnh s ILE 222 Ca 0.00 -0.70 -0.14 0.00 0.00 0.00 0.00 60.65 59.81 3dnh s ILE 222 Cb 0.00 -1.38 -0.05 0.00 0.01 0.00 0.00 42.46 41.03 3dnh s ILE 222 CO 0.00 0.45 0.38 -1.81 0.00 0.00 0.00 174.94 173.96 3dnh s ASP 223 N 0.71 6.73 0.07 3.58 1.01 -0.11 -0.43 116.67 128.23 3dnh s ASP 223 Ca -0.12 0.86 0.04 0.00 0.71 0.00 0.00 52.55 54.04 3dnh s ASP 223 Cb -0.16 -2.23 -0.03 0.00 1.01 0.00 0.00 42.92 41.51 3dnh s ASP 223 CO 0.03 0.28 -0.11 -0.76 0.21 0.00 0.00 175.17 174.81 3dnh s LEU 224 N -0.74 2.32 -0.01 1.23 1.02 -0.58 -0.57 118.68 121.35 3dnh s LEU 224 Ca 0.23 -0.67 -0.00 0.00 0.02 0.00 0.00 54.13 53.70 3dnh s LEU 224 Cb -0.16 -0.36 0.01 0.00 0.02 0.00 0.00 46.19 45.71 3dnh s LEU 224 CO 0.11 -0.17 0.01 0.00 0.02 0.00 0.00 176.35 176.32 3dnh s ALA 225 N -1.73 0.02 0.00 4.21 0.00 0.65 -1.81 121.76 123.11 3dnh s ALA 225 Ca -0.01 0.11 0.00 0.00 0.00 0.00 0.00 51.96 52.06 3dnh s ALA 225 Cb -0.07 -0.09 0.00 0.00 0.00 0.00 0.00 23.12 22.96 3dnh s ALA 225 CO 0.01 -0.04 0.00 -1.13 0.00 0.00 0.00 175.76 174.60 3dnh n SER 226 N 3.47 0.55 0.28 0.00 3.41 -0.30 -0.37 113.62 120.65 3dnh n SER 226 Ca -0.18 -0.95 0.17 0.00 -0.26 0.00 0.00 58.87 57.66 3dnh n SER 226 Cb 0.56 0.00 0.69 0.00 -0.26 0.00 0.00 64.21 65.20 3dnh n SER 226 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dnh h ALA 227 N 0.58 1.00 0.00 7.33 0.00 -1.97 -3.34 119.26 122.87 3dnh h ALA 227 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3dnh h ALA 227 Cb 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3dnh h ALA 227 CO 0.00 0.01 -0.15 -1.13 0.00 0.00 0.00 179.25 177.98 3dnh n SER 228 N -3.10 0.75 -4.22 0.00 3.41 -1.26 -5.11 113.62 104.10 3dnh n SER 228 Ca 0.01 -0.15 -0.13 0.00 -0.26 0.00 0.00 58.87 58.34 3dnh n SER 228 Cb 0.31 0.45 -0.10 0.00 -0.26 0.00 0.00 64.21 64.61 3dnh n SER 228 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3dnh s ASP 229 N -0.60 0.98 0.11 4.04 2.15 -1.25 -5.07 116.67 117.01 3dnh s ASP 229 Ca 0.00 -1.19 0.07 0.00 0.43 0.00 0.00 52.55 51.85 3dnh s ASP 229 Cb 0.00 0.17 -0.03 0.00 -0.30 0.00 0.00 42.92 42.75 3dnh s ASP 229 CO 0.00 -0.62 -0.17 -0.76 -0.17 0.00 0.00 175.17 173.46 3dnh s LEU 230 N -3.15 2.34 0.05 -1.34 1.43 -1.26 -1.15 118.68 115.60 3dnh s LEU 230 Ca 0.25 -0.72 -0.02 0.00 -1.03 0.00 0.00 54.13 52.61 3dnh s LEU 230 Cb 0.07 -0.67 -0.04 0.00 0.03 0.00 0.00 46.19 45.58 3dnh s LEU 230 CO 0.04 -0.05 -0.01 0.00 0.23 0.00 0.00 176.35 176.56 3dnh s ALA 231 N -1.59 0.43 -0.03 4.21 0.00 -0.75 -4.91 121.76 119.12 3dnh s ALA 231 Ca 0.06 -1.14 -0.01 0.00 0.00 0.00 0.00 51.96 50.87 3dnh s ALA 231 Cb -0.08 0.29 0.03 0.00 0.00 0.00 0.00 23.12 23.36 3dnh s ALA 231 CO 0.04 -0.38 0.04 0.50 0.00 0.00 0.00 175.76 175.96 3dnh s ARG 232 N -3.87 -0.05 -0.25 0.00 3.52 -1.26 -1.53 118.95 115.51 3dnh s ARG 232 Ca 0.06 0.26 -0.16 0.00 -0.13 0.00 0.00 55.73 55.77 3dnh s ARG 232 Cb 0.07 -0.36 -0.04 0.00 -1.56 0.00 0.00 34.95 33.07 3dnh s ARG 232 CO -0.10 -0.23 0.41 -1.17 -0.81 0.00 0.00 175.30 173.40 3dnh s LEU 233 N 1.50 4.06 -0.12 -0.88 2.96 0.43 -4.78 118.68 121.85 3dnh s LEU 233 Ca -0.04 0.39 -0.14 0.00 -0.22 0.00 0.00 54.13 54.12 3dnh s LEU 233 Cb -0.13 -2.50 -0.05 0.00 0.50 0.00 0.00 46.19 44.02 3dnh s LEU 233 CO -0.03 -0.19 0.33 0.26 -1.32 0.00 0.00 176.35 175.41 3dnh s TRP 234 N 1.97 3.53 0.49 5.38 0.52 -1.26 -0.12 118.94 129.46 3dnh s TRP 234 Ca 0.17 0.71 -0.21 0.00 0.02 0.00 0.00 56.10 56.79 3dnh s TRP 234 Cb -0.16 -2.33 -0.07 0.00 -1.15 0.00 0.00 33.47 29.77 3dnh s TRP 234 CO 0.09 0.35 1.13 -0.06 0.02 0.00 0.00 176.95 178.48 3dnh s PHE 235 N 0.06 2.82 0.35 -1.98 0.08 -0.33 -4.94 117.98 114.05 3dnh s PHE 235 Ca 0.19 1.55 0.05 0.00 0.12 0.00 0.00 56.93 58.84 3dnh s PHE 235 Cb -0.14 -3.30 0.66 0.00 -0.57 0.00 0.00 43.02 39.68 3dnh s PHE 235 CO 0.07 -1.42 1.93 0.00 -0.10 0.00 0.00 175.22 175.70 3dnh h ALA 236 N 1.66 1.46 -2.36 5.36 0.00 -1.95 -3.45 119.26 119.98 3dnh h ALA 236 Ca -0.50 -0.15 -0.16 0.00 0.00 0.00 0.00 54.91 54.11 3dnh h ALA 236 Cb 1.25 -0.16 -0.15 0.00 0.00 0.00 0.00 17.79 18.73 3dnh h ALA 236 CO 0.59 0.40 -0.65 -1.21 0.00 0.00 0.00 179.25 178.38 3dnh s GLU 237 N -5.15 0.81 0.43 0.00 2.02 -1.26 -5.14 118.70 110.41 3dnh s GLU 237 Ca -0.08 -1.34 -0.26 0.00 0.02 0.00 0.00 54.97 53.31 3dnh s GLU 237 Cb 0.16 0.23 -0.09 0.00 0.10 0.00 0.00 34.13 34.54 3dnh s GLU 237 CO 0.76 -0.20 1.41 0.50 0.02 0.00 0.00 175.26 177.74 3dnh s ARG 238 N -3.99 3.80 -0.15 1.61 3.52 -1.26 -4.91 118.95 117.57 3dnh s ARG 238 Ca 0.17 2.39 0.02 0.00 -0.13 0.00 0.00 55.73 58.18 3dnh s ARG 238 Cb 0.08 -2.72 0.01 0.00 -1.56 0.00 0.00 34.95 30.75 3dnh s ARG 238 CO -0.03 -0.72 -0.20 0.08 -0.81 0.00 0.00 175.30 173.63 3dnh s VAL 239 N -1.20 2.24 -0.00 7.11 1.01 0.43 -5.00 120.40 124.99 3dnh s VAL 239 Ca 0.59 -0.91 0.00 0.00 0.00 0.00 0.00 61.98 61.66 3dnh s VAL 239 Cb -0.43 -1.92 -0.01 0.00 0.00 0.00 0.00 36.38 34.03 3dnh s VAL 239 CO 0.56 0.54 0.01 -0.62 0.00 0.00 0.00 175.10 175.59 3dnh n GLU 240 N 4.14 0.17 -4.44 2.72 1.02 -1.26 -4.24 120.64 118.75 3dnh n GLU 240 Ca -0.20 -0.00 -0.21 0.00 -0.02 0.00 0.00 57.16 56.73 3dnh n GLU 240 Cb 0.51 -1.00 -0.11 0.00 -0.02 0.00 0.00 31.44 30.83 3dnh n GLU 240 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 3dnh s THR 241 N -2.01 1.17 0.17 2.62 -4.23 -1.26 -2.84 115.64 109.26 3dnh s THR 241 Ca -0.00 -2.01 -0.09 0.00 -1.18 0.00 0.00 61.69 58.41 3dnh s THR 241 Cb 0.00 -2.76 0.01 0.00 1.34 0.00 0.00 72.50 71.09 3dnh s THR 241 CO 0.02 -0.03 1.56 0.25 -0.54 0.00 0.00 174.62 175.88 3dnh h LEU 242 N 2.15 0.97 -0.33 4.79 5.85 -1.93 -2.29 115.31 124.53 3dnh h LEU 242 Ca -0.40 -0.38 -0.00 0.00 0.84 0.00 0.00 57.88 57.94 3dnh h LEU 242 Cb 1.24 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.99 3dnh h LEU 242 CO 0.69 1.16 0.19 0.11 -0.34 0.00 0.00 178.44 180.24 3dnh h LYS 243 N 0.81 0.45 -0.47 1.25 1.79 -1.99 -1.22 116.57 117.19 3dnh h LYS 243 Ca 0.10 -0.05 -0.00 0.00 -2.18 0.00 0.00 60.65 58.52 3dnh h LYS 243 Cb 0.81 -0.09 -0.02 0.00 -1.58 0.00 0.00 32.23 31.35 3dnh h LYS 243 CO 0.07 0.36 0.28 1.96 -1.08 0.00 0.00 179.45 181.04 3dnh h GLN 244 N 0.41 0.63 0.18 3.15 4.20 -1.96 -1.81 115.11 119.90 3dnh h GLN 244 Ca 0.12 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.77 3dnh h GLN 244 Cb 0.03 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 27.68 3dnh h GLN 244 CO -0.02 0.44 -0.09 0.35 -0.67 0.00 0.00 178.83 178.84 3dnh h PHE 245 N 0.64 -0.23 -0.66 2.96 3.57 -0.94 -1.72 116.94 120.56 3dnh h PHE 245 Ca 0.17 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.72 3dnh h PHE 245 Cb -0.02 0.08 -0.05 0.00 2.79 0.00 0.00 35.95 38.74 3dnh h PHE 245 CO 0.00 -0.14 0.37 0.93 -2.23 0.00 0.00 178.31 177.24 3dnh h GLU 246 N -0.24 0.66 -0.17 1.11 5.08 -0.77 -1.44 114.58 118.80 3dnh h GLU 246 Ca -0.02 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.30 3dnh h GLU 246 Cb 0.19 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 3dnh h GLU 246 CO 0.04 0.44 0.10 0.87 -1.00 0.00 0.00 179.01 179.45 3dnh h LYS 247 N 0.68 0.20 -0.64 2.33 1.57 -1.26 -2.57 116.57 116.88 3dnh h LYS 247 Ca 0.30 -0.01 0.04 0.00 -1.87 0.00 0.00 60.65 59.11 3dnh h LYS 247 Cb 0.18 -0.04 -0.05 0.00 0.08 0.00 0.00 32.23 32.40 3dnh h LYS 247 CO -0.18 0.13 0.37 0.00 -0.57 0.00 0.00 179.45 179.20 3dnh h ALA 248 N 1.07 0.84 -0.76 3.86 0.00 -0.67 -1.56 119.26 122.05 3dnh h ALA 248 Ca 0.06 -0.00 0.06 0.00 0.00 0.00 0.00 54.91 55.03 3dnh h ALA 248 Cb -0.01 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.58 3dnh h ALA 248 CO -0.03 0.08 0.50 -0.07 0.00 0.00 0.00 179.25 179.73 3dnh h LEU 249 N 0.71 0.72 -0.79 0.00 4.07 -1.14 -2.56 115.31 116.33 3dnh h LEU 249 Ca 0.27 0.00 -0.13 0.00 0.08 0.00 0.00 57.88 58.11 3dnh h LEU 249 Cb 0.10 -0.15 -0.02 0.00 1.08 0.00 0.00 40.66 41.67 3dnh h LEU 249 CO -0.14 0.47 -0.60 0.00 -1.08 0.00 0.00 178.44 177.09 3dnh h ALA 250 N 1.59 1.00 0.59 1.53 0.00 -0.88 -2.86 119.26 120.23 3dnh h ALA 250 Ca 0.32 -0.55 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 3dnh h ALA 250 Cb 0.22 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 17.92 3dnh h ALA 250 CO -0.11 0.75 -0.28 1.96 0.00 0.00 0.00 179.25 181.57 3dnh h GLN 251 N 0.01 -0.76 0.00 0.00 4.20 -1.28 -3.52 115.11 113.77 3dnh h GLN 251 Ca -0.01 0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.76 3dnh h GLN 251 Cb 1.07 0.17 0.00 0.00 0.30 0.00 0.00 27.48 29.02 3dnh h GLN 251 CO 0.08 -0.51 0.00 1.28 -0.67 0.00 0.00 178.83 179.01