#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dsf s VAL 2 N 0.00 3.18 -0.07 2.62 1.01 -1.26 -4.20 120.40 121.69 3dsf s VAL 2 Ca 0.00 0.88 -0.06 0.00 0.00 0.00 0.00 61.98 62.80 3dsf s VAL 2 Cb 0.00 -3.57 0.02 0.00 0.00 0.00 0.00 36.38 32.83 3dsf s VAL 2 CO 0.00 0.09 0.18 0.00 0.00 0.00 0.00 175.10 175.37 3dsf s GLN 3 N 0.72 0.21 -0.19 2.72 -2.07 0.34 -5.00 119.66 116.39 3dsf s GLN 3 Ca 0.63 0.23 -0.00 0.00 -1.82 0.00 0.00 55.36 54.40 3dsf s GLN 3 Cb -0.38 0.10 0.05 0.00 -1.09 0.00 0.00 33.01 31.69 3dsf s GLN 3 CO 0.33 -0.03 -0.05 -0.51 -1.32 0.00 0.00 175.29 173.71 3dsf s LEU 4 N 0.07 1.84 -0.25 2.60 1.43 -1.26 -1.42 118.68 121.69 3dsf s LEU 4 Ca -0.00 -0.80 -0.06 0.00 -1.03 0.00 0.00 54.13 52.23 3dsf s LEU 4 Cb -0.01 -0.97 -0.02 0.00 0.03 0.00 0.00 46.19 45.22 3dsf s LEU 4 CO 0.00 -0.20 0.04 -0.69 0.23 0.00 0.00 176.35 175.73 3dsf s VAL 5 N 1.58 4.02 0.24 -1.59 1.01 -0.23 -3.89 120.40 121.54 3dsf s VAL 5 Ca -0.01 -0.32 -0.07 0.00 0.00 0.00 0.00 61.98 61.58 3dsf s VAL 5 Cb -0.16 -2.89 -0.06 0.00 0.00 0.00 0.00 36.38 33.27 3dsf s VAL 5 CO -0.07 0.33 0.53 -1.61 0.00 0.00 0.00 175.10 174.27 3dsf s GLU 6 N 1.56 3.70 0.30 2.72 8.01 -1.26 -0.97 118.70 132.77 3dsf s GLU 6 Ca 0.06 0.10 -0.18 0.00 0.01 0.00 0.00 54.97 54.96 3dsf s GLU 6 Cb -0.15 -2.67 0.02 0.00 -4.31 0.00 0.00 34.13 27.02 3dsf s GLU 6 CO 0.02 0.29 0.68 -1.54 0.01 0.00 0.00 175.26 174.72 3dsf s SER 7 N -2.73 -0.13 0.00 -0.19 1.04 -0.86 -4.71 113.70 106.12 3dsf s SER 7 Ca 0.45 -0.80 0.00 0.00 0.48 0.00 0.00 55.95 56.08 3dsf s SER 7 Cb -0.11 0.73 0.00 0.00 0.10 0.00 0.00 66.02 66.73 3dsf s SER 7 CO 0.26 -1.38 0.00 0.61 0.98 0.00 0.00 173.24 173.71 3dsf n GLY 8 N -0.46 1.89 3.79 7.32 0.00 -1.26 -1.35 105.19 115.12 3dsf n GLY 8 Ca -0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.64 3dsf n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3dsf s GLY 9 N -2.48 2.30 0.00 -0.02 0.00 -1.26 -4.76 107.32 101.10 3dsf s GLY 9 Ca 0.00 0.53 0.00 0.00 0.00 0.00 0.00 44.72 45.25 3dsf s GLY 9 CO 0.00 0.86 0.00 0.61 0.00 0.00 0.00 173.10 174.57 3dsf n GLY 10 N -0.57 -1.19 3.71 0.20 0.00 -0.71 -4.83 105.19 101.80 3dsf n GLY 10 Ca 0.09 -0.97 -0.41 0.00 0.00 0.00 0.00 46.02 44.73 3dsf n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3dsf s LEU 11 N 0.00 4.33 -0.04 0.99 2.96 -1.26 -2.68 118.68 122.97 3dsf s LEU 11 Ca 0.00 1.49 0.01 0.00 -0.22 0.00 0.00 54.13 55.40 3dsf s LEU 11 Cb 0.00 -3.41 0.02 0.00 0.50 0.00 0.00 46.19 43.30 3dsf s LEU 11 CO 0.00 -0.25 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.06 3dsf s VAL 12 N 1.14 0.43 0.28 1.68 1.01 -0.59 -4.99 120.40 119.36 3dsf s VAL 12 Ca 0.47 -0.04 -0.29 0.00 0.00 0.00 0.00 61.98 62.11 3dsf s VAL 12 Cb -0.19 -0.49 -0.13 0.00 0.00 0.00 0.00 36.38 35.56 3dsf s VAL 12 CO 0.23 0.21 1.23 1.67 0.00 0.00 0.00 175.10 178.44 3dsf n GLN 13 N 4.22 1.77 -1.63 2.72 -0.06 -1.26 -2.89 117.38 120.24 3dsf n GLN 13 Ca -0.23 0.62 -0.42 0.00 -2.00 0.00 0.00 57.00 54.98 3dsf n GLN 13 Cb 0.51 -2.16 0.01 0.00 -4.06 0.00 0.00 30.24 24.54 3dsf n GLN 13 CO 0.00 0.00 0.00 -2.30 -0.20 0.00 0.00 177.06 174.56 3dsf n PRO 14 N 1.17 1.51 -1.32 3.69 -0.02 -1.26 -1.81 135.00 136.95 3dsf n PRO 14 Ca 0.09 0.54 -0.06 0.00 -2.02 0.00 0.00 63.50 62.05 3dsf n PRO 14 Cb 0.32 -2.11 -0.02 0.00 -0.02 0.00 0.00 33.50 31.67 3dsf n PRO 14 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3dsf n LYS 15 N 0.19 -0.42 -2.52 -0.52 5.02 0.25 -4.93 118.16 115.23 3dsf n LYS 15 Ca 0.09 0.64 -0.12 0.00 -2.02 0.00 0.00 58.31 56.89 3dsf n LYS 15 Cb 0.38 -4.40 0.01 0.00 -0.02 0.00 0.00 35.03 31.00 3dsf n LYS 15 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3dsf n GLY 16 N -2.06 2.72 3.17 0.72 0.00 -0.75 -4.53 105.19 104.45 3dsf n GLY 16 Ca -0.06 -2.22 -0.21 0.00 0.00 0.00 0.00 46.02 43.52 3dsf n GLY 16 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3dsf s SER 17 N -2.63 1.83 -0.06 1.61 0.01 -1.26 -2.19 113.70 111.01 3dsf s SER 17 Ca 0.18 -0.48 -0.14 0.00 1.31 0.00 0.00 55.95 56.82 3dsf s SER 17 Cb -0.01 -0.12 0.03 0.00 0.21 0.00 0.00 66.02 66.12 3dsf s SER 17 CO 0.11 0.05 0.33 -0.22 0.41 0.00 0.00 173.24 173.93 3dsf s LEU 18 N -1.17 0.76 -0.40 2.44 0.20 -0.36 -5.00 118.68 115.15 3dsf s LEU 18 Ca 0.03 0.33 0.04 0.00 0.69 0.00 0.00 54.13 55.21 3dsf s LEU 18 Cb -0.08 1.26 0.11 0.00 -0.43 0.00 0.00 46.19 47.05 3dsf s LEU 18 CO 0.01 -0.33 0.12 -0.75 -0.29 0.00 0.00 176.35 175.12 3dsf s LYS 19 N -0.76 1.60 0.53 1.98 2.20 -1.26 -0.14 119.74 123.90 3dsf s LYS 19 Ca -0.08 -2.09 -0.16 0.00 -0.36 0.00 0.00 55.97 53.28 3dsf s LYS 19 Cb -0.04 -3.18 -0.07 0.00 -1.51 0.00 0.00 37.83 33.03 3dsf s LYS 19 CO 0.03 -1.00 1.00 0.96 -0.36 0.00 0.00 175.35 175.98 3dsf s ILE 20 N 0.54 4.41 0.20 5.43 -4.36 -0.87 -4.82 121.20 121.73 3dsf s ILE 20 Ca 0.13 1.15 0.06 0.00 -0.26 0.00 0.00 60.65 61.72 3dsf s ILE 20 Cb -0.21 -3.67 -0.05 0.00 1.25 0.00 0.00 42.46 39.78 3dsf s ILE 20 CO -0.06 -0.67 -0.09 -0.44 0.24 0.00 0.00 174.94 173.92 3dsf s SER 21 N -3.05 2.21 -0.14 4.36 0.01 -0.46 -1.52 113.70 115.11 3dsf s SER 21 Ca 0.60 -1.08 -0.04 0.00 1.31 0.00 0.00 55.95 56.73 3dsf s SER 21 Cb -0.11 -0.07 0.07 0.00 0.21 0.00 0.00 66.02 66.12 3dsf s SER 21 CO 0.33 -0.31 0.26 0.00 0.41 0.00 0.00 173.24 173.93 3dsf s ALA 23 N 2.40 3.67 0.03 0.00 0.00 -0.14 -0.26 121.76 127.46 3dsf s ALA 23 Ca 0.03 -0.70 0.05 0.00 0.00 0.00 0.00 51.96 51.33 3dsf s ALA 23 Cb -0.13 -2.21 -0.03 0.00 0.00 0.00 0.00 23.12 20.74 3dsf s ALA 23 CO -0.09 0.09 -0.11 0.00 0.00 0.00 0.00 175.76 175.65 3dsf s ALA 24 N 0.49 2.88 -0.01 0.00 0.00 -0.53 -1.06 121.76 123.53 3dsf s ALA 24 Ca 0.09 -1.10 -0.28 0.00 0.00 0.00 0.00 51.96 50.67 3dsf s ALA 24 Cb -0.12 -0.98 0.09 0.00 0.00 0.00 0.00 23.12 22.11 3dsf s ALA 24 CO -0.00 0.60 0.76 -1.54 0.00 0.00 0.00 175.76 175.58 3dsf s SER 25 N -1.51 -0.52 0.00 0.00 1.04 -0.51 -4.85 113.70 107.35 3dsf s SER 25 Ca 0.17 0.33 0.00 0.00 0.48 0.00 0.00 55.95 56.92 3dsf s SER 25 Cb -0.11 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.49 3dsf s SER 25 CO 0.08 -0.66 0.00 0.61 0.98 0.00 0.00 173.24 174.25 3dsf n GLY 26 N 0.30 0.74 3.44 7.32 0.00 -1.26 -0.51 105.19 115.22 3dsf n GLY 26 Ca -0.15 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.76 3dsf n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3dsf s PHE 27 N -2.10 -0.43 -1.03 1.61 -0.71 -1.26 -4.26 117.98 109.80 3dsf s PHE 27 Ca 0.00 0.18 -0.23 0.00 -1.04 0.00 0.00 56.93 55.84 3dsf s PHE 27 Cb 0.00 0.51 0.01 0.00 -1.21 0.00 0.00 43.02 42.32 3dsf s PHE 27 CO 0.00 -0.85 1.70 0.99 -1.34 0.00 0.00 175.22 175.72 3dsf s THR 28 N -3.78 3.75 0.19 -4.49 2.01 -1.26 -4.84 115.64 107.22 3dsf s THR 28 Ca 0.02 -0.78 -0.13 0.00 0.31 0.00 0.00 61.69 61.12 3dsf s THR 28 Cb -0.01 -4.67 0.14 0.00 0.01 0.00 0.00 72.50 67.97 3dsf s THR 28 CO -0.11 -1.52 1.68 0.15 -0.69 0.00 0.00 174.62 174.13 3dsf h PHE 29 N 10.04 0.01 0.00 4.92 3.04 -1.96 -2.87 116.94 130.12 3dsf h PHE 29 Ca 0.20 0.04 0.00 0.00 3.98 0.00 0.00 57.97 62.18 3dsf h PHE 29 Cb 0.98 0.08 0.00 0.00 2.56 0.00 0.00 35.95 39.57 3dsf h PHE 29 CO 1.27 -0.10 0.00 0.27 -2.02 0.00 0.00 178.31 177.73 3dsf n ASN 30 N -5.22 0.16 -0.75 0.41 0.23 -1.26 -1.69 115.26 107.14 3dsf n ASN 30 Ca 0.06 0.54 0.12 0.00 -0.53 0.00 0.00 54.58 54.78 3dsf n ASN 30 Cb 0.28 -0.58 0.15 0.00 -2.08 0.00 0.00 39.78 37.55 3dsf n ASN 30 CO 0.00 0.00 0.00 2.30 -0.93 0.00 0.00 177.26 178.63 3dsf n ILE 31 N -1.68 0.00 -4.12 1.53 -5.35 -1.08 -3.99 119.36 104.66 3dsf n ILE 31 Ca 0.03 -0.39 -0.35 0.00 -0.27 0.00 0.00 62.75 61.76 3dsf n ILE 31 Cb 0.16 1.26 -0.08 0.00 -1.74 0.00 0.00 39.64 39.24 3dsf n ILE 31 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 3dsf s TYR 32 N -2.14 3.37 0.42 4.28 1.51 -0.68 -4.84 117.35 119.27 3dsf s TYR 32 Ca 0.27 0.34 -0.23 0.00 -1.01 0.00 0.00 57.07 56.44 3dsf s TYR 32 Cb 0.20 -1.85 -0.09 0.00 -0.11 0.00 0.00 41.96 40.12 3dsf s TYR 32 CO 0.38 0.60 1.07 0.00 -1.11 0.00 0.00 175.55 176.49 3dsf s ALA 33 N -1.00 3.04 0.08 3.71 0.00 -1.26 -4.25 121.76 122.07 3dsf s ALA 33 Ca 0.16 0.74 0.04 0.00 0.00 0.00 0.00 51.96 52.90 3dsf s ALA 33 Cb -0.12 -3.29 -0.03 0.00 0.00 0.00 0.00 23.12 19.68 3dsf s ALA 33 CO 0.05 -0.32 -0.12 -1.64 0.00 0.00 0.00 175.76 173.73 3dsf s MET 34 N -2.63 0.78 0.15 0.00 -1.94 -0.14 -0.69 119.30 114.83 3dsf s MET 34 Ca 0.60 -1.00 -0.06 0.00 -1.71 0.00 0.00 55.69 53.52 3dsf s MET 34 Cb -0.23 -0.63 -0.02 0.00 2.01 0.00 0.00 34.83 35.96 3dsf s MET 34 CO 0.28 0.12 0.19 0.54 -0.01 0.00 0.00 175.02 176.15 3dsf s ASN 35 N -1.98 0.15 -0.06 3.03 2.20 -0.64 -0.16 114.94 117.47 3dsf s ASN 35 Ca -0.01 -1.00 0.02 0.00 -0.94 0.00 0.00 52.86 50.94 3dsf s ASN 35 Cb -0.07 0.38 -0.03 0.00 -2.00 0.00 0.00 41.25 39.53 3dsf s ASN 35 CO 0.01 -0.83 -0.10 0.26 -2.94 0.00 0.00 177.10 173.51 3dsf s TRP 36 N -4.00 2.85 -0.02 1.54 0.52 0.01 -1.24 118.94 118.60 3dsf s TRP 36 Ca 0.20 -0.07 0.04 0.00 0.02 0.00 0.00 56.10 56.28 3dsf s TRP 36 Cb 0.05 -1.69 -0.01 0.00 -1.15 0.00 0.00 33.47 30.67 3dsf s TRP 36 CO 0.00 0.26 -0.13 0.08 0.02 0.00 0.00 176.95 177.18 3dsf s VAL 37 N -0.73 1.04 0.24 4.03 1.01 0.71 -1.62 120.40 125.10 3dsf s VAL 37 Ca 0.11 -0.54 0.10 0.00 0.00 0.00 0.00 61.98 61.65 3dsf s VAL 37 Cb -0.11 -0.89 -0.04 0.00 0.00 0.00 0.00 36.38 35.34 3dsf s VAL 37 CO 0.01 0.30 -0.11 0.00 0.00 0.00 0.00 175.10 175.30 3dsf s ARG 38 N -0.16 1.96 -0.26 2.72 1.70 0.34 0.17 118.95 125.41 3dsf s ARG 38 Ca 0.02 -1.50 -0.02 0.00 -0.47 0.00 0.00 55.73 53.76 3dsf s ARG 38 Cb -0.07 -2.01 0.12 0.00 -0.57 0.00 0.00 34.95 32.42 3dsf s ARG 38 CO 0.00 0.38 0.25 -1.14 -1.08 0.00 0.00 175.30 173.70 3dsf s GLN 39 N -3.28 0.26 0.45 3.89 0.74 -0.24 -0.12 119.66 121.36 3dsf s GLN 39 Ca 0.28 -0.09 -0.25 0.00 0.05 0.00 0.00 55.36 55.35 3dsf s GLN 39 Cb -0.07 -0.90 -0.08 0.00 1.10 0.00 0.00 33.01 33.06 3dsf s GLN 39 CO 0.16 -0.91 1.35 0.00 -0.55 0.00 0.00 175.29 175.33 3dsf s ALA 40 N 2.31 3.14 -0.29 1.58 0.00 -1.26 -1.28 121.76 125.97 3dsf s ALA 40 Ca 0.09 1.31 -0.39 0.00 0.00 0.00 0.00 51.96 52.96 3dsf s ALA 40 Cb -0.15 -3.53 -0.15 0.00 0.00 0.00 0.00 23.12 19.29 3dsf s ALA 40 CO -0.27 -1.05 1.84 -0.35 0.00 0.00 0.00 175.76 175.93 3dsf n PRO 41 N -0.27 1.17 0.00 0.00 -0.04 -1.26 -0.47 135.00 134.13 3dsf n PRO 41 Ca 0.06 0.41 0.00 0.00 -0.04 0.00 0.00 63.50 63.93 3dsf n PRO 41 Cb 0.44 -2.17 0.00 0.00 -0.04 0.00 0.00 33.50 31.72 3dsf n PRO 41 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3dsf n GLY 42 N 4.72 2.85 1.94 0.55 0.00 -1.26 -5.01 105.19 108.99 3dsf n GLY 42 Ca 0.30 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.20 3dsf n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3dsf n LYS 43 N -2.00 0.26 -2.39 1.61 5.02 0.38 -5.12 118.16 115.91 3dsf n LYS 43 Ca 0.00 -1.36 -0.25 0.00 -2.02 0.00 0.00 58.31 54.68 3dsf n LYS 43 Cb 0.00 -0.33 0.15 0.00 -0.02 0.00 0.00 35.03 34.82 3dsf n LYS 43 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3dsf n GLY 44 N 1.16 0.03 3.72 0.72 0.00 -1.26 -4.69 105.19 104.87 3dsf n GLY 44 Ca 0.08 -1.94 -0.40 0.00 0.00 0.00 0.00 46.02 43.76 3dsf n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dsf s LEU 45 N 0.00 4.37 -0.12 0.99 1.43 -1.26 -4.21 118.68 119.88 3dsf s LEU 45 Ca 0.70 1.41 0.03 0.00 -1.03 0.00 0.00 54.13 55.23 3dsf s LEU 45 Cb -0.03 -3.27 0.01 0.00 0.03 0.00 0.00 46.19 42.92 3dsf s LEU 45 CO 0.47 -0.12 -0.21 -0.70 0.23 0.00 0.00 176.35 176.02 3dsf s GLU 46 N 0.60 2.85 0.14 1.70 2.12 0.82 -4.99 118.70 121.95 3dsf s GLU 46 Ca 0.42 -0.80 -0.30 0.00 0.36 0.00 0.00 54.97 54.65 3dsf s GLU 46 Cb -0.20 -2.27 -0.07 0.00 0.26 0.00 0.00 34.13 31.86 3dsf s GLU 46 CO 0.23 0.04 1.12 -0.46 -0.54 0.00 0.00 175.26 175.64 3dsf s TRP 47 N 0.69 3.56 -0.13 5.30 -0.00 -1.26 -0.50 118.94 126.59 3dsf s TRP 47 Ca -0.11 1.53 -0.09 0.00 -0.00 0.00 0.00 56.10 57.43 3dsf s TRP 47 Cb -0.16 -3.30 -0.06 0.00 -0.00 0.00 0.00 33.47 29.94 3dsf s TRP 47 CO 0.02 -0.75 -0.22 0.28 -0.00 0.00 0.00 176.95 176.28 3dsf n VAL 48 N 2.82 1.11 -3.48 5.86 0.31 -0.64 -4.69 118.33 119.62 3dsf n VAL 48 Ca 0.04 -0.06 -0.12 0.00 -0.01 0.00 0.00 64.34 64.19 3dsf n VAL 48 Cb 0.46 -1.85 -0.03 0.00 -0.91 0.00 0.00 33.84 31.51 3dsf n VAL 48 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3dsf s ALA 49 N -2.40 -1.73 0.04 3.52 0.00 -1.14 -0.98 121.76 119.07 3dsf s ALA 49 Ca -0.22 0.92 -0.04 0.00 0.00 0.00 0.00 51.96 52.62 3dsf s ALA 49 Cb 0.07 0.42 -0.02 0.00 0.00 0.00 0.00 23.12 23.58 3dsf s ALA 49 CO 0.29 -0.62 0.05 0.50 0.00 0.00 0.00 175.76 175.98 3dsf s ARG 50 N -2.78 0.59 -0.08 0.00 3.52 -0.11 -0.81 118.95 119.27 3dsf s ARG 50 Ca -0.01 -0.91 -0.04 0.00 -0.13 0.00 0.00 55.73 54.64 3dsf s ARG 50 Cb -0.01 0.22 0.04 0.00 -1.56 0.00 0.00 34.95 33.65 3dsf s ARG 50 CO -0.06 -0.13 0.18 -1.50 -0.81 0.00 0.00 175.30 172.98 3dsf s ILE 51 N -3.03 -0.09 0.68 4.11 2.07 0.78 -1.04 121.20 124.68 3dsf s ILE 51 Ca -0.01 0.19 -0.07 0.00 -1.41 0.00 0.00 60.65 59.35 3dsf s ILE 51 Cb 0.01 -0.30 0.04 0.00 0.13 0.00 0.00 42.46 42.35 3dsf s ILE 51 CO -0.07 0.08 1.00 -0.13 -1.91 0.00 0.00 174.94 173.91 3dsf s ARG 52 N 1.38 2.47 0.85 3.50 0.52 -0.67 -0.97 118.95 126.03 3dsf s ARG 52 Ca -0.07 -0.08 -0.12 0.00 -0.52 0.00 0.00 55.73 54.94 3dsf s ARG 52 Cb -0.11 -2.17 0.10 0.00 0.52 0.00 0.00 34.95 33.29 3dsf s ARG 52 CO -0.07 -1.08 1.12 -1.54 0.02 0.00 0.00 175.30 173.75 3dsf s SER 53 N -4.44 4.04 0.20 0.23 1.04 -1.26 -4.02 113.70 109.48 3dsf s SER 53 Ca 0.58 1.09 -0.12 0.00 0.48 0.00 0.00 55.95 57.98 3dsf s SER 53 Cb -0.11 -1.73 0.24 0.00 0.10 0.00 0.00 66.02 64.51 3dsf s SER 53 CO 0.46 -2.23 1.68 -0.61 0.98 0.00 0.00 173.24 173.51 3dsf h GLN 54 N -1.27 0.12 -0.10 4.02 -0.00 -1.93 0.08 115.11 116.03 3dsf h GLN 54 Ca -0.49 -0.01 0.03 0.00 -0.00 0.00 0.00 58.65 58.19 3dsf h GLN 54 Cb 1.30 -0.03 -0.00 0.00 0.00 0.00 0.00 27.48 28.75 3dsf h GLN 54 CO 0.61 0.08 0.26 0.66 0.00 0.00 0.00 178.83 180.44 3dsf h SER 55 N 0.12 0.00 -0.52 -0.69 4.64 -1.93 0.13 113.55 115.30 3dsf h SER 55 Ca 0.28 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.36 3dsf h SER 55 Cb 0.44 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 62.39 3dsf h SER 55 CO -0.46 0.00 0.12 0.59 -0.87 0.00 0.00 176.83 176.21 3dsf n ASN 56 N -3.25 3.10 -1.51 4.97 3.02 -0.03 -4.96 115.26 116.60 3dsf n ASN 56 Ca 0.00 -3.61 -0.18 0.00 -0.03 0.00 0.00 54.58 50.76 3dsf n ASN 56 Cb 0.35 -0.68 -0.06 0.00 -0.61 0.00 0.00 39.78 38.78 3dsf n ASN 56 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3dsf n ASN 57 N -0.99 -5.16 -2.46 6.41 3.02 0.44 -3.36 115.26 113.17 3dsf n ASN 57 Ca 0.39 0.34 -0.18 0.00 -0.03 0.00 0.00 54.58 55.10 3dsf n ASN 57 Cb 1.19 -4.23 -0.01 0.00 -0.61 0.00 0.00 39.78 36.13 3dsf n ASN 57 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 3dsf n TYR 58 N -2.82 -1.22 -1.90 3.10 0.53 -0.93 -4.90 117.16 109.03 3dsf n TYR 58 Ca -0.19 0.03 -0.41 0.00 -1.02 0.00 0.00 57.90 56.31 3dsf n TYR 58 Cb 0.60 -3.52 -0.01 0.00 -1.03 0.00 0.00 39.34 35.38 3dsf n TYR 58 CO 0.00 0.00 0.00 -0.08 -1.02 0.00 0.00 176.86 175.76 3dsf s THR 59 N -2.88 2.32 0.14 -0.72 -1.32 -1.21 -4.47 115.64 107.49 3dsf s THR 59 Ca 0.02 0.29 0.07 0.00 -1.21 0.00 0.00 61.69 60.86 3dsf s THR 59 Cb -0.01 -3.19 -0.04 0.00 -1.51 0.00 0.00 72.50 67.75 3dsf s THR 59 CO 0.02 0.06 -0.06 0.42 -2.21 0.00 0.00 174.62 172.85 3dsf s THR 60 N -0.47 3.50 0.03 5.08 -4.23 -1.26 -1.67 115.64 116.62 3dsf s THR 60 Ca 0.57 -1.36 0.03 0.00 -1.18 0.00 0.00 61.69 59.75 3dsf s THR 60 Cb -0.45 -2.69 -0.02 0.00 1.34 0.00 0.00 72.50 70.68 3dsf s THR 60 CO 0.51 0.01 -0.09 -0.31 -0.54 0.00 0.00 174.62 174.20 3dsf s TYR 61 N -1.46 0.81 0.23 3.99 1.51 -0.20 -4.98 117.35 117.25 3dsf s TYR 61 Ca 0.24 -0.35 0.00 0.00 -1.01 0.00 0.00 57.07 55.95 3dsf s TYR 61 Cb -0.10 -0.49 -0.05 0.00 -0.11 0.00 0.00 41.96 41.21 3dsf s TYR 61 CO 0.16 -0.02 0.10 0.71 -1.11 0.00 0.00 175.55 175.38 3dsf s TYR 62 N -0.90 1.36 0.08 2.71 2.02 -1.26 -0.94 117.35 120.42 3dsf s TYR 62 Ca -0.03 -1.23 -0.05 0.00 -0.37 0.00 0.00 57.07 55.38 3dsf s TYR 62 Cb -0.07 -0.76 -0.05 0.00 -0.40 0.00 0.00 41.96 40.68 3dsf s TYR 62 CO 0.01 -0.43 0.33 0.00 -1.57 0.00 0.00 175.55 173.89 3dsf s ALA 63 N -3.89 3.83 0.35 3.71 0.00 -0.15 -4.90 121.76 120.71 3dsf s ALA 63 Ca 0.36 -0.57 0.08 0.00 0.00 0.00 0.00 51.96 51.83 3dsf s ALA 63 Cb 0.07 -2.09 0.80 0.00 0.00 0.00 0.00 23.12 21.90 3dsf s ALA 63 CO 0.12 0.67 1.87 -0.44 0.00 0.00 0.00 175.76 177.97 3dsf h ASP 64 N 3.32 0.68 0.53 0.00 3.32 -1.94 0.39 116.42 122.71 3dsf h ASP 64 Ca -0.47 0.04 0.00 0.00 0.02 0.00 0.00 57.03 56.62 3dsf h ASP 64 Cb 1.18 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.63 3dsf h ASP 64 CO 0.70 0.34 0.00 -1.54 -1.72 0.00 0.00 179.24 177.03 3dsf n SER 65 N -4.57 0.00 0.00 6.45 3.41 -1.26 -3.57 113.62 114.08 3dsf n SER 65 Ca 0.17 0.04 0.00 0.00 -0.26 0.00 0.00 58.87 58.82 3dsf n SER 65 Cb 0.46 -0.32 0.00 0.00 -0.26 0.00 0.00 64.21 64.08 3dsf n SER 65 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 3dsf n VAL 66 N -1.32 0.00 -1.67 -3.33 0.31 -0.44 -5.03 118.33 106.84 3dsf n VAL 66 Ca 0.11 -0.07 -0.37 0.00 -0.01 0.00 0.00 64.34 64.00 3dsf n VAL 66 Cb 0.21 0.54 0.07 0.00 -0.91 0.00 0.00 33.84 33.75 3dsf n VAL 66 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 3dsf n LYS 67 N -1.29 1.01 -0.48 5.55 4.81 -0.00 -1.18 118.16 126.57 3dsf n LYS 67 Ca 0.00 0.40 0.00 0.00 -0.87 0.00 0.00 58.31 57.84 3dsf n LYS 67 Cb 0.00 -2.45 0.00 0.00 0.02 0.00 0.00 35.03 32.60 3dsf n LYS 67 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 3dsf n ASP 68 N -1.76 0.00 0.00 3.14 8.00 -1.26 -4.62 116.55 120.05 3dsf n ASP 68 Ca 0.15 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.65 3dsf n ASP 68 Cb 0.48 -1.51 0.00 0.00 -0.02 0.00 0.00 41.12 40.07 3dsf n ASP 68 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 3dsf n ARG 69 N -2.00 1.97 -4.97 -1.24 0.63 -0.97 -5.01 116.66 105.07 3dsf n ARG 69 Ca 0.00 0.00 -0.32 0.00 -0.92 0.00 0.00 57.85 56.61 3dsf n ARG 69 Cb 0.00 -0.84 -0.15 0.00 0.45 0.00 0.00 32.46 31.92 3dsf n ARG 69 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 3dsf s PHE 70 N -1.68 2.67 -0.16 -0.14 2.99 -0.33 -1.30 117.98 120.04 3dsf s PHE 70 Ca 0.00 -0.59 0.01 0.00 0.00 0.00 0.00 56.93 56.35 3dsf s PHE 70 Cb 0.00 -1.72 0.02 0.00 0.00 0.00 0.00 43.02 41.32 3dsf s PHE 70 CO 0.00 -0.14 -0.15 -0.08 -0.00 0.00 0.00 175.22 174.85 3dsf s THR 71 N -0.03 1.69 0.08 0.64 -1.32 -0.38 -4.80 115.64 111.51 3dsf s THR 71 Ca -0.05 -0.74 -0.23 0.00 -1.21 0.00 0.00 61.69 59.46 3dsf s THR 71 Cb -0.14 -1.59 -0.06 0.00 -1.51 0.00 0.00 72.50 69.19 3dsf s THR 71 CO 0.04 0.45 0.69 -0.51 -2.21 0.00 0.00 174.62 173.08 3dsf s ILE 72 N 1.43 4.67 0.20 5.08 2.07 -1.26 -1.54 121.20 131.84 3dsf s ILE 72 Ca 0.04 1.48 -0.09 0.00 -1.41 0.00 0.00 60.65 60.67 3dsf s ILE 72 Cb -0.13 -4.03 -0.01 0.00 0.13 0.00 0.00 42.46 38.41 3dsf s ILE 72 CO -0.11 0.47 0.33 -0.94 -1.91 0.00 0.00 174.94 172.78 3dsf s SER 73 N -0.64 0.01 -0.05 4.50 1.04 -1.00 -5.01 113.70 112.54 3dsf s SER 73 Ca 0.34 -0.97 -0.03 0.00 0.48 0.00 0.00 55.95 55.76 3dsf s SER 73 Cb -0.21 0.48 0.02 0.00 0.10 0.00 0.00 66.02 66.42 3dsf s SER 73 CO 0.22 -0.98 0.13 0.00 0.98 0.00 0.00 173.24 173.59 3dsf s ARG 74 N -4.02 0.11 -0.46 4.02 1.70 -1.26 -0.46 118.95 118.59 3dsf s ARG 74 Ca 0.23 0.26 -0.13 0.00 -0.47 0.00 0.00 55.73 55.62 3dsf s ARG 74 Cb 0.02 -0.05 0.08 0.00 -0.57 0.00 0.00 34.95 34.43 3dsf s ARG 74 CO 0.05 -0.09 0.36 0.34 -1.08 0.00 0.00 175.30 174.88 3dsf s ASP 75 N 0.60 5.96 0.32 -2.89 2.15 0.09 -4.95 116.67 117.96 3dsf s ASP 75 Ca -0.04 -1.45 0.09 0.00 0.43 0.00 0.00 52.55 51.57 3dsf s ASP 75 Cb -0.06 -2.11 0.55 0.00 -0.30 0.00 0.00 42.92 41.00 3dsf s ASP 75 CO -0.03 -0.63 1.75 0.44 -0.17 0.00 0.00 175.17 176.53 3dsf h ASP 76 N 8.63 0.15 0.03 -0.34 3.32 -1.96 0.18 116.42 126.44 3dsf h ASP 76 Ca -0.26 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 56.72 3dsf h ASP 76 Cb 1.10 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 40.61 3dsf h ASP 76 CO 0.85 0.54 -0.03 0.28 -1.72 0.00 0.00 179.24 179.15 3dsf h SER 77 N 0.12 0.00 -0.01 6.45 0.02 -1.96 -2.86 113.55 115.32 3dsf h SER 77 Ca 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 3dsf h SER 77 Cb 0.76 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.30 3dsf h SER 77 CO 0.06 0.03 -0.05 0.00 -1.14 0.00 0.00 176.83 175.73 3dsf n GLN 78 N -4.47 0.93 -3.28 3.45 6.02 -1.15 -5.02 117.38 113.86 3dsf n GLN 78 Ca -0.03 -0.64 -0.15 0.00 -0.01 0.00 0.00 57.00 56.16 3dsf n GLN 78 Cb 0.12 -1.02 0.08 0.00 1.02 0.00 0.00 30.24 30.44 3dsf n GLN 78 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 3dsf n SER 79 N 0.00 -2.55 -4.21 1.08 7.64 -0.44 -4.81 113.62 110.33 3dsf n SER 79 Ca 0.03 -0.58 -0.28 0.00 1.01 0.00 0.00 58.87 59.05 3dsf n SER 79 Cb 0.12 -4.74 -0.16 0.00 -1.01 0.00 0.00 64.21 58.42 3dsf n SER 79 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 3dsf s MET 80 N -5.12 1.91 -0.08 1.43 1.00 -0.08 -1.45 119.30 116.91 3dsf s MET 80 Ca 0.05 -0.74 0.03 0.00 0.00 0.00 0.00 55.69 55.03 3dsf s MET 80 Cb -0.01 -1.73 -0.02 0.00 0.00 0.00 0.00 34.83 33.07 3dsf s MET 80 CO 0.67 0.37 -0.15 -1.17 0.00 0.00 0.00 175.02 174.74 3dsf s LEU 81 N -0.26 2.68 0.21 -0.03 2.96 0.65 -0.73 118.68 124.16 3dsf s LEU 81 Ca 0.02 -0.26 0.09 0.00 -0.22 0.00 0.00 54.13 53.76 3dsf s LEU 81 Cb -0.10 -1.56 -0.05 0.00 0.50 0.00 0.00 46.19 44.98 3dsf s LEU 81 CO 0.01 0.28 -0.17 -0.31 -1.32 0.00 0.00 176.35 174.84 3dsf s TYR 82 N -0.33 1.90 -0.25 5.38 2.02 0.39 -0.16 117.35 126.31 3dsf s TYR 82 Ca 0.03 -0.48 -0.03 0.00 -0.37 0.00 0.00 57.07 56.22 3dsf s TYR 82 Cb -0.13 -0.88 0.08 0.00 -0.40 0.00 0.00 41.96 40.63 3dsf s TYR 82 CO 0.02 0.44 0.08 -1.17 -1.57 0.00 0.00 175.55 173.36 3dsf s LEU 83 N -3.16 1.22 -0.15 -1.29 0.20 -0.57 -2.37 118.68 112.56 3dsf s LEU 83 Ca 0.22 -1.14 -0.29 0.00 0.69 0.00 0.00 54.13 53.60 3dsf s LEU 83 Cb -0.03 -0.57 -0.01 0.00 -0.43 0.00 0.00 46.19 45.15 3dsf s LEU 83 CO 0.09 -0.38 1.10 -1.10 -0.29 0.00 0.00 176.35 175.77 3dsf s GLN 84 N 1.89 4.32 -0.28 1.98 -1.52 -0.59 -2.06 119.66 123.39 3dsf s GLN 84 Ca 0.05 1.48 0.03 0.00 -1.95 0.00 0.00 55.36 54.97 3dsf s GLN 84 Cb -0.17 -3.62 0.07 0.00 -0.22 0.00 0.00 33.01 29.07 3dsf s GLN 84 CO -0.20 -0.51 -0.06 -1.64 -0.25 0.00 0.00 175.29 172.62 3dsf s MET 85 N 2.71 2.08 0.25 2.91 -1.94 0.81 -1.25 119.30 124.86 3dsf s MET 85 Ca 0.49 -1.47 0.06 0.00 -1.71 0.00 0.00 55.69 53.06 3dsf s MET 85 Cb -0.19 -3.00 -0.03 0.00 2.01 0.00 0.00 34.83 33.62 3dsf s MET 85 CO 0.14 -0.67 0.29 -0.80 -0.01 0.00 0.00 175.02 173.97 3dsf s ASN 86 N 1.08 5.96 -1.12 3.03 0.01 -0.42 -1.22 114.94 122.27 3dsf s ASN 86 Ca -0.04 -0.07 -0.27 0.00 -0.71 0.00 0.00 52.86 51.77 3dsf s ASN 86 Cb -0.20 -1.65 0.04 0.00 0.41 0.00 0.00 41.25 39.84 3dsf s ASN 86 CO -0.05 -0.06 0.66 -3.20 -1.51 0.00 0.00 177.10 172.94 3dsf n ASN 87 N -1.31 -4.28 -4.77 -1.22 5.15 -1.02 -4.73 115.26 103.09 3dsf n ASN 87 Ca -0.08 -1.23 -0.39 0.00 -0.60 0.00 0.00 54.58 52.27 3dsf n ASN 87 Cb 0.57 -1.60 -0.03 0.00 -0.53 0.00 0.00 39.78 38.20 3dsf n ASN 87 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3dsf s LEU 88 N -6.86 4.33 0.29 1.20 1.43 -0.93 -4.74 118.68 113.40 3dsf s LEU 88 Ca 0.37 2.42 0.10 0.00 -1.03 0.00 0.00 54.13 55.99 3dsf s LEU 88 Cb -0.21 -3.84 -0.05 0.00 0.03 0.00 0.00 46.19 42.13 3dsf s LEU 88 CO 0.96 -0.52 -0.01 -0.54 0.23 0.00 0.00 176.35 176.46 3dsf s LYS 89 N -1.98 2.18 0.26 1.70 1.02 -1.26 -0.58 119.74 121.08 3dsf s LYS 89 Ca 0.52 -1.54 -0.02 0.00 0.02 0.00 0.00 55.97 54.95 3dsf s LYS 89 Cb -0.33 -2.07 0.52 0.00 -0.52 0.00 0.00 37.83 35.43 3dsf s LYS 89 CO 0.43 0.29 1.73 1.15 -0.92 0.00 0.00 175.35 178.03 3dsf h THR 90 N 1.89 0.64 0.00 2.17 2.02 -1.97 -0.96 112.91 116.70 3dsf h THR 90 Ca -0.43 -0.16 0.00 0.00 0.77 0.00 0.00 66.41 66.58 3dsf h THR 90 Cb 1.25 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 67.78 3dsf h THR 90 CO 0.62 0.09 0.00 -1.84 0.37 0.00 0.00 175.52 174.75 3dsf n GLU 91 N -4.98 0.57 0.00 6.66 0.00 -1.26 -1.93 120.64 119.71 3dsf n GLU 91 Ca 0.16 0.00 0.12 0.00 0.00 0.00 0.00 57.16 57.44 3dsf n GLU 91 Cb 0.46 -1.38 0.19 0.00 0.00 0.00 0.00 31.44 30.71 3dsf n GLU 91 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 3dsf n ASP 92 N -0.88 0.99 -4.67 -1.84 8.00 -0.36 -4.90 116.55 112.88 3dsf n ASP 92 Ca 0.10 -0.78 -0.43 0.00 0.71 0.00 0.00 54.79 54.39 3dsf n ASP 92 Cb 0.05 0.38 -0.03 0.00 -0.02 0.00 0.00 41.12 41.49 3dsf n ASP 92 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 3dsf n THR 93 N -1.00 0.58 -3.60 -3.53 -1.04 -0.81 -4.89 114.28 99.99 3dsf n THR 93 Ca 0.08 -0.10 0.02 0.00 -2.04 0.00 0.00 64.05 62.00 3dsf n THR 93 Cb 0.36 -2.16 -0.01 0.00 -1.82 0.00 0.00 70.33 66.70 3dsf n THR 93 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3dsf s ALA 94 N 3.70 -2.31 -0.22 2.41 0.00 -0.18 -4.44 121.76 120.72 3dsf s ALA 94 Ca 0.87 0.90 -0.22 0.00 0.00 0.00 0.00 51.96 53.51 3dsf s ALA 94 Cb -0.50 0.25 -0.02 0.00 0.00 0.00 0.00 23.12 22.85 3dsf s ALA 94 CO 0.42 -1.00 0.71 1.41 0.00 0.00 0.00 175.76 177.30 3dsf s MET 95 N -2.28 4.18 -0.23 0.00 -2.45 -0.40 0.50 119.30 118.62 3dsf s MET 95 Ca 0.14 0.74 -0.11 0.00 -1.25 0.00 0.00 55.69 55.21 3dsf s MET 95 Cb 0.05 -3.62 -0.05 0.00 1.25 0.00 0.00 34.83 32.46 3dsf s MET 95 CO -0.05 -0.38 0.16 0.71 1.05 0.00 0.00 175.02 176.51 3dsf s TYR 96 N 2.39 3.34 -0.08 4.11 1.51 0.09 -1.08 117.35 127.63 3dsf s TYR 96 Ca 0.31 0.27 -0.01 0.00 -1.01 0.00 0.00 57.07 56.63 3dsf s TYR 96 Cb -0.16 -2.25 -0.03 0.00 -0.11 0.00 0.00 41.96 39.41 3dsf s TYR 96 CO 0.09 0.12 -0.03 0.71 -1.11 0.00 0.00 175.55 175.33 3dsf s TYR 97 N 0.89 3.05 -0.29 2.71 1.51 0.44 -2.80 117.35 122.87 3dsf s TYR 97 Ca 0.08 0.11 -0.10 0.00 -1.01 0.00 0.00 57.07 56.15 3dsf s TYR 97 Cb -0.13 -1.75 -0.03 0.00 -0.11 0.00 0.00 41.96 39.94 3dsf s TYR 97 CO 0.03 0.40 0.17 0.00 -1.11 0.00 0.00 175.55 175.04 3dsf s VAL 99 N 1.69 1.98 0.17 0.00 1.01 -0.38 -1.18 120.40 123.69 3dsf s VAL 99 Ca 0.06 -1.04 -0.15 0.00 0.00 0.00 0.00 61.98 60.85 3dsf s VAL 99 Cb -0.16 -1.66 -0.07 0.00 0.00 0.00 0.00 36.38 34.48 3dsf s VAL 99 CO 0.08 0.55 0.59 -0.60 0.00 0.00 0.00 175.10 175.73 3dsf s ARG 100 N -0.33 4.03 0.91 2.72 3.52 -0.44 -1.63 118.95 127.73 3dsf s ARG 100 Ca 0.02 0.56 0.00 0.00 -0.13 0.00 0.00 55.73 56.18 3dsf s ARG 100 Cb -0.12 -2.89 0.00 0.00 -1.56 0.00 0.00 34.95 30.38 3dsf s ARG 100 CO 0.02 0.44 0.00 0.94 -0.81 0.00 0.00 175.30 175.89 3dsf n GLN 101 N 0.71 0.00 -0.19 5.12 0.00 0.13 -0.71 117.38 122.45 3dsf n GLN 101 Ca -0.04 0.00 0.07 0.00 -0.00 0.00 0.00 57.00 57.03 3dsf n GLN 101 Cb 0.52 0.00 0.17 0.00 0.00 0.00 0.00 30.24 30.93 3dsf n GLN 101 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.06 176.94 3dsf n MET 102 N 4.95 2.50 0.00 3.69 1.56 -1.26 -4.68 117.12 123.88 3dsf n MET 102 Ca 0.00 -2.06 0.00 0.00 -0.27 0.00 0.00 57.70 55.37 3dsf n MET 102 Cb 0.00 -1.33 0.00 0.00 2.15 0.00 0.00 33.22 34.04 3dsf n MET 102 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 3dsf n GLY 103 N 0.81 1.86 0.13 -5.12 0.00 0.12 -5.04 105.19 97.95 3dsf n GLY 103 Ca 0.14 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.14 3dsf n GLY 103 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 3dsf h ASP 104 N 0.00 0.00 -3.74 1.61 3.04 -1.92 -3.44 116.42 111.98 3dsf h ASP 104 Ca 0.00 -0.00 -0.36 0.00 -3.24 0.00 0.00 57.03 53.43 3dsf h ASP 104 Cb 0.00 -0.00 -0.31 0.00 -1.04 0.00 0.00 39.33 37.98 3dsf h ASP 104 CO 0.00 0.63 -0.76 -0.31 -2.04 0.00 0.00 179.24 176.76 3dsf s TYR 105 N -3.58 0.56 0.14 4.15 1.51 -1.26 -5.04 117.35 113.83 3dsf s TYR 105 Ca -0.01 -0.12 0.10 0.00 -1.01 0.00 0.00 57.07 56.03 3dsf s TYR 105 Cb 0.13 -0.44 -0.04 0.00 -0.11 0.00 0.00 41.96 41.49 3dsf s TYR 105 CO 0.77 -0.08 -0.24 -1.58 -1.11 0.00 0.00 175.55 173.31 3dsf s TRP 106 N 0.31 2.16 0.59 2.71 0.52 -1.26 -1.32 118.94 122.64 3dsf s TRP 106 Ca -0.03 -0.39 -0.09 0.00 0.02 0.00 0.00 56.10 55.61 3dsf s TRP 106 Cb -0.07 -1.14 0.13 0.00 -1.15 0.00 0.00 33.47 31.24 3dsf s TRP 106 CO -0.00 0.35 0.80 0.41 0.02 0.00 0.00 176.95 178.53 3dsf n GLY 107 N 0.76 -0.98 0.15 0.98 0.00 -0.33 -4.75 105.19 101.02 3dsf n GLY 107 Ca -0.17 -1.75 0.09 0.00 0.00 0.00 0.00 46.02 44.19 3dsf n GLY 107 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 3dsf h GLN 108 N 0.00 0.00 0.00 1.61 -0.00 -1.91 -3.45 115.11 111.36 3dsf h GLN 108 Ca -0.26 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.39 3dsf h GLN 108 Cb 0.76 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.24 3dsf h GLN 108 CO 0.20 0.10 0.00 0.41 -0.00 0.00 0.00 178.83 179.54 3dsf n GLY 109 N 1.19 1.63 3.53 0.06 0.00 -1.26 -5.05 105.19 105.28 3dsf n GLY 109 Ca 0.00 -1.59 -0.31 0.00 0.00 0.00 0.00 46.02 44.12 3dsf n GLY 109 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dsf s THR 110 N -1.49 3.22 0.16 2.61 -4.23 -1.12 -4.83 115.64 109.96 3dsf s THR 110 Ca 0.00 -0.97 -0.27 0.00 -1.18 0.00 0.00 61.69 59.27 3dsf s THR 110 Cb 0.00 -2.38 -0.08 0.00 1.34 0.00 0.00 72.50 71.39 3dsf s THR 110 CO 0.00 0.37 0.84 -0.89 -0.54 0.00 0.00 174.62 174.40 3dsf s THR 111 N -0.96 4.37 -0.09 3.99 2.01 -1.26 -0.73 115.64 122.97 3dsf s THR 111 Ca 0.16 1.84 0.02 0.00 0.31 0.00 0.00 61.69 64.02 3dsf s THR 111 Cb -0.11 -4.21 -0.02 0.00 0.01 0.00 0.00 72.50 68.18 3dsf s THR 111 CO 0.06 0.46 -0.16 -0.22 -0.69 0.00 0.00 174.62 174.08 3dsf s LEU 112 N -0.82 2.58 -0.21 4.42 2.96 0.18 -1.74 118.68 126.05 3dsf s LEU 112 Ca 0.39 -0.33 0.01 0.00 -0.22 0.00 0.00 54.13 53.98 3dsf s LEU 112 Cb -0.23 -1.54 0.05 0.00 0.50 0.00 0.00 46.19 44.96 3dsf s LEU 112 CO 0.28 0.23 -0.08 -0.89 -1.32 0.00 0.00 176.35 174.57 3dsf s THR 113 N -0.07 1.53 -0.41 3.68 2.01 -1.09 -1.01 115.64 120.29 3dsf s THR 113 Ca -0.03 -1.05 -0.13 0.00 0.31 0.00 0.00 61.69 60.78 3dsf s THR 113 Cb -0.14 -1.70 0.03 0.00 0.01 0.00 0.00 72.50 70.70 3dsf s THR 113 CO 0.04 0.05 0.28 -0.69 -0.69 0.00 0.00 174.62 173.61 3dsf s VAL 114 N 1.42 4.97 -0.16 3.82 1.01 -1.26 -1.54 120.40 128.66 3dsf s VAL 114 Ca -0.03 -0.81 -0.28 0.00 0.00 0.00 0.00 61.98 60.85 3dsf s VAL 114 Cb -0.17 -3.80 0.08 0.00 0.00 0.00 0.00 36.38 32.48 3dsf s VAL 114 CO -0.07 -0.33 0.74 -0.55 0.00 0.00 0.00 175.10 174.90 3dsf s SER 115 N 1.75 -0.66 0.00 3.32 0.15 -1.14 -4.61 113.70 112.51 3dsf s SER 115 Ca 0.04 0.99 0.20 0.00 0.70 0.00 0.00 55.95 57.88 3dsf s SER 115 Cb -0.20 0.91 0.57 0.00 -1.71 0.00 0.00 66.02 65.58 3dsf s SER 115 CO 0.08 -0.42 1.45 -1.54 1.20 0.00 0.00 173.24 174.02 3dsf n SER 116 N 1.67 2.46 -4.80 5.45 3.41 -1.26 -4.12 113.62 116.44 3dsf n SER 116 Ca -0.16 -1.87 -0.33 0.00 -0.26 0.00 0.00 58.87 56.25 3dsf n SER 116 Cb 0.56 -0.20 0.01 0.00 -0.26 0.00 0.00 64.21 64.32 3dsf n SER 116 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dsf s ALA 117 N -1.60 2.72 0.06 7.33 0.00 -1.26 -5.04 121.76 123.97 3dsf s ALA 117 Ca 0.34 0.47 -0.08 0.00 0.00 0.00 0.00 51.96 52.70 3dsf s ALA 117 Cb 0.19 -3.25 -0.05 0.00 0.00 0.00 0.00 23.12 20.00 3dsf s ALA 117 CO 0.27 -0.79 0.34 0.08 0.00 0.00 0.00 175.76 175.66 3dsf s VAL 118 N -2.32 5.18 0.09 0.00 1.01 -1.26 -5.03 120.40 118.07 3dsf s VAL 118 Ca 0.65 0.30 -0.31 0.00 0.00 0.00 0.00 61.98 62.62 3dsf s VAL 118 Cb -0.17 -3.61 -0.08 0.00 0.00 0.00 0.00 36.38 32.51 3dsf s VAL 118 CO 0.34 0.30 1.59 -0.54 0.00 0.00 0.00 175.10 176.79 3dsf s LYS 119 N -1.92 4.22 -0.03 2.72 1.02 -1.26 -4.65 119.74 119.84 3dsf s LYS 119 Ca 0.32 2.29 0.01 0.00 0.02 0.00 0.00 55.97 58.60 3dsf s LYS 119 Cb -0.13 -3.45 0.01 0.00 -0.52 0.00 0.00 37.83 33.73 3dsf s LYS 119 CO 0.18 -0.66 -0.04 0.99 -0.92 0.00 0.00 175.35 174.89 3dsf s THR 120 N 2.11 0.45 0.53 2.17 2.01 0.63 -4.94 115.64 118.60 3dsf s THR 120 Ca 0.71 -0.14 -0.19 0.00 0.31 0.00 0.00 61.69 62.38 3dsf s THR 120 Cb -0.40 -0.45 -0.06 0.00 0.01 0.00 0.00 72.50 71.60 3dsf s THR 120 CO 0.31 0.17 1.10 -2.16 -0.69 0.00 0.00 174.62 173.36 3dsf s PRO 121 N 0.52 3.45 0.52 4.92 0.04 -1.26 -2.33 135.00 140.86 3dsf s PRO 121 Ca -0.06 1.53 -0.07 0.00 0.04 0.00 0.00 61.00 62.44 3dsf s PRO 121 Cb -0.10 -2.03 -0.04 0.00 0.04 0.00 0.00 34.50 32.38 3dsf s PRO 121 CO -0.00 -0.76 0.86 -1.25 0.04 0.00 0.00 177.00 175.89 3dsf s PRO 122 N -3.32 3.58 -0.26 0.56 0.04 -1.25 -4.60 135.00 129.75 3dsf s PRO 122 Ca 0.71 0.39 -0.11 0.00 0.04 0.00 0.00 61.00 62.03 3dsf s PRO 122 Cb -0.22 -2.28 -0.05 0.00 0.04 0.00 0.00 34.50 31.99 3dsf s PRO 122 CO 0.26 -0.31 0.21 -1.12 0.04 0.00 0.00 177.00 176.08 3dsf s SER 123 N -4.07 6.10 -0.24 6.66 0.01 0.43 -4.92 113.70 117.66 3dsf s SER 123 Ca 0.50 0.09 -0.10 0.00 1.31 0.00 0.00 55.95 57.75 3dsf s SER 123 Cb -0.10 -2.13 -0.05 0.00 0.21 0.00 0.00 66.02 63.95 3dsf s SER 123 CO 0.47 -0.03 0.15 -0.69 0.41 0.00 0.00 173.24 173.55 3dsf s VAL 124 N 1.53 5.22 -0.05 3.43 1.01 -1.26 -0.91 120.40 129.36 3dsf s VAL 124 Ca 0.09 0.13 0.05 0.00 0.00 0.00 0.00 61.98 62.25 3dsf s VAL 124 Cb -0.15 -3.44 -0.02 0.00 0.00 0.00 0.00 36.38 32.78 3dsf s VAL 124 CO 0.08 0.34 -0.21 -0.31 0.00 0.00 0.00 175.10 175.00 3dsf s TYR 125 N 1.17 2.51 0.25 5.22 4.12 -0.11 -5.01 117.35 125.50 3dsf s TYR 125 Ca 0.07 -0.49 -0.30 0.00 0.02 0.00 0.00 57.07 56.37 3dsf s TYR 125 Cb -0.14 -1.60 -0.09 0.00 -1.52 0.00 0.00 41.96 38.61 3dsf s TYR 125 CO 0.05 -0.06 1.09 -1.25 0.02 0.00 0.00 175.55 175.40 3dsf s PRO 126 N -0.38 4.65 -0.38 -1.71 0.04 -1.26 -1.45 135.00 134.50 3dsf s PRO 126 Ca 0.03 1.75 -0.10 0.00 0.04 0.00 0.00 61.00 62.72 3dsf s PRO 126 Cb -0.12 -3.22 0.03 0.00 0.04 0.00 0.00 34.50 31.23 3dsf s PRO 126 CO 0.02 0.20 0.20 -0.51 0.04 0.00 0.00 177.00 176.95 3dsf s LEU 127 N -1.10 4.72 0.15 -3.56 1.02 -0.56 -4.86 118.68 114.50 3dsf s LEU 127 Ca 0.46 -1.05 0.08 0.00 0.02 0.00 0.00 54.13 53.64 3dsf s LEU 127 Cb -0.31 -2.01 -0.04 0.00 0.02 0.00 0.00 46.19 43.85 3dsf s LEU 127 CO 0.38 -0.39 -0.08 0.00 0.02 0.00 0.00 176.35 176.28 3dsf s ALA 128 N 1.53 2.99 0.52 4.21 0.00 -1.26 -2.31 121.76 127.43 3dsf s ALA 128 Ca 0.02 -1.38 -0.20 0.00 0.00 0.00 0.00 51.96 50.40 3dsf s ALA 128 Cb -0.19 -0.83 -0.07 0.00 0.00 0.00 0.00 23.12 22.03 3dsf s ALA 128 CO 0.06 0.53 1.08 -2.14 0.00 0.00 0.00 175.76 175.29 3dsf s PRO 129 N -2.64 3.57 0.07 0.00 0.02 -1.26 -5.02 135.00 129.73 3dsf s PRO 129 Ca 0.24 1.46 -0.01 0.00 0.02 0.00 0.00 61.00 62.71 3dsf s PRO 129 Cb -0.10 -2.05 -0.04 0.00 0.02 0.00 0.00 34.50 32.33 3dsf s PRO 129 CO 0.15 -0.64 -0.02 0.20 -0.33 0.00 0.00 177.00 176.36 3dsf s GLY 130 N -1.94 0.60 0.00 0.52 0.00 -1.26 -4.74 107.32 100.50 3dsf s GLY 130 Ca 0.69 -1.28 0.00 0.00 0.00 0.00 0.00 44.72 44.14 3dsf s GLY 130 CO 0.24 -1.35 0.00 0.61 0.00 0.00 0.00 173.10 172.60 3dsf n GLY 131 N 0.05 2.30 0.00 0.20 0.00 -1.26 -4.95 105.19 101.54 3dsf n GLY 131 Ca -0.12 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.78 3dsf n GLY 131 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dsf n GLY 132 N 0.00 0.64 3.08 -0.02 0.00 -1.26 -5.10 105.19 102.54 3dsf n GLY 132 Ca 0.00 -1.96 -0.16 0.00 0.00 0.00 0.00 46.02 43.90 3dsf n GLY 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dsf n ALA 133 N -1.00 -2.77 -2.67 4.61 0.00 -1.26 -4.96 120.51 112.46 3dsf n ALA 133 Ca 0.00 0.78 -0.40 0.00 0.00 0.00 0.00 53.44 53.81 3dsf n ALA 133 Cb 0.00 -3.03 -0.05 0.00 0.00 0.00 0.00 19.45 16.37 3dsf n ALA 133 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 3dsf s ILE 134 N -2.39 4.97 -0.28 0.00 2.07 -1.26 -4.97 121.20 119.35 3dsf s ILE 134 Ca 0.24 1.38 0.09 0.00 -1.41 0.00 0.00 60.65 60.96 3dsf s ILE 134 Cb -0.05 -4.03 0.50 0.00 0.13 0.00 0.00 42.46 39.02 3dsf s ILE 134 CO 0.80 0.10 1.45 -1.54 -1.91 0.00 0.00 174.94 173.84 3dsf n SER 135 N 4.96 2.52 -3.65 4.50 3.41 -1.26 -4.95 113.62 119.14 3dsf n SER 135 Ca 0.01 -3.73 -0.09 0.00 -0.26 0.00 0.00 58.87 54.79 3dsf n SER 135 Cb 0.50 -0.63 -0.08 0.00 -0.26 0.00 0.00 64.21 63.74 3dsf n SER 135 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 3dsf s ASN 136 N -2.53 -0.80 0.42 4.04 3.04 -1.26 -5.03 114.94 112.81 3dsf s ASN 136 Ca 0.44 1.35 0.08 0.00 0.04 0.00 0.00 52.86 54.77 3dsf s ASN 136 Cb 0.40 1.26 0.88 0.00 -1.54 0.00 0.00 41.25 42.25 3dsf s ASN 136 CO 0.00 -0.23 2.04 -1.28 -3.04 0.00 0.00 177.10 174.59 3dsf h SER 137 N 6.58 0.39 -3.35 -4.21 0.87 -1.97 -3.41 113.55 108.44 3dsf h SER 137 Ca -0.31 -0.02 -0.57 0.00 -1.23 0.00 0.00 61.79 59.66 3dsf h SER 137 Cb 1.21 -0.10 -0.08 0.00 -0.44 0.00 0.00 62.40 62.99 3dsf h SER 137 CO 0.17 0.32 -0.05 -0.04 -0.53 0.00 0.00 176.83 176.70 3dsf s MET 138 N -5.32 4.35 -0.16 2.24 -1.94 -1.26 -2.53 119.30 114.67 3dsf s MET 138 Ca -0.07 0.58 -0.07 0.00 -1.71 0.00 0.00 55.69 54.42 3dsf s MET 138 Cb 0.17 -3.46 -0.04 0.00 2.01 0.00 0.00 34.83 33.51 3dsf s MET 138 CO 0.73 0.08 0.06 0.54 -0.01 0.00 0.00 175.02 176.41 3dsf s VAL 139 N 0.85 4.76 -0.18 -6.03 0.11 0.11 -4.90 120.40 115.12 3dsf s VAL 139 Ca 0.29 -0.05 -0.16 0.00 -2.93 0.00 0.00 61.98 59.13 3dsf s VAL 139 Cb -0.16 -3.12 -0.04 0.00 -1.53 0.00 0.00 36.38 31.53 3dsf s VAL 139 CO 0.12 0.49 0.38 0.42 -3.33 0.00 0.00 175.10 173.19 3dsf s THR 140 N 0.10 5.23 0.31 5.04 -4.23 -1.26 -1.08 115.64 119.74 3dsf s THR 140 Ca 0.05 0.70 0.08 0.00 -1.18 0.00 0.00 61.69 61.34 3dsf s THR 140 Cb -0.12 -3.71 -0.06 0.00 1.34 0.00 0.00 72.50 69.94 3dsf s THR 140 CO 0.01 0.30 -0.08 -0.76 -0.54 0.00 0.00 174.62 173.55 3dsf s LEU 141 N 0.99 2.59 0.00 4.79 1.43 0.27 -4.73 118.68 124.02 3dsf s LEU 141 Ca 0.19 -1.19 -0.02 0.00 -1.03 0.00 0.00 54.13 52.08 3dsf s LEU 141 Cb -0.14 -0.81 0.01 0.00 0.03 0.00 0.00 46.19 45.28 3dsf s LEU 141 CO 0.07 -0.27 0.26 0.61 0.23 0.00 0.00 176.35 177.25 3dsf n GLY 142 N -0.67 2.35 3.01 -3.19 0.00 -0.98 0.14 105.19 105.85 3dsf n GLY 142 Ca -0.05 -1.38 -0.13 0.00 0.00 0.00 0.00 46.02 44.45 3dsf n GLY 142 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dsf s LEU 144 N 2.44 4.43 -0.23 0.00 2.96 -0.53 -0.75 118.68 127.00 3dsf s LEU 144 Ca 0.02 1.22 0.02 0.00 -0.22 0.00 0.00 54.13 55.17 3dsf s LEU 144 Cb -0.12 -2.98 0.04 0.00 0.50 0.00 0.00 46.19 43.63 3dsf s LEU 144 CO -0.09 0.09 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.20 3dsf s VAL 145 N -0.21 2.10 -0.01 1.68 1.01 0.74 -0.93 120.40 124.78 3dsf s VAL 145 Ca 0.32 -1.36 0.06 0.00 0.00 0.00 0.00 61.98 61.01 3dsf s VAL 145 Cb -0.19 -2.10 -0.03 0.00 0.00 0.00 0.00 36.38 34.07 3dsf s VAL 145 CO 0.18 0.18 -0.19 0.21 0.00 0.00 0.00 175.10 175.48 3dsf s ASN 146 N 1.18 3.65 -0.54 3.32 2.47 -0.09 -2.01 114.94 122.92 3dsf s ASN 146 Ca -0.04 -0.35 -0.11 0.00 0.42 0.00 0.00 52.86 52.79 3dsf s ASN 146 Cb -0.17 -0.61 0.01 0.00 -1.45 0.00 0.00 41.25 39.03 3dsf s ASN 146 CO -0.08 0.31 0.64 0.61 -3.72 0.00 0.00 177.10 174.86 3dsf n GLY 147 N 2.13 -1.27 3.02 1.21 0.00 -0.94 -0.43 105.19 108.90 3dsf n GLY 147 Ca -0.17 0.98 -0.13 0.00 0.00 0.00 0.00 46.02 46.71 3dsf n GLY 147 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3dsf s TYR 148 N -2.74 0.53 -0.15 1.61 -0.85 -0.95 -3.88 117.35 110.92 3dsf s TYR 148 Ca 0.16 -0.41 -0.14 0.00 -0.52 0.00 0.00 57.07 56.16 3dsf s TYR 148 Cb -0.04 -0.33 0.04 0.00 0.38 0.00 0.00 41.96 42.01 3dsf s TYR 148 CO 0.77 -0.08 0.41 0.12 -1.52 0.00 0.00 175.55 175.24 3dsf s PHE 149 N -1.11 -0.45 0.34 -3.49 5.36 -0.98 -0.36 117.98 117.29 3dsf s PHE 149 Ca -0.08 1.10 -0.00 0.00 -0.96 0.00 0.00 56.93 56.98 3dsf s PHE 149 Cb -0.08 0.15 0.07 0.00 -0.34 0.00 0.00 43.02 42.82 3dsf s PHE 149 CO 0.00 -0.22 0.47 -0.35 -1.46 0.00 0.00 175.22 173.66 3dsf n PRO 150 N 2.87 0.26 -1.68 10.12 -0.04 -1.26 -0.27 135.00 145.01 3dsf n PRO 150 Ca -0.13 -1.26 -0.32 0.00 -0.04 0.00 0.00 63.50 61.75 3dsf n PRO 150 Cb 0.57 -0.31 0.05 0.00 -0.04 0.00 0.00 33.50 33.77 3dsf n PRO 150 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3dsf s GLU 151 N -3.66 2.82 0.52 0.54 0.41 -1.26 -4.77 118.70 113.30 3dsf s GLU 151 Ca 0.31 1.23 0.08 0.00 -0.41 0.00 0.00 54.97 56.18 3dsf s GLU 151 Cb -0.02 -1.96 0.05 0.00 -1.78 0.00 0.00 34.13 30.42 3dsf s GLU 151 CO 0.20 -1.22 0.58 -1.25 -0.49 0.00 0.00 175.26 173.09 3dsf s PRO 152 N -4.41 2.38 0.30 0.39 0.04 -1.26 -5.02 135.00 127.43 3dsf s PRO 152 Ca 0.64 -1.70 0.10 0.00 0.04 0.00 0.00 61.00 60.07 3dsf s PRO 152 Cb -0.18 -2.44 -0.06 0.00 0.04 0.00 0.00 34.50 31.86 3dsf s PRO 152 CO 0.46 -0.61 -0.13 0.14 0.04 0.00 0.00 177.00 176.90 3dsf s VAL 153 N -2.63 2.21 -0.17 -0.36 -7.23 -1.26 -4.37 120.40 106.58 3dsf s VAL 153 Ca 0.50 -2.27 -0.00 0.00 -1.81 0.00 0.00 61.98 58.40 3dsf s VAL 153 Cb -0.05 -2.46 0.04 0.00 0.56 0.00 0.00 36.38 34.48 3dsf s VAL 153 CO 0.31 -0.31 -0.07 -0.89 -0.31 0.00 0.00 175.10 173.83 3dsf s THR 154 N -2.66 1.26 -0.16 5.32 2.01 -0.53 -4.98 115.64 115.91 3dsf s THR 154 Ca 0.30 -0.71 -0.03 0.00 0.31 0.00 0.00 61.69 61.57 3dsf s THR 154 Cb -0.00 -1.39 -0.02 0.00 0.01 0.00 0.00 72.50 71.09 3dsf s THR 154 CO 0.15 0.17 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.49 3dsf s VAL 155 N 1.57 3.58 0.23 3.82 1.01 -1.26 -0.28 120.40 129.07 3dsf s VAL 155 Ca 0.01 -0.46 0.01 0.00 0.00 0.00 0.00 61.98 61.54 3dsf s VAL 155 Cb -0.15 -2.57 -0.05 0.00 0.00 0.00 0.00 36.38 33.61 3dsf s VAL 155 CO -0.08 0.49 0.06 0.42 0.00 0.00 0.00 175.10 175.99 3dsf s THR 156 N 0.58 0.59 -0.06 3.92 -4.23 -1.04 -4.96 115.64 110.44 3dsf s THR 156 Ca -0.04 -1.99 0.05 0.00 -1.18 0.00 0.00 61.69 58.53 3dsf s THR 156 Cb -0.15 -2.45 -0.01 0.00 1.34 0.00 0.00 72.50 71.23 3dsf s THR 156 CO 0.03 -0.17 -0.23 0.26 -0.54 0.00 0.00 174.62 173.97 3dsf s TRP 157 N -3.73 2.30 -0.98 3.99 0.52 -1.26 0.11 118.94 119.88 3dsf s TRP 157 Ca 0.33 -0.75 -0.14 0.00 0.02 0.00 0.00 56.10 55.56 3dsf s TRP 157 Cb 0.07 -1.52 0.01 0.00 -1.15 0.00 0.00 33.47 30.88 3dsf s TRP 157 CO 0.10 -0.26 0.68 0.09 0.02 0.00 0.00 176.95 177.58 3dsf n ASN 158 N 3.14 -5.12 0.00 2.95 4.13 0.32 -1.37 115.26 119.31 3dsf n ASN 158 Ca -0.18 -0.96 0.00 0.00 1.68 0.00 0.00 54.58 55.12 3dsf n ASN 158 Cb 0.52 -2.47 0.00 0.00 -1.54 0.00 0.00 39.78 36.30 3dsf n ASN 158 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3dsf n ALA 159 N -3.50 0.00 0.00 5.41 0.00 -1.26 -0.30 120.51 120.86 3dsf n ALA 159 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.26 3dsf n ALA 159 Cb 0.62 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.07 3dsf n ALA 159 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dsf n GLY 160 N -0.39 0.86 0.23 0.00 0.00 -0.47 -5.01 105.19 100.40 3dsf n GLY 160 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 3dsf n GLY 160 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3dsf h SER 161 N 0.00 0.27 -2.66 1.61 0.02 -0.39 -3.36 113.55 109.03 3dsf h SER 161 Ca 0.00 -0.07 -0.72 0.00 -0.84 0.00 0.00 61.79 60.15 3dsf h SER 161 Cb 0.00 -0.07 -0.20 0.00 0.14 0.00 0.00 62.40 62.27 3dsf h SER 161 CO 0.00 0.49 0.81 -0.76 -1.14 0.00 0.00 176.83 176.23 3dsf s LEU 162 N -8.64 5.42 0.03 5.07 2.01 -1.16 -4.86 118.68 116.56 3dsf s LEU 162 Ca -0.05 -2.47 -0.17 0.00 0.01 0.00 0.00 54.13 51.44 3dsf s LEU 162 Cb 0.15 -2.36 -0.26 0.00 0.01 0.00 0.00 46.19 43.73 3dsf s LEU 162 CO 0.75 -0.86 1.11 1.23 1.01 0.00 0.00 176.35 179.59 3dsf h GLY 163 N 9.57 0.62 -2.15 -3.19 0.00 -1.90 -3.42 103.07 102.61 3dsf h GLY 163 Ca 0.19 -1.18 -0.57 0.00 0.00 0.00 0.00 47.33 45.77 3dsf h GLY 163 CO 1.07 1.04 -0.57 -1.35 0.00 0.00 0.00 176.54 176.73 3dsf s SER 164 N -7.13 4.39 0.00 0.19 1.04 -1.26 -4.59 113.70 106.34 3dsf s SER 164 Ca -0.11 -0.93 0.00 0.00 0.48 0.00 0.00 55.95 55.39 3dsf s SER 164 Cb 0.05 -0.59 0.00 0.00 0.10 0.00 0.00 66.02 65.57 3dsf s SER 164 CO 0.89 -0.31 0.00 0.61 0.98 0.00 0.00 173.24 175.41 3dsf n GLY 165 N -1.07 0.52 3.27 7.32 0.00 -1.26 -4.80 105.19 109.17 3dsf n GLY 165 Ca -0.03 -0.08 -0.36 0.00 0.00 0.00 0.00 46.02 45.55 3dsf n GLY 165 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dsf s VAL 166 N -2.00 3.51 -0.31 1.61 1.01 -1.26 -2.21 120.40 120.75 3dsf s VAL 166 Ca 0.00 -0.95 -0.08 0.00 0.00 0.00 0.00 61.98 60.96 3dsf s VAL 166 Cb 0.00 -2.86 0.01 0.00 0.00 0.00 0.00 36.38 33.53 3dsf s VAL 166 CO 0.00 0.04 0.10 -1.00 0.00 0.00 0.00 175.10 174.25 3dsf s HIS 167 N 1.40 3.17 -0.34 5.22 3.76 -0.03 -4.97 115.29 123.50 3dsf s HIS 167 Ca 0.00 -0.95 -0.13 0.00 -0.15 0.00 0.00 55.06 53.83 3dsf s HIS 167 Cb -0.18 -2.29 -0.01 0.00 1.11 0.00 0.00 32.58 31.21 3dsf s HIS 167 CO 0.00 -0.58 0.24 0.99 -0.85 0.00 0.00 174.74 174.55 3dsf s THR 168 N 1.51 5.22 0.22 1.30 2.01 -1.26 -1.04 115.64 123.59 3dsf s THR 168 Ca 0.02 -0.28 -0.23 0.00 0.31 0.00 0.00 61.69 61.51 3dsf s THR 168 Cb -0.17 -3.70 -0.08 0.00 0.01 0.00 0.00 72.50 68.55 3dsf s THR 168 CO 0.03 -0.03 0.78 -0.36 -0.69 0.00 0.00 174.62 174.35 3dsf s PHE 169 N 1.71 3.76 0.00 4.92 0.08 -1.03 -5.03 117.98 122.38 3dsf s PHE 169 Ca 0.06 1.55 0.00 0.00 0.12 0.00 0.00 56.93 58.66 3dsf s PHE 169 Cb -0.18 -2.73 0.00 0.00 -0.57 0.00 0.00 43.02 39.55 3dsf s PHE 169 CO 0.10 0.39 0.60 -2.30 -0.10 0.00 0.00 175.22 173.91 3dsf n PRO 170 N 1.03 0.00 0.00 0.24 -0.02 -1.26 -4.54 135.00 130.45 3dsf n PRO 170 Ca -0.03 0.59 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 3dsf n PRO 170 Cb 0.50 -1.10 0.00 0.00 -0.02 0.00 0.00 33.50 32.88 3dsf n PRO 170 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3dsf n ALA 171 N -1.38 0.00 -3.29 3.55 0.00 -1.26 -4.86 120.51 113.26 3dsf n ALA 171 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 3dsf n ALA 171 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.36 3dsf n ALA 171 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3dsf s VAL 172 N -2.00 0.02 -0.02 0.00 0.11 -1.16 -4.94 120.40 112.41 3dsf s VAL 172 Ca 0.00 -0.14 -0.15 0.00 -2.93 0.00 0.00 61.98 58.76 3dsf s VAL 172 Cb 0.00 -0.61 -0.06 0.00 -1.53 0.00 0.00 36.38 34.19 3dsf s VAL 172 CO 0.00 -0.08 0.41 -0.76 -3.33 0.00 0.00 175.10 171.34 3dsf s LEU 173 N -0.32 4.45 0.10 2.54 1.43 -1.26 -2.49 118.68 123.13 3dsf s LEU 173 Ca -0.05 0.94 0.00 0.00 -1.03 0.00 0.00 54.13 53.99 3dsf s LEU 173 Cb -0.03 -2.59 0.00 0.00 0.03 0.00 0.00 46.19 43.60 3dsf s LEU 173 CO 0.02 0.29 0.00 0.00 0.23 0.00 0.00 176.35 176.89 3dsf n GLN 174 N 2.06 0.00 -3.21 1.70 0.00 -1.11 -4.96 117.38 111.86 3dsf n GLN 174 Ca -0.13 0.00 -0.24 0.00 0.00 0.00 0.00 57.00 56.63 3dsf n GLN 174 Cb 0.52 -0.41 -0.06 0.00 0.00 0.00 0.00 30.24 30.29 3dsf n GLN 174 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 3dsf n SER 175 N -3.35 1.72 -1.93 2.61 7.64 -1.26 -4.86 113.62 114.19 3dsf n SER 175 Ca 0.00 -3.07 -0.16 0.00 1.01 0.00 0.00 58.87 56.65 3dsf n SER 175 Cb 0.10 -0.63 -0.04 0.00 -1.01 0.00 0.00 64.21 62.63 3dsf n SER 175 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 3dsf n ASP 176 N 0.81 -4.57 -4.07 6.43 8.00 -1.26 -4.97 116.55 116.92 3dsf n ASP 176 Ca 0.25 0.26 -0.19 0.00 0.71 0.00 0.00 54.79 55.82 3dsf n ASP 176 Cb 0.51 -3.99 -0.14 0.00 -0.02 0.00 0.00 41.12 37.48 3dsf n ASP 176 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3dsf s LEU 177 N -4.96 2.09 0.09 0.64 1.43 -1.26 -4.76 118.68 111.95 3dsf s LEU 177 Ca 0.00 -0.30 0.01 0.00 -1.03 0.00 0.00 54.13 52.81 3dsf s LEU 177 Cb 0.00 -0.50 -0.04 0.00 0.03 0.00 0.00 46.19 45.68 3dsf s LEU 177 CO 0.00 0.06 0.22 -0.31 0.23 0.00 0.00 176.35 176.55 3dsf s TYR 178 N -0.54 3.48 -0.13 0.29 1.51 0.51 -2.74 117.35 119.73 3dsf s TYR 178 Ca 0.02 0.19 -0.05 0.00 -1.01 0.00 0.00 57.07 56.22 3dsf s TYR 178 Cb -0.06 -1.72 0.06 0.00 -0.11 0.00 0.00 41.96 40.14 3dsf s TYR 178 CO 0.00 0.56 0.27 0.99 -1.11 0.00 0.00 175.55 176.26 3dsf s THR 179 N -1.57 -0.34 0.04 -0.71 2.01 -1.04 -2.22 115.64 111.80 3dsf s THR 179 Ca 0.34 0.25 0.00 0.00 0.31 0.00 0.00 61.69 62.60 3dsf s THR 179 Cb -0.12 -0.44 -0.03 0.00 0.01 0.00 0.00 72.50 71.92 3dsf s THR 179 CO 0.28 0.10 -0.04 -1.48 -0.69 0.00 0.00 174.62 172.79 3dsf s LEU 180 N 2.18 2.32 0.23 4.42 2.34 -0.85 -2.98 118.68 126.34 3dsf s LEU 180 Ca -0.01 -0.65 0.10 0.00 0.06 0.00 0.00 54.13 53.62 3dsf s LEU 180 Cb -0.12 0.06 -0.04 0.00 -0.56 0.00 0.00 46.19 45.53 3dsf s LEU 180 CO -0.09 -0.36 -0.06 -0.44 -1.06 0.00 0.00 176.35 174.34 3dsf s SER 181 N -1.91 4.32 0.04 1.48 0.01 -1.26 -0.18 113.70 116.20 3dsf s SER 181 Ca -0.08 -0.66 0.06 0.00 1.31 0.00 0.00 55.95 56.58 3dsf s SER 181 Cb -0.05 -0.74 -0.02 0.00 0.21 0.00 0.00 66.02 65.42 3dsf s SER 181 CO -0.03 0.05 -0.17 -0.55 0.41 0.00 0.00 173.24 172.95 3dsf s SER 182 N -3.33 2.01 0.03 2.44 0.15 0.07 -2.48 113.70 112.59 3dsf s SER 182 Ca 0.29 -0.48 0.06 0.00 0.70 0.00 0.00 55.95 56.52 3dsf s SER 182 Cb -0.07 -0.15 -0.02 0.00 -1.71 0.00 0.00 66.02 64.07 3dsf s SER 182 CO 0.18 0.09 -0.18 -0.94 1.20 0.00 0.00 173.24 173.58 3dsf s SER 183 N -1.14 2.17 -0.01 5.45 1.04 -0.21 -0.86 113.70 120.15 3dsf s SER 183 Ca 0.04 -0.46 0.01 0.00 0.48 0.00 0.00 55.95 56.02 3dsf s SER 183 Cb -0.08 -0.19 0.01 0.00 0.10 0.00 0.00 66.02 65.86 3dsf s SER 183 CO 0.01 0.14 -0.03 0.54 0.98 0.00 0.00 173.24 174.89 3dsf s VAL 184 N -0.72 0.27 -0.23 5.02 0.11 0.36 -0.85 120.40 124.37 3dsf s VAL 184 Ca 0.06 -0.09 -0.03 0.00 -2.93 0.00 0.00 61.98 58.98 3dsf s VAL 184 Cb -0.08 -0.27 0.00 0.00 -1.53 0.00 0.00 36.38 34.50 3dsf s VAL 184 CO 0.01 0.10 -0.05 0.42 -3.33 0.00 0.00 175.10 172.26 3dsf s THR 185 N 0.25 3.22 0.09 5.04 -4.23 -0.94 0.95 115.64 120.02 3dsf s THR 185 Ca -0.02 -0.66 0.07 0.00 -1.18 0.00 0.00 61.69 59.90 3dsf s THR 185 Cb -0.05 -2.52 -0.03 0.00 1.34 0.00 0.00 72.50 71.24 3dsf s THR 185 CO -0.01 0.35 -0.19 0.68 -0.54 0.00 0.00 174.62 174.91 3dsf s VAL 186 N 1.43 1.58 1.01 2.29 -7.23 -0.24 -4.85 120.40 114.39 3dsf s VAL 186 Ca 0.04 -1.43 -0.12 0.00 -1.81 0.00 0.00 61.98 58.66 3dsf s VAL 186 Cb -0.15 -1.44 0.15 0.00 0.56 0.00 0.00 36.38 35.50 3dsf s VAL 186 CO -0.04 -0.04 0.83 -2.65 -0.31 0.00 0.00 175.10 172.89 3dsf n PRO 187 N 1.27 -0.99 0.17 4.82 -0.02 -1.26 0.08 135.00 139.07 3dsf n PRO 187 Ca -0.19 -0.24 0.05 0.00 -2.02 0.00 0.00 63.50 61.09 3dsf n PRO 187 Cb 0.54 -2.14 0.23 0.00 -0.02 0.00 0.00 33.50 32.10 3dsf n PRO 187 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3dsf h VAL 188 N -2.02 0.84 -0.46 -1.45 2.07 -1.75 -2.95 116.25 110.53 3dsf h VAL 188 Ca -0.48 -1.76 -0.04 0.00 0.82 0.00 0.00 66.70 65.23 3dsf h VAL 188 Cb 1.30 2.11 -0.02 0.00 -1.52 0.00 0.00 31.29 33.16 3dsf h VAL 188 CO 0.41 0.40 0.11 0.28 0.02 0.00 0.00 177.57 178.80 3dsf h SER 189 N 0.00 0.64 0.82 0.57 0.02 -1.92 -2.93 113.55 110.75 3dsf h SER 189 Ca -0.00 -0.10 -0.10 0.00 -0.84 0.00 0.00 61.79 60.75 3dsf h SER 189 Cb 1.08 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 63.44 3dsf h SER 189 CO 0.05 0.63 -0.47 0.74 -1.14 0.00 0.00 176.83 176.65 3dsf h THR 190 N 0.67 1.06 -3.35 -2.27 2.02 -1.89 -3.40 112.91 105.75 3dsf h THR 190 Ca 0.15 -1.78 -0.23 0.00 0.77 0.00 0.00 66.41 65.33 3dsf h THR 190 Cb 0.25 2.04 -0.30 0.00 -1.74 0.00 0.00 68.15 68.40 3dsf h THR 190 CO -0.00 0.46 -0.60 0.86 0.37 0.00 0.00 175.52 176.61 3dsf s TRP 191 N -3.55 -0.14 -1.65 3.16 -0.00 -1.11 -0.45 118.94 115.21 3dsf s TRP 191 Ca -0.00 0.39 0.02 0.00 -0.00 0.00 0.00 56.10 56.51 3dsf s TRP 191 Cb 0.11 -0.03 0.08 0.00 -0.00 0.00 0.00 33.47 33.63 3dsf s TRP 191 CO 0.71 -0.12 0.93 -2.30 -0.00 0.00 0.00 176.95 176.17 3dsf n PRO 192 N 3.66 1.28 0.21 5.86 -0.02 -1.26 -4.64 135.00 140.09 3dsf n PRO 192 Ca -0.20 -0.32 0.17 0.00 -2.02 0.00 0.00 63.50 61.13 3dsf n PRO 192 Cb 0.55 -1.23 0.83 0.00 -0.02 0.00 0.00 33.50 33.63 3dsf n PRO 192 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3dsf h SER 193 N 0.48 0.00 -2.86 2.55 0.87 -1.78 -3.41 113.55 109.40 3dsf h SER 193 Ca 0.00 0.00 -0.50 0.00 -1.23 0.00 0.00 61.79 60.06 3dsf h SER 193 Cb 0.29 0.00 -0.14 0.00 -0.44 0.00 0.00 62.40 62.11 3dsf h SER 193 CO 0.02 0.00 -0.68 -1.61 -0.53 0.00 0.00 176.83 174.03 3dsf s GLU 194 N -4.62 1.56 -0.53 2.24 2.02 0.40 -5.04 118.70 114.72 3dsf s GLU 194 Ca -0.05 -1.78 -0.18 0.00 0.02 0.00 0.00 54.97 52.98 3dsf s GLU 194 Cb 0.15 -1.21 0.08 0.00 0.10 0.00 0.00 34.13 33.25 3dsf s GLU 194 CO 0.54 0.06 0.62 0.00 0.02 0.00 0.00 175.26 176.50 3dsf s ALA 195 N -2.97 3.43 -0.45 5.21 0.00 -1.26 -4.71 121.76 121.00 3dsf s ALA 195 Ca 0.29 -1.99 -0.20 0.00 0.00 0.00 0.00 51.96 50.06 3dsf s ALA 195 Cb 0.03 -3.37 0.03 0.00 0.00 0.00 0.00 23.12 19.81 3dsf s ALA 195 CO 0.12 -2.09 0.61 0.54 0.00 0.00 0.00 175.76 174.94 3dsf s VAL 196 N 2.48 4.87 0.08 0.00 0.11 -1.26 -4.94 120.40 121.74 3dsf s VAL 196 Ca 0.12 -0.11 0.07 0.00 -2.93 0.00 0.00 61.98 59.13 3dsf s VAL 196 Cb -0.22 -4.21 -0.04 0.00 -1.53 0.00 0.00 36.38 30.38 3dsf s VAL 196 CO 0.09 -0.63 -0.12 0.42 -3.33 0.00 0.00 175.10 171.53 3dsf s THR 197 N 2.69 3.23 -0.05 5.04 -4.23 -1.26 -2.23 115.64 118.83 3dsf s THR 197 Ca 0.19 -1.20 -0.04 0.00 -1.18 0.00 0.00 61.69 59.46 3dsf s THR 197 Cb -0.16 -2.47 -0.04 0.00 1.34 0.00 0.00 72.50 71.18 3dsf s THR 197 CO 0.16 0.20 0.13 0.00 -0.54 0.00 0.00 174.62 174.58 3dsf s ASN 199 N -1.50 5.55 -0.07 0.00 0.02 0.30 -2.62 114.94 116.61 3dsf s ASN 199 Ca 0.21 -3.34 -0.26 0.00 -1.02 0.00 0.00 52.86 48.45 3dsf s ASN 199 Cb -0.12 -1.86 -0.03 0.00 0.02 0.00 0.00 41.25 39.26 3dsf s ASN 199 CO 0.11 -0.26 0.83 -0.69 0.02 0.00 0.00 177.10 177.12 3dsf s VAL 200 N -0.78 4.94 0.03 1.60 1.01 -0.71 -2.51 120.40 123.99 3dsf s VAL 200 Ca 0.22 1.71 0.08 0.00 0.00 0.00 0.00 61.98 63.99 3dsf s VAL 200 Cb -0.13 -4.16 -0.02 0.00 0.00 0.00 0.00 36.38 32.06 3dsf s VAL 200 CO -0.09 0.16 -0.23 0.00 0.00 0.00 0.00 175.10 174.94 3dsf s ALA 201 N 1.24 1.98 -0.32 5.51 0.00 0.61 -1.65 121.76 129.13 3dsf s ALA 201 Ca 0.43 -1.12 -0.02 0.00 0.00 0.00 0.00 51.96 51.25 3dsf s ALA 201 Cb -0.18 -0.42 0.11 0.00 0.00 0.00 0.00 23.12 22.62 3dsf s ALA 201 CO 0.20 0.46 0.14 -1.58 0.00 0.00 0.00 175.76 174.98 3dsf s HIS 202 N -0.74 1.11 0.20 0.00 2.46 -0.53 -1.45 115.29 116.33 3dsf s HIS 202 Ca 0.09 -1.47 -0.11 0.00 0.47 0.00 0.00 55.06 54.04 3dsf s HIS 202 Cb -0.09 -1.34 0.22 0.00 -0.13 0.00 0.00 32.58 31.24 3dsf s HIS 202 CO 0.01 -0.85 1.75 -1.00 -2.47 0.00 0.00 174.74 172.19 3dsf h PRO 203 N 7.95 0.39 0.06 2.88 0.13 -1.82 -2.35 132.00 139.24 3dsf h PRO 203 Ca -0.12 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 64.98 3dsf h PRO 203 Cb 1.00 -0.09 -0.00 0.00 0.13 0.00 0.00 31.00 32.04 3dsf h PRO 203 CO 0.44 0.26 -0.08 0.00 -0.23 0.00 0.00 178.00 178.38 3dsf h ALA 204 N 1.37 -0.75 0.00 -0.56 0.00 -1.92 -2.59 119.26 114.81 3dsf h ALA 204 Ca 0.27 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.16 3dsf h ALA 204 Cb 0.30 0.39 0.00 0.00 0.00 0.00 0.00 17.79 18.48 3dsf h ALA 204 CO -0.26 -0.76 0.00 -1.13 0.00 0.00 0.00 179.25 177.10 3dsf n SER 205 N -2.81 0.10 -2.62 0.00 3.41 -1.23 -4.84 113.62 105.63 3dsf n SER 205 Ca -0.02 -1.45 -0.17 0.00 -0.26 0.00 0.00 58.87 56.98 3dsf n SER 205 Cb 0.07 -0.05 -0.00 0.00 -0.26 0.00 0.00 64.21 63.96 3dsf n SER 205 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dsf n ALA 206 N -0.41 -0.81 -2.56 7.33 0.00 -0.98 -4.94 120.51 118.15 3dsf n ALA 206 Ca 0.00 0.13 -0.39 0.00 0.00 0.00 0.00 53.44 53.19 3dsf n ALA 206 Cb 0.03 -2.07 -0.06 0.00 0.00 0.00 0.00 19.45 17.35 3dsf n ALA 206 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3dsf s THR 207 N -2.80 5.00 -0.11 0.00 2.01 -0.90 -4.99 115.64 113.84 3dsf s THR 207 Ca 0.09 1.14 -0.01 0.00 0.31 0.00 0.00 61.69 63.21 3dsf s THR 207 Cb -0.04 -3.89 0.04 0.00 0.01 0.00 0.00 72.50 68.62 3dsf s THR 207 CO 0.11 0.40 -0.01 -0.44 -0.69 0.00 0.00 174.62 173.99 3dsf s SER 208 N -0.01 2.11 -0.04 3.53 0.01 -1.26 -1.46 113.70 116.58 3dsf s SER 208 Ca 0.29 -0.34 0.05 0.00 1.31 0.00 0.00 55.95 57.26 3dsf s SER 208 Cb -0.17 -0.60 -0.01 0.00 0.21 0.00 0.00 66.02 65.45 3dsf s SER 208 CO 0.15 -0.20 -0.18 -0.69 0.41 0.00 0.00 173.24 172.73 3dsf s VAL 209 N 1.86 1.52 -0.23 3.43 1.01 -0.66 -5.04 120.40 122.30 3dsf s VAL 209 Ca 0.03 -0.77 0.02 0.00 0.00 0.00 0.00 61.98 61.25 3dsf s VAL 209 Cb -0.14 -1.30 0.05 0.00 0.00 0.00 0.00 36.38 35.00 3dsf s VAL 209 CO -0.07 0.43 -0.11 -1.81 0.00 0.00 0.00 175.10 173.55 3dsf s ASP 210 N -0.06 3.83 -0.20 3.32 -0.00 -1.26 -1.74 116.67 120.57 3dsf s ASP 210 Ca -0.02 -1.10 -0.04 0.00 -0.00 0.00 0.00 52.55 51.38 3dsf s ASP 210 Cb -0.11 -1.37 -0.02 0.00 -0.00 0.00 0.00 42.92 41.42 3dsf s ASP 210 CO 0.02 -0.16 -0.02 -0.54 -0.00 0.00 0.00 175.17 174.47 3dsf s LYS 211 N 1.28 3.53 0.53 8.23 -0.14 -1.08 -4.95 119.74 127.14 3dsf s LYS 211 Ca -0.04 -0.56 -0.19 0.00 -1.36 0.00 0.00 55.97 53.82 3dsf s LYS 211 Cb -0.18 -3.04 -0.07 0.00 -1.68 0.00 0.00 37.83 32.86 3dsf s LYS 211 CO -0.07 -0.05 1.05 0.00 -0.76 0.00 0.00 175.35 175.52 3dsf s ALA 212 N 1.14 2.82 -0.25 5.17 0.00 -1.26 -1.27 121.76 128.10 3dsf s ALA 212 Ca 0.02 0.55 -0.10 0.00 0.00 0.00 0.00 51.96 52.44 3dsf s ALA 212 Cb -0.14 -3.25 -0.04 0.00 0.00 0.00 0.00 23.12 19.68 3dsf s ALA 212 CO 0.01 -0.51 0.14 0.42 0.00 0.00 0.00 175.76 175.81 3dsf s ILE 213 N -2.12 5.02 -0.05 0.00 -1.09 -0.95 -4.78 121.20 117.24 3dsf s ILE 213 Ca 0.66 0.07 0.02 0.00 -2.23 0.00 0.00 60.65 59.17 3dsf s ILE 213 Cb -0.17 -3.36 -0.03 0.00 -1.58 0.00 0.00 42.46 37.32 3dsf s ILE 213 CO 0.26 0.32 -0.08 -0.44 -1.23 0.00 0.00 174.94 173.77 3dsf s SER 214 N 1.40 4.56 0.18 3.58 0.01 -1.26 -4.77 113.70 117.39 3dsf s SER 214 Ca 0.06 -0.08 -0.32 0.00 1.31 0.00 0.00 55.95 56.93 3dsf s SER 214 Cb -0.15 -1.10 -0.11 0.00 0.21 0.00 0.00 66.02 64.88 3dsf s SER 214 CO 0.06 0.34 1.63 -2.84 0.41 0.00 0.00 173.24 172.84 3dsf s PRO 215 N -0.96 4.18 0.00 12.44 0.02 -1.26 -4.82 135.00 144.60 3dsf s PRO 215 Ca 0.13 2.45 0.08 0.00 0.02 0.00 0.00 61.00 63.69 3dsf s PRO 215 Cb -0.11 -3.14 0.50 0.00 0.02 0.00 0.00 34.50 31.77 3dsf s PRO 215 CO 0.03 -0.66 0.95 1.33 -0.33 0.00 0.00 177.00 178.32