#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 -3.85 -4.88 1.61 7.64 -1.26 -4.95 113.62 107.94 1x1m n SER 2 Ca 0.00 -0.82 -0.30 0.00 1.01 0.00 0.00 58.87 58.75 1x1m n SER 2 Cb 0.00 -3.74 0.02 0.00 -1.01 0.00 0.00 64.21 59.48 1x1m n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1x1m s SER 3 N -3.53 5.94 0.00 6.43 0.01 -1.26 -4.93 113.70 116.36 1x1m s SER 3 Ca 0.54 1.28 0.00 0.00 1.31 0.00 0.00 55.95 59.08 1x1m s SER 3 Cb -0.27 -2.25 0.00 0.00 0.21 0.00 0.00 66.02 63.71 1x1m s SER 3 CO 0.84 -1.03 0.00 0.61 0.41 0.00 0.00 173.24 174.07 1x1m n GLY 4 N -2.82 0.00 3.32 3.44 0.00 -1.26 -5.15 105.19 102.72 1x1m n GLY 4 Ca 0.06 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.73 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 4.25 0.23 1.61 0.15 -1.26 -5.11 113.70 113.57 1x1m s SER 5 Ca 0.00 -0.38 0.05 0.00 0.70 0.00 0.00 55.95 56.32 1x1m s SER 5 Cb 0.00 -1.72 -0.03 0.00 -1.71 0.00 0.00 66.02 62.56 1x1m s SER 5 CO 0.00 0.01 0.28 -0.44 1.20 0.00 0.00 173.24 174.29 1x1m s SER 6 N 1.31 6.00 0.00 5.45 0.01 -1.26 -5.04 113.70 120.17 1x1m s SER 6 Ca 0.04 -0.04 0.00 0.00 1.31 0.00 0.00 55.95 57.26 1x1m s SER 6 Cb -0.14 -1.68 0.00 0.00 0.21 0.00 0.00 66.02 64.40 1x1m s SER 6 CO -0.03 -0.03 0.00 0.61 0.41 0.00 0.00 173.24 174.20 1x1m n GLY 7 N -1.15 -1.24 3.32 3.44 0.00 -1.26 -5.10 105.19 103.21 1x1m n GLY 7 Ca -0.08 0.62 -0.47 0.00 0.00 0.00 0.00 46.02 46.09 1x1m n GLY 7 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1x1m s MET 8 N 0.00 3.55 -0.13 1.61 1.75 -1.26 -5.00 119.30 119.82 1x1m s MET 8 Ca 0.00 -2.43 -0.11 0.00 -1.25 0.00 0.00 55.69 51.90 1x1m s MET 8 Cb 0.00 -4.41 0.03 0.00 2.84 0.00 0.00 34.83 33.30 1x1m s MET 8 CO 0.00 -1.29 0.33 -1.12 -0.65 0.00 0.00 175.02 172.29 1x1m s SER 9 N 2.21 -0.35 -0.28 1.11 0.01 -1.26 -5.14 113.70 110.00 1x1m s SER 9 Ca 0.17 0.67 -0.02 0.00 1.31 0.00 0.00 55.95 58.08 1x1m s SER 9 Cb -0.11 0.67 0.03 0.00 0.21 0.00 0.00 66.02 66.82 1x1m s SER 9 CO -0.08 -0.12 -0.02 -0.76 0.41 0.00 0.00 173.24 172.67 1x1m s LEU 10 N 0.27 3.57 0.51 2.44 1.43 -1.26 -5.11 118.68 120.53 1x1m s LEU 10 Ca -0.01 -1.03 -0.05 0.00 -1.03 0.00 0.00 54.13 52.01 1x1m s LEU 10 Cb -0.03 -1.71 -0.02 0.00 0.03 0.00 0.00 46.19 44.47 1x1m s LEU 10 CO -0.00 -0.19 0.80 -0.55 0.23 0.00 0.00 176.35 176.63 1x1m s SER 11 N 1.31 6.00 -0.15 2.29 0.15 -1.26 -5.03 113.70 117.02 1x1m s SER 11 Ca -0.02 0.77 -0.14 0.00 0.70 0.00 0.00 55.95 57.26 1x1m s SER 11 Cb -0.18 -1.99 -0.24 0.00 -1.71 0.00 0.00 66.02 61.90 1x1m s SER 11 CO -0.02 -0.73 0.35 -0.78 1.20 0.00 0.00 173.24 173.25 1x1m h ASP 12 N 0.14 0.26 -3.16 5.45 1.82 -1.99 -3.45 116.42 115.48 1x1m h ASP 12 Ca -0.46 -0.78 -0.58 0.00 -0.39 0.00 0.00 57.03 54.82 1x1m h ASP 12 Cb 1.23 -0.09 -0.06 0.00 0.68 0.00 0.00 39.33 41.09 1x1m h ASP 12 CO 0.61 1.69 0.67 0.86 -1.61 0.00 0.00 179.24 181.46 1x1m s TRP 13 N -2.47 3.37 -0.04 0.28 -0.11 -1.26 -5.03 118.94 113.67 1x1m s TRP 13 Ca -0.24 1.41 0.02 0.00 1.22 0.00 0.00 56.10 58.51 1x1m s TRP 13 Cb 0.06 -3.20 0.01 0.00 -1.50 0.00 0.00 33.47 28.84 1x1m s TRP 13 CO 0.71 -0.41 -0.10 -3.38 -4.62 0.00 0.00 176.95 169.15 1x1m s HIS 14 N 2.87 1.06 0.21 5.86 -3.43 -1.26 -4.03 115.29 116.57 1x1m s HIS 14 Ca 0.43 -0.30 0.11 0.00 -0.80 0.00 0.00 55.06 54.50 1x1m s HIS 14 Cb -0.16 -0.78 -0.05 0.00 -1.43 0.00 0.00 32.58 30.17 1x1m s HIS 14 CO 0.09 -0.15 -0.22 -1.17 -2.00 0.00 0.00 174.74 171.29 1x1m s LEU 15 N 0.36 2.51 -0.11 5.38 2.96 -0.56 -2.96 118.68 126.25 1x1m s LEU 15 Ca -0.06 -0.88 -0.09 0.00 -0.22 0.00 0.00 54.13 52.88 1x1m s LEU 15 Cb -0.11 -1.20 -0.04 0.00 0.50 0.00 0.00 46.19 45.34 1x1m s LEU 15 CO 0.01 0.10 0.19 0.00 -1.32 0.00 0.00 176.35 175.34 1x1m s ALA 16 N -1.84 3.81 0.06 5.97 0.00 -0.41 -1.19 121.76 128.17 1x1m s ALA 16 Ca 0.23 -0.56 0.08 0.00 0.00 0.00 0.00 51.96 51.71 1x1m s ALA 16 Cb -0.07 -2.09 -0.03 0.00 0.00 0.00 0.00 23.12 20.93 1x1m s ALA 16 CO 0.11 0.52 -0.21 0.08 0.00 0.00 0.00 175.76 176.26 1x1m s VAL 17 N -0.80 1.72 -0.11 0.00 1.01 -1.02 -1.62 120.40 119.57 1x1m s VAL 17 Ca 0.16 -1.31 -0.06 0.00 0.00 0.00 0.00 61.98 60.77 1x1m s VAL 17 Cb -0.13 -1.51 0.05 0.00 0.00 0.00 0.00 36.38 34.79 1x1m s VAL 17 CO 0.05 0.15 0.27 -0.54 0.00 0.00 0.00 175.10 175.02 1x1m s LYS 18 N -1.39 0.24 -0.56 2.72 -0.14 -0.54 -2.38 119.74 117.69 1x1m s LYS 18 Ca 0.08 0.55 -0.28 0.00 -1.36 0.00 0.00 55.97 54.95 1x1m s LYS 18 Cb -0.09 -0.08 0.02 0.00 -1.68 0.00 0.00 37.83 36.00 1x1m s LYS 18 CO 0.03 -0.15 1.28 -1.17 -0.76 0.00 0.00 175.35 174.58 1x1m s LEU 19 N 1.17 3.44 0.34 3.17 2.96 -1.26 -2.88 118.68 125.62 1x1m s LEU 19 Ca -0.08 0.21 0.05 0.00 -0.22 0.00 0.00 54.13 54.09 1x1m s LEU 19 Cb -0.09 -3.16 0.70 0.00 0.50 0.00 0.00 46.19 44.14 1x1m s LEU 19 CO -0.08 -1.56 1.93 0.00 -1.32 0.00 0.00 176.35 175.32 1x1m h ALA 20 N 10.13 1.68 -0.71 5.97 0.00 -1.87 -1.10 119.26 133.36 1x1m h ALA 20 Ca -0.26 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 1x1m h ALA 20 Cb 1.07 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.63 1x1m h ALA 20 CO 1.18 0.18 0.41 -0.44 0.00 0.00 0.00 179.25 180.58 1x1m h ASP 21 N 0.82 0.85 -3.83 0.00 5.19 -1.90 -3.35 116.42 114.19 1x1m h ASP 21 Ca 0.36 -0.05 -0.64 0.00 -0.62 0.00 0.00 57.03 56.08 1x1m h ASP 21 Cb 0.33 -0.22 -0.40 0.00 0.18 0.00 0.00 39.33 39.23 1x1m h ASP 21 CO -0.14 0.67 -0.70 -1.10 -3.12 0.00 0.00 179.24 174.86 1x1m s GLN 22 N -5.70 1.53 0.09 3.56 -0.21 -0.42 -4.95 119.66 113.57 1x1m s GLN 22 Ca -0.11 -2.05 0.17 0.00 0.02 0.00 0.00 55.36 53.40 1x1m s GLN 22 Cb 0.17 -2.99 0.74 0.00 1.00 0.00 0.00 33.01 31.93 1x1m s GLN 22 CO 0.79 -1.03 1.54 -0.35 -2.12 0.00 0.00 175.29 174.12 1x1m n PRO 23 N 3.85 0.07 0.00 2.91 -0.04 -1.23 -2.65 135.00 137.91 1x1m n PRO 23 Ca 0.04 0.31 -0.16 0.00 -0.04 0.00 0.00 63.50 63.66 1x1m n PRO 23 Cb 0.38 -1.63 -0.14 0.00 -0.04 0.00 0.00 33.50 32.07 1x1m n PRO 23 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1x1m h LEU 24 N 0.00 0.24 -9.48 1.53 3.38 -1.92 -3.48 115.31 105.58 1x1m h LEU 24 Ca 0.00 -0.52 -0.59 0.00 0.09 0.00 0.00 57.88 56.87 1x1m h LEU 24 Cb 0.28 -0.08 0.16 0.00 0.09 0.00 0.00 40.66 41.12 1x1m h LEU 24 CO 0.00 1.46 -0.34 0.00 0.09 0.00 0.00 178.44 179.65 1x1m n ALA 25 N -2.77 -1.08 -1.15 1.53 0.00 -1.08 -4.96 120.51 111.00 1x1m n ALA 25 Ca -0.24 0.04 -0.29 0.00 0.00 0.00 0.00 53.44 52.96 1x1m n ALA 25 Cb 1.05 -1.84 0.19 0.00 0.00 0.00 0.00 19.45 18.85 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 -1.98 0.12 0.24 0.00 0.04 -1.26 -4.87 135.00 127.29 1x1m s PRO 26 Ca 0.67 0.42 -0.17 0.00 0.04 0.00 0.00 61.00 61.96 1x1m s PRO 26 Cb -0.49 -1.71 -0.08 0.00 0.04 0.00 0.00 34.50 32.26 1x1m s PRO 26 CO 0.55 -2.92 0.69 0.21 0.04 0.00 0.00 177.00 175.57 1x1m s LYS 27 N -5.02 4.12 -0.27 4.56 2.20 -1.26 -4.74 119.74 119.33 1x1m s LYS 27 Ca 0.66 0.73 0.02 0.00 -0.36 0.00 0.00 55.97 57.02 1x1m s LYS 27 Cb -0.18 -2.76 0.07 0.00 -1.51 0.00 0.00 37.83 33.46 1x1m s LYS 27 CO 0.58 0.34 -0.05 -1.12 -0.36 0.00 0.00 175.35 174.73 1x1m s SER 28 N -1.86 4.33 -0.07 1.43 0.01 -1.00 -4.98 113.70 111.55 1x1m s SER 28 Ca 0.45 -1.50 -0.30 0.00 1.31 0.00 0.00 55.95 55.91 1x1m s SER 28 Cb -0.14 -1.43 -0.03 0.00 0.21 0.00 0.00 66.02 64.62 1x1m s SER 28 CO 0.20 -0.25 1.29 -0.63 0.41 0.00 0.00 173.24 174.25 1x1m s ILE 29 N 1.16 4.11 -0.02 1.44 -1.09 -1.26 -2.44 121.20 123.10 1x1m s ILE 29 Ca -0.03 1.42 -0.02 0.00 -2.23 0.00 0.00 60.65 59.79 1x1m s ILE 29 Cb -0.19 -3.91 -0.04 0.00 -1.58 0.00 0.00 42.46 36.74 1x1m s ILE 29 CO -0.07 -0.04 0.11 -0.22 -1.23 0.00 0.00 174.94 173.49 1x1m s LEU 30 N 2.70 4.06 -0.33 2.97 2.96 -0.33 -4.95 118.68 125.75 1x1m s LEU 30 Ca 0.58 0.23 0.01 0.00 -0.22 0.00 0.00 54.13 54.74 1x1m s LEU 30 Cb -0.26 -2.32 0.10 0.00 0.50 0.00 0.00 46.19 44.21 1x1m s LEU 30 CO 0.21 0.29 0.08 -1.10 -1.32 0.00 0.00 176.35 174.51 1x1m s GLN 31 N -1.68 1.07 0.57 1.98 -0.21 -1.26 -1.50 119.66 118.63 1x1m s GLN 31 Ca 0.23 -1.45 -0.17 0.00 0.02 0.00 0.00 55.36 53.98 1x1m s GLN 31 Cb -0.12 -2.54 -0.04 0.00 1.00 0.00 0.00 33.01 31.30 1x1m s GLN 31 CO 0.14 -0.97 1.08 -0.48 -2.12 0.00 0.00 175.29 172.94 1x1m s LEU 32 N 1.27 3.61 1.11 2.90 0.05 -1.26 -5.03 118.68 121.32 1x1m s LEU 32 Ca 0.11 1.96 -0.16 0.00 0.05 0.00 0.00 54.13 56.09 1x1m s LEU 32 Cb -0.18 -4.55 0.24 0.00 -2.05 0.00 0.00 46.19 39.65 1x1m s LEU 32 CO -0.17 -1.18 1.10 -2.16 -0.55 0.00 0.00 176.35 173.39 1x1m s PRO 33 N -3.71 -0.46 0.52 1.48 0.04 -1.26 -4.83 135.00 126.77 1x1m s PRO 33 Ca 0.67 0.21 -0.12 0.00 0.04 0.00 0.00 61.00 61.81 1x1m s PRO 33 Cb -0.19 -1.66 -0.06 0.00 0.04 0.00 0.00 34.50 32.64 1x1m s PRO 33 CO 0.32 -3.26 0.92 -2.00 0.04 0.00 0.00 177.00 173.01 1x1m s GLU 34 N -5.18 3.73 0.34 4.56 2.12 -1.26 -5.07 118.70 117.94 1x1m s GLU 34 Ca 0.68 0.65 0.05 0.00 0.36 0.00 0.00 54.97 56.72 1x1m s GLU 34 Cb -0.14 -2.21 -0.07 0.00 0.26 0.00 0.00 34.13 31.97 1x1m s GLU 34 CO 0.57 -0.30 0.03 -0.08 -0.54 0.00 0.00 175.26 174.94 1x1m s THR 35 N -2.77 1.43 0.25 -1.70 -1.32 -1.26 -5.03 115.64 105.24 1x1m s THR 35 Ca 0.54 -2.01 -0.04 0.00 -1.21 0.00 0.00 61.69 58.96 1x1m s THR 35 Cb -0.10 -2.81 0.22 0.00 -1.51 0.00 0.00 72.50 68.30 1x1m s THR 35 CO 0.41 -0.03 1.84 1.05 -2.21 0.00 0.00 174.62 175.68 1x1m h GLU 36 N 2.05 0.90 0.16 7.08 4.11 -1.98 -2.56 114.58 124.34 1x1m h GLU 36 Ca -0.41 -0.05 -0.01 0.00 0.07 0.00 0.00 59.36 58.95 1x1m h GLU 36 Cb 1.24 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.29 1x1m h GLU 36 CO 0.72 0.59 -0.08 -0.07 0.07 0.00 0.00 179.01 180.25 1x1m h LEU 37 N 0.92 -0.18 0.00 3.06 -0.00 -1.90 -3.49 115.31 113.72 1x1m h LEU 37 Ca 0.40 -0.07 0.00 0.00 -0.00 0.00 0.00 57.88 58.21 1x1m h LEU 37 Cb 0.26 0.05 0.00 0.00 -0.00 0.00 0.00 40.66 40.97 1x1m h LEU 37 CO -0.21 -0.04 0.00 0.61 -0.00 0.00 0.00 178.44 178.80 1x1m n GLY 38 N -0.93 0.63 0.02 0.83 0.00 -0.97 -4.93 105.19 99.85 1x1m n GLY 38 Ca -0.09 -1.51 -0.02 0.00 0.00 0.00 0.00 46.02 44.40 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 1.00 0.11 1.61 0.28 -1.26 -4.01 120.64 118.37 1x1m n GLU 39 Ca 0.00 0.02 0.06 0.00 -0.16 0.00 0.00 57.16 57.07 1x1m n GLU 39 Cb 0.00 -1.07 0.32 0.00 1.43 0.00 0.00 31.44 32.11 1x1m n GLU 39 CO 0.00 0.00 0.00 2.48 -0.16 0.00 0.00 177.13 179.45 1x1m n TYR 40 N -2.48 0.39 -3.27 -1.84 0.18 -1.26 -4.41 117.16 104.48 1x1m n TYR 40 Ca -0.06 0.21 0.03 0.00 1.88 0.00 0.00 57.90 59.95 1x1m n TYR 40 Cb 0.58 -0.73 -0.04 0.00 -0.38 0.00 0.00 39.34 38.76 1x1m n TYR 40 CO 0.00 0.00 0.00 -1.54 -2.08 0.00 0.00 176.86 173.24 1x1m s SER 41 N -3.42 -0.30 -0.14 9.48 1.04 -1.26 -5.08 113.70 114.01 1x1m s SER 41 Ca -0.01 0.39 -0.10 0.00 0.48 0.00 0.00 55.95 56.71 1x1m s SER 41 Cb 0.03 1.33 -0.03 0.00 0.10 0.00 0.00 66.02 67.45 1x1m s SER 41 CO 0.11 -0.06 -0.19 0.18 0.98 0.00 0.00 173.24 174.26 1x1m n LEU 42 N 4.78 1.77 -3.36 2.42 4.77 -1.26 -4.12 117.00 122.00 1x1m n LEU 42 Ca -0.08 0.59 -0.19 0.00 -0.03 0.00 0.00 56.01 56.31 1x1m n LEU 42 Cb 0.54 -0.85 0.00 0.00 -2.33 0.00 0.00 43.42 40.79 1x1m n LEU 42 CO -0.05 -0.45 -0.19 0.61 -1.33 0.00 0.00 177.39 175.98 1x1m n GLY 43 N 1.60 -0.82 0.00 -0.72 0.00 -1.26 -4.60 105.19 99.39 1x1m n GLY 43 Ca -0.08 0.47 0.00 0.00 0.00 0.00 0.00 46.02 46.41 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 -1.19 0.06 3.68 -0.02 0.00 -1.26 -4.93 105.19 101.53 1x1m n GLY 44 Ca -0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 1x1m n GLY 44 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1x1m s TYR 45 N 0.00 2.29 -0.06 1.61 2.02 -1.26 -4.92 117.35 117.04 1x1m s TYR 45 Ca 0.00 0.24 -0.28 0.00 -0.37 0.00 0.00 57.07 56.65 1x1m s TYR 45 Cb 0.00 -3.99 -0.02 0.00 -0.40 0.00 0.00 41.96 37.54 1x1m s TYR 45 CO 0.00 -4.04 0.93 -1.54 -1.57 0.00 0.00 175.55 169.34 1x1m s SER 46 N 2.63 7.24 0.23 2.29 1.04 -1.26 -2.66 113.70 123.21 1x1m s SER 46 Ca 0.75 1.51 0.05 0.00 0.48 0.00 0.00 55.95 58.74 1x1m s SER 46 Cb -0.40 -2.53 0.66 0.00 0.10 0.00 0.00 66.02 63.85 1x1m s SER 46 CO 0.33 -0.31 1.11 -0.38 0.98 0.00 0.00 173.24 174.97 1x1m n ILE 47 N 4.15 -0.30 -0.18 -1.02 2.08 -0.85 0.12 119.36 123.36 1x1m n ILE 47 Ca 0.06 1.52 -0.03 0.00 0.56 0.00 0.00 62.75 64.85 1x1m n ILE 47 Cb 0.50 -2.29 0.03 0.00 -0.75 0.00 0.00 39.64 37.14 1x1m n ILE 47 CO 0.00 0.00 0.00 -1.28 0.56 0.00 0.00 176.55 175.83 1x1m h SER 48 N 0.00 -0.81 -0.18 4.38 0.87 -1.81 -2.08 113.55 113.93 1x1m h SER 48 Ca 0.48 0.19 0.02 0.00 -1.23 0.00 0.00 61.79 61.25 1x1m h SER 48 Cb 1.08 0.45 -0.04 0.00 -0.44 0.00 0.00 62.40 63.45 1x1m h SER 48 CO -0.63 -0.25 -0.25 0.15 -0.53 0.00 0.00 176.83 175.31 1x1m h PHE 49 N -0.09 -0.78 -0.62 2.24 3.57 0.58 -2.29 116.94 119.55 1x1m h PHE 49 Ca 0.25 0.04 0.08 0.00 3.53 0.00 0.00 57.97 61.87 1x1m h PHE 49 Cb 0.49 0.36 -0.10 0.00 2.79 0.00 0.00 35.95 39.49 1x1m h PHE 49 CO -0.54 -0.23 -0.50 -0.07 -2.23 0.00 0.00 178.31 174.74 1x1m h LEU 50 N -0.19 -1.74 -1.46 0.59 3.38 -1.48 0.59 115.31 115.01 1x1m h LEU 50 Ca 0.03 0.26 0.42 0.00 0.09 0.00 0.00 57.88 58.69 1x1m h LEU 50 Cb 0.28 0.76 -0.06 0.00 0.09 0.00 0.00 40.66 41.73 1x1m h LEU 50 CO -0.27 -0.34 1.24 0.29 0.09 0.00 0.00 178.44 179.46 1x1m n LYS 51 N -5.37 0.01 0.09 1.13 5.02 -0.83 0.24 118.16 118.45 1x1m n LYS 51 Ca 0.00 0.98 -0.23 0.00 -2.02 0.00 0.00 58.31 57.04 1x1m n LYS 51 Cb 0.33 -2.33 -0.15 0.00 -0.02 0.00 0.00 35.03 32.86 1x1m n LYS 51 CO 0.00 0.00 0.00 1.96 -0.52 0.00 0.00 177.40 178.84 1x1m h GLN 52 N 0.00 0.42 0.46 1.97 4.20 0.40 -2.85 115.11 119.72 1x1m h GLN 52 Ca 0.69 -0.73 -0.02 0.00 0.06 0.00 0.00 58.65 58.65 1x1m h GLN 52 Cb 3.17 0.27 0.00 0.00 0.30 0.00 0.00 27.48 31.22 1x1m h GLN 52 CO -0.01 1.35 -0.22 -0.07 -0.67 0.00 0.00 178.83 179.21 1x1m h LEU 53 N -0.04 -0.52 0.03 1.46 4.07 0.34 -2.19 115.31 118.45 1x1m h LEU 53 Ca -0.25 -0.09 0.02 0.00 0.08 0.00 0.00 57.88 57.64 1x1m h LEU 53 Cb 1.98 0.14 -0.03 0.00 1.08 0.00 0.00 40.66 43.83 1x1m h LEU 53 CO 0.20 -0.19 -0.16 0.40 -1.08 0.00 0.00 178.44 177.62 1x1m h ILE 54 N -0.89 0.62 -0.73 1.22 5.03 -1.35 -1.37 117.51 120.04 1x1m h ILE 54 Ca -0.06 0.00 0.20 0.00 -0.12 0.00 0.00 64.86 64.88 1x1m h ILE 54 Cb 0.58 0.62 -0.03 0.00 -3.03 0.00 0.00 36.82 34.95 1x1m h ILE 54 CO 0.10 0.00 0.51 0.00 -0.68 0.00 0.00 178.15 178.09 1x1m h ALA 55 N 0.62 2.58 0.00 1.87 0.00 -1.55 0.37 119.26 123.15 1x1m h ALA 55 Ca 0.04 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1x1m h ALA 55 Cb 0.33 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 1x1m h ALA 55 CO -0.13 -0.79 -0.15 0.78 0.00 0.00 0.00 179.25 178.97 1x1m h GLY 56 N 0.07 0.00 0.43 0.00 0.00 -0.58 -2.84 103.07 100.15 1x1m h GLY 56 Ca 0.35 0.00 -0.36 0.00 0.00 0.00 0.00 47.33 47.32 1x1m h GLY 56 CO -0.03 0.00 -2.13 0.28 0.00 0.00 0.00 176.54 174.66 1x1m n LYS 57 N -3.31 0.70 0.00 4.80 4.76 0.11 -4.04 118.16 121.17 1x1m n LYS 57 Ca 0.00 0.21 0.09 0.00 -2.87 0.00 0.00 58.31 55.73 1x1m n LYS 57 Cb 0.38 -1.65 0.51 0.00 -1.84 0.00 0.00 35.03 32.43 1x1m n LYS 57 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1x1m n LEU 58 N -3.27 0.00 -0.30 -0.35 4.77 -0.21 -4.09 117.00 113.55 1x1m n LEU 58 Ca -0.34 0.00 0.26 0.00 -0.03 0.00 0.00 56.01 55.90 1x1m n LEU 58 Cb 1.04 0.00 0.43 0.00 -2.33 0.00 0.00 43.42 42.57 1x1m n LEU 58 CO 0.38 0.00 0.78 0.00 -1.33 0.00 0.00 177.39 177.22 1x1m n GLN 59 N -0.87 -0.02 -0.33 3.23 10.64 -1.08 0.43 117.38 129.38 1x1m n GLN 59 Ca 0.13 0.81 0.12 0.00 -1.83 0.00 0.00 57.00 56.22 1x1m n GLN 59 Cb 0.06 -1.59 0.23 0.00 -0.86 0.00 0.00 30.24 28.09 1x1m n GLN 59 CO 0.00 0.00 0.00 -0.85 -1.83 0.00 0.00 177.06 174.38 1x1m n GLU 60 N -3.99 -0.08 0.00 2.61 -0.00 -1.26 -3.02 120.64 114.91 1x1m n GLU 60 Ca 0.26 1.42 0.00 0.00 -0.00 0.00 0.00 57.16 58.84 1x1m n GLU 60 Cb 1.00 -2.22 0.00 0.00 -0.00 0.00 0.00 31.44 30.22 1x1m n GLU 60 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.13 177.56 1x1m n SER 61 N -5.43 4.72 -4.61 -1.84 7.64 0.17 -4.99 113.62 109.29 1x1m n SER 61 Ca 0.20 0.00 -0.43 0.00 1.01 0.00 0.00 58.87 59.65 1x1m n SER 61 Cb 0.65 0.51 -0.02 0.00 -1.01 0.00 0.00 64.21 64.34 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 -1.94 4.22 -0.02 0.44 1.01 0.40 -4.92 120.40 119.59 1x1m s VAL 62 Ca 0.00 1.30 -0.25 0.00 0.00 0.00 0.00 61.98 63.02 1x1m s VAL 62 Cb 0.00 -4.49 -0.19 0.00 0.00 0.00 0.00 36.38 31.70 1x1m s VAL 62 CO 0.00 -0.84 1.22 1.55 0.00 0.00 0.00 175.10 177.04 1x1m h PRO 63 N 9.18 -0.06 -3.62 2.72 0.13 -1.88 -3.33 132.00 135.14 1x1m h PRO 63 Ca -0.23 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.78 1x1m h PRO 63 Cb 1.07 0.01 -0.18 0.00 0.13 0.00 0.00 31.00 32.03 1x1m h PRO 63 CO 1.10 0.40 -0.47 -0.51 -0.23 0.00 0.00 178.00 178.29 1x1m s ASP 64 N -5.61 0.08 0.45 1.44 1.01 -1.26 -5.03 116.67 107.75 1x1m s ASP 64 Ca -0.15 -0.37 0.30 0.00 0.71 0.00 0.00 52.55 53.04 1x1m s ASP 64 Cb 0.02 0.24 1.26 0.00 1.01 0.00 0.00 42.92 45.45 1x1m s ASP 64 CO 0.64 -0.48 1.89 1.55 0.21 0.00 0.00 175.17 178.98 1x1m h PRO 65 N 3.78 0.00 0.00 8.23 0.13 -1.88 -2.83 132.00 139.43 1x1m h PRO 65 Ca -0.32 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.55 1x1m h PRO 65 Cb 1.19 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.28 1x1m h PRO 65 CO 0.47 0.00 -1.46 0.93 -0.23 0.00 0.00 178.00 177.71 1x1m h GLU 66 N 0.00 0.00 -0.88 0.86 5.08 -1.96 -3.31 114.58 114.37 1x1m h GLU 66 Ca 0.00 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 1x1m h GLU 66 Cb 0.44 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.65 1x1m h GLU 66 CO 0.00 0.65 0.07 1.28 -1.00 0.00 0.00 179.01 180.02 1x1m n LEU 67 N -3.14 3.30 -4.20 1.33 4.77 -1.07 -4.87 117.00 113.13 1x1m n LEU 67 Ca -0.11 -1.69 -0.16 0.00 -0.03 0.00 0.00 56.01 54.02 1x1m n LEU 67 Cb 1.01 -0.59 -0.07 0.00 -2.33 0.00 0.00 43.42 41.44 1x1m n LEU 67 CO 0.46 0.49 -0.05 0.27 -1.33 0.00 0.00 177.39 177.22 1x1m s ILE 68 N -1.58 0.00 0.25 -0.08 -5.25 -1.23 -2.70 121.20 110.61 1x1m s ILE 68 Ca 0.22 -1.86 -0.01 0.00 -0.99 0.00 0.00 60.65 58.01 1x1m s ILE 68 Cb 0.17 -2.53 -0.03 0.00 2.95 0.00 0.00 42.46 43.02 1x1m s ILE 68 CO 0.06 0.00 0.24 -1.81 -1.79 0.00 0.00 174.94 171.63 1x1m s ASP 69 N -3.28 0.53 -0.06 4.36 1.01 -0.13 -4.81 116.67 114.30 1x1m s ASP 69 Ca 0.37 -1.43 0.05 0.00 0.71 0.00 0.00 52.55 52.25 1x1m s ASP 69 Cb 0.02 0.47 -0.00 0.00 1.01 0.00 0.00 42.92 44.42 1x1m s ASP 69 CO 0.22 -0.97 -0.20 -0.22 0.21 0.00 0.00 175.17 174.21 1x1m s LEU 70 N -3.20 1.97 -0.05 1.23 2.96 -1.26 -2.04 118.68 118.29 1x1m s LEU 70 Ca 0.37 -0.44 0.05 0.00 -0.22 0.00 0.00 54.13 53.88 1x1m s LEU 70 Cb 0.04 -1.17 -0.00 0.00 0.50 0.00 0.00 46.19 45.56 1x1m s LEU 70 CO 0.16 0.17 -0.19 -0.63 -1.32 0.00 0.00 176.35 174.54 1x1m s ILE 71 N 0.12 1.57 -0.04 6.68 -1.09 0.62 -2.08 121.20 126.98 1x1m s ILE 71 Ca -0.08 -0.80 -0.04 0.00 -2.23 0.00 0.00 60.65 57.50 1x1m s ILE 71 Cb -0.14 -1.35 0.01 0.00 -1.58 0.00 0.00 42.46 39.40 1x1m s ILE 71 CO 0.04 0.45 0.11 -0.47 -1.23 0.00 0.00 174.94 173.84 1x1m s TYR 72 N 0.02 -0.12 -1.37 3.97 5.04 0.45 -1.82 117.35 123.52 1x1m s TYR 72 Ca -0.04 0.30 -0.09 0.00 -2.44 0.00 0.00 57.07 54.80 1x1m s TYR 72 Cb -0.12 0.03 0.06 0.00 0.35 0.00 0.00 41.96 42.28 1x1m s TYR 72 CO 0.03 -0.06 0.56 0.00 -1.34 0.00 0.00 175.55 174.74 1x1m n GLY 74 N -1.30 1.22 2.89 0.00 0.00 -1.26 -4.99 105.19 101.75 1x1m n GLY 74 Ca -0.03 -0.42 -0.13 0.00 0.00 0.00 0.00 46.02 45.43 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 -3.23 0.05 0.33 1.61 1.70 0.15 -5.14 118.95 114.41 1x1m s ARG 75 Ca 0.00 0.22 -0.28 0.00 -0.47 0.00 0.00 55.73 55.19 1x1m s ARG 75 Cb 0.00 -0.12 -0.10 0.00 -0.57 0.00 0.00 34.95 34.16 1x1m s ARG 75 CO 0.00 -0.11 1.24 0.21 -1.08 0.00 0.00 175.30 175.56 1x1m s LYS 76 N 0.73 4.39 -0.21 3.89 2.36 -1.26 -0.41 119.74 129.23 1x1m s LYS 76 Ca -0.06 2.07 -0.09 0.00 -2.55 0.00 0.00 55.97 55.34 1x1m s LYS 76 Cb -0.08 -3.05 -0.05 0.00 -1.05 0.00 0.00 37.83 33.60 1x1m s LYS 76 CO -0.03 -0.10 0.11 -0.51 1.55 0.00 0.00 175.35 176.37 1x1m s LEU 77 N -1.79 4.00 0.53 5.43 1.43 -0.88 -4.89 118.68 122.50 1x1m s LEU 77 Ca 0.49 0.11 -0.08 0.00 -1.03 0.00 0.00 54.13 53.62 1x1m s LEU 77 Cb -0.37 -2.04 -0.04 0.00 0.03 0.00 0.00 46.19 43.77 1x1m s LEU 77 CO 0.48 0.12 0.88 -0.54 0.23 0.00 0.00 176.35 177.52 1x1m s LYS 78 N 0.68 3.59 0.50 1.70 1.02 -1.26 -4.70 119.74 121.27 1x1m s LYS 78 Ca 0.06 0.43 0.29 0.00 0.02 0.00 0.00 55.97 56.78 1x1m s LYS 78 Cb -0.13 -2.26 1.14 0.00 -0.52 0.00 0.00 37.83 36.06 1x1m s LYS 78 CO 0.01 -0.33 1.90 -0.44 -0.92 0.00 0.00 175.35 175.58 1x1m h ASP 79 N 0.11 0.00 1.17 2.83 3.32 -1.96 -2.58 116.42 119.31 1x1m h ASP 79 Ca -0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.59 1x1m h ASP 79 Cb 1.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.75 1x1m h ASP 79 CO 0.62 0.09 0.00 0.44 -1.72 0.00 0.00 179.24 178.67 1x1m h ASP 80 N 0.00 0.00 -2.04 6.45 3.32 -1.97 -3.37 116.42 118.81 1x1m h ASP 80 Ca -0.00 0.00 -0.47 0.00 0.02 0.00 0.00 57.03 56.58 1x1m h ASP 80 Cb 0.63 0.00 0.08 0.00 0.22 0.00 0.00 39.33 40.26 1x1m h ASP 80 CO 0.01 0.00 0.10 -1.10 -1.72 0.00 0.00 179.24 176.53 1x1m s GLN 81 N -3.47 1.69 0.18 3.56 1.11 -0.97 -4.98 119.66 116.78 1x1m s GLN 81 Ca 0.04 -1.16 0.04 0.00 0.01 0.00 0.00 55.36 54.28 1x1m s GLN 81 Cb 0.09 -2.35 -0.01 0.00 -1.01 0.00 0.00 33.01 29.72 1x1m s GLN 81 CO 0.54 -1.43 0.16 0.25 0.01 0.00 0.00 175.29 174.81 1x1m n THR 82 N -2.81 0.00 0.11 -0.19 -2.24 -1.26 -2.01 114.28 105.88 1x1m n THR 82 Ca 0.15 -1.26 -0.13 0.00 -2.27 0.00 0.00 64.05 60.53 1x1m n THR 82 Cb 0.61 0.64 -0.08 0.00 -2.10 0.00 0.00 70.33 69.40 1x1m n THR 82 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1x1m h LEU 83 N 0.00 -0.20 -0.35 3.22 -0.00 -1.86 -3.15 115.31 112.97 1x1m h LEU 83 Ca -0.13 -0.10 -0.08 0.00 -0.00 0.00 0.00 57.88 57.57 1x1m h LEU 83 Cb 0.64 0.05 -0.01 0.00 -0.00 0.00 0.00 40.66 41.34 1x1m h LEU 83 CO 0.18 -0.02 -0.10 -0.78 -0.00 0.00 0.00 178.44 177.73 1x1m h ASP 84 N -0.37 0.69 -0.85 -0.43 1.82 -1.88 0.08 116.42 115.48 1x1m h ASP 84 Ca -0.02 -0.37 0.26 0.00 -0.39 0.00 0.00 57.03 56.51 1x1m h ASP 84 Cb 0.29 -0.19 -0.16 0.00 0.68 0.00 0.00 39.33 39.95 1x1m h ASP 84 CO 0.04 0.90 0.11 0.33 -1.61 0.00 0.00 179.24 179.01 1x1m n PHE 85 N -4.39 0.63 -0.05 0.28 -0.00 -1.19 -0.15 117.46 112.58 1x1m n PHE 85 Ca -0.02 1.02 -0.15 0.00 -0.00 0.00 0.00 57.45 58.30 1x1m n PHE 85 Cb 0.35 -1.19 -0.14 0.00 -0.00 0.00 0.00 39.48 38.49 1x1m n PHE 85 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.76 177.42 1x1m n TYR 86 N -5.16 0.68 0.00 -5.13 4.01 -1.19 -4.96 117.16 105.41 1x1m n TYR 86 Ca 0.22 0.19 0.00 0.00 -0.16 0.00 0.00 57.90 58.15 1x1m n TYR 86 Cb 0.74 -1.10 0.00 0.00 -0.31 0.00 0.00 39.34 38.67 1x1m n TYR 86 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1x1m n GLY 87 N 1.88 1.56 3.78 2.72 0.00 0.78 -5.10 105.19 110.81 1x1m n GLY 87 Ca -0.31 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.35 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 3.30 0.17 -0.61 1.01 -0.24 -4.99 121.20 117.84 1x1m s ILE 88 Ca 0.00 0.93 0.10 0.00 0.00 0.00 0.00 60.65 61.68 1x1m s ILE 88 Cb 0.00 -3.44 -0.04 0.00 0.01 0.00 0.00 42.46 38.98 1x1m s ILE 88 CO 0.00 -0.06 -0.22 -1.10 0.00 0.00 0.00 174.94 173.56 1x1m s GLN 89 N -2.84 1.38 -0.91 2.79 -1.52 -1.26 -4.77 119.66 112.53 1x1m s GLN 89 Ca 0.65 -1.44 -0.24 0.00 -1.95 0.00 0.00 55.36 52.38 1x1m s GLN 89 Cb -0.25 -1.60 -0.05 0.00 -0.22 0.00 0.00 33.01 30.89 1x1m s GLN 89 CO 0.30 0.34 1.95 -1.25 -0.25 0.00 0.00 175.29 176.38 1x1m s PRO 90 N -2.62 2.55 0.00 2.91 0.04 -1.26 -2.78 135.00 133.84 1x1m s PRO 90 Ca 0.17 -0.33 0.00 0.00 0.04 0.00 0.00 61.00 60.88 1x1m s PRO 90 Cb -0.07 -5.07 0.00 0.00 0.04 0.00 0.00 34.50 29.40 1x1m s PRO 90 CO 0.08 -3.41 0.00 0.41 0.04 0.00 0.00 177.00 174.12 1x1m n GLY 91 N 6.81 0.21 3.18 0.56 0.00 -1.16 -4.78 105.19 110.01 1x1m n GLY 91 Ca 0.40 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.13 1x1m n GLY 91 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1x1m n SER 92 N 0.00 -3.33 -3.88 1.61 3.41 -1.12 -4.44 113.62 105.87 1x1m n SER 92 Ca 0.00 -0.96 -0.23 0.00 -0.26 0.00 0.00 58.87 57.42 1x1m n SER 92 Cb 0.00 -0.96 -0.17 0.00 -0.26 0.00 0.00 64.21 62.82 1x1m n SER 92 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1x1m s THR 93 N -2.39 0.70 0.18 6.66 2.01 -1.26 -1.29 115.64 120.26 1x1m s THR 93 Ca 0.66 -0.15 0.05 0.00 0.31 0.00 0.00 61.69 62.56 1x1m s THR 93 Cb -0.10 -0.75 -0.04 0.00 0.01 0.00 0.00 72.50 71.63 1x1m s THR 93 CO 0.53 0.29 0.20 0.68 -0.69 0.00 0.00 174.62 175.64 1x1m s VAL 94 N 1.38 4.74 -0.06 3.82 -7.23 -0.64 -4.85 120.40 117.56 1x1m s VAL 94 Ca -0.03 -1.04 0.06 0.00 -1.81 0.00 0.00 61.98 59.16 1x1m s VAL 94 Cb -0.13 -3.46 -0.01 0.00 0.56 0.00 0.00 36.38 33.33 1x1m s VAL 94 CO -0.03 -0.17 -0.24 -1.00 -0.31 0.00 0.00 175.10 173.36 1x1m s HIS 95 N -1.84 2.32 -0.15 2.82 3.76 -0.75 -1.47 115.29 119.97 1x1m s HIS 95 Ca 0.32 -0.72 -0.10 0.00 -0.15 0.00 0.00 55.06 54.42 1x1m s HIS 95 Cb -0.10 -1.53 -0.05 0.00 1.11 0.00 0.00 32.58 32.01 1x1m s HIS 95 CO 0.25 -0.23 0.18 0.08 -0.85 0.00 0.00 174.74 174.17 1x1m s VAL 96 N -0.08 5.40 -0.21 -0.90 1.01 -1.14 -0.28 120.40 124.20 1x1m s VAL 96 Ca -0.05 0.30 -0.00 0.00 0.00 0.00 0.00 61.98 62.23 1x1m s VAL 96 Cb -0.14 -3.49 0.02 0.00 0.00 0.00 0.00 36.38 32.77 1x1m s VAL 96 CO 0.04 0.50 -0.12 -0.22 0.00 0.00 0.00 175.10 175.29 1x1m s LEU 97 N -0.15 2.70 -0.04 3.92 1.98 -0.87 -2.94 118.68 123.29 1x1m s LEU 97 Ca 0.13 -0.74 -0.30 0.00 -2.89 0.00 0.00 54.13 50.32 1x1m s LEU 97 Cb -0.12 -1.59 -0.04 0.00 0.66 0.00 0.00 46.19 45.10 1x1m s LEU 97 CO 0.02 -0.06 1.31 -0.13 -1.89 0.00 0.00 176.35 175.60 1x1m s ARG 98 N 1.31 4.31 0.72 1.98 0.52 -1.26 -0.95 118.95 125.58 1x1m s ARG 98 Ca 0.02 1.83 -0.16 0.00 -0.52 0.00 0.00 55.73 56.90 1x1m s ARG 98 Cb -0.15 -3.59 0.03 0.00 0.52 0.00 0.00 34.95 31.76 1x1m s ARG 98 CO -0.08 -0.54 1.19 1.63 0.02 0.00 0.00 175.30 177.53 1x1m n LYS 99 N 5.42 0.66 -2.96 3.54 5.02 -1.10 -4.95 118.16 123.80 1x1m n LYS 99 Ca 0.12 0.29 -0.42 0.00 -2.02 0.00 0.00 58.31 56.29 1x1m n LYS 99 Cb 0.45 -2.43 -0.05 0.00 -0.02 0.00 0.00 35.03 32.97 1x1m n LYS 99 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1x1m s SER 100 N -1.69 6.72 0.08 4.39 0.15 -1.26 -4.98 113.70 117.11 1x1m s SER 100 Ca 0.78 0.84 0.06 0.00 0.70 0.00 0.00 55.95 58.32 1x1m s SER 100 Cb -0.34 -2.40 -0.03 0.00 -1.71 0.00 0.00 66.02 61.53 1x1m s SER 100 CO 0.46 -0.52 -0.15 0.86 1.20 0.00 0.00 173.24 175.09 1x1m s TRP 101 N 2.81 1.31 0.13 3.44 -0.00 -1.26 -5.06 118.94 120.31 1x1m s TRP 101 Ca 0.32 -0.47 -0.32 0.00 -0.00 0.00 0.00 56.10 55.64 1x1m s TRP 101 Cb -0.15 -0.73 -0.09 0.00 -0.00 0.00 0.00 33.47 32.51 1x1m s TRP 101 CO 0.09 0.08 1.56 0.77 -0.00 0.00 0.00 176.95 179.46 1x1m h SER 102 N 4.18 -1.62 0.00 5.86 0.02 -2.05 -3.47 113.55 116.47 1x1m h SER 102 Ca -0.41 0.21 0.00 0.00 -0.84 0.00 0.00 61.79 60.74 1x1m h SER 102 Cb 1.19 0.65 0.00 0.00 0.14 0.00 0.00 62.40 64.38 1x1m h SER 102 CO 0.41 -0.44 0.00 0.61 -1.14 0.00 0.00 176.83 176.27 1x1m n GLY 103 N -1.42 0.83 3.58 -3.77 0.00 -1.26 -5.06 105.19 98.09 1x1m n GLY 103 Ca -0.04 0.05 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 1x1m n GLY 103 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x1m s PRO 104 N 0.00 2.49 -0.03 1.61 0.04 -1.26 -4.74 135.00 133.11 1x1m s PRO 104 Ca 0.00 -1.19 -0.22 0.00 0.04 0.00 0.00 61.00 59.64 1x1m s PRO 104 Cb 0.00 -5.25 -0.15 0.00 0.04 0.00 0.00 34.50 29.14 1x1m s PRO 104 CO 0.00 -4.00 0.96 0.77 0.04 0.00 0.00 177.00 174.77 1x1m h SER 105 N 9.69 -0.27 -6.02 6.66 0.02 -1.99 -3.47 113.55 118.16 1x1m h SER 105 Ca 0.22 -0.26 -0.42 0.00 -0.84 0.00 0.00 61.79 60.49 1x1m h SER 105 Cb 0.94 0.07 0.07 0.00 0.14 0.00 0.00 62.40 63.61 1x1m h SER 105 CO 1.22 0.21 -0.73 -0.24 -1.14 0.00 0.00 176.83 176.16 1x1m n SER 106 N -5.01 -4.93 0.00 3.07 2.88 -1.26 -5.22 113.62 103.14 1x1m n SER 106 Ca -0.08 -0.66 0.00 0.00 -1.33 0.00 0.00 58.87 56.80 1x1m n SER 106 Cb 0.26 -4.52 0.00 0.00 -0.75 0.00 0.00 64.21 59.20 1x1m n SER 106 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42