#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x1m n SER 2 N 0.00 6.92 -0.08 1.61 7.64 -1.26 -4.62 113.62 123.83 1x1m n SER 2 Ca 0.00 -3.79 -0.12 0.00 1.01 0.00 0.00 58.87 55.98 1x1m n SER 2 Cb 0.00 -0.83 -0.06 0.00 -1.01 0.00 0.00 64.21 62.31 1x1m n SER 2 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 1x1m h SER 3 N 2.25 0.00 -4.35 6.43 4.64 -2.16 -3.51 113.55 116.85 1x1m h SER 3 Ca 0.53 -0.21 0.00 0.00 -0.47 0.00 0.00 61.79 61.64 1x1m h SER 3 Cb 0.83 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.92 1x1m h SER 3 CO 1.35 1.06 0.00 0.61 -0.87 0.00 0.00 176.83 178.98 1x1m n GLY 4 N 1.54 4.05 2.88 -0.77 0.00 -1.26 -5.12 105.19 106.51 1x1m n GLY 4 Ca -0.17 -1.62 -0.15 0.00 0.00 0.00 0.00 46.02 44.08 1x1m n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x1m s SER 5 N 0.00 0.37 -0.13 1.61 0.15 -1.26 -5.11 113.70 109.33 1x1m s SER 5 Ca 0.00 0.34 0.00 0.00 0.70 0.00 0.00 55.95 56.99 1x1m s SER 5 Cb 0.00 0.27 0.02 0.00 -1.71 0.00 0.00 66.02 64.60 1x1m s SER 5 CO 0.00 -0.21 -0.12 -0.44 1.20 0.00 0.00 173.24 173.67 1x1m s SER 6 N 1.85 2.50 -0.44 5.45 0.01 -1.26 -5.10 113.70 116.70 1x1m s SER 6 Ca -0.02 -0.42 -0.23 0.00 1.31 0.00 0.00 55.95 56.58 1x1m s SER 6 Cb -0.12 -1.07 0.02 0.00 0.21 0.00 0.00 66.02 65.07 1x1m s SER 6 CO -0.06 -0.06 0.80 -0.83 0.41 0.00 0.00 173.24 173.49 1x1m s GLY 7 N 1.48 1.59 0.45 3.44 0.00 -1.26 -5.04 107.32 107.98 1x1m s GLY 7 Ca 0.03 -0.96 -0.21 0.00 0.00 0.00 0.00 44.72 43.59 1x1m s GLY 7 CO -0.09 1.80 0.97 1.06 0.00 0.00 0.00 173.10 176.84 1x1m s MET 8 N 3.32 4.14 0.11 2.90 1.00 -1.26 -5.07 119.30 124.43 1x1m s MET 8 Ca 0.31 1.14 0.10 0.00 0.00 0.00 0.00 55.69 57.24 1x1m s MET 8 Cb -0.12 -2.16 -0.04 0.00 0.00 0.00 0.00 34.83 32.51 1x1m s MET 8 CO 0.23 -0.11 -0.25 0.45 0.00 0.00 0.00 175.02 175.33 1x1m s SER 9 N -2.22 3.09 0.28 3.03 0.15 -1.26 -5.03 113.70 111.74 1x1m s SER 9 Ca 0.63 -0.71 0.11 0.00 0.70 0.00 0.00 55.95 56.68 1x1m s SER 9 Cb -0.10 -0.21 0.37 0.00 -1.71 0.00 0.00 66.02 64.37 1x1m s SER 9 CO 0.15 0.16 1.61 0.17 1.20 0.00 0.00 173.24 176.53 1x1m h LEU 10 N 4.04 0.00 -7.69 3.45 8.10 -2.05 -3.39 115.31 117.76 1x1m h LEU 10 Ca -0.49 0.00 -0.66 0.00 0.11 0.00 0.00 57.88 56.84 1x1m h LEU 10 Cb 1.17 0.00 -0.40 0.00 -0.44 0.00 0.00 40.66 40.99 1x1m h LEU 10 CO 0.40 0.60 -0.71 -0.94 -4.11 0.00 0.00 178.44 173.68 1x1m s SER 11 N -6.79 4.80 -0.14 0.17 1.04 -1.26 -4.95 113.70 106.56 1x1m s SER 11 Ca -0.01 -2.16 0.03 0.00 0.48 0.00 0.00 55.95 54.29 1x1m s SER 11 Cb 0.12 -1.64 0.30 0.00 0.10 0.00 0.00 66.02 64.90 1x1m s SER 11 CO 0.76 -0.39 1.21 -0.67 0.98 0.00 0.00 173.24 175.13 1x1m n ASP 12 N 4.26 3.14 -4.64 7.02 -0.08 -1.26 -4.92 116.55 120.06 1x1m n ASP 12 Ca 0.04 -2.53 -0.42 0.00 -1.51 0.00 0.00 54.79 50.36 1x1m n ASP 12 Cb 0.42 -0.61 -0.03 0.00 2.34 0.00 0.00 41.12 43.24 1x1m n ASP 12 CO 0.00 0.00 0.00 0.86 0.12 0.00 0.00 177.20 178.18 1x1m s TRP 13 N -1.49 1.30 0.06 -0.67 -0.11 -1.26 -4.97 118.94 111.80 1x1m s TRP 13 Ca 0.23 -0.10 0.04 0.00 1.22 0.00 0.00 56.10 57.49 1x1m s TRP 13 Cb 0.18 -4.13 -0.03 0.00 -1.50 0.00 0.00 33.47 28.00 1x1m s TRP 13 CO 0.05 -4.96 -0.13 -3.38 -4.62 0.00 0.00 176.95 163.92 1x1m s HIS 14 N 5.65 1.09 0.10 5.86 -3.43 -1.26 -4.01 115.29 119.29 1x1m s HIS 14 Ca 0.91 -0.45 0.02 0.00 -0.80 0.00 0.00 55.06 54.74 1x1m s HIS 14 Cb -0.39 -0.62 -0.04 0.00 -1.43 0.00 0.00 32.58 30.10 1x1m s HIS 14 CO 0.39 0.02 -0.07 -1.17 -2.00 0.00 0.00 174.74 171.91 1x1m s LEU 15 N -1.63 2.49 0.10 5.38 2.96 0.04 -2.85 118.68 125.18 1x1m s LEU 15 Ca -0.03 -0.97 -0.02 0.00 -0.22 0.00 0.00 54.13 52.89 1x1m s LEU 15 Cb -0.10 -0.13 -0.05 0.00 0.50 0.00 0.00 46.19 46.42 1x1m s LEU 15 CO 0.02 -0.42 0.28 0.00 -1.32 0.00 0.00 176.35 174.91 1x1m s ALA 16 N -3.40 3.92 -0.07 5.97 0.00 -1.10 -0.69 121.76 126.39 1x1m s ALA 16 Ca 0.11 -0.75 0.00 0.00 0.00 0.00 0.00 51.96 51.32 1x1m s ALA 16 Cb 0.04 -1.94 0.02 0.00 0.00 0.00 0.00 23.12 21.24 1x1m s ALA 16 CO -0.04 0.73 -0.06 0.08 0.00 0.00 0.00 175.76 176.48 1x1m s VAL 17 N -1.60 0.74 -0.01 0.00 1.01 -0.33 -3.27 120.40 116.94 1x1m s VAL 17 Ca 0.37 -0.18 0.05 0.00 0.00 0.00 0.00 61.98 62.23 1x1m s VAL 17 Cb -0.12 -0.77 -0.01 0.00 0.00 0.00 0.00 36.38 35.47 1x1m s VAL 17 CO 0.27 0.30 -0.17 -0.54 0.00 0.00 0.00 175.10 174.96 1x1m s LYS 18 N 1.32 1.38 -0.20 2.72 -0.14 -0.36 -1.63 119.74 122.84 1x1m s LYS 18 Ca -0.04 -0.60 -0.21 0.00 -1.36 0.00 0.00 55.97 53.75 1x1m s LYS 18 Cb -0.14 -1.33 -0.02 0.00 -1.68 0.00 0.00 37.83 34.66 1x1m s LYS 18 CO -0.03 0.36 0.66 -1.17 -0.76 0.00 0.00 175.35 174.42 1x1m s LEU 19 N -0.38 4.14 0.45 3.17 2.96 -1.26 -0.09 118.68 127.67 1x1m s LEU 19 Ca 0.06 0.88 0.25 0.00 -0.22 0.00 0.00 54.13 55.10 1x1m s LEU 19 Cb -0.07 -2.95 0.82 0.00 0.50 0.00 0.00 46.19 44.50 1x1m s LEU 19 CO -0.01 -0.30 1.78 0.00 -1.32 0.00 0.00 176.35 176.50 1x1m h ALA 20 N 7.49 0.97 0.06 5.97 0.00 -1.55 -3.07 119.26 129.12 1x1m h ALA 20 Ca -0.31 -0.15 -0.25 0.00 0.00 0.00 0.00 54.91 54.20 1x1m h ALA 20 Cb 1.14 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 1x1m h ALA 20 CO 0.79 0.21 -1.18 -0.44 0.00 0.00 0.00 179.25 178.63 1x1m h ASP 21 N 0.00 0.18 -3.67 0.00 3.32 -1.92 -3.41 116.42 110.92 1x1m h ASP 21 Ca -0.00 -0.21 -0.62 0.00 0.02 0.00 0.00 57.03 56.22 1x1m h ASP 21 Cb 0.81 -0.06 -0.40 0.00 0.22 0.00 0.00 39.33 39.90 1x1m h ASP 21 CO 0.02 1.17 -0.72 -1.10 -1.72 0.00 0.00 179.24 176.89 1x1m s GLN 22 N -2.68 1.41 0.00 3.56 -0.21 -1.16 -4.95 119.66 115.64 1x1m s GLN 22 Ca -0.02 -2.11 0.15 0.00 0.02 0.00 0.00 55.36 53.39 1x1m s GLN 22 Cb 0.09 -2.53 0.70 0.00 1.00 0.00 0.00 33.01 32.27 1x1m s GLN 22 CO 0.85 -1.15 1.42 -0.35 -2.12 0.00 0.00 175.29 173.94 1x1m n PRO 23 N 3.48 0.14 -0.06 2.91 -0.04 -1.23 -2.40 135.00 137.80 1x1m n PRO 23 Ca 0.08 0.18 -0.09 0.00 -0.04 0.00 0.00 63.50 63.63 1x1m n PRO 23 Cb 0.34 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.15 1x1m n PRO 23 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1x1m n LEU 24 N -1.35 0.36 -4.54 1.53 4.77 -1.26 -4.97 117.00 111.53 1x1m n LEU 24 Ca 0.06 0.17 -0.38 0.00 -0.03 0.00 0.00 56.01 55.83 1x1m n LEU 24 Cb 0.13 0.35 0.04 0.00 -2.33 0.00 0.00 43.42 41.62 1x1m n LEU 24 CO 0.12 0.44 0.31 0.00 -1.33 0.00 0.00 177.39 176.92 1x1m n ALA 25 N -2.65 -0.49 -1.77 -1.18 0.00 -1.01 -4.92 120.51 108.49 1x1m n ALA 25 Ca -0.26 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 52.80 1x1m n ALA 25 Cb 1.10 -1.97 -0.02 0.00 0.00 0.00 0.00 19.45 18.56 1x1m n ALA 25 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1x1m s PRO 26 N -2.39 4.00 0.57 0.00 0.04 -1.26 -4.91 135.00 131.05 1x1m s PRO 26 Ca 0.72 1.88 -0.20 0.00 0.04 0.00 0.00 61.00 63.43 1x1m s PRO 26 Cb -0.44 -2.65 -0.04 0.00 0.04 0.00 0.00 34.50 31.41 1x1m s PRO 26 CO 0.51 -0.38 1.27 0.21 0.04 0.00 0.00 177.00 178.65 1x1m s LYS 27 N -2.34 3.07 -0.19 4.56 2.20 -1.26 -4.92 119.74 120.86 1x1m s LYS 27 Ca 0.58 2.00 0.01 0.00 -0.36 0.00 0.00 55.97 58.21 1x1m s LYS 27 Cb -0.31 -2.10 0.03 0.00 -1.51 0.00 0.00 37.83 33.94 1x1m s LYS 27 CO 0.39 -1.17 -0.16 0.45 -0.36 0.00 0.00 175.35 174.50 1x1m s SER 28 N -1.30 3.35 -0.03 1.43 0.15 -0.65 -4.98 113.70 111.67 1x1m s SER 28 Ca 0.74 -0.80 -0.30 0.00 0.70 0.00 0.00 55.95 56.29 1x1m s SER 28 Cb -0.35 -1.41 -0.03 0.00 -1.71 0.00 0.00 66.02 62.53 1x1m s SER 28 CO 0.40 -0.07 1.03 -0.63 1.20 0.00 0.00 173.24 175.16 1x1m s ILE 29 N 1.30 4.72 -0.03 6.45 -1.09 -1.26 -1.18 121.20 130.10 1x1m s ILE 29 Ca 0.01 1.96 0.03 0.00 -2.23 0.00 0.00 60.65 60.43 1x1m s ILE 29 Cb -0.15 -4.26 -0.03 0.00 -1.58 0.00 0.00 42.46 36.45 1x1m s ILE 29 CO -0.10 0.10 -0.11 -0.22 -1.23 0.00 0.00 174.94 173.37 1x1m s LEU 30 N 1.41 2.92 -0.24 2.97 2.96 0.13 -4.98 118.68 123.85 1x1m s LEU 30 Ca 0.52 -0.17 -0.01 0.00 -0.22 0.00 0.00 54.13 54.25 1x1m s LEU 30 Cb -0.21 -1.64 0.07 0.00 0.50 0.00 0.00 46.19 44.91 1x1m s LEU 30 CO 0.25 0.33 0.03 -1.10 -1.32 0.00 0.00 176.35 174.53 1x1m s GLN 31 N -0.97 0.99 0.59 1.98 -0.21 -1.26 -0.78 119.66 120.00 1x1m s GLN 31 Ca 0.13 -0.81 -0.18 0.00 0.02 0.00 0.00 55.36 54.52 1x1m s GLN 31 Cb -0.11 -2.26 -0.04 0.00 1.00 0.00 0.00 33.01 31.60 1x1m s GLN 31 CO 0.03 -0.73 1.12 -0.48 -2.12 0.00 0.00 175.29 173.11 1x1m s LEU 32 N 1.62 3.62 0.76 2.90 0.05 -1.26 -5.02 118.68 121.35 1x1m s LEU 32 Ca 0.01 2.11 -0.11 0.00 0.05 0.00 0.00 54.13 56.18 1x1m s LEU 32 Cb -0.18 -4.57 0.05 0.00 -2.05 0.00 0.00 46.19 39.44 1x1m s LEU 32 CO -0.12 -1.36 1.09 -2.16 -0.55 0.00 0.00 176.35 173.25 1x1m s PRO 33 N -3.59 2.33 0.56 1.48 0.04 -1.26 -4.90 135.00 129.66 1x1m s PRO 33 Ca 0.71 1.20 -0.21 0.00 0.04 0.00 0.00 61.00 62.74 1x1m s PRO 33 Cb -0.22 -1.90 -0.05 0.00 0.04 0.00 0.00 34.50 32.36 1x1m s PRO 33 CO 0.32 -1.59 1.28 -1.91 0.04 0.00 0.00 177.00 175.14 1x1m n GLU 34 N -3.36 1.49 -4.06 4.56 2.13 -1.26 -5.01 120.64 115.12 1x1m n GLU 34 Ca 0.09 0.55 -0.27 0.00 0.66 0.00 0.00 57.16 58.20 1x1m n GLU 34 Cb 0.53 -2.48 -0.05 0.00 0.27 0.00 0.00 31.44 29.70 1x1m n GLU 34 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 1x1m s THR 35 N -1.33 4.59 0.14 6.31 2.01 -1.26 -5.03 115.64 121.08 1x1m s THR 35 Ca 0.73 -0.99 -0.14 0.00 0.31 0.00 0.00 61.69 61.61 1x1m s THR 35 Cb -0.42 -3.33 0.01 0.00 0.01 0.00 0.00 72.50 68.78 1x1m s THR 35 CO 0.48 -0.07 1.63 1.05 -0.69 0.00 0.00 174.62 177.03 1x1m h GLU 36 N 2.52 0.76 -6.31 4.92 4.11 -2.05 -3.44 114.58 115.08 1x1m h GLU 36 Ca -0.48 -0.20 -0.29 0.00 0.07 0.00 0.00 59.36 58.47 1x1m h GLU 36 Cb 1.19 -0.09 0.16 0.00 0.50 0.00 0.00 28.75 30.51 1x1m h GLU 36 CO 0.64 0.77 -0.38 1.28 0.07 0.00 0.00 179.01 181.39 1x1m n LEU 37 N -4.47 -1.33 0.00 3.06 7.99 -1.26 -5.00 117.00 116.00 1x1m n LEU 37 Ca 0.01 -0.43 0.00 0.00 -0.01 0.00 0.00 56.01 55.58 1x1m n LEU 37 Cb 0.24 -0.85 0.00 0.00 -0.11 0.00 0.00 43.42 42.70 1x1m n LEU 37 CO 0.40 -3.47 0.00 0.61 -1.51 0.00 0.00 177.39 173.42 1x1m n GLY 38 N 2.25 -3.16 0.00 -0.72 0.00 -1.26 -4.99 105.19 97.32 1x1m n GLY 38 Ca 0.06 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.70 1x1m n GLY 38 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1x1m n GLU 39 N 0.00 2.30 -0.98 1.61 -0.00 -1.26 -4.90 120.64 117.41 1x1m n GLU 39 Ca 0.00 0.00 -0.35 0.00 -0.00 0.00 0.00 57.16 56.81 1x1m n GLU 39 Cb 0.00 -0.79 0.03 0.00 -0.00 0.00 0.00 31.44 30.68 1x1m n GLU 39 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.13 179.61 1x1m n TYR 40 N -1.40 -4.70 -1.07 -1.84 4.11 -1.26 -4.41 117.16 106.58 1x1m n TYR 40 Ca 0.00 0.02 -0.49 0.00 -0.00 0.00 0.00 57.90 57.43 1x1m n TYR 40 Cb 0.29 -1.39 -0.09 0.00 -0.00 0.00 0.00 39.34 38.15 1x1m n TYR 40 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.86 177.31 1x1m n SER 41 N 3.20 0.67 -0.28 9.48 2.88 -1.26 -4.76 113.62 123.55 1x1m n SER 41 Ca -0.01 0.62 -0.07 0.00 -1.33 0.00 0.00 58.87 58.08 1x1m n SER 41 Cb 0.52 -0.72 -0.07 0.00 -0.75 0.00 0.00 64.21 63.20 1x1m n SER 41 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1x1m n LEU 42 N 5.48 -0.72 -4.20 2.46 4.77 -1.26 -4.70 117.00 118.83 1x1m n LEU 42 Ca 0.40 1.29 -0.36 0.00 -0.03 0.00 0.00 56.01 57.31 1x1m n LEU 42 Cb -0.03 -0.20 -0.07 0.00 -2.33 0.00 0.00 43.42 40.78 1x1m n LEU 42 CO 0.71 -1.02 -0.20 0.61 -1.33 0.00 0.00 177.39 176.16 1x1m n GLY 43 N -1.17 -0.31 0.00 -0.72 0.00 -1.26 -4.59 105.19 97.14 1x1m n GLY 43 Ca 0.01 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1x1m n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x1m n GLY 44 N -1.28 0.02 3.65 -0.02 0.00 -1.26 -4.53 105.19 101.78 1x1m n GLY 44 Ca 0.03 -0.01 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 1x1m n GLY 44 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1x1m n TYR 45 N -0.81 1.86 -3.31 1.61 4.02 -1.26 -4.78 117.16 114.49 1x1m n TYR 45 Ca 0.00 0.61 -0.38 0.00 -0.01 0.00 0.00 57.90 58.12 1x1m n TYR 45 Cb 0.00 -2.35 -0.06 0.00 -0.02 0.00 0.00 39.34 36.91 1x1m n TYR 45 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 1x1m s SER 46 N -0.40 6.74 0.33 7.72 0.01 -1.26 -2.45 113.70 124.39 1x1m s SER 46 Ca 0.57 0.89 0.11 0.00 1.31 0.00 0.00 55.95 58.83 1x1m s SER 46 Cb -0.62 -2.30 1.03 0.00 0.21 0.00 0.00 66.02 64.34 1x1m s SER 46 CO 0.61 0.04 1.54 -0.38 0.41 0.00 0.00 173.24 175.46 1x1m n ILE 47 N 3.37 -0.41 -0.20 1.44 2.08 -0.77 0.33 119.36 125.21 1x1m n ILE 47 Ca -0.08 2.07 -0.02 0.00 0.56 0.00 0.00 62.75 65.28 1x1m n ILE 47 Cb 0.52 -3.19 0.04 0.00 -0.75 0.00 0.00 39.64 36.26 1x1m n ILE 47 CO 0.00 0.00 0.00 0.77 0.56 0.00 0.00 176.55 177.88 1x1m h SER 48 N 0.00 -0.74 -0.32 4.38 4.64 -1.81 -2.27 113.55 117.43 1x1m h SER 48 Ca 0.71 0.19 0.03 0.00 -0.47 0.00 0.00 61.79 62.26 1x1m h SER 48 Cb 1.71 0.43 -0.04 0.00 -0.31 0.00 0.00 62.40 64.19 1x1m h SER 48 CO -0.84 -0.24 -0.25 0.15 -0.87 0.00 0.00 176.83 174.78 1x1m h PHE 49 N -0.06 -0.79 -0.46 4.77 3.57 -0.51 -1.40 116.94 122.05 1x1m h PHE 49 Ca 0.27 0.05 0.08 0.00 3.53 0.00 0.00 57.97 61.90 1x1m h PHE 49 Cb 0.49 0.39 -0.10 0.00 2.79 0.00 0.00 35.95 39.52 1x1m h PHE 49 CO -0.53 -0.18 -0.40 -0.07 -2.23 0.00 0.00 178.31 174.90 1x1m h LEU 50 N -0.08 -1.33 -0.93 0.59 3.38 -1.51 0.59 115.31 116.03 1x1m h LEU 50 Ca 0.05 0.22 0.11 0.00 0.09 0.00 0.00 57.88 58.36 1x1m h LEU 50 Cb 0.21 0.60 -0.02 0.00 0.09 0.00 0.00 40.66 41.55 1x1m h LEU 50 CO -0.34 -0.35 0.89 0.11 0.09 0.00 0.00 178.44 178.84 1x1m h LYS 51 N -0.27 0.00 0.06 1.13 1.57 -0.75 0.57 116.57 118.87 1x1m h LYS 51 Ca 0.16 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.66 1x1m h LYS 51 Cb 0.57 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.85 1x1m h LYS 51 CO -0.60 0.00 -1.54 1.96 -0.57 0.00 0.00 179.45 178.70 1x1m h GLN 52 N 0.00 0.12 -0.56 3.15 4.20 0.71 -3.18 115.11 119.55 1x1m h GLN 52 Ca 0.19 -0.21 0.01 0.00 0.06 0.00 0.00 58.65 58.70 1x1m h GLN 52 Cb 1.97 0.08 -0.03 0.00 0.30 0.00 0.00 27.48 29.80 1x1m h GLN 52 CO -0.00 1.10 0.36 -0.07 -0.67 0.00 0.00 178.83 179.55 1x1m h LEU 53 N -0.54 0.62 0.23 1.46 4.07 0.80 -0.57 115.31 121.38 1x1m h LEU 53 Ca -0.37 -0.01 -0.01 0.00 0.08 0.00 0.00 57.88 57.56 1x1m h LEU 53 Cb 1.61 -0.15 0.00 0.00 1.08 0.00 0.00 40.66 43.21 1x1m h LEU 53 CO -0.08 0.45 -0.11 0.40 -1.08 0.00 0.00 178.44 178.02 1x1m h ILE 54 N 0.74 0.84 -0.17 1.22 5.03 -1.21 -2.05 117.51 121.92 1x1m h ILE 54 Ca 0.21 -0.43 0.05 0.00 -0.12 0.00 0.00 64.86 64.57 1x1m h ILE 54 Cb -0.06 1.09 -0.01 0.00 -3.03 0.00 0.00 36.82 34.81 1x1m h ILE 54 CO -0.06 0.10 0.16 0.00 -0.68 0.00 0.00 178.15 177.67 1x1m h ALA 55 N 0.20 1.89 0.00 1.87 0.00 -1.50 0.23 119.26 121.94 1x1m h ALA 55 Ca -0.03 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.70 1x1m h ALA 55 Cb 0.39 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1x1m h ALA 55 CO 0.05 -0.25 -0.84 0.78 0.00 0.00 0.00 179.25 179.00 1x1m h GLY 56 N 0.00 0.00 0.99 0.00 0.00 -0.78 -2.74 103.07 100.54 1x1m h GLY 56 Ca 0.08 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.10 1x1m h GLY 56 CO -0.00 0.00 -1.71 0.50 0.00 0.00 0.00 176.54 175.33 1x1m h LYS 57 N 0.00 0.16 -0.85 4.80 1.79 -0.37 -3.33 116.57 118.76 1x1m h LYS 57 Ca -0.01 -0.28 -0.26 0.00 -2.18 0.00 0.00 60.65 57.92 1x1m h LYS 57 Cb 1.59 0.10 -0.16 0.00 -1.58 0.00 0.00 32.23 32.19 1x1m h LYS 57 CO 0.11 0.93 0.33 1.28 -1.08 0.00 0.00 179.45 181.02 1x1m n LEU 58 N -3.32 5.75 0.23 2.94 4.77 0.63 -4.53 117.00 123.47 1x1m n LEU 58 Ca -0.21 -3.01 0.09 0.00 -0.03 0.00 0.00 56.01 52.86 1x1m n LEU 58 Cb 1.04 -0.74 0.49 0.00 -2.33 0.00 0.00 43.42 41.89 1x1m n LEU 58 CO 0.46 0.81 0.91 1.56 -1.33 0.00 0.00 177.39 179.80 1x1m h GLN 59 N 1.92 0.00 -0.19 3.23 4.20 -1.60 0.38 115.11 123.04 1x1m h GLN 59 Ca 0.32 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.95 1x1m h GLN 59 Cb 2.27 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 30.04 1x1m h GLN 59 CO 0.73 0.00 -0.26 1.05 -0.67 0.00 0.00 178.83 179.68 1x1m h GLU 60 N 0.00 0.35 0.00 1.46 4.11 -1.88 -3.36 114.58 115.26 1x1m h GLU 60 Ca 0.00 -0.13 -0.12 0.00 0.07 0.00 0.00 59.36 59.18 1x1m h GLU 60 Cb 0.68 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.88 1x1m h GLU 60 CO 0.00 0.60 -1.45 0.43 0.07 0.00 0.00 179.01 178.66 1x1m n SER 61 N -4.13 2.60 -4.64 3.06 7.64 0.94 -4.97 113.62 114.12 1x1m n SER 61 Ca -0.01 -0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.45 1x1m n SER 61 Cb 0.39 -0.16 -0.04 0.00 -1.01 0.00 0.00 64.21 63.40 1x1m n SER 61 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1x1m s VAL 62 N -2.15 4.77 -0.02 0.44 1.01 0.92 -4.96 120.40 120.41 1x1m s VAL 62 Ca -0.11 1.52 -0.25 0.00 0.00 0.00 0.00 61.98 63.14 1x1m s VAL 62 Cb 0.03 -4.18 -0.19 0.00 0.00 0.00 0.00 36.38 32.04 1x1m s VAL 62 CO 0.17 -0.18 1.22 1.55 0.00 0.00 0.00 175.10 177.86 1x1m h PRO 63 N 7.83 -0.06 -3.68 2.72 0.13 -1.86 -3.36 132.00 133.72 1x1m h PRO 63 Ca -0.23 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.75 1x1m h PRO 63 Cb 1.09 0.01 -0.21 0.00 0.13 0.00 0.00 31.00 32.02 1x1m h PRO 63 CO 0.90 0.40 -0.57 -0.51 -0.23 0.00 0.00 178.00 178.00 1x1m s ASP 64 N -5.60 0.10 0.54 1.44 1.11 -1.26 -5.03 116.67 107.97 1x1m s ASP 64 Ca -0.15 -0.31 0.33 0.00 0.18 0.00 0.00 52.55 52.59 1x1m s ASP 64 Cb 0.02 0.17 1.36 0.00 1.07 0.00 0.00 42.92 45.53 1x1m s ASP 64 CO 0.64 -0.35 1.98 1.55 1.18 0.00 0.00 175.17 180.18 1x1m h PRO 65 N 4.41 0.00 0.00 8.23 0.13 -1.88 -2.77 132.00 140.11 1x1m h PRO 65 Ca -0.31 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.66 1x1m h PRO 65 Cb 1.20 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.31 1x1m h PRO 65 CO 0.41 0.04 -0.98 0.93 -0.23 0.00 0.00 178.00 178.16 1x1m h GLU 66 N 0.00 0.00 -0.30 0.86 5.08 -1.96 -3.25 114.58 115.01 1x1m h GLU 66 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1x1m h GLU 66 Cb 0.52 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.77 1x1m h GLU 66 CO 0.00 0.49 0.00 1.28 -1.00 0.00 0.00 179.01 179.78 1x1m n LEU 67 N -3.11 1.48 -4.52 1.33 4.77 -1.05 -4.87 117.00 111.04 1x1m n LEU 67 Ca -0.04 -0.74 -0.25 0.00 -0.03 0.00 0.00 56.01 54.95 1x1m n LEU 67 Cb 0.82 -0.20 -0.08 0.00 -2.33 0.00 0.00 43.42 41.63 1x1m n LEU 67 CO 0.43 0.35 -0.20 0.27 -1.33 0.00 0.00 177.39 176.90 1x1m s ILE 68 N -1.65 0.66 0.03 -0.08 -4.36 -1.22 -0.59 121.20 113.99 1x1m s ILE 68 Ca 0.17 -2.00 -0.15 0.00 -0.26 0.00 0.00 60.65 58.41 1x1m s ILE 68 Cb 0.09 -2.38 0.03 0.00 1.25 0.00 0.00 42.46 41.45 1x1m s ILE 68 CO 0.11 0.00 0.34 1.51 0.24 0.00 0.00 174.94 177.14 1x1m s ASP 69 N -3.60 -0.19 -0.20 4.36 1.47 -0.54 -4.82 116.67 113.14 1x1m s ASP 69 Ca 0.24 -0.05 -0.10 0.00 1.18 0.00 0.00 52.55 53.82 1x1m s ASP 69 Cb 0.03 0.36 -0.05 0.00 -0.34 0.00 0.00 42.92 42.92 1x1m s ASP 69 CO 0.14 -0.58 0.12 -0.22 0.68 0.00 0.00 175.17 175.32 1x1m s LEU 70 N -1.83 4.16 -0.18 2.11 2.96 -1.26 -1.36 118.68 123.28 1x1m s LEU 70 Ca -0.08 0.21 -0.02 0.00 -0.22 0.00 0.00 54.13 54.02 1x1m s LEU 70 Cb -0.02 -2.07 -0.01 0.00 0.50 0.00 0.00 46.19 44.59 1x1m s LEU 70 CO -0.01 0.17 -0.09 -0.63 -1.32 0.00 0.00 176.35 174.48 1x1m s ILE 71 N 0.40 3.15 0.03 6.68 -1.09 -0.50 -0.42 121.20 129.45 1x1m s ILE 71 Ca 0.07 -0.59 0.01 0.00 -2.23 0.00 0.00 60.65 57.91 1x1m s ILE 71 Cb -0.11 -2.38 -0.02 0.00 -1.58 0.00 0.00 42.46 38.36 1x1m s ILE 71 CO -0.01 0.48 -0.05 -0.47 -1.23 0.00 0.00 174.94 173.66 1x1m s TYR 72 N 0.96 0.42 -0.87 3.97 6.14 0.16 -1.83 117.35 126.30 1x1m s TYR 72 Ca -0.01 -0.54 -0.02 0.00 0.64 0.00 0.00 57.07 57.14 1x1m s TYR 72 Cb -0.15 -0.28 0.01 0.00 0.42 0.00 0.00 41.96 41.97 1x1m s TYR 72 CO -0.00 -0.16 0.08 0.00 0.64 0.00 0.00 175.55 176.10 1x1m n GLY 74 N -0.80 0.13 3.43 0.00 0.00 -1.26 -5.01 105.19 101.68 1x1m n GLY 74 Ca -0.09 -0.46 -0.12 0.00 0.00 0.00 0.00 46.02 45.34 1x1m n GLY 74 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1x1m s ARG 75 N -4.27 0.59 0.68 1.61 1.70 0.24 -5.16 118.95 114.35 1x1m s ARG 75 Ca 0.00 0.80 -0.17 0.00 -0.47 0.00 0.00 55.73 55.90 1x1m s ARG 75 Cb 0.00 0.23 0.01 0.00 -0.57 0.00 0.00 34.95 34.62 1x1m s ARG 75 CO 0.00 -0.10 1.24 0.21 -1.08 0.00 0.00 175.30 175.58 1x1m s LYS 76 N 0.62 2.38 -0.27 3.89 2.20 -1.26 -0.67 119.74 126.63 1x1m s LYS 76 Ca -0.03 1.89 -0.03 0.00 -0.36 0.00 0.00 55.97 57.45 1x1m s LYS 76 Cb -0.05 -1.85 0.03 0.00 -1.51 0.00 0.00 37.83 34.45 1x1m s LYS 76 CO -0.04 -1.69 -0.02 -0.51 -0.36 0.00 0.00 175.35 172.74 1x1m s LEU 77 N -4.73 3.46 0.75 5.43 1.43 0.44 -4.82 118.68 120.65 1x1m s LEU 77 Ca 0.78 -0.90 -0.14 0.00 -1.03 0.00 0.00 54.13 52.85 1x1m s LEU 77 Cb -0.33 -1.72 0.05 0.00 0.03 0.00 0.00 46.19 44.22 1x1m s LEU 77 CO 0.42 -0.17 1.17 -0.54 0.23 0.00 0.00 176.35 177.46 1x1m s LYS 78 N 1.36 2.09 -0.13 1.70 -0.14 -1.26 -4.56 119.74 118.80 1x1m s LYS 78 Ca -0.00 1.60 0.02 0.00 -1.36 0.00 0.00 55.97 56.23 1x1m s LYS 78 Cb -0.17 -1.84 0.23 0.00 -1.68 0.00 0.00 37.83 34.37 1x1m s LYS 78 CO -0.02 -1.84 1.21 -0.40 -0.76 0.00 0.00 175.35 173.54 1x1m n ASP 79 N -2.99 3.08 0.00 2.83 5.75 -1.26 -3.38 116.55 120.59 1x1m n ASP 79 Ca 0.12 -2.48 0.00 0.00 -0.01 0.00 0.00 54.79 52.42 1x1m n ASP 79 Cb 0.51 -0.60 0.00 0.00 -1.03 0.00 0.00 41.12 40.00 1x1m n ASP 79 CO 0.00 0.00 0.00 -0.67 -0.11 0.00 0.00 177.20 176.42 1x1m n ASP 80 N 0.02 1.21 -4.20 -1.12 -0.08 -1.26 -4.41 116.55 106.71 1x1m n ASP 80 Ca 0.17 -1.52 -0.24 0.00 -1.51 0.00 0.00 54.79 51.69 1x1m n ASP 80 Cb 0.81 0.00 -0.03 0.00 2.34 0.00 0.00 41.12 44.24 1x1m n ASP 80 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1x1m n GLN 81 N -0.26 0.94 -4.43 -0.67 1.13 -1.22 -5.01 117.38 107.85 1x1m n GLN 81 Ca 0.00 -2.88 -0.21 0.00 -1.94 0.00 0.00 57.00 51.96 1x1m n GLN 81 Cb 0.27 0.58 -0.10 0.00 0.11 0.00 0.00 30.24 31.10 1x1m n GLN 81 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1x1m s THR 82 N -2.35 0.88 0.35 5.09 -4.23 -1.26 -1.84 115.64 112.28 1x1m s THR 82 Ca 0.11 -2.00 0.05 0.00 -1.18 0.00 0.00 61.69 58.67 1x1m s THR 82 Cb -0.01 -2.64 0.29 0.00 1.34 0.00 0.00 72.50 71.48 1x1m s THR 82 CO 0.07 0.00 1.95 -0.07 -0.54 0.00 0.00 174.62 176.03 1x1m h LEU 83 N 2.09 0.71 -0.24 4.79 -0.00 -1.78 -2.10 115.31 118.77 1x1m h LEU 83 Ca -0.39 0.00 -0.12 0.00 -0.00 0.00 0.00 57.88 57.38 1x1m h LEU 83 Cb 1.25 -0.15 -0.00 0.00 -0.00 0.00 0.00 40.66 41.76 1x1m h LEU 83 CO 0.64 0.46 -0.32 -0.78 -0.00 0.00 0.00 178.44 178.44 1x1m h ASP 84 N 0.81 0.70 -0.75 -0.43 1.82 -1.83 0.38 116.42 117.12 1x1m h ASP 84 Ca 0.32 -0.50 0.12 0.00 -0.39 0.00 0.00 57.03 56.58 1x1m h ASP 84 Cb 0.23 -0.20 -0.13 0.00 0.68 0.00 0.00 39.33 39.91 1x1m h ASP 84 CO -0.11 1.06 -0.37 -0.26 -1.61 0.00 0.00 179.24 177.96 1x1m h PHE 85 N 0.35 -1.03 0.00 0.28 -1.00 -1.73 -0.81 116.94 113.00 1x1m h PHE 85 Ca 0.03 0.09 -0.22 0.00 2.81 0.00 0.00 57.97 60.68 1x1m h PHE 85 Cb 0.90 0.56 -0.03 0.00 3.61 0.00 0.00 35.95 40.99 1x1m h PHE 85 CO 0.08 -0.39 -1.25 1.88 -1.61 0.00 0.00 178.31 177.02 1x1m h TYR 86 N -0.11 0.00 0.00 -0.55 0.05 -1.59 -3.48 116.97 111.29 1x1m h TYR 86 Ca 0.27 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.05 1x1m h TYR 86 Cb 0.57 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.31 1x1m h TYR 86 CO -0.74 0.85 0.00 0.41 -1.05 0.00 0.00 178.16 177.63 1x1m n GLY 87 N 1.41 0.97 3.73 3.88 0.00 0.73 -5.05 105.19 110.86 1x1m n GLY 87 Ca -0.07 -0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.48 1x1m n GLY 87 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1x1m s ILE 88 N -2.00 2.02 0.27 -0.61 1.01 0.99 -4.94 121.20 117.94 1x1m s ILE 88 Ca 0.00 0.02 0.12 0.00 0.00 0.00 0.00 60.65 60.78 1x1m s ILE 88 Cb 0.00 -3.01 -0.05 0.00 0.01 0.00 0.00 42.46 39.41 1x1m s ILE 88 CO 0.00 0.00 -0.19 -1.10 0.00 0.00 0.00 174.94 173.65 1x1m s GLN 89 N 0.44 1.70 -0.90 2.79 -0.21 -1.26 -4.68 119.66 117.54 1x1m s GLN 89 Ca 0.70 -1.72 -0.25 0.00 0.02 0.00 0.00 55.36 54.12 1x1m s GLN 89 Cb -0.49 -1.81 -0.05 0.00 1.00 0.00 0.00 33.01 31.67 1x1m s GLN 89 CO 0.39 0.34 1.95 -1.25 -2.12 0.00 0.00 175.29 174.60 1x1m s PRO 90 N -3.41 2.56 0.00 2.91 0.04 -1.26 -2.72 135.00 133.12 1x1m s PRO 90 Ca 0.29 -0.28 0.00 0.00 0.04 0.00 0.00 61.00 61.05 1x1m s PRO 90 Cb -0.05 -5.05 0.00 0.00 0.04 0.00 0.00 34.50 29.43 1x1m s PRO 90 CO 0.15 -3.37 0.00 0.41 0.04 0.00 0.00 177.00 174.23 1x1m n GLY 91 N 6.84 0.17 2.40 0.56 0.00 -1.13 -4.76 105.19 109.27 1x1m n GLY 91 Ca 0.40 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.21 1x1m n GLY 91 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1x1m n SER 92 N 0.00 -1.76 -3.77 1.61 7.64 -1.10 -4.74 113.62 111.51 1x1m n SER 92 Ca 0.00 -0.96 -0.25 0.00 1.01 0.00 0.00 58.87 58.68 1x1m n SER 92 Cb 0.00 -0.69 -0.17 0.00 -1.01 0.00 0.00 64.21 62.34 1x1m n SER 92 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1x1m s THR 93 N -2.36 0.46 0.19 0.44 2.01 -1.26 -2.70 115.64 112.41 1x1m s THR 93 Ca 0.49 -0.12 0.04 0.00 0.31 0.00 0.00 61.69 62.41 1x1m s THR 93 Cb -0.05 -0.72 -0.03 0.00 0.01 0.00 0.00 72.50 71.70 1x1m s THR 93 CO 0.37 0.11 0.26 0.68 -0.69 0.00 0.00 174.62 175.35 1x1m s VAL 94 N 1.92 4.99 -0.11 3.82 -7.23 -1.20 -4.87 120.40 117.72 1x1m s VAL 94 Ca 0.03 -0.95 0.02 0.00 -1.81 0.00 0.00 61.98 59.26 1x1m s VAL 94 Cb -0.14 -3.62 -0.01 0.00 0.56 0.00 0.00 36.38 33.17 1x1m s VAL 94 CO -0.06 -0.19 -0.17 -1.00 -0.31 0.00 0.00 175.10 173.37 1x1m s HIS 95 N -1.86 2.71 0.26 2.82 3.76 -0.76 -1.22 115.29 121.00 1x1m s HIS 95 Ca 0.33 -0.67 -0.19 0.00 -0.15 0.00 0.00 55.06 54.38 1x1m s HIS 95 Cb -0.10 -1.77 -0.09 0.00 1.11 0.00 0.00 32.58 31.74 1x1m s HIS 95 CO 0.27 -0.20 0.76 0.08 -0.85 0.00 0.00 174.74 174.79 1x1m s VAL 96 N 0.16 4.55 -0.00 -0.90 1.01 0.87 -1.41 120.40 124.67 1x1m s VAL 96 Ca -0.09 1.28 0.05 0.00 0.00 0.00 0.00 61.98 63.22 1x1m s VAL 96 Cb -0.15 -3.82 -0.01 0.00 0.00 0.00 0.00 36.38 32.39 1x1m s VAL 96 CO 0.06 0.11 -0.15 -0.22 0.00 0.00 0.00 175.10 174.90 1x1m s LEU 97 N -2.20 2.05 -0.55 3.92 1.98 -0.46 -1.40 118.68 122.01 1x1m s LEU 97 Ca 0.46 -0.30 -0.11 0.00 -2.89 0.00 0.00 54.13 51.29 1x1m s LEU 97 Cb -0.15 -0.75 0.14 0.00 0.66 0.00 0.00 46.19 46.08 1x1m s LEU 97 CO 0.20 0.16 0.46 -0.13 -1.89 0.00 0.00 176.35 175.16 1x1m s ARG 98 N -0.48 2.79 0.16 1.98 1.81 -1.26 -1.47 118.95 122.48 1x1m s ARG 98 Ca 0.05 -1.91 -0.30 0.00 -1.72 0.00 0.00 55.73 51.85 1x1m s ARG 98 Cb -0.06 -4.09 -0.18 0.00 -0.45 0.00 0.00 34.95 30.17 1x1m s ARG 98 CO -0.00 -1.25 0.63 1.63 -0.68 0.00 0.00 175.30 175.63 1x1m n LYS 99 N 4.77 0.00 -3.72 3.54 5.02 0.24 -4.91 118.16 123.10 1x1m n LYS 99 Ca -0.05 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.87 1x1m n LYS 99 Cb 0.41 -1.10 -0.10 0.00 -0.02 0.00 0.00 35.03 34.22 1x1m n LYS 99 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1x1m s SER 100 N -0.79 5.33 -0.06 4.39 0.01 -1.26 -4.94 113.70 116.38 1x1m s SER 100 Ca 0.69 -2.35 -0.14 0.00 1.31 0.00 0.00 55.95 55.47 1x1m s SER 100 Cb -1.00 -1.87 0.03 0.00 0.21 0.00 0.00 66.02 63.39 1x1m s SER 100 CO 0.56 -0.50 0.32 0.86 0.41 0.00 0.00 173.24 174.89 1x1m s TRP 101 N 0.69 -0.25 0.00 2.43 -0.00 -1.26 -5.09 118.94 115.46 1x1m s TRP 101 Ca 0.11 0.50 0.00 0.00 -0.00 0.00 0.00 56.10 56.71 1x1m s TRP 101 Cb -0.22 0.11 0.00 0.00 -0.00 0.00 0.00 33.47 33.36 1x1m s TRP 101 CO -0.04 -0.31 0.77 0.43 -0.00 0.00 0.00 176.95 177.81 1x1m n SER 102 N 1.88 0.00 0.00 5.86 7.64 -1.26 -4.96 113.62 122.77 1x1m n SER 102 Ca -0.18 0.77 0.00 0.00 1.01 0.00 0.00 58.87 60.47 1x1m n SER 102 Cb 0.57 -0.27 0.00 0.00 -1.01 0.00 0.00 64.21 63.49 1x1m n SER 102 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x1m n GLY 103 N -0.98 0.65 0.00 0.23 0.00 -1.26 -4.96 105.19 98.87 1x1m n GLY 103 Ca 0.00 -0.65 0.06 0.00 0.00 0.00 0.00 46.02 45.43 1x1m n GLY 103 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x1m n PRO 104 N 0.00 0.49 -0.20 1.61 -0.04 -1.26 -3.78 135.00 131.82 1x1m n PRO 104 Ca 0.00 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.45 1x1m n PRO 104 Cb 0.00 -1.36 0.06 0.00 -0.04 0.00 0.00 33.50 32.16 1x1m n PRO 104 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1x1m h SER 105 N 0.00 -0.54 -3.58 3.54 0.02 -2.01 -3.38 113.55 107.59 1x1m h SER 105 Ca 0.00 0.18 -0.62 0.00 -0.84 0.00 0.00 61.79 60.51 1x1m h SER 105 Cb 0.00 0.37 -0.32 0.00 0.14 0.00 0.00 62.40 62.58 1x1m h SER 105 CO 0.00 -0.19 -0.86 -0.94 -1.14 0.00 0.00 176.83 173.70 1x1m s SER 106 N -5.23 2.61 0.00 3.07 1.04 -1.25 -5.34 113.70 108.60 1x1m s SER 106 Ca -0.14 -0.45 0.00 0.00 0.48 0.00 0.00 55.95 55.84 1x1m s SER 106 Cb 0.19 -1.02 0.00 0.00 0.10 0.00 0.00 66.02 65.28 1x1m s SER 106 CO 0.73 0.14 0.00 0.61 0.98 0.00 0.00 173.24 175.71