#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3frn s LEU 18 N 0.00 4.32 -0.41 2.46 1.43 -1.26 -4.91 118.68 120.30 3frn s LEU 18 Ca 0.00 0.28 -0.11 0.00 -1.03 0.00 0.00 54.13 53.27 3frn s LEU 18 Cb 0.00 -3.01 0.06 0.00 0.03 0.00 0.00 46.19 43.26 3frn s LEU 18 CO 0.00 0.07 0.27 -0.89 0.23 0.00 0.00 176.35 176.03 3frn s THR 19 N -1.69 4.59 -0.20 5.49 2.01 -1.26 -1.76 115.64 122.83 3frn s THR 19 Ca 0.36 -1.10 -0.12 0.00 0.31 0.00 0.00 61.69 61.13 3frn s THR 19 Cb -0.12 -3.69 -0.05 0.00 0.01 0.00 0.00 72.50 68.66 3frn s THR 19 CO 0.28 -0.41 0.24 -0.76 -0.69 0.00 0.00 174.62 173.28 3frn s LEU 20 N 1.52 4.18 0.07 4.42 1.43 -0.89 -4.89 118.68 124.53 3frn s LEU 20 Ca 0.03 0.33 -0.30 0.00 -1.03 0.00 0.00 54.13 53.16 3frn s LEU 20 Cb -0.22 -2.26 -0.05 0.00 0.03 0.00 0.00 46.19 43.69 3frn s LEU 20 CO 0.05 0.07 1.03 -0.89 0.23 0.00 0.00 176.35 176.84 3frn s THR 21 N 0.79 4.46 0.10 5.49 2.01 -1.26 -1.90 115.64 125.33 3frn s THR 21 Ca 0.13 1.89 -0.19 0.00 0.31 0.00 0.00 61.69 63.82 3frn s THR 21 Cb -0.13 -4.21 -0.07 0.00 0.01 0.00 0.00 72.50 68.10 3frn s THR 21 CO 0.04 0.21 0.60 -0.76 -0.69 0.00 0.00 174.62 174.01 3frn s LEU 22 N 0.53 4.50 0.63 4.42 1.43 -0.34 -1.56 118.68 128.30 3frn s LEU 22 Ca 0.51 1.29 -0.17 0.00 -1.03 0.00 0.00 54.13 54.73 3frn s LEU 22 Cb -0.24 -3.01 -0.01 0.00 0.03 0.00 0.00 46.19 42.95 3frn s LEU 22 CO 0.30 0.24 1.16 -0.54 0.23 0.00 0.00 176.35 177.74 3frn s LYS 23 N -1.25 2.82 -0.10 1.70 1.02 -0.58 -4.46 119.74 118.90 3frn s LYS 23 Ca 0.31 1.65 -0.25 0.00 0.02 0.00 0.00 55.97 57.70 3frn s LYS 23 Cb -0.19 -1.93 -0.21 0.00 -0.52 0.00 0.00 37.83 34.98 3frn s LYS 23 CO 0.20 -1.28 0.83 1.49 -0.92 0.00 0.00 175.35 175.67 3frn h GLU 24 N 0.46 -0.04 -4.85 1.68 4.81 -1.91 -3.41 114.58 111.31 3frn h GLU 24 Ca -0.49 0.00 -0.30 0.00 -0.13 0.00 0.00 59.36 58.45 3frn h GLU 24 Cb 1.28 0.01 -0.15 0.00 0.63 0.00 0.00 28.75 30.52 3frn h GLU 24 CO 0.54 0.67 -0.67 0.95 -0.73 0.00 0.00 179.01 179.77 3frn s THR 25 N -2.82 0.78 -0.11 0.32 -4.23 -1.26 -2.13 115.64 106.18 3frn s THR 25 Ca -0.16 -1.99 -0.05 0.00 -1.18 0.00 0.00 61.69 58.31 3frn s THR 25 Cb -0.01 -2.08 0.05 0.00 1.34 0.00 0.00 72.50 71.80 3frn s THR 25 CO 0.59 -0.52 0.25 -0.22 -0.54 0.00 0.00 174.62 174.18 3frn s LEU 26 N -3.18 0.25 -0.26 4.79 2.96 -0.12 -4.90 118.68 118.22 3frn s LEU 26 Ca 0.23 0.55 -0.18 0.00 -0.22 0.00 0.00 54.13 54.51 3frn s LEU 26 Cb 0.06 0.74 -0.03 0.00 0.50 0.00 0.00 46.19 47.46 3frn s LEU 26 CO 0.03 -0.18 0.51 -0.22 -1.32 0.00 0.00 176.35 175.17 3frn s LEU 27 N 1.51 4.06 0.45 -0.68 2.96 -1.26 -1.20 118.68 124.51 3frn s LEU 27 Ca -0.07 0.52 0.03 0.00 -0.22 0.00 0.00 54.13 54.39 3frn s LEU 27 Cb -0.11 -2.65 -0.03 0.00 0.50 0.00 0.00 46.19 43.90 3frn s LEU 27 CO -0.09 -0.27 0.04 0.00 -1.32 0.00 0.00 176.35 174.71 3frn s ALA 28 N 2.24 3.47 0.28 5.97 0.00 0.12 -4.96 121.76 128.88 3frn s ALA 28 Ca 0.21 -1.13 0.11 0.00 0.00 0.00 0.00 51.96 51.15 3frn s ALA 28 Cb -0.16 0.29 -0.05 0.00 0.00 0.00 0.00 23.12 23.20 3frn s ALA 28 CO 0.09 -0.14 -0.16 0.45 0.00 0.00 0.00 175.76 175.99 3frn s SER 29 N -3.74 3.45 0.51 0.00 0.15 -1.26 -0.89 113.70 111.92 3frn s SER 29 Ca 0.19 -1.07 -0.23 0.00 0.70 0.00 0.00 55.95 55.54 3frn s SER 29 Cb 0.04 -0.28 -0.06 0.00 -1.71 0.00 0.00 66.02 64.01 3frn s SER 29 CO 0.10 -0.06 1.35 -2.84 1.20 0.00 0.00 173.24 172.99 3frn s PRO 30 N -3.56 3.37 0.00 5.44 0.02 -1.26 -4.80 135.00 134.21 3frn s PRO 30 Ca 0.30 2.22 0.00 0.00 0.02 0.00 0.00 61.00 63.54 3frn s PRO 30 Cb -0.02 -2.39 0.00 0.00 0.02 0.00 0.00 34.50 32.11 3frn s PRO 30 CO 0.14 -1.00 0.00 0.41 -0.33 0.00 0.00 177.00 176.22 3frn n GLY 31 N 0.66 -0.38 3.25 0.52 0.00 -0.65 -4.98 105.19 103.61 3frn n GLY 31 Ca 0.08 -0.53 -0.32 0.00 0.00 0.00 0.00 46.02 45.26 3frn n GLY 31 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3frn s VAL 32 N -3.92 2.28 -0.02 1.61 1.01 -1.26 -1.08 120.40 119.01 3frn s VAL 32 Ca 0.00 -0.94 -0.21 0.00 0.00 0.00 0.00 61.98 60.83 3frn s VAL 32 Cb 0.00 -1.89 -0.05 0.00 0.00 0.00 0.00 36.38 34.44 3frn s VAL 32 CO 0.00 0.55 0.60 -0.22 0.00 0.00 0.00 175.10 176.03 3frn s LEU 33 N 0.36 4.39 0.17 3.92 2.96 -0.48 -4.95 118.68 125.05 3frn s LEU 33 Ca -0.17 1.14 0.10 0.00 -0.22 0.00 0.00 54.13 54.99 3frn s LEU 33 Cb -0.17 -2.93 -0.04 0.00 0.50 0.00 0.00 46.19 43.54 3frn s LEU 33 CO 0.08 0.07 -0.19 -0.36 -1.32 0.00 0.00 176.35 174.63 3frn s PHE 34 N -0.01 2.45 0.30 5.38 0.08 -1.26 -1.57 117.98 123.35 3frn s PHE 34 Ca 0.32 -0.30 0.05 0.00 0.12 0.00 0.00 56.93 57.12 3frn s PHE 34 Cb -0.18 -1.23 0.80 0.00 -0.57 0.00 0.00 43.02 41.85 3frn s PHE 34 CO 0.17 0.47 1.66 1.25 -0.10 0.00 0.00 175.22 178.68 3frn h LEU 35 N 3.24 0.21 -1.85 -0.37 5.85 -1.89 0.22 115.31 120.72 3frn h LEU 35 Ca -0.47 0.18 0.18 0.00 0.84 0.00 0.00 57.88 58.61 3frn h LEU 35 Cb 1.20 0.20 -0.04 0.00 0.37 0.00 0.00 40.66 42.39 3frn h LEU 35 CO 0.49 -0.11 0.50 -0.78 -0.34 0.00 0.00 178.44 178.20 3frn h ASP 36 N 0.29 0.13 0.20 1.25 -0.00 -1.91 -1.26 116.42 115.13 3frn h ASP 36 Ca 0.60 0.01 -0.08 0.00 -0.00 0.00 0.00 57.03 57.55 3frn h ASP 36 Cb 1.23 -0.02 -0.01 0.00 -0.00 0.00 0.00 39.33 40.53 3frn h ASP 36 CO -0.61 0.06 -0.32 0.44 -0.00 0.00 0.00 179.24 178.81 3frn h ASP 37 N 0.14 0.19 -0.38 2.28 3.32 -1.32 -3.20 116.42 117.44 3frn h ASP 37 Ca 0.34 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.33 3frn h ASP 37 Cb 1.16 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.66 3frn h ASP 37 CO -0.05 0.51 0.00 2.30 -1.72 0.00 0.00 179.24 180.28 3frn n ILE 38 N -4.11 1.88 -4.38 0.35 -5.35 -0.50 -4.95 119.36 102.30 3frn n ILE 38 Ca -0.01 -1.47 -0.28 0.00 -0.27 0.00 0.00 62.75 60.72 3frn n ILE 38 Cb 0.40 0.03 -0.12 0.00 -1.74 0.00 0.00 39.64 38.21 3frn n ILE 38 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 3frn s THR 39 N -2.12 2.48 0.08 7.28 -4.23 -1.08 -1.52 115.64 116.53 3frn s THR 39 Ca 0.40 -1.79 -0.14 0.00 -1.18 0.00 0.00 61.69 58.98 3frn s THR 39 Cb 0.28 -2.15 -0.18 0.00 1.34 0.00 0.00 72.50 71.80 3frn s THR 39 CO 0.14 0.01 1.26 0.40 -0.54 0.00 0.00 174.62 175.90 3frn h ILE 40 N 3.50 1.29 -3.75 2.99 2.04 -1.60 -3.45 117.51 118.53 3frn h ILE 40 Ca -0.49 -2.00 -0.49 0.00 1.00 0.00 0.00 64.86 62.87 3frn h ILE 40 Cb 1.18 2.11 0.01 0.00 -0.74 0.00 0.00 36.82 39.38 3frn h ILE 40 CO 0.44 0.63 0.15 -1.83 0.00 0.00 0.00 178.15 177.54 3frn s GLU 41 N -3.64 3.77 -0.17 2.37 1.03 -1.26 -5.03 118.70 115.77 3frn s GLU 41 Ca -0.11 0.50 -0.29 0.00 0.03 0.00 0.00 54.97 55.11 3frn s GLU 41 Cb 0.08 -2.36 -0.01 0.00 -0.80 0.00 0.00 34.13 31.04 3frn s GLU 41 CO 0.89 -0.08 1.27 0.15 -1.33 0.00 0.00 175.26 176.16 3frn s LYS 42 N -3.96 4.21 -0.01 -4.83 -0.14 -1.26 -4.93 119.74 108.82 3frn s LYS 42 Ca 0.52 1.64 0.07 0.00 -1.36 0.00 0.00 55.97 56.84 3frn s LYS 42 Cb -0.10 -3.78 -0.02 0.00 -1.68 0.00 0.00 37.83 32.25 3frn s LYS 42 CO 0.33 -0.74 -0.22 0.08 -0.76 0.00 0.00 175.35 174.03 3frn s VAL 43 N 3.59 1.74 -0.25 3.17 1.01 -1.26 -5.12 120.40 123.27 3frn s VAL 43 Ca 0.55 -0.99 -0.15 0.00 0.00 0.00 0.00 61.98 61.40 3frn s VAL 43 Cb -0.21 -1.45 -0.04 0.00 0.00 0.00 0.00 36.38 34.67 3frn s VAL 43 CO 0.15 0.44 0.35 -1.83 0.00 0.00 0.00 175.10 174.22 3frn s GLU 44 N -0.64 4.06 -0.18 2.72 1.03 -1.26 -4.51 118.70 119.92 3frn s GLU 44 Ca 0.08 0.04 -0.22 0.00 0.03 0.00 0.00 54.97 54.90 3frn s GLU 44 Cb -0.09 -3.61 0.06 0.00 -0.80 0.00 0.00 34.13 29.69 3frn s GLU 44 CO -0.00 -0.17 0.60 0.45 -1.33 0.00 0.00 175.26 174.81 3frn s SER 45 N 1.41 -0.61 0.00 0.83 0.15 -1.26 -5.05 113.70 109.17 3frn s SER 45 Ca 0.15 1.06 0.03 0.00 0.70 0.00 0.00 55.95 57.89 3frn s SER 45 Cb -0.15 1.06 0.04 0.00 -1.71 0.00 0.00 66.02 65.26 3frn s SER 45 CO 0.09 -0.29 0.75 1.21 1.20 0.00 0.00 173.24 176.20 3frn n GLU 46 N 2.35 0.59 -3.08 5.44 4.07 -1.26 -4.85 120.64 123.90 3frn n GLU 46 Ca -0.15 -1.00 -0.39 0.00 -0.06 0.00 0.00 57.16 55.56 3frn n GLU 46 Cb 0.56 -1.06 -0.06 0.00 -0.06 0.00 0.00 31.44 30.82 3frn n GLU 46 CO 0.00 0.00 0.00 -1.59 -0.06 0.00 0.00 177.13 175.48 3frn s LYS 47 N -0.49 4.43 -0.13 5.31 -2.85 -1.26 -5.01 119.74 119.73 3frn s LYS 47 Ca 0.04 0.99 -0.29 0.00 -1.00 0.00 0.00 55.97 55.70 3frn s LYS 47 Cb 0.03 -3.29 -0.03 0.00 -2.06 0.00 0.00 37.83 32.48 3frn s LYS 47 CO 0.04 0.51 1.41 1.21 0.10 0.00 0.00 175.35 178.61 3frn s ASN 48 N -0.80 6.82 -0.21 0.03 3.04 -1.26 -4.65 114.94 117.91 3frn s ASN 48 Ca 0.34 1.86 -0.17 0.00 0.04 0.00 0.00 52.86 54.93 3frn s ASN 48 Cb -0.21 -2.54 -0.14 0.00 -1.54 0.00 0.00 41.25 36.83 3frn s ASN 48 CO 0.23 -0.84 -0.05 -0.11 -3.04 0.00 0.00 177.10 173.29 3frn n LEU 49 N 6.88 1.88 -3.99 3.21 7.94 -0.61 -5.02 117.00 127.30 3frn n LEU 49 Ca 0.15 0.43 -0.09 0.00 -1.11 0.00 0.00 56.01 55.39 3frn n LEU 49 Cb 0.44 -0.90 -0.11 0.00 0.53 0.00 0.00 43.42 43.39 3frn n LEU 49 CO 0.59 0.19 -0.33 -0.04 -1.11 0.00 0.00 177.39 176.69 3frn s MET 50 N -2.43 0.42 -0.37 1.96 -1.94 -1.22 -4.73 119.30 110.99 3frn s MET 50 Ca -0.29 -0.74 -0.17 0.00 -1.71 0.00 0.00 55.69 52.78 3frn s MET 50 Cb 0.08 0.15 0.00 0.00 2.01 0.00 0.00 34.83 37.07 3frn s MET 50 CO 0.49 -0.08 0.44 0.42 -0.01 0.00 0.00 175.02 176.28 3frn s ILE 51 N -2.10 5.09 -0.34 2.53 1.01 -1.26 -1.38 121.20 124.75 3frn s ILE 51 Ca -0.10 0.04 -0.20 0.00 0.00 0.00 0.00 60.65 60.39 3frn s ILE 51 Cb -0.05 -3.93 -0.00 0.00 0.01 0.00 0.00 42.46 38.48 3frn s ILE 51 CO -0.03 -0.23 0.60 -0.76 0.00 0.00 0.00 174.94 174.52 3frn s LEU 52 N 2.19 4.24 0.06 2.97 1.02 -0.24 -4.97 118.68 123.94 3frn s LEU 52 Ca 0.14 0.20 0.05 0.00 0.02 0.00 0.00 54.13 54.54 3frn s LEU 52 Cb -0.16 -2.74 -0.04 0.00 0.02 0.00 0.00 46.19 43.27 3frn s LEU 52 CO 0.13 -0.52 -0.06 -0.76 0.02 0.00 0.00 176.35 175.16 3frn s LEU 53 N 2.59 3.23 0.35 1.79 1.43 -1.26 -1.63 118.68 125.17 3frn s LEU 53 Ca 0.23 -0.22 -0.28 0.00 -1.03 0.00 0.00 54.13 52.83 3frn s LEU 53 Cb -0.15 -1.94 -0.10 0.00 0.03 0.00 0.00 46.19 44.03 3frn s LEU 53 CO 0.13 0.22 1.36 -2.16 0.23 0.00 0.00 176.35 176.13 3frn s PRO 54 N -1.91 4.27 0.00 1.29 0.04 -1.26 -2.96 135.00 134.47 3frn s PRO 54 Ca 0.21 2.31 0.00 0.00 0.04 0.00 0.00 61.00 63.56 3frn s PRO 54 Cb -0.11 -3.03 0.00 0.00 0.04 0.00 0.00 34.50 31.40 3frn s PRO 54 CO 0.13 -0.30 0.00 0.41 0.04 0.00 0.00 177.00 177.28 3frn n GLY 55 N 0.70 0.84 3.80 0.56 0.00 0.03 -4.46 105.19 106.66 3frn n GLY 55 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 3frn n GLY 55 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3frn s LEU 56 N 0.00 3.86 -0.13 0.99 1.43 -1.16 -4.75 118.68 118.92 3frn s LEU 56 Ca 0.00 -0.04 -0.06 0.00 -1.03 0.00 0.00 54.13 52.99 3frn s LEU 56 Cb 0.00 -2.50 -0.04 0.00 0.03 0.00 0.00 46.19 43.68 3frn s LEU 56 CO 0.00 0.12 0.09 -0.70 0.23 0.00 0.00 176.35 176.08 3frn s GLU 57 N -2.78 3.53 0.11 1.70 2.56 -1.26 -2.45 118.70 120.10 3frn s GLU 57 Ca 0.31 -0.25 0.09 0.00 0.00 0.00 0.00 54.97 55.12 3frn s GLU 57 Cb -0.11 -3.12 -0.04 0.00 2.00 0.00 0.00 34.13 32.86 3frn s GLU 57 CO 0.23 0.60 -0.21 0.71 -0.56 0.00 0.00 175.26 176.03 3frn s TYR 58 N -0.54 2.46 -0.23 5.30 1.51 0.11 -1.02 117.35 124.94 3frn s TYR 58 Ca 0.11 -0.31 -0.01 0.00 -1.01 0.00 0.00 57.07 55.86 3frn s TYR 58 Cb -0.12 -1.34 0.06 0.00 -0.11 0.00 0.00 41.96 40.46 3frn s TYR 58 CO 0.02 0.34 0.00 -1.17 -1.11 0.00 0.00 175.55 173.63 3frn s LEU 59 N -1.97 1.97 -0.34 -1.29 2.96 -0.02 -0.97 118.68 119.02 3frn s LEU 59 Ca 0.16 -1.08 -0.26 0.00 -0.22 0.00 0.00 54.13 52.73 3frn s LEU 59 Cb -0.10 -0.90 0.01 0.00 0.50 0.00 0.00 46.19 45.70 3frn s LEU 59 CO 0.08 -0.29 0.94 -0.69 -1.32 0.00 0.00 176.35 175.07 3frn s VAL 60 N 1.61 4.61 0.39 1.68 1.01 0.30 -4.39 120.40 125.61 3frn s VAL 60 Ca -0.02 1.34 0.05 0.00 0.00 0.00 0.00 61.98 63.35 3frn s VAL 60 Cb -0.18 -4.32 -0.00 0.00 0.00 0.00 0.00 36.38 31.88 3frn s VAL 60 CO -0.09 -0.46 0.55 0.42 0.00 0.00 0.00 175.10 175.52 3frn s THR 61 N 3.42 3.89 0.32 3.92 -4.23 -1.26 -1.53 115.64 120.16 3frn s THR 61 Ca 0.39 -0.84 0.08 0.00 -1.18 0.00 0.00 61.69 60.14 3frn s THR 61 Cb -0.12 -3.37 0.06 0.00 1.34 0.00 0.00 72.50 70.41 3frn s THR 61 CO 0.17 -0.18 1.75 0.03 -0.54 0.00 0.00 174.62 175.84 3frn h ARG 62 N 0.69 0.21 -0.16 3.99 2.47 -1.97 -2.17 114.38 117.44 3frn h ARG 62 Ca -0.45 -0.09 -0.10 0.00 -1.26 0.00 0.00 59.98 58.08 3frn h ARG 62 Cb 1.26 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 29.56 3frn h ARG 62 CO 0.53 0.55 -0.34 0.22 0.56 0.00 0.00 179.97 181.49 3frn h ASP 63 N 0.18 0.33 -0.30 7.04 -0.00 -1.95 0.20 116.42 121.92 3frn h ASP 63 Ca 0.02 -0.12 -0.07 0.00 -0.00 0.00 0.00 57.03 56.86 3frn h ASP 63 Cb 0.72 -0.09 -0.01 0.00 -0.00 0.00 0.00 39.33 39.95 3frn h ASP 63 CO 0.05 0.65 -0.07 0.25 -0.00 0.00 0.00 179.24 180.12 3frn h LEU 64 N 0.28 0.59 -0.86 2.28 5.85 -1.83 -2.85 115.31 118.76 3frn h LEU 64 Ca 0.03 -0.37 -0.12 0.00 0.84 0.00 0.00 57.88 58.27 3frn h LEU 64 Cb 0.73 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 3frn h LEU 64 CO 0.06 0.82 -0.44 -0.07 -0.34 0.00 0.00 178.44 178.47 3frn h LEU 65 N 0.35 0.30 -1.12 2.25 3.38 -1.04 -0.61 115.31 118.82 3frn h LEU 65 Ca 0.08 -0.13 -0.09 0.00 0.09 0.00 0.00 57.88 57.83 3frn h LEU 65 Cb 0.56 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 3frn h LEU 65 CO 0.03 0.70 -0.34 -0.09 0.09 0.00 0.00 178.44 178.83 3frn h ARG 66 N 0.23 0.17 0.00 1.13 2.43 -0.64 0.56 114.38 118.26 3frn h ARG 66 Ca 0.02 -0.07 -0.00 0.00 -0.81 0.00 0.00 59.98 59.12 3frn h ARG 66 Cb 0.87 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.41 3frn h ARG 66 CO 0.07 0.50 -0.02 1.15 -1.51 0.00 0.00 179.97 180.16 3frn h THR 67 N 0.15 1.63 0.04 0.20 2.02 -1.19 -3.10 112.91 112.66 3frn h THR 67 Ca 0.02 -1.89 -0.00 0.00 0.77 0.00 0.00 66.41 65.31 3frn h THR 67 Cb 0.68 2.92 0.00 0.00 -1.74 0.00 0.00 68.15 70.01 3frn h THR 67 CO 0.05 0.49 -0.02 0.11 0.37 0.00 0.00 175.52 176.52 3frn h LYS 68 N -0.78 -0.05 -2.94 6.66 1.79 -1.12 -3.39 116.57 116.73 3frn h LYS 68 Ca -0.00 0.00 -0.61 0.00 -2.18 0.00 0.00 60.65 57.86 3frn h LYS 68 Cb 0.82 0.01 -0.41 0.00 -1.58 0.00 0.00 32.23 31.07 3frn h LYS 68 CO 0.00 0.55 -0.64 1.19 -1.08 0.00 0.00 179.45 179.48 3frn n PHE 69 N -4.81 2.62 0.65 -1.35 3.72 0.18 -4.92 117.46 113.57 3frn n PHE 69 Ca -0.09 -4.15 0.10 0.00 -0.05 0.00 0.00 57.45 53.26 3frn n PHE 69 Cb 0.31 -0.49 0.44 0.00 -0.94 0.00 0.00 39.48 38.80 3frn n PHE 69 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 3frn n PRO 70 N 2.04 0.05 0.11 -1.08 -0.04 -1.17 -3.14 135.00 131.77 3frn n PRO 70 Ca 0.22 0.19 0.12 0.00 -0.04 0.00 0.00 63.50 63.99 3frn n PRO 70 Cb 0.37 -1.57 0.15 0.00 -0.04 0.00 0.00 33.50 32.41 3frn n PRO 70 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 3frn h GLU 71 N 0.00 0.00 -6.26 0.54 9.09 -1.91 -3.46 114.58 112.58 3frn h GLU 71 Ca 0.00 0.00 -0.63 0.00 0.05 0.00 0.00 59.36 58.78 3frn h GLU 71 Cb 0.38 0.00 -0.10 0.00 -1.65 0.00 0.00 28.75 27.38 3frn h GLU 71 CO 0.00 0.00 -0.62 0.71 0.05 0.00 0.00 179.01 179.15 3frn s TYR 72 N -3.22 3.08 0.20 2.06 2.02 -1.19 0.49 117.35 120.79 3frn s TYR 72 Ca 0.05 0.01 0.03 0.00 -0.37 0.00 0.00 57.07 56.79 3frn s TYR 72 Cb 0.10 -1.55 -0.03 0.00 -0.40 0.00 0.00 41.96 40.08 3frn s TYR 72 CO 0.71 0.50 0.34 -0.51 -1.57 0.00 0.00 175.55 175.03 3frn s ASP 73 N -2.51 6.33 -0.03 2.29 -0.00 -0.72 -4.80 116.67 117.25 3frn s ASP 73 Ca 0.28 0.16 0.02 0.00 -0.00 0.00 0.00 52.55 53.01 3frn s ASP 73 Cb -0.11 -1.90 0.01 0.00 -0.00 0.00 0.00 42.92 40.91 3frn s ASP 73 CO 0.20 -0.03 -0.06 -0.36 -0.00 0.00 0.00 175.17 174.92 3frn s PHE 74 N -1.89 0.74 0.45 4.23 0.08 -1.26 -2.08 117.98 118.25 3frn s PHE 74 Ca 0.35 -0.18 0.04 0.00 0.12 0.00 0.00 56.93 57.26 3frn s PHE 74 Cb -0.10 -0.57 -0.04 0.00 -0.57 0.00 0.00 43.02 41.73 3frn s PHE 74 CO 0.29 -0.11 0.02 -0.08 -0.10 0.00 0.00 175.22 175.24 3frn s THR 75 N 0.37 1.46 0.00 0.64 -1.32 -0.80 -4.94 115.64 111.05 3frn s THR 75 Ca -0.05 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.43 3frn s THR 75 Cb -0.09 -2.55 0.00 0.00 -1.51 0.00 0.00 72.50 68.35 3frn s THR 75 CO 0.00 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.02 3frn n GLY 76 N -1.08 -0.10 3.72 6.08 0.00 -1.26 -1.20 105.19 111.35 3frn n GLY 76 Ca -0.12 -1.96 -0.32 0.00 0.00 0.00 0.00 46.02 43.62 3frn n GLY 76 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3frn s PRO 77 N 0.00 1.82 0.15 1.61 0.04 -1.26 -4.96 135.00 132.40 3frn s PRO 77 Ca 0.00 1.47 -0.17 0.00 0.04 0.00 0.00 61.00 62.34 3frn s PRO 77 Cb 0.00 -1.82 0.01 0.00 0.04 0.00 0.00 34.50 32.73 3frn s PRO 77 CO 0.00 -2.02 1.80 1.49 0.04 0.00 0.00 177.00 178.31 3frn h GLU 78 N -1.10 0.45 -5.04 4.56 4.57 -1.96 -3.44 114.58 112.62 3frn h GLU 78 Ca -0.45 -0.03 -0.33 0.00 -1.18 0.00 0.00 59.36 57.38 3frn h GLU 78 Cb 1.26 -0.10 -0.17 0.00 -0.16 0.00 0.00 28.75 29.58 3frn h GLU 78 CO 0.48 0.30 -0.73 -0.80 -1.18 0.00 0.00 179.01 177.07 3frn s ASN 79 N -5.50 1.61 -0.20 1.04 -0.87 -1.26 -4.06 114.94 105.69 3frn s ASN 79 Ca -0.13 -0.88 -0.09 0.00 -1.57 0.00 0.00 52.86 50.19 3frn s ASN 79 Cb 0.11 -0.00 -0.04 0.00 -0.02 0.00 0.00 41.25 41.29 3frn s ASN 79 CO 0.72 -0.28 0.10 -0.69 -2.57 0.00 0.00 177.10 174.38 3frn s VAL 80 N -2.72 5.02 -0.32 1.60 1.01 -0.58 -4.86 120.40 119.55 3frn s VAL 80 Ca 0.09 0.05 -0.12 0.00 0.00 0.00 0.00 61.98 62.01 3frn s VAL 80 Cb -0.01 -3.29 -0.02 0.00 0.00 0.00 0.00 36.38 33.05 3frn s VAL 80 CO 0.00 0.42 0.21 -0.60 0.00 0.00 0.00 175.10 175.14 3frn s ARG 81 N 0.61 3.53 -0.18 2.72 3.52 -0.90 -0.54 118.95 127.71 3frn s ARG 81 Ca 0.05 -0.61 -0.02 0.00 -0.13 0.00 0.00 55.73 55.02 3frn s ARG 81 Cb -0.13 -3.73 -0.01 0.00 -1.56 0.00 0.00 34.95 29.53 3frn s ARG 81 CO 0.01 -0.40 -0.08 0.42 -0.81 0.00 0.00 175.30 174.44 3frn s ILE 82 N 1.70 3.24 -0.24 4.11 1.01 -0.14 -0.95 121.20 129.93 3frn s ILE 82 Ca 0.06 -0.56 -0.09 0.00 0.00 0.00 0.00 60.65 60.06 3frn s ILE 82 Cb -0.17 -2.43 -0.04 0.00 0.01 0.00 0.00 42.46 39.83 3frn s ILE 82 CO 0.10 0.47 0.11 -0.89 0.00 0.00 0.00 174.94 174.73 3frn s THR 83 N 1.01 4.86 -0.26 2.92 2.01 -0.34 0.06 115.64 125.89 3frn s THR 83 Ca -0.00 0.01 -0.13 0.00 0.31 0.00 0.00 61.69 61.87 3frn s THR 83 Cb -0.15 -3.26 -0.04 0.00 0.01 0.00 0.00 72.50 69.06 3frn s THR 83 CO -0.01 0.35 0.28 -0.69 -0.69 0.00 0.00 174.62 173.87 3frn s VAL 84 N 1.20 5.25 0.79 3.82 1.01 -1.03 0.10 120.40 131.54 3frn s VAL 84 Ca 0.06 0.38 -0.15 0.00 0.00 0.00 0.00 61.98 62.27 3frn s VAL 84 Cb -0.14 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.63 3frn s VAL 84 CO 0.05 0.22 0.66 -0.62 0.00 0.00 0.00 175.10 175.41 3frn n GLU 85 N 5.04 0.18 0.00 2.72 1.02 -0.07 -0.79 120.64 128.74 3frn n GLU 85 Ca -0.11 0.11 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 3frn n GLU 85 Cb 0.51 -1.98 0.00 0.00 -0.02 0.00 0.00 31.44 29.95 3frn n GLU 85 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3frn n GLY 86 N 1.37 4.01 3.63 0.62 0.00 -1.26 -3.25 105.19 110.31 3frn n GLY 86 Ca 0.10 -1.54 -0.34 0.00 0.00 0.00 0.00 46.02 44.24 3frn n GLY 86 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3frn n TYR 87 N -1.95 0.75 -0.74 1.61 4.01 -1.26 -4.35 117.16 115.23 3frn n TYR 87 Ca 0.00 0.38 0.09 0.00 -0.16 0.00 0.00 57.90 58.21 3frn n TYR 87 Cb 0.00 -2.06 0.38 0.00 -0.31 0.00 0.00 39.34 37.35 3frn n TYR 87 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 3frn n SER 88 N -2.50 5.18 -0.00 7.72 3.41 -1.26 -4.26 113.62 121.90 3frn n SER 88 Ca 0.13 -2.64 -0.17 0.00 -0.26 0.00 0.00 58.87 55.92 3frn n SER 88 Cb 0.50 -0.63 -0.09 0.00 -0.26 0.00 0.00 64.21 63.73 3frn n SER 88 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3frn h SER 89 N 4.08 0.68 0.32 4.04 4.64 -1.92 -1.07 113.55 124.33 3frn h SER 89 Ca 0.00 -0.70 -0.02 0.00 -0.47 0.00 0.00 61.79 60.61 3frn h SER 89 Cb 1.67 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 63.56 3frn h SER 89 CO 0.34 1.28 -0.15 0.25 -0.87 0.00 0.00 176.83 177.68 3frn h LEU 90 N 0.15 -0.36 -0.60 5.97 5.85 -1.87 -1.44 115.31 123.01 3frn h LEU 90 Ca -0.07 -0.07 0.10 0.00 0.84 0.00 0.00 57.88 58.68 3frn h LEU 90 Cb 1.33 0.09 -0.11 0.00 0.37 0.00 0.00 40.66 42.34 3frn h LEU 90 CO 0.13 -0.16 -0.38 0.50 -0.34 0.00 0.00 178.44 178.20 3frn h LYS 91 N -0.55 -0.18 -0.49 1.25 3.64 -1.78 0.27 116.57 118.73 3frn h LYS 91 Ca -0.04 0.01 0.08 0.00 -1.27 0.00 0.00 60.65 59.43 3frn h LYS 91 Cb 0.41 0.04 -0.07 0.00 -0.41 0.00 0.00 32.23 32.20 3frn h LYS 91 CO 0.07 -0.12 0.10 -0.91 -2.27 0.00 0.00 179.45 176.32 3frn h ASN 92 N -0.19 -0.00 0.25 4.20 -0.26 -1.12 0.39 115.58 118.84 3frn h ASN 92 Ca 0.21 0.09 -0.12 0.00 -0.56 0.00 0.00 56.30 55.91 3frn h ASN 92 Cb 0.56 0.12 -0.01 0.00 -1.06 0.00 0.00 38.32 37.93 3frn h ASN 92 CO -0.69 0.03 -0.48 0.00 -1.06 0.00 0.00 177.43 175.22 3frn h ALA 93 N 1.38 0.98 0.10 -0.83 0.00 -0.25 0.23 119.26 120.86 3frn h ALA 93 Ca 0.24 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 3frn h ALA 93 Cb 0.32 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3frn h ALA 93 CO -0.32 0.65 -0.05 0.28 0.00 0.00 0.00 179.25 179.81 3frn h VAL 94 N 0.23 1.10 -0.79 0.00 2.07 -0.01 -2.84 116.25 116.00 3frn h VAL 94 Ca 0.01 -0.89 0.01 0.00 0.82 0.00 0.00 66.70 66.66 3frn h VAL 94 Cb 0.94 1.65 -0.04 0.00 -1.52 0.00 0.00 31.29 32.32 3frn h VAL 94 CO 0.08 0.21 0.52 -0.26 0.02 0.00 0.00 177.57 178.14 3frn h PHE 95 N -0.56 0.99 -0.83 1.57 -1.00 -0.08 0.17 116.94 117.20 3frn h PHE 95 Ca -0.01 0.02 0.07 0.00 2.81 0.00 0.00 57.97 60.86 3frn h PHE 95 Cb 0.45 -0.33 -0.06 0.00 3.61 0.00 0.00 35.95 39.62 3frn h PHE 95 CO 0.06 0.61 0.50 0.93 -1.61 0.00 0.00 178.31 178.80 3frn h GLU 96 N 1.06 0.87 -0.23 1.51 5.08 -1.04 -1.08 114.58 120.75 3frn h GLU 96 Ca 0.30 -0.05 -0.08 0.00 -1.00 0.00 0.00 59.36 58.53 3frn h GLU 96 Cb -0.10 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 28.95 3frn h GLU 96 CO -0.07 0.58 -0.16 1.49 -1.00 0.00 0.00 179.01 179.85 3frn h GLU 97 N 0.90 0.51 -0.18 2.33 4.57 -1.06 -2.80 114.58 118.84 3frn h GLU 97 Ca 0.37 -0.24 0.03 0.00 -1.18 0.00 0.00 59.36 58.34 3frn h GLU 97 Cb 0.21 -0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 28.76 3frn h GLU 97 CO -0.19 0.81 -0.03 0.82 -1.18 0.00 0.00 179.01 179.24 3frn h ILE 98 N 0.21 0.84 -0.98 2.32 2.04 -0.88 -2.32 117.51 118.73 3frn h ILE 98 Ca 0.04 -0.01 0.29 0.00 1.00 0.00 0.00 64.86 66.19 3frn h ILE 98 Cb 0.68 0.81 -0.14 0.00 -0.74 0.00 0.00 36.82 37.44 3frn h ILE 98 CO 0.04 0.00 0.52 1.23 0.00 0.00 0.00 178.15 179.95 3frn h GLY 99 N 0.02 1.92 0.79 5.37 0.00 -1.13 0.61 103.07 110.64 3frn h GLY 99 Ca 0.09 -0.22 -0.12 0.00 0.00 0.00 0.00 47.33 47.08 3frn h GLY 99 CO -0.17 -0.41 -0.40 0.50 0.00 0.00 0.00 176.54 176.06 3frn h LYS 100 N 0.37 0.43 0.03 4.80 1.57 -1.17 -2.46 116.57 120.14 3frn h LYS 100 Ca 0.68 -0.34 -0.22 0.00 -1.87 0.00 0.00 60.65 58.90 3frn h LYS 100 Cb 1.47 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.83 3frn h LYS 100 CO -0.58 0.97 -1.06 0.87 -0.57 0.00 0.00 179.45 179.09 3frn h LYS 101 N -0.00 0.06 0.07 3.15 1.79 -0.78 -3.33 116.57 117.53 3frn h LYS 101 Ca -0.02 -0.11 -0.24 0.00 -2.18 0.00 0.00 60.65 58.10 3frn h LYS 101 Cb 1.04 0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 31.72 3frn h LYS 101 CO 0.08 1.05 -1.11 0.00 -1.08 0.00 0.00 179.45 178.39 3frn h ALA 102 N 0.90 0.23 0.00 3.86 0.00 0.07 -3.48 119.26 120.84 3frn h ALA 102 Ca -0.04 -0.88 0.00 0.00 0.00 0.00 0.00 54.91 53.99 3frn h ALA 102 Cb 1.82 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.54 3frn h ALA 102 CO 0.15 1.08 0.00 -0.85 0.00 0.00 0.00 179.25 179.63 3frn n GLU 103 N -3.47 0.00 -3.27 0.00 0.28 -0.93 -5.07 120.64 108.18 3frn n GLU 103 Ca -0.05 0.00 -0.23 0.00 -0.16 0.00 0.00 57.16 56.72 3frn n GLU 103 Cb 0.97 -0.42 -0.00 0.00 1.43 0.00 0.00 31.44 33.42 3frn n GLU 103 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3frn s ALA 104 N -2.28 3.77 0.18 -1.84 0.00 -1.19 -4.98 121.76 115.42 3frn s ALA 104 Ca 0.00 -1.02 0.00 0.00 0.00 0.00 0.00 51.96 50.94 3frn s ALA 104 Cb 0.00 -2.07 -0.04 0.00 0.00 0.00 0.00 23.12 21.01 3frn s ALA 104 CO 0.00 -0.14 0.05 -1.59 0.00 0.00 0.00 175.76 174.08 3frn s LYS 105 N -4.38 1.11 -1.47 0.00 0.00 -1.26 -4.42 119.74 109.33 3frn s LYS 105 Ca 0.43 -1.55 -0.10 0.00 0.00 0.00 0.00 55.97 54.75 3frn s LYS 105 Cb -0.10 -0.04 0.06 0.00 0.00 0.00 0.00 37.83 37.75 3frn s LYS 105 CO 0.36 -0.23 0.89 -0.25 0.00 0.00 0.00 175.35 176.12 3frn n ASP 106 N -0.23 -3.65 -4.71 0.03 9.92 -1.26 -4.98 116.55 111.66 3frn n ASP 106 Ca -0.04 -0.80 -0.23 0.00 -0.53 0.00 0.00 54.79 53.19 3frn n ASP 106 Cb 0.64 -3.91 -0.06 0.00 -0.64 0.00 0.00 41.12 37.15 3frn n ASP 106 CO 0.00 0.00 0.00 0.72 0.13 0.00 0.00 177.20 178.05 3frn s PHE 107 N -3.43 2.80 -0.03 1.24 -0.71 -1.26 -4.91 117.98 111.69 3frn s PHE 107 Ca 0.46 -0.23 -0.03 0.00 -1.04 0.00 0.00 56.93 56.09 3frn s PHE 107 Cb -0.23 -1.36 -0.04 0.00 -1.21 0.00 0.00 43.02 40.18 3frn s PHE 107 CO 0.83 0.52 0.17 -1.21 -1.34 0.00 0.00 175.22 174.19 3frn s GLU 108 N -3.76 3.41 -0.00 1.99 2.02 0.12 -4.98 118.70 117.49 3frn s GLU 108 Ca 0.33 -0.31 0.04 0.00 0.02 0.00 0.00 54.97 55.05 3frn s GLU 108 Cb -0.06 -3.09 -0.01 0.00 0.10 0.00 0.00 34.13 31.07 3frn s GLU 108 CO 0.22 0.69 -0.12 0.00 0.02 0.00 0.00 175.26 176.07 3frn s ALA 109 N -1.27 0.96 -0.07 5.21 0.00 -1.26 -0.43 121.76 124.89 3frn s ALA 109 Ca 0.25 -0.53 0.02 0.00 0.00 0.00 0.00 51.96 51.70 3frn s ALA 109 Cb -0.12 -0.23 0.01 0.00 0.00 0.00 0.00 23.12 22.78 3frn s ALA 109 CO 0.16 0.23 -0.12 -0.06 0.00 0.00 0.00 175.76 175.97 3frn s PHE 110 N -0.35 1.48 0.04 0.00 0.08 -0.54 -4.55 117.98 114.14 3frn s PHE 110 Ca 0.04 -0.57 -0.30 0.00 0.12 0.00 0.00 56.93 56.22 3frn s PHE 110 Cb -0.05 -1.10 -0.04 0.00 -0.57 0.00 0.00 43.02 41.26 3frn s PHE 110 CO -0.00 -0.31 0.99 0.54 -0.10 0.00 0.00 175.22 176.35 3frn s VAL 111 N 0.77 4.70 -0.08 -0.44 0.11 -0.19 -0.39 120.40 124.88 3frn s VAL 111 Ca -0.13 2.01 0.02 0.00 -2.93 0.00 0.00 61.98 60.95 3frn s VAL 111 Cb -0.15 -4.29 -0.02 0.00 -1.53 0.00 0.00 36.38 30.39 3frn s VAL 111 CO 0.03 0.20 0.07 1.33 -3.33 0.00 0.00 175.10 173.39 3frn n VAL 112 N 3.59 0.00 -3.71 2.04 0.24 0.69 -0.84 118.33 120.35 3frn n VAL 112 Ca 0.05 -0.42 -0.13 0.00 -2.04 0.00 0.00 64.34 61.80 3frn n VAL 112 Cb 0.50 0.95 -0.09 0.00 -1.47 0.00 0.00 33.84 33.73 3frn n VAL 112 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 3frn s LYS 113 N -1.26 0.58 0.09 7.34 2.20 -1.20 -4.75 119.74 122.74 3frn s LYS 113 Ca 0.01 0.62 0.08 0.00 -0.36 0.00 0.00 55.97 56.32 3frn s LYS 113 Cb 0.01 0.28 -0.03 0.00 -1.51 0.00 0.00 37.83 36.58 3frn s LYS 113 CO 0.07 -0.08 -0.21 0.95 -0.36 0.00 0.00 175.35 175.73 3frn s THR 114 N 0.16 1.68 0.07 3.43 -4.23 -1.26 -0.54 115.64 114.95 3frn s THR 114 Ca -0.01 -1.47 0.06 0.00 -1.18 0.00 0.00 61.69 59.08 3frn s THR 114 Cb -0.03 -1.52 -0.03 0.00 1.34 0.00 0.00 72.50 72.26 3frn s THR 114 CO 0.01 -0.02 -0.15 -0.36 -0.54 0.00 0.00 174.62 173.55 3frn s PHE 115 N -1.10 1.32 0.00 3.99 0.40 0.29 -4.84 117.98 118.04 3frn s PHE 115 Ca 0.06 -0.44 0.00 0.00 -0.60 0.00 0.00 56.93 55.95 3frn s PHE 115 Cb -0.10 -0.75 0.00 0.00 0.51 0.00 0.00 43.02 42.69 3frn s PHE 115 CO 0.04 0.08 0.00 0.41 0.70 0.00 0.00 175.22 176.45 3frn n GLY 116 N 1.33 0.34 3.38 4.36 0.00 -1.26 -0.69 105.19 112.65 3frn n GLY 116 Ca -0.20 -2.13 -0.22 0.00 0.00 0.00 0.00 46.02 43.47 3frn n GLY 116 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3frn s THR 117 N 0.00 2.03 -0.01 2.61 -4.23 -1.14 -5.04 115.64 109.87 3frn s THR 117 Ca 0.00 -2.14 -0.30 0.00 -1.18 0.00 0.00 61.69 58.07 3frn s THR 117 Cb 0.00 -2.05 -0.06 0.00 1.34 0.00 0.00 72.50 71.72 3frn s THR 117 CO 0.00 -0.39 1.61 -0.22 -0.54 0.00 0.00 174.62 175.08 3frn s LEU 118 N -3.07 4.33 0.71 4.79 2.96 -1.26 -4.64 118.68 122.51 3frn s LEU 118 Ca 0.22 2.29 -0.11 0.00 -0.22 0.00 0.00 54.13 56.31 3frn s LEU 118 Cb -0.04 -3.55 0.02 0.00 0.50 0.00 0.00 46.19 43.12 3frn s LEU 118 CO 0.09 -0.88 1.07 -2.16 -1.32 0.00 0.00 176.35 173.16 3frn s PRO 119 N 3.32 2.73 -0.03 0.98 0.04 -1.26 -5.00 135.00 135.78 3frn s PRO 119 Ca 0.72 1.08 -0.25 0.00 0.04 0.00 0.00 61.00 62.58 3frn s PRO 119 Cb -0.35 -1.96 -0.20 0.00 0.04 0.00 0.00 34.50 32.03 3frn s PRO 119 CO 0.30 -1.27 1.17 0.93 0.04 0.00 0.00 177.00 178.17 3frn h GLU 120 N -0.71 -0.05 -6.46 4.56 5.08 -1.97 -3.46 114.58 111.57 3frn h GLU 120 Ca -0.44 0.00 -0.63 0.00 -1.00 0.00 0.00 59.36 57.29 3frn h GLU 120 Cb 1.22 0.01 -0.14 0.00 0.50 0.00 0.00 28.75 30.34 3frn h GLU 120 CO 0.55 0.46 -0.72 0.15 -1.00 0.00 0.00 179.01 178.44 3frn s LYS 121 N -4.01 2.12 -0.24 2.33 1.02 -1.26 -5.06 119.74 114.64 3frn s LYS 121 Ca -0.16 -1.19 0.14 0.00 0.02 0.00 0.00 55.97 54.78 3frn s LYS 121 Cb 0.01 -2.22 0.63 0.00 -0.52 0.00 0.00 37.83 35.73 3frn s LYS 121 CO 0.64 0.45 1.58 1.19 -0.92 0.00 0.00 175.35 178.29 3frn n PHE 122 N 0.18 1.52 -3.34 3.18 3.72 -1.26 -4.86 117.46 116.60 3frn n PHE 122 Ca -0.11 -1.02 -0.45 0.00 -0.05 0.00 0.00 57.45 55.82 3frn n PHE 122 Cb 0.55 -0.46 -0.07 0.00 -0.94 0.00 0.00 39.48 38.56 3frn n PHE 122 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 3frn s GLU 123 N -2.91 3.00 0.56 -1.08 8.01 -1.26 -4.80 118.70 120.23 3frn s GLU 123 Ca 0.48 -1.33 -0.19 0.00 0.01 0.00 0.00 54.97 53.94 3frn s GLU 123 Cb 0.39 -4.15 -0.05 0.00 -4.31 0.00 0.00 34.13 26.00 3frn s GLU 123 CO 0.10 -1.11 1.14 -1.25 0.01 0.00 0.00 175.26 174.15 3frn s PRO 124 N 1.81 3.23 -0.14 0.39 0.04 -1.26 -4.71 135.00 134.36 3frn s PRO 124 Ca 0.06 1.63 -0.18 0.00 0.04 0.00 0.00 61.00 62.55 3frn s PRO 124 Cb -0.24 -1.98 -0.15 0.00 0.04 0.00 0.00 34.50 32.16 3frn s PRO 124 CO 0.07 -0.96 0.36 1.96 0.04 0.00 0.00 177.00 178.47 3frn h GLN 125 N 1.03 0.00 -6.19 4.56 4.20 -0.28 -3.48 115.11 114.94 3frn h GLN 125 Ca -0.50 0.00 -0.59 0.00 0.06 0.00 0.00 58.65 57.62 3frn h GLN 125 Cb 1.27 0.00 -0.25 0.00 0.30 0.00 0.00 27.48 28.80 3frn h GLN 125 CO 0.56 0.63 -0.84 0.99 -0.67 0.00 0.00 178.83 179.50 3frn s THR 126 N -2.07 1.74 -0.25 -0.54 2.01 -1.22 -4.99 115.64 110.32 3frn s THR 126 Ca -0.15 -1.31 -0.01 0.00 0.31 0.00 0.00 61.69 60.53 3frn s THR 126 Cb 0.00 -1.53 0.07 0.00 0.01 0.00 0.00 72.50 71.06 3frn s THR 126 CO 0.44 0.16 0.03 -0.63 -0.69 0.00 0.00 174.62 173.92 3frn s ILE 127 N -0.89 1.02 -0.14 1.82 1.01 -1.26 -2.14 121.20 120.62 3frn s ILE 127 Ca 0.08 -1.09 -0.00 0.00 0.00 0.00 0.00 60.65 59.64 3frn s ILE 127 Cb -0.09 -1.53 -0.01 0.00 0.01 0.00 0.00 42.46 40.84 3frn s ILE 127 CO 0.02 -0.33 -0.14 -0.60 0.00 0.00 0.00 174.94 173.90 3frn s ARG 128 N 1.60 3.33 -0.12 2.79 3.52 -0.39 -4.96 118.95 124.72 3frn s ARG 128 Ca 0.01 -0.71 0.02 0.00 -0.13 0.00 0.00 55.73 54.93 3frn s ARG 128 Cb -0.18 -2.63 0.00 0.00 -1.56 0.00 0.00 34.95 30.58 3frn s ARG 128 CO -0.12 0.15 -0.20 0.08 -0.81 0.00 0.00 175.30 174.39 3frn s VAL 129 N 0.51 2.31 0.04 7.11 1.01 -1.26 0.34 120.40 130.47 3frn s VAL 129 Ca -0.09 -0.91 0.05 0.00 0.00 0.00 0.00 61.98 61.03 3frn s VAL 129 Cb -0.16 -1.92 -0.02 0.00 0.00 0.00 0.00 36.38 34.28 3frn s VAL 129 CO 0.04 0.54 -0.16 -0.89 0.00 0.00 0.00 175.10 174.64 3frn s THR 130 N 0.55 1.24 -0.03 3.92 2.01 -0.54 -4.95 115.64 117.83 3frn s THR 130 Ca -0.12 -1.01 -0.30 0.00 0.31 0.00 0.00 61.69 60.57 3frn s THR 130 Cb -0.17 -1.10 -0.04 0.00 0.01 0.00 0.00 72.50 71.20 3frn s THR 130 CO 0.04 0.08 1.21 -0.75 -0.69 0.00 0.00 174.62 174.50 3frn s LYS 131 N -1.08 4.36 -0.18 4.92 2.20 -1.26 -0.01 119.74 128.69 3frn s LYS 131 Ca 0.03 1.70 -0.16 0.00 -0.36 0.00 0.00 55.97 57.18 3frn s LYS 131 Cb -0.08 -3.52 -0.12 0.00 -1.51 0.00 0.00 37.83 32.60 3frn s LYS 131 CO 0.01 -0.42 0.03 -0.89 -0.36 0.00 0.00 175.35 173.72 3frn n ILE 132 N 4.50 1.48 -2.27 5.43 2.08 0.25 -4.89 119.36 125.94 3frn n ILE 132 Ca 0.11 0.08 0.00 0.00 0.56 0.00 0.00 62.75 63.50 3frn n ILE 132 Cb 0.46 -2.20 0.00 0.00 -0.75 0.00 0.00 39.64 37.15 3frn n ILE 132 CO 0.00 0.00 0.00 -1.54 0.56 0.00 0.00 176.55 175.57 3frn n SER 133 N -4.51 0.00 -4.66 4.38 3.41 -1.15 -5.04 113.62 106.05 3frn n SER 133 Ca -0.21 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 57.98 3frn n SER 133 Cb 0.49 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.42 3frn n SER 133 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 3frn s LYS 134 N 1.16 4.17 -0.37 4.33 2.20 -1.26 -2.99 119.74 126.99 3frn s LYS 134 Ca 0.00 2.29 0.00 0.00 -0.36 0.00 0.00 55.97 57.90 3frn s LYS 134 Cb 0.00 -4.02 0.00 0.00 -1.51 0.00 0.00 37.83 32.30 3frn s LYS 134 CO 0.00 -0.87 0.00 0.09 -0.36 0.00 0.00 175.35 174.21 3frn n ASN 135 N 7.22 -4.49 -3.92 1.43 3.02 -1.26 -4.99 115.26 112.27 3frn n ASN 135 Ca 0.18 0.09 -0.27 0.00 -0.03 0.00 0.00 54.58 54.55 3frn n ASN 135 Cb 0.42 -2.29 -0.17 0.00 -0.61 0.00 0.00 39.78 37.13 3frn n ASN 135 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3frn s LEU 136 N -0.79 1.22 0.01 3.41 2.96 -1.16 -0.47 118.68 123.87 3frn s LEU 136 Ca 0.00 -0.31 0.06 0.00 -0.22 0.00 0.00 54.13 53.66 3frn s LEU 136 Cb 0.00 -0.86 -0.02 0.00 0.50 0.00 0.00 46.19 45.81 3frn s LEU 136 CO 0.00 -0.11 -0.18 -0.36 -1.32 0.00 0.00 176.35 174.38 3frn s PHE 137 N 1.66 1.57 -0.40 5.38 0.08 -0.62 -0.58 117.98 125.07 3frn s PHE 137 Ca 0.04 -0.32 -0.18 0.00 0.12 0.00 0.00 56.93 56.59 3frn s PHE 137 Cb -0.13 -0.98 0.01 0.00 -0.57 0.00 0.00 43.02 41.35 3frn s PHE 137 CO -0.08 0.01 0.52 -1.54 -0.10 0.00 0.00 175.22 174.03 3frn s SER 138 N -0.70 6.27 -0.45 1.36 1.04 0.98 -0.24 113.70 121.96 3frn s SER 138 Ca 0.06 -0.32 -0.16 0.00 0.48 0.00 0.00 55.95 56.01 3frn s SER 138 Cb -0.07 -2.26 0.04 0.00 0.10 0.00 0.00 66.02 63.83 3frn s SER 138 CO 0.00 -0.58 0.41 -0.69 0.98 0.00 0.00 173.24 173.36 3frn s VAL 139 N 2.41 5.16 -0.18 5.02 1.01 0.16 -1.47 120.40 132.51 3frn s VAL 139 Ca 0.17 -0.71 -0.16 0.00 0.00 0.00 0.00 61.98 61.29 3frn s VAL 139 Cb -0.16 -4.08 -0.04 0.00 0.00 0.00 0.00 36.38 32.11 3frn s VAL 139 CO 0.15 -0.50 0.39 0.12 0.00 0.00 0.00 175.10 175.26 3frn s PHE 140 N 1.90 3.42 -0.17 5.22 5.36 0.15 -0.64 117.98 133.22 3frn s PHE 140 Ca 0.08 0.66 0.01 0.00 -0.96 0.00 0.00 56.93 56.71 3frn s PHE 140 Cb -0.20 -2.49 0.01 0.00 -0.34 0.00 0.00 43.02 40.00 3frn s PHE 140 CO 0.10 0.08 -0.18 -0.51 -1.46 0.00 0.00 175.22 173.25 3frn s LEU 141 N 1.00 2.29 -0.16 6.12 1.43 0.18 -1.26 118.68 128.28 3frn s LEU 141 Ca 0.20 -0.57 -0.16 0.00 -1.03 0.00 0.00 54.13 52.57 3frn s LEU 141 Cb -0.14 -1.52 -0.04 0.00 0.03 0.00 0.00 46.19 44.52 3frn s LEU 141 CO 0.07 0.04 0.38 -0.60 0.23 0.00 0.00 176.35 176.47 3frn s ARG 142 N 1.07 4.25 0.24 1.70 3.00 -0.91 -1.08 118.95 127.22 3frn s ARG 142 Ca -0.01 0.22 0.10 0.00 -1.00 0.00 0.00 55.73 55.05 3frn s ARG 142 Cb -0.14 -3.46 -0.04 0.00 0.00 0.00 0.00 34.95 31.30 3frn s ARG 142 CO -0.06 0.13 -0.08 -0.06 0.00 0.00 0.00 175.30 175.23 3frn s PHE 143 N 0.79 2.59 0.43 5.12 0.08 0.68 0.52 117.98 128.19 3frn s PHE 143 Ca 0.20 -0.25 0.21 0.00 0.12 0.00 0.00 56.93 57.21 3frn s PHE 143 Cb -0.14 -1.18 1.18 0.00 -0.57 0.00 0.00 43.02 42.30 3frn s PHE 143 CO 0.07 0.60 1.81 -1.35 -0.10 0.00 0.00 175.22 176.25 3frn h PRO 144 N 2.33 0.31 0.00 0.24 0.11 -1.93 -3.03 132.00 130.03 3frn h PRO 144 Ca -0.44 -0.02 -0.35 0.00 0.11 0.00 0.00 66.00 65.30 3frn h PRO 144 Cb 1.24 -0.07 -0.06 0.00 0.11 0.00 0.00 31.00 32.21 3frn h PRO 144 CO 0.58 0.21 -2.21 -0.40 -0.21 0.00 0.00 178.00 175.97 3frn n ASP 145 N -4.51 0.23 -0.98 -2.05 3.85 -1.26 -5.09 116.55 106.75 3frn n ASP 145 Ca 0.23 0.11 0.00 0.00 -0.71 0.00 0.00 54.79 54.42 3frn n ASP 145 Cb 0.87 0.72 0.00 0.00 -1.35 0.00 0.00 41.12 41.36 3frn n ASP 145 CO 0.00 0.00 0.00 1.07 -1.01 0.00 0.00 177.20 177.26 3frn n THR 146 N -2.83 0.00 -4.40 2.12 5.66 -1.15 -5.07 114.28 108.62 3frn n THR 146 Ca -0.29 0.00 -0.20 0.00 -3.05 0.00 0.00 64.05 60.52 3frn n THR 146 Cb 1.13 0.00 -0.15 0.00 -1.55 0.00 0.00 70.33 69.76 3frn n THR 146 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 3frn s TYR 147 N -8.63 0.91 -0.10 1.09 -0.85 -1.26 -0.23 117.35 108.28 3frn s TYR 147 Ca 0.00 -0.20 0.02 0.00 -0.52 0.00 0.00 57.07 56.38 3frn s TYR 147 Cb 0.00 -0.62 0.01 0.00 0.38 0.00 0.00 41.96 41.73 3frn s TYR 147 CO 0.00 -0.05 -0.17 0.08 -1.52 0.00 0.00 175.55 173.89 3frn s VAL 148 N -0.03 1.59 -0.24 -3.49 1.01 -0.24 -2.88 120.40 116.12 3frn s VAL 148 Ca 0.01 -0.71 -0.09 0.00 0.00 0.00 0.00 61.98 61.18 3frn s VAL 148 Cb -0.06 -1.42 -0.04 0.00 0.00 0.00 0.00 36.38 34.85 3frn s VAL 148 CO 0.00 0.46 0.13 -0.89 0.00 0.00 0.00 175.10 174.80 3frn s THR 149 N 0.78 5.02 -0.20 3.92 2.01 0.14 0.47 115.64 127.77 3frn s THR 149 Ca -0.11 0.06 -0.04 0.00 0.31 0.00 0.00 61.69 61.91 3frn s THR 149 Cb -0.16 -3.34 -0.02 0.00 0.01 0.00 0.00 72.50 69.00 3frn s THR 149 CO 0.02 0.35 -0.03 -0.76 -0.69 0.00 0.00 174.62 173.50 3frn s LEU 150 N 1.18 3.08 -0.29 4.42 1.43 0.19 -0.55 118.68 128.15 3frn s LEU 150 Ca 0.06 -0.27 -0.21 0.00 -1.03 0.00 0.00 54.13 52.68 3frn s LEU 150 Cb -0.14 -1.77 -0.01 0.00 0.03 0.00 0.00 46.19 44.29 3frn s LEU 150 CO 0.05 0.05 0.66 0.20 0.23 0.00 0.00 176.35 177.54 3frn s ASN 151 N 1.05 6.56 -0.15 2.29 0.02 0.30 0.39 114.94 125.40 3frn s ASN 151 Ca 0.01 0.58 0.01 0.00 -1.02 0.00 0.00 52.86 52.44 3frn s ASN 151 Cb -0.15 -2.35 0.00 0.00 0.02 0.00 0.00 41.25 38.78 3frn s ASN 151 CO 0.01 -0.46 -0.17 -0.04 0.02 0.00 0.00 177.10 176.45 3frn s MET 152 N 2.63 3.15 -0.13 -0.60 -1.94 0.67 -0.23 119.30 122.86 3frn s MET 152 Ca 0.27 -0.78 -0.22 0.00 -1.71 0.00 0.00 55.69 53.25 3frn s MET 152 Cb -0.15 -2.56 -0.03 0.00 2.01 0.00 0.00 34.83 34.10 3frn s MET 152 CO 0.11 0.01 0.64 -1.17 -0.01 0.00 0.00 175.02 174.60 3frn s LEU 153 N 0.80 4.24 -0.11 -0.03 2.96 0.48 -1.60 118.68 125.41 3frn s LEU 153 Ca -0.06 0.98 -0.14 0.00 -0.22 0.00 0.00 54.13 54.70 3frn s LEU 153 Cb -0.15 -2.94 -0.05 0.00 0.50 0.00 0.00 46.19 43.54 3frn s LEU 153 CO -0.00 -0.17 0.32 -0.76 -1.32 0.00 0.00 176.35 174.42 3frn s LEU 154 N 1.24 4.33 -0.02 -0.68 1.02 0.38 -1.47 118.68 123.48 3frn s LEU 154 Ca 0.32 0.65 0.03 0.00 0.02 0.00 0.00 54.13 55.15 3frn s LEU 154 Cb -0.16 -2.42 -0.00 0.00 0.02 0.00 0.00 46.19 43.62 3frn s LEU 154 CO 0.13 0.19 -0.09 -0.13 0.02 0.00 0.00 176.35 176.47 3frn s ARG 155 N -0.11 0.82 -0.35 1.70 0.52 0.42 -4.91 118.95 117.03 3frn s ARG 155 Ca 0.19 -0.30 0.01 0.00 -0.52 0.00 0.00 55.73 55.11 3frn s ARG 155 Cb -0.14 -0.78 0.11 0.00 0.52 0.00 0.00 34.95 34.66 3frn s ARG 155 CO 0.07 0.15 0.13 0.21 0.02 0.00 0.00 175.30 175.88 3frn s LYS 156 N -0.00 1.02 -0.22 3.54 2.20 -1.26 0.11 119.74 125.13 3frn s LYS 156 Ca 0.00 -1.49 -0.16 0.00 -0.36 0.00 0.00 55.97 53.96 3frn s LYS 156 Cb -0.06 -2.32 -0.04 0.00 -1.51 0.00 0.00 37.83 33.90 3frn s LYS 156 CO -0.00 -1.03 0.40 -2.00 -0.36 0.00 0.00 175.35 172.36 3frn s GLU 157 N 1.12 4.14 0.13 4.03 2.56 -1.26 0.10 118.70 129.51 3frn s GLU 157 Ca 0.12 0.17 -0.08 0.00 0.00 0.00 0.00 54.97 55.18 3frn s GLU 157 Cb -0.20 -3.56 -0.01 0.00 2.00 0.00 0.00 34.13 32.36 3frn s GLU 157 CO -0.15 -0.10 0.23 0.50 -0.56 0.00 0.00 175.26 175.18 3frn s ARG 158 N 1.50 1.01 -0.33 4.30 6.06 0.04 -4.93 118.95 126.59 3frn s ARG 158 Ca 0.18 -1.10 -0.27 0.00 -2.50 0.00 0.00 55.73 52.04 3frn s ARG 158 Cb -0.15 0.35 0.01 0.00 0.06 0.00 0.00 34.95 35.23 3frn s ARG 158 CO 0.08 -0.35 0.97 -0.80 -2.50 0.00 0.00 175.30 172.70 3frn s ASN 159 N -2.93 6.79 0.32 -2.12 0.01 -1.26 0.28 114.94 116.03 3frn s ASN 159 Ca 0.12 0.81 0.09 0.00 -0.71 0.00 0.00 52.86 53.17 3frn s ASN 159 Cb 0.04 -2.49 -0.05 0.00 0.41 0.00 0.00 41.25 39.17 3frn s ASN 159 CO -0.04 -0.82 0.05 0.68 -1.51 0.00 0.00 177.10 175.45 3frn s VAL 160 N 3.45 2.98 -0.23 1.60 -7.23 0.25 -4.47 120.40 116.76 3frn s VAL 160 Ca 0.40 -1.87 -0.25 0.00 -1.81 0.00 0.00 61.98 58.45 3frn s VAL 160 Cb -0.12 -2.86 -0.01 0.00 0.56 0.00 0.00 36.38 33.95 3frn s VAL 160 CO 0.16 -0.25 0.82 -0.69 -0.31 0.00 0.00 175.10 174.84 3frn s VAL 161 N -2.43 4.85 0.02 1.32 1.01 -0.57 -0.40 120.40 124.20 3frn s VAL 161 Ca 0.35 1.57 0.07 0.00 0.00 0.00 0.00 61.98 63.97 3frn s VAL 161 Cb -0.03 -4.12 -0.02 0.00 0.00 0.00 0.00 36.38 32.22 3frn s VAL 161 CO 0.20 -0.05 -0.22 -0.69 0.00 0.00 0.00 175.10 174.35 3frn s VAL 162 N 2.68 1.74 0.14 2.92 1.01 0.50 -1.40 120.40 127.99 3frn s VAL 162 Ca 0.35 -1.09 -0.31 0.00 0.00 0.00 0.00 61.98 60.93 3frn s VAL 162 Cb -0.16 -1.48 -0.09 0.00 0.00 0.00 0.00 36.38 34.66 3frn s VAL 162 CO 0.08 0.36 1.47 -0.76 0.00 0.00 0.00 175.10 176.25 3frn s LEU 163 N -0.87 4.37 0.17 3.92 1.43 -0.78 -0.87 118.68 126.06 3frn s LEU 163 Ca 0.08 2.46 0.12 0.00 -1.03 0.00 0.00 54.13 55.77 3frn s LEU 163 Cb -0.09 -3.59 -0.08 0.00 0.03 0.00 0.00 46.19 42.46 3frn s LEU 163 CO 0.01 -0.73 1.25 0.11 0.23 0.00 0.00 176.35 177.22 3frn h LYS 164 N 6.80 0.00 -3.78 1.70 1.57 -0.36 -1.86 116.57 120.64 3frn h LYS 164 Ca -0.42 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.27 3frn h LYS 164 Cb 1.21 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 33.39 3frn h LYS 164 CO 0.89 0.66 -0.27 -0.98 -0.57 0.00 0.00 179.45 179.17 3frn s ARG 165 N -2.84 1.13 0.34 3.15 1.70 -1.24 -4.84 118.95 116.35 3frn s ARG 165 Ca 0.01 -1.08 -0.28 0.00 -0.47 0.00 0.00 55.73 53.91 3frn s ARG 165 Cb 0.09 0.39 -0.10 0.00 -0.57 0.00 0.00 34.95 34.76 3frn s ARG 165 CO 0.79 -0.42 1.29 -0.80 -1.08 0.00 0.00 175.30 175.08 3frn s ASN 166 N -2.93 6.75 0.10 -2.89 0.01 -1.26 -4.14 114.94 110.58 3frn s ASN 166 Ca 0.13 2.66 0.04 0.00 -0.71 0.00 0.00 52.86 54.98 3frn s ASN 166 Cb 0.03 -2.65 -0.04 0.00 0.41 0.00 0.00 41.25 39.01 3frn s ASN 166 CO -0.03 -0.55 -0.10 0.27 -1.51 0.00 0.00 177.10 175.19 3frn s ILE 167 N -1.16 0.94 0.39 0.60 -4.36 -0.52 -4.97 121.20 112.13 3frn s ILE 167 Ca 0.50 -1.71 0.08 0.00 -0.26 0.00 0.00 60.65 59.25 3frn s ILE 167 Cb -0.39 -1.44 -0.06 0.00 1.25 0.00 0.00 42.46 41.82 3frn s ILE 167 CO 0.52 -0.61 0.10 0.21 0.24 0.00 0.00 174.94 175.40 3frn s ASN 168 N -2.58 4.23 0.09 4.36 3.84 -1.26 -1.07 114.94 122.55 3frn s ASN 168 Ca 0.07 -1.13 -0.34 0.00 0.21 0.00 0.00 52.86 51.68 3frn s ASN 168 Cb -0.02 -0.48 -0.13 0.00 -0.55 0.00 0.00 41.25 40.08 3frn s ASN 168 CO -0.00 -0.44 1.70 0.52 -2.79 0.00 0.00 177.10 176.08 3frn n VAL 169 N -1.10 0.21 0.00 -5.21 0.31 -1.19 -1.90 118.33 109.45 3frn n VAL 169 Ca -0.03 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.26 3frn n VAL 169 Cb 0.65 -1.71 0.00 0.00 -0.91 0.00 0.00 33.84 31.87 3frn n VAL 169 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3frn n GLY 170 N 3.80 1.31 3.74 2.92 0.00 0.05 -4.97 105.19 112.04 3frn n GLY 170 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 3frn n GLY 170 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3frn s ASP 171 N -2.85 6.77 0.03 1.61 1.01 -0.80 -4.70 116.67 117.74 3frn s ASP 171 Ca 0.00 2.56 -0.30 0.00 0.71 0.00 0.00 52.55 55.51 3frn s ASP 171 Cb 0.00 -2.62 -0.04 0.00 1.01 0.00 0.00 42.92 41.27 3frn s ASP 171 CO 0.00 -0.61 1.05 -0.69 0.21 0.00 0.00 175.17 175.13 3frn s VAL 172 N -0.03 4.56 -0.02 -1.27 1.01 -1.26 -0.88 120.40 122.51 3frn s VAL 172 Ca 0.57 1.86 -0.30 0.00 0.00 0.00 0.00 61.98 64.11 3frn s VAL 172 Cb -0.39 -4.19 -0.04 0.00 0.00 0.00 0.00 36.38 31.75 3frn s VAL 172 CO 0.42 0.16 1.23 -0.63 0.00 0.00 0.00 175.10 176.27 3frn s ILE 173 N 0.94 4.12 0.38 2.22 -1.09 0.31 -4.95 121.20 123.12 3frn s ILE 173 Ca 0.54 1.47 0.08 0.00 -2.23 0.00 0.00 60.65 60.52 3frn s ILE 173 Cb -0.24 -3.95 -0.07 0.00 -1.58 0.00 0.00 42.46 36.62 3frn s ILE 173 CO 0.29 0.03 -0.03 -1.59 -1.23 0.00 0.00 174.94 172.40 3frn s LYS 174 N 1.94 1.91 0.60 2.79 0.00 -1.26 -1.37 119.74 124.35 3frn s LYS 174 Ca 0.58 -2.01 0.29 0.00 0.00 0.00 0.00 55.97 54.83 3frn s LYS 174 Cb -0.27 -1.69 1.65 0.00 0.00 0.00 0.00 37.83 37.52 3frn s LYS 174 CO 0.25 0.04 2.06 0.93 0.00 0.00 0.00 175.35 178.63 3frn h GLU 175 N 1.88 0.00 0.00 1.78 5.08 -1.95 0.86 114.58 122.23 3frn h GLU 175 Ca -0.43 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 3frn h GLU 175 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 3frn h GLU 175 CO 0.75 0.00 0.00 1.49 -1.00 0.00 0.00 179.01 180.25 3frn h GLU 176 N 0.00 0.00 0.00 2.33 4.57 -2.01 -3.22 114.58 116.25 3frn h GLU 176 Ca 0.10 0.00 -0.04 0.00 -1.18 0.00 0.00 59.36 58.25 3frn h GLU 176 Cb 0.61 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.20 3frn h GLU 176 CO -0.00 0.00 -0.60 -0.44 -1.18 0.00 0.00 179.01 176.78 3frn h ASP 177 N 0.00 0.00 -4.28 1.04 3.32 -1.22 -3.45 116.42 111.83 3frn h ASP 177 Ca 0.00 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.53 3frn h ASP 177 Cb 0.72 0.00 -0.23 0.00 0.22 0.00 0.00 39.33 40.04 3frn h ASP 177 CO 0.00 0.14 -0.82 0.68 -1.72 0.00 0.00 179.24 177.53 3frn s VAL 178 N -3.20 1.51 0.37 -1.35 -7.23 -1.22 0.41 120.40 109.69 3frn s VAL 178 Ca 0.03 -1.35 0.03 0.00 -1.81 0.00 0.00 61.98 58.88 3frn s VAL 178 Cb 0.07 -1.37 -0.04 0.00 0.56 0.00 0.00 36.38 35.60 3frn s VAL 178 CO 0.74 -0.03 0.10 0.00 -0.31 0.00 0.00 175.10 175.60 3frn s ARG 179 N -1.62 1.78 -0.13 4.82 1.70 -0.05 -4.82 118.95 120.63 3frn s ARG 179 Ca 0.04 -2.05 -0.04 0.00 -0.47 0.00 0.00 55.73 53.22 3frn s ARG 179 Cb -0.09 -0.69 -0.03 0.00 -0.57 0.00 0.00 34.95 33.56 3frn s ARG 179 CO 0.03 -0.35 0.01 -1.17 -1.08 0.00 0.00 175.30 172.73 3frn s LEU 180 N -3.54 3.56 0.01 -1.89 2.96 -1.26 -0.37 118.68 118.15 3frn s LEU 180 Ca 0.29 0.05 0.00 0.00 -0.22 0.00 0.00 54.13 54.26 3frn s LEU 180 Cb 0.05 -1.85 -0.01 0.00 0.50 0.00 0.00 46.19 44.88 3frn s LEU 180 CO 0.15 0.27 -0.02 -1.61 -1.32 0.00 0.00 176.35 173.81 3frn s GLU 181 N -0.20 0.21 0.02 1.98 2.02 0.47 -4.93 118.70 118.26 3frn s GLU 181 Ca 0.05 -0.32 -0.30 0.00 0.02 0.00 0.00 54.97 54.43 3frn s GLU 181 Cb -0.12 -0.03 -0.05 0.00 0.10 0.00 0.00 34.13 34.03 3frn s GLU 181 CO 0.02 -0.00 1.23 0.15 0.02 0.00 0.00 175.26 176.68 3frn s LYS 182 N -0.70 4.38 0.06 1.61 -0.14 -1.26 0.87 119.74 124.56 3frn s LYS 182 Ca -0.07 1.77 -0.06 0.00 -1.36 0.00 0.00 55.97 56.25 3frn s LYS 182 Cb -0.05 -3.44 -0.01 0.00 -1.68 0.00 0.00 37.83 32.65 3frn s LYS 182 CO -0.00 -0.36 0.12 1.03 -0.76 0.00 0.00 175.35 175.37 3frn s ARG 183 N 1.61 0.69 -0.51 1.68 1.81 0.14 -4.91 118.95 119.47 3frn s ARG 183 Ca 0.59 -0.87 -0.29 0.00 -1.72 0.00 0.00 55.73 53.44 3frn s ARG 183 Cb -0.28 0.27 0.03 0.00 -0.45 0.00 0.00 34.95 34.52 3frn s ARG 183 CO 0.26 -0.19 1.16 1.21 -0.68 0.00 0.00 175.30 177.07 3frn s ASN 184 N -2.47 6.57 0.57 0.23 2.47 -1.26 -0.78 114.94 120.27 3frn s ASN 184 Ca -0.00 0.36 0.33 0.00 0.42 0.00 0.00 52.86 53.97 3frn s ASN 184 Cb 0.02 -2.55 1.75 0.00 -1.45 0.00 0.00 41.25 39.03 3frn s ASN 184 CO -0.07 -1.33 2.18 0.58 -3.72 0.00 0.00 177.10 174.73 3frn h VAL 185 N 6.22 0.37 -0.00 -5.21 2.07 -0.69 -1.36 116.25 117.65 3frn h VAL 185 Ca -0.24 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.00 3frn h VAL 185 Cb 1.06 1.20 0.00 0.00 -1.52 0.00 0.00 31.29 32.03 3frn h VAL 185 CO 1.15 0.05 -0.03 0.49 0.02 0.00 0.00 177.57 179.25 3frn n PHE 186 N -3.51 0.00 -1.10 1.57 3.72 -1.26 -2.97 117.46 113.92 3frn n PHE 186 Ca -0.02 0.00 0.10 0.00 -0.05 0.00 0.00 57.45 57.48 3frn n PHE 186 Cb 0.17 -0.08 0.15 0.00 -0.94 0.00 0.00 39.48 38.78 3frn n PHE 186 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 3frn n GLU 187 N -0.81 1.38 -4.42 -1.08 1.02 -0.52 -4.93 120.64 111.28 3frn n GLU 187 Ca 0.19 -2.63 -0.34 0.00 -0.02 0.00 0.00 57.16 54.36 3frn n GLU 187 Cb 0.21 -1.52 -0.12 0.00 -0.02 0.00 0.00 31.44 29.99 3frn n GLU 187 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3frn s ILE 188 N -2.90 3.83 -0.42 -3.67 1.01 -1.16 -5.00 121.20 112.89 3frn s ILE 188 Ca 0.33 -0.38 -0.23 0.00 0.00 0.00 0.00 60.65 60.37 3frn s ILE 188 Cb 0.29 -2.68 0.02 0.00 0.01 0.00 0.00 42.46 40.10 3frn s ILE 188 CO 0.03 0.49 0.77 -0.31 0.00 0.00 0.00 174.94 175.92 3frn s TYR 189 N 0.38 3.03 0.00 3.97 1.51 -1.26 -4.85 117.35 120.13 3frn s TYR 189 Ca -0.04 0.25 0.00 0.00 -1.01 0.00 0.00 57.07 56.27 3frn s TYR 189 Cb -0.14 -3.56 0.00 0.00 -0.11 0.00 0.00 41.96 38.15 3frn s TYR 189 CO 0.03 -0.90 0.00 0.41 -1.11 0.00 0.00 175.55 173.98 3frn n GLY 190 N 4.86 1.61 3.60 0.71 0.00 -1.26 -4.97 105.19 109.75 3frn n GLY 190 Ca 0.02 -2.04 -0.41 0.00 0.00 0.00 0.00 46.02 43.59 3frn n GLY 190 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3frn s GLU 191 N -1.97 3.90 0.95 1.61 2.12 -1.26 -4.95 118.70 119.09 3frn s GLU 191 Ca 0.00 0.29 -0.15 0.00 0.36 0.00 0.00 54.97 55.47 3frn s GLU 191 Cb 0.00 -3.73 0.18 0.00 0.26 0.00 0.00 34.13 30.85 3frn s GLU 191 CO 0.00 -0.57 1.28 -1.25 -0.54 0.00 0.00 175.26 174.19 3frn s PRO 192 N 2.60 0.77 0.01 4.30 0.04 -1.26 -0.56 135.00 140.90 3frn s PRO 192 Ca 0.25 -0.29 0.03 0.00 0.04 0.00 0.00 61.00 61.03 3frn s PRO 192 Cb -0.15 -1.85 -0.03 0.00 0.04 0.00 0.00 34.50 32.51 3frn s PRO 192 CO 0.12 -2.34 -0.07 -0.06 0.04 0.00 0.00 177.00 174.69 3frn s PHE 193 N -3.78 2.88 -0.92 0.56 0.08 -1.24 -4.78 117.98 110.77 3frn s PHE 193 Ca 0.72 -0.05 0.10 0.00 0.12 0.00 0.00 56.93 57.81 3frn s PHE 193 Cb -0.06 -1.60 0.22 0.00 -0.57 0.00 0.00 43.02 41.02 3frn s PHE 193 CO 0.52 0.38 1.12 1.19 -0.10 0.00 0.00 175.22 178.33 3frn n PHE 194 N 1.49 0.30 -3.66 0.36 3.72 -1.26 -1.51 117.46 116.91 3frn n PHE 194 Ca -0.15 -0.37 -0.13 0.00 -0.05 0.00 0.00 57.45 56.75 3frn n PHE 194 Cb 0.52 -0.02 -0.08 0.00 -0.94 0.00 0.00 39.48 38.96 3frn n PHE 194 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3frn s ASP 195 N -0.95 -0.68 0.28 4.37 2.15 -1.26 -4.86 116.67 115.72 3frn s ASP 195 Ca 0.18 1.27 -0.02 0.00 0.43 0.00 0.00 52.55 54.41 3frn s ASP 195 Cb 0.10 1.26 0.41 0.00 -0.30 0.00 0.00 42.92 44.39 3frn s ASP 195 CO 0.13 -0.22 1.92 0.58 -0.17 0.00 0.00 175.17 177.42 3frn h VAL 196 N 4.32 1.16 -0.00 1.11 2.07 -1.95 -2.06 116.25 120.90 3frn h VAL 196 Ca -0.29 -0.41 0.00 0.00 0.82 0.00 0.00 66.70 66.83 3frn h VAL 196 Cb 1.17 -0.13 -0.00 0.00 -1.52 0.00 0.00 31.29 30.82 3frn h VAL 196 CO 0.13 0.22 0.10 -1.28 0.02 0.00 0.00 177.57 176.75 3frn h SER 197 N 1.18 0.00 1.53 0.57 0.87 -1.95 -0.50 113.55 115.25 3frn h SER 197 Ca 0.38 0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.85 3frn h SER 197 Cb 0.02 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 61.97 3frn h SER 197 CO -0.12 0.00 -0.48 -0.33 -0.53 0.00 0.00 176.83 175.38 3frn h GLU 198 N 0.00 0.00 0.00 2.24 5.08 -1.78 -3.39 114.58 116.73 3frn h GLU 198 Ca 0.00 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.27 3frn h GLU 198 Cb 0.20 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 3frn h GLU 198 CO -0.00 0.38 -1.60 0.28 -1.00 0.00 0.00 179.01 177.07 3frn n VAL 199 N -3.17 0.35 -1.92 3.13 0.31 -0.29 -4.92 118.33 111.83 3frn n VAL 199 Ca 0.02 -0.34 -0.42 0.00 -0.01 0.00 0.00 64.34 63.58 3frn n VAL 199 Cb 0.70 -0.24 -0.03 0.00 -0.91 0.00 0.00 33.84 33.36 3frn n VAL 199 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 3frn s VAL 200 N -2.51 2.57 0.00 2.52 -7.23 -0.64 -1.65 120.40 113.46 3frn s VAL 200 Ca -0.05 0.41 0.00 0.00 -1.81 0.00 0.00 61.98 60.54 3frn s VAL 200 Cb 0.05 -3.26 0.00 0.00 0.56 0.00 0.00 36.38 33.73 3frn s VAL 200 CO 0.44 0.03 0.00 0.61 -0.31 0.00 0.00 175.10 175.87 3frn n GLY 201 N 3.65 2.45 3.81 2.32 0.00 -0.47 -5.00 105.19 111.94 3frn n GLY 201 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 3frn n GLY 201 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3frn s LYS 202 N -0.98 3.22 -0.19 1.61 -0.14 -0.66 -4.16 119.74 118.45 3frn s LYS 202 Ca 0.00 1.15 -0.03 0.00 -1.36 0.00 0.00 55.97 55.73 3frn s LYS 202 Cb 0.00 -2.02 -0.02 0.00 -1.68 0.00 0.00 37.83 34.11 3frn s LYS 202 CO 0.00 -0.89 -0.05 0.42 -0.76 0.00 0.00 175.35 174.07 3frn s ILE 203 N -2.58 3.54 0.21 2.17 1.01 0.56 -0.53 121.20 125.57 3frn s ILE 203 Ca 0.62 -0.46 -0.31 0.00 0.00 0.00 0.00 60.65 60.51 3frn s ILE 203 Cb -0.16 -2.57 -0.10 0.00 0.01 0.00 0.00 42.46 39.64 3frn s ILE 203 CO 0.41 0.46 1.52 -0.55 0.00 0.00 0.00 174.94 176.77 3frn s SER 204 N 0.94 6.60 0.00 3.58 0.15 -0.06 -0.43 113.70 124.47 3frn s SER 204 Ca -0.00 2.66 0.26 0.00 0.70 0.00 0.00 55.95 59.57 3frn s SER 204 Cb -0.15 -2.61 0.78 0.00 -1.71 0.00 0.00 66.02 62.33 3frn s SER 204 CO 0.01 -0.78 1.60 0.54 1.20 0.00 0.00 173.24 175.80 3frn n ARG 205 N 3.16 0.19 -4.03 5.44 1.74 0.98 -0.77 116.66 123.36 3frn n ARG 205 Ca 0.10 -0.09 -0.10 0.00 -0.77 0.00 0.00 57.85 57.00 3frn n ARG 205 Cb 0.39 -1.50 -0.07 0.00 -1.02 0.00 0.00 32.46 30.26 3frn n ARG 205 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 3frn s ARG 206 N -2.87 1.23 -0.38 5.56 1.70 -1.25 -4.78 118.95 118.15 3frn s ARG 206 Ca 0.15 -1.30 -0.28 0.00 -0.47 0.00 0.00 55.73 53.83 3frn s ARG 206 Cb 0.18 0.36 0.02 0.00 -0.57 0.00 0.00 34.95 34.95 3frn s ARG 206 CO 0.61 -0.45 1.05 -0.47 -1.08 0.00 0.00 175.30 174.97 3frn s TYR 207 N -4.02 3.03 0.10 5.89 6.14 -1.26 -3.14 117.35 124.08 3frn s TYR 207 Ca 0.23 0.93 0.09 0.00 0.64 0.00 0.00 57.07 58.96 3frn s TYR 207 Cb 0.04 -3.91 -0.04 0.00 0.42 0.00 0.00 41.96 38.46 3frn s TYR 207 CO 0.04 -0.94 -0.23 -0.51 0.64 0.00 0.00 175.55 174.56 3frn s LEU 208 N 3.86 2.46 0.24 6.97 1.02 -0.24 -4.99 118.68 128.00 3frn s LEU 208 Ca 0.44 -0.61 0.03 0.00 0.02 0.00 0.00 54.13 54.01 3frn s LEU 208 Cb -0.11 -1.38 -0.03 0.00 0.02 0.00 0.00 46.19 44.69 3frn s LEU 208 CO 0.21 0.20 0.39 -0.54 0.02 0.00 0.00 176.35 176.64 3frn s LYS 209 N -1.85 3.46 0.41 1.70 -0.14 -1.26 -1.44 119.74 120.62 3frn s LYS 209 Ca 0.15 -0.59 -0.24 0.00 -1.36 0.00 0.00 55.97 53.92 3frn s LYS 209 Cb -0.10 -2.85 -0.11 0.00 -1.68 0.00 0.00 37.83 33.09 3frn s LYS 209 CO 0.07 0.38 0.93 -1.91 -0.76 0.00 0.00 175.35 174.06 3frn n GLU 210 N -1.26 1.20 0.00 1.68 2.13 -1.26 -2.61 120.64 120.52 3frn n GLU 210 Ca -0.07 0.43 0.00 0.00 0.66 0.00 0.00 57.16 58.18 3frn n GLU 210 Cb 0.56 -1.94 0.00 0.00 0.27 0.00 0.00 31.44 30.33 3frn n GLU 210 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3frn n GLY 211 N 1.29 1.42 3.66 8.31 0.00 -0.70 -4.99 105.19 114.18 3frn n GLY 211 Ca 0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 3frn n GLY 211 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3frn s THR 212 N -2.31 4.03 -0.01 2.61 2.01 -1.07 -4.71 115.64 116.18 3frn s THR 212 Ca 0.00 1.25 -0.30 0.00 0.31 0.00 0.00 61.69 62.95 3frn s THR 212 Cb 0.00 -3.80 -0.07 0.00 0.01 0.00 0.00 72.50 68.64 3frn s THR 212 CO 0.00 -0.11 1.66 -0.69 -0.69 0.00 0.00 174.62 174.79 3frn s VAL 213 N 3.68 3.41 0.19 3.82 1.01 -1.26 -1.86 120.40 129.39 3frn s VAL 213 Ca 0.61 0.62 -0.30 0.00 0.00 0.00 0.00 61.98 62.91 3frn s VAL 213 Cb -0.26 -3.40 -0.08 0.00 0.00 0.00 0.00 36.38 32.64 3frn s VAL 213 CO 0.20 -0.04 1.08 -0.22 0.00 0.00 0.00 175.10 176.12 3frn s LEU 214 N 3.60 4.51 0.11 3.92 2.96 -0.49 -5.00 118.68 128.30 3frn s LEU 214 Ca 0.74 2.09 0.05 0.00 -0.22 0.00 0.00 54.13 56.78 3frn s LEU 214 Cb -0.36 -3.61 -0.04 0.00 0.50 0.00 0.00 46.19 42.69 3frn s LEU 214 CO 0.31 -0.18 -0.11 0.42 -1.32 0.00 0.00 176.35 175.47 3frn s THR 215 N -0.40 1.11 0.39 3.68 -4.23 -1.26 -3.69 115.64 111.24 3frn s THR 215 Ca 0.48 -1.73 0.18 0.00 -1.18 0.00 0.00 61.69 59.44 3frn s THR 215 Cb -0.29 -1.49 0.39 0.00 1.34 0.00 0.00 72.50 72.44 3frn s THR 215 CO 0.35 -0.54 1.77 0.00 -0.54 0.00 0.00 174.62 175.66 3frn h ALA 216 N 3.42 2.22 0.00 3.99 0.00 -1.13 -1.07 119.26 126.68 3frn h ALA 216 Ca -0.38 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.59 3frn h ALA 216 Cb 1.19 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.01 3frn h ALA 216 CO 0.54 -0.63 0.00 -0.25 0.00 0.00 0.00 179.25 178.91 3frn n ASP 217 N -4.64 0.00 -0.01 0.00 9.92 -1.26 -3.10 116.55 117.47 3frn n ASP 217 Ca 0.25 -0.50 0.08 0.00 -0.53 0.00 0.00 54.79 54.09 3frn n ASP 217 Cb 0.88 -0.12 -0.09 0.00 -0.64 0.00 0.00 41.12 41.14 3frn n ASP 217 CO 0.00 0.00 0.00 0.23 0.13 0.00 0.00 177.20 177.56 3frn n MET 218 N -1.12 1.39 -4.35 -1.24 2.81 -0.40 -4.96 117.12 109.24 3frn n MET 218 Ca 0.17 -0.02 -0.18 0.00 -1.81 0.00 0.00 57.70 55.86 3frn n MET 218 Cb 0.14 -1.30 -0.10 0.00 -0.71 0.00 0.00 33.22 31.25 3frn n MET 218 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 3frn s VAL 219 N -2.59 1.49 0.06 2.03 -7.23 -1.18 -0.02 120.40 112.97 3frn s VAL 219 Ca 0.07 -2.13 0.00 0.00 -1.81 0.00 0.00 61.98 58.11 3frn s VAL 219 Cb 0.13 -2.17 -0.04 0.00 0.56 0.00 0.00 36.38 34.86 3frn s VAL 219 CO 0.69 -0.50 -0.05 -1.59 -0.31 0.00 0.00 175.10 173.35 3frn s LYS 220 N -3.72 0.66 0.62 4.82 -2.85 0.42 -4.83 119.74 114.86 3frn s LYS 220 Ca 0.24 -1.18 -0.17 0.00 -1.00 0.00 0.00 55.97 53.86 3frn s LYS 220 Cb 0.02 0.03 -0.02 0.00 -2.06 0.00 0.00 37.83 35.80 3frn s LYS 220 CO 0.07 -0.06 1.15 -0.51 0.10 0.00 0.00 175.35 176.10 3frn s ASP 221 N -2.76 5.19 0.48 0.03 1.01 -1.26 -0.32 116.67 119.04 3frn s ASP 221 Ca 0.06 2.19 -0.24 0.00 0.71 0.00 0.00 52.55 55.27 3frn s ASP 221 Cb 0.04 -2.58 -0.07 0.00 1.01 0.00 0.00 42.92 41.33 3frn s ASP 221 CO -0.07 -1.58 1.32 -2.16 0.21 0.00 0.00 175.17 172.89 3frn s PRO 222 N -3.64 3.56 0.56 8.23 0.04 -1.26 -4.71 135.00 137.77 3frn s PRO 222 Ca 0.72 2.17 -0.18 0.00 0.04 0.00 0.00 61.00 63.74 3frn s PRO 222 Cb -0.25 -2.48 -0.05 0.00 0.04 0.00 0.00 34.50 31.76 3frn s PRO 222 CO 0.35 -0.83 1.10 -2.14 0.04 0.00 0.00 177.00 175.53 3frn s PRO 223 N -2.62 3.33 0.31 0.56 0.02 -1.26 -4.96 135.00 130.38 3frn s PRO 223 Ca 0.64 1.49 0.16 0.00 0.02 0.00 0.00 61.00 63.32 3frn s PRO 223 Cb -0.38 -2.01 0.33 0.00 0.02 0.00 0.00 34.50 32.45 3frn s PRO 223 CO 0.47 -0.84 1.57 -0.44 -0.33 0.00 0.00 177.00 177.42 3frn h ASP 224 N 0.99 0.00 -4.43 2.53 3.32 -0.60 -3.43 116.42 114.79 3frn h ASP 224 Ca -0.49 0.00 -0.38 0.00 0.02 0.00 0.00 57.03 56.18 3frn h ASP 224 Cb 1.25 0.00 -0.23 0.00 0.22 0.00 0.00 39.33 40.56 3frn h ASP 224 CO 0.57 0.50 -0.77 0.68 -1.72 0.00 0.00 179.24 178.50 3frn s VAL 225 N -3.25 0.88 0.21 -1.35 -7.23 -0.22 -4.86 120.40 104.59 3frn s VAL 225 Ca 0.02 -1.01 0.07 0.00 -1.81 0.00 0.00 61.98 59.26 3frn s VAL 225 Cb 0.09 -0.84 -0.04 0.00 0.56 0.00 0.00 36.38 36.15 3frn s VAL 225 CO 0.73 -0.14 0.08 0.68 -0.31 0.00 0.00 175.10 176.13 3frn s VAL 226 N -1.01 3.99 0.06 1.32 -7.23 -1.26 -0.53 120.40 115.74 3frn s VAL 226 Ca -0.02 -1.47 -0.33 0.00 -1.81 0.00 0.00 61.98 58.35 3frn s VAL 226 Cb -0.08 -3.08 -0.12 0.00 0.56 0.00 0.00 36.38 33.66 3frn s VAL 226 CO 0.01 -0.23 1.80 1.17 -0.31 0.00 0.00 175.10 177.54 3frn n LYS 227 N -0.61 2.45 -0.09 4.82 4.81 -1.20 -2.15 118.16 126.18 3frn n LYS 227 Ca -0.08 0.89 0.00 0.00 -0.87 0.00 0.00 58.31 58.25 3frn n LYS 227 Cb 0.57 -2.74 0.00 0.00 0.02 0.00 0.00 35.03 32.87 3frn n LYS 227 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3frn n GLY 228 N 4.11 0.74 3.77 3.14 0.00 0.22 -4.96 105.19 112.22 3frn n GLY 228 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 3frn n GLY 228 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3frn s GLN 229 N -0.73 3.89 -0.26 1.61 0.74 -0.92 -4.64 119.66 119.34 3frn s GLN 229 Ca 0.00 1.74 -0.16 0.00 0.05 0.00 0.00 55.36 56.99 3frn s GLN 229 Cb 0.00 -2.48 -0.03 0.00 1.10 0.00 0.00 33.01 31.60 3frn s GLN 229 CO 0.00 -0.44 0.45 0.08 -0.55 0.00 0.00 175.29 174.83 3frn s VAL 230 N -1.54 5.12 0.09 1.34 1.01 -1.26 -2.37 120.40 122.79 3frn s VAL 230 Ca 0.61 0.74 0.06 0.00 0.00 0.00 0.00 61.98 63.39 3frn s VAL 230 Cb -0.28 -3.77 -0.03 0.00 0.00 0.00 0.00 36.38 32.30 3frn s VAL 230 CO 0.34 0.12 -0.16 0.68 0.00 0.00 0.00 175.10 176.09 3frn s VAL 231 N 2.16 1.31 0.70 2.92 -7.23 -0.96 -4.97 120.40 114.34 3frn s VAL 231 Ca 0.18 -1.45 -0.16 0.00 -1.81 0.00 0.00 61.98 58.74 3frn s VAL 231 Cb -0.16 -1.29 0.02 0.00 0.56 0.00 0.00 36.38 35.52 3frn s VAL 231 CO 0.09 -0.23 1.23 -2.84 -0.31 0.00 0.00 175.10 173.05 3frn s PRO 232 N -1.98 2.28 -0.01 4.82 0.02 -1.26 -0.86 135.00 138.00 3frn s PRO 232 Ca 0.02 1.86 -0.09 0.00 0.02 0.00 0.00 61.00 62.81 3frn s PRO 232 Cb -0.09 -1.84 0.01 0.00 0.02 0.00 0.00 34.50 32.60 3frn s PRO 232 CO 0.03 -1.75 0.18 0.00 -0.33 0.00 0.00 177.00 175.13 3frn s ALA 233 N -1.79 -0.44 -0.04 -1.55 0.00 0.34 -1.16 121.76 117.12 3frn s ALA 233 Ca 0.77 0.03 0.06 0.00 0.00 0.00 0.00 51.96 52.82 3frn s ALA 233 Cb -0.32 0.07 -0.01 0.00 0.00 0.00 0.00 23.12 22.86 3frn s ALA 233 CO 0.43 -0.21 -0.23 0.71 0.00 0.00 0.00 175.76 176.45 3frn s TYR 234 N -1.25 2.23 -0.03 0.00 2.02 -0.60 -1.55 117.35 118.17 3frn s TYR 234 Ca -0.13 -0.59 0.00 0.00 -0.37 0.00 0.00 57.07 55.98 3frn s TYR 234 Cb -0.07 -1.46 -0.02 0.00 -0.40 0.00 0.00 41.96 40.01 3frn s TYR 234 CO 0.02 -0.16 -0.02 0.28 -1.57 0.00 0.00 175.55 174.10 3frn n VAL 235 N 2.84 0.16 0.00 0.71 0.31 -1.26 0.35 118.33 121.44 3frn n VAL 235 Ca -0.17 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.10 3frn n VAL 235 Cb 0.52 -0.62 0.00 0.00 -0.91 0.00 0.00 33.84 32.83 3frn n VAL 235 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 3frn n THR 243 N -2.55 0.00 -4.07 2.52 5.66 -0.60 -4.92 114.28 110.32 3frn n THR 243 Ca -0.05 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.82 3frn n THR 243 Cb 0.55 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.29 3frn n THR 243 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 3frn s THR 244 N 0.00 0.00 -0.08 1.09 -1.32 -0.76 -4.99 115.64 109.59 3frn s THR 244 Ca 0.00 -1.58 -0.05 0.00 -1.21 0.00 0.00 61.69 58.85 3frn s THR 244 Cb 0.00 -2.55 -0.04 0.00 -1.51 0.00 0.00 72.50 68.40 3frn s THR 244 CO 0.00 0.00 0.13 -0.36 -2.21 0.00 0.00 174.62 172.18 3frn s PHE 245 N -3.31 3.52 0.26 9.09 0.40 -1.26 0.13 117.98 126.80 3frn s PHE 245 Ca 0.29 0.43 0.05 0.00 -0.60 0.00 0.00 56.93 57.09 3frn s PHE 245 Cb -0.00 -1.88 -0.05 0.00 0.51 0.00 0.00 43.02 41.60 3frn s PHE 245 CO 0.17 0.68 -0.02 0.14 0.70 0.00 0.00 175.22 176.89 3frn s VAL 246 N -1.11 1.26 -0.19 -0.44 -7.23 -0.04 -4.82 120.40 107.82 3frn s VAL 246 Ca 0.19 -2.06 -0.02 0.00 -1.81 0.00 0.00 61.98 58.27 3frn s VAL 246 Cb -0.12 -2.42 -0.00 0.00 0.56 0.00 0.00 36.38 34.39 3frn s VAL 246 CO 0.09 -0.29 -0.09 -0.70 -0.31 0.00 0.00 175.10 173.80 3frn s GLU 247 N -3.82 3.32 0.17 4.82 2.12 -0.86 -2.26 118.70 122.19 3frn s GLU 247 Ca 0.29 -0.67 -0.30 0.00 0.36 0.00 0.00 54.97 54.65 3frn s GLU 247 Cb 0.05 -2.85 -0.08 0.00 0.26 0.00 0.00 34.13 31.51 3frn s GLU 247 CO 0.10 -0.11 1.19 0.08 -0.54 0.00 0.00 175.26 175.98 3frn s VAL 248 N 1.20 3.66 -0.45 3.70 1.01 -1.00 -1.43 120.40 127.09 3frn s VAL 248 Ca 0.02 1.37 0.23 0.00 0.00 0.00 0.00 61.98 63.60 3frn s VAL 248 Cb -0.14 -3.87 0.00 0.00 0.00 0.00 0.00 36.38 32.37 3frn s VAL 248 CO -0.03 0.20 1.15 0.25 0.00 0.00 0.00 175.10 176.68 3frn h LEU 249 N 5.45 0.00 -8.28 3.92 7.12 -1.12 0.64 115.31 123.04 3frn h LEU 249 Ca -0.44 -0.14 -0.14 0.00 0.13 0.00 0.00 57.88 57.28 3frn h LEU 249 Cb 1.21 0.00 -0.15 0.00 -0.53 0.00 0.00 40.66 41.20 3frn h LEU 249 CO 0.75 0.07 -0.61 -1.61 -0.13 0.00 0.00 178.44 176.91 3frn s GLU 250 N -3.26 0.81 0.55 1.25 2.02 -1.26 -4.83 118.70 113.99 3frn s GLU 250 Ca 0.03 -1.29 -0.18 0.00 0.02 0.00 0.00 54.97 53.54 3frn s GLU 250 Cb 0.12 0.25 -0.05 0.00 0.10 0.00 0.00 34.13 34.54 3frn s GLU 250 CO 0.76 -0.21 1.07 -0.80 0.02 0.00 0.00 175.26 176.10 3frn s ASN 251 N -2.98 5.91 0.03 -0.19 0.01 -1.26 -3.25 114.94 113.21 3frn s ASN 251 Ca 0.15 1.95 -0.27 0.00 -0.71 0.00 0.00 52.86 53.98 3frn s ASN 251 Cb 0.07 -2.55 0.07 0.00 0.41 0.00 0.00 41.25 39.24 3frn s ASN 251 CO -0.04 -1.08 0.62 -0.83 -1.51 0.00 0.00 177.10 174.25 3frn s GLY 252 N -2.27 -0.55 0.36 0.66 0.00 0.31 -4.90 107.32 100.92 3frn s GLY 252 Ca 0.67 0.91 0.08 0.00 0.00 0.00 0.00 44.72 46.38 3frn s GLY 252 CO 0.29 0.58 0.22 -0.19 0.00 0.00 0.00 173.10 174.00 3frn s TYR 253 N -2.19 2.73 0.18 1.90 2.02 -1.26 0.18 117.35 120.91 3frn s TYR 253 Ca -0.06 -0.41 -0.32 0.00 -0.37 0.00 0.00 57.07 55.90 3frn s TYR 253 Cb -0.01 -1.81 -0.16 0.00 -0.40 0.00 0.00 41.96 39.58 3frn s TYR 253 CO 0.01 0.20 1.09 1.28 -1.57 0.00 0.00 175.55 176.57 3frn n LEU 254 N -1.28 1.28 0.00 -1.29 7.99 -1.26 -1.95 117.00 120.49 3frn n LEU 254 Ca -0.01 1.15 0.00 0.00 -0.01 0.00 0.00 56.01 57.13 3frn n LEU 254 Cb 0.61 -1.19 0.00 0.00 -0.11 0.00 0.00 43.42 42.74 3frn n LEU 254 CO 0.43 -1.46 0.00 0.61 -1.51 0.00 0.00 177.39 175.46 3frn n GLY 255 N 1.90 2.57 3.83 -0.72 0.00 0.25 -4.95 105.19 108.07 3frn n GLY 255 Ca 0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 3frn n GLY 255 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3frn s GLU 256 N -0.30 4.18 -0.35 1.61 2.02 -0.82 -4.76 118.70 120.27 3frn s GLU 256 Ca 0.00 0.95 -0.18 0.00 0.02 0.00 0.00 54.97 55.76 3frn s GLU 256 Cb 0.00 -2.38 -0.00 0.00 0.10 0.00 0.00 34.13 31.84 3frn s GLU 256 CO 0.00 0.10 0.50 0.99 0.02 0.00 0.00 175.26 176.87 3frn s THR 257 N -2.01 5.03 -0.08 3.63 2.01 -1.26 0.06 115.64 123.03 3frn s THR 257 Ca 0.57 0.28 0.01 0.00 0.31 0.00 0.00 61.69 62.86 3frn s THR 257 Cb -0.11 -3.96 -0.03 0.00 0.01 0.00 0.00 72.50 68.42 3frn s THR 257 CO 0.16 -0.22 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.09 3frn s VAL 258 N 2.35 3.41 0.42 3.82 1.01 0.12 -4.88 120.40 126.65 3frn s VAL 258 Ca 0.18 -0.58 -0.24 0.00 0.00 0.00 0.00 61.98 61.35 3frn s VAL 258 Cb -0.16 -2.39 -0.08 0.00 0.00 0.00 0.00 36.38 33.75 3frn s VAL 258 CO 0.13 0.57 1.10 -0.13 0.00 0.00 0.00 175.10 176.78 3frn s ARG 259 N -0.47 3.99 0.21 2.72 0.52 -1.26 -2.16 118.95 122.49 3frn s ARG 259 Ca 0.07 1.64 -0.12 0.00 -0.52 0.00 0.00 55.73 56.79 3frn s ARG 259 Cb -0.12 -2.49 0.00 0.00 0.52 0.00 0.00 34.95 32.86 3frn s ARG 259 CO 0.02 -0.32 0.42 0.00 0.02 0.00 0.00 175.30 175.44 3frn s ALA 260 N -1.60 -0.29 -0.09 2.13 0.00 -0.67 -0.49 121.76 120.75 3frn s ALA 260 Ca 0.60 -0.76 0.00 0.00 0.00 0.00 0.00 51.96 51.81 3frn s ALA 260 Cb -0.25 0.97 0.02 0.00 0.00 0.00 0.00 23.12 23.86 3frn s ALA 260 CO 0.31 -0.78 -0.07 1.41 0.00 0.00 0.00 175.76 176.64 3frn s MET 261 N -3.97 1.29 0.00 0.00 1.75 -0.51 -2.04 119.30 115.82 3frn s MET 261 Ca 0.18 -0.20 0.00 0.00 -1.25 0.00 0.00 55.69 54.43 3frn s MET 261 Cb 0.01 -1.34 0.00 0.00 2.84 0.00 0.00 34.83 36.34 3frn s MET 261 CO 0.04 -0.19 0.00 0.09 -0.65 0.00 0.00 175.02 174.31 3frn n ASN 262 N 4.64 0.00 0.00 1.11 5.03 -1.16 -2.02 115.26 122.86 3frn n ASN 262 Ca -0.15 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.30 3frn n ASN 262 Cb 0.50 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.26 3frn n ASN 262 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.26 173.89 3frn n SER 265 N 0.00 0.00 0.01 6.41 3.41 -1.26 -4.57 113.62 117.62 3frn n SER 265 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3frn n SER 265 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 3frn n SER 265 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 3frn n ARG 266 N -1.73 0.00 -2.58 4.33 3.00 -1.26 -5.17 116.66 113.25 3frn n ARG 266 Ca 0.00 0.00 -0.23 0.00 -0.00 0.00 0.00 57.85 57.62 3frn n ARG 266 Cb 0.00 -0.02 0.09 0.00 0.00 0.00 0.00 32.46 32.53 3frn n ARG 266 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 3frn s LYS 267 N -2.00 1.85 -0.11 -0.14 1.02 -1.26 -4.98 119.74 114.12 3frn s LYS 267 Ca 0.00 -1.02 -0.24 0.00 0.02 0.00 0.00 55.97 54.73 3frn s LYS 267 Cb 0.00 -2.35 -0.03 0.00 -0.52 0.00 0.00 37.83 34.93 3frn s LYS 267 CO 0.00 -1.31 0.76 -0.47 -0.92 0.00 0.00 175.35 173.41 3frn s TYR 268 N -3.08 3.51 -0.04 3.18 6.14 -1.26 -3.01 117.35 122.79 3frn s TYR 268 Ca 0.64 1.26 0.02 0.00 0.64 0.00 0.00 57.07 59.63 3frn s TYR 268 Cb -0.06 -2.90 0.02 0.00 0.42 0.00 0.00 41.96 39.43 3frn s TYR 268 CO 0.43 -0.06 -0.06 0.14 0.64 0.00 0.00 175.55 176.64 3frn s VAL 269 N 1.39 0.64 0.11 3.14 -7.23 -0.87 -5.02 120.40 112.57 3frn s VAL 269 Ca 0.38 -0.21 -0.29 0.00 -1.81 0.00 0.00 61.98 60.05 3frn s VAL 269 Cb -0.17 -0.63 -0.06 0.00 0.56 0.00 0.00 36.38 36.08 3frn s VAL 269 CO 0.16 0.24 0.92 -0.36 -0.31 0.00 0.00 175.10 175.75 3frn s PHE 270 N 0.68 3.82 -0.20 2.82 0.40 -1.26 -1.67 117.98 122.57 3frn s PHE 270 Ca -0.10 1.75 -0.10 0.00 -0.60 0.00 0.00 56.93 57.88 3frn s PHE 270 Cb -0.13 -3.00 0.07 0.00 0.51 0.00 0.00 43.02 40.47 3frn s PHE 270 CO 0.01 0.25 0.47 0.20 0.70 0.00 0.00 175.22 176.85 3frn s GLY 271 N -0.13 -0.40 0.11 4.36 0.00 -0.92 -1.73 107.32 108.61 3frn s GLY 271 Ca 0.45 1.73 -0.27 0.00 0.00 0.00 0.00 44.72 46.63 3frn s GLY 271 CO 0.29 1.93 0.83 1.09 0.00 0.00 0.00 173.10 177.23 3frn s ARG 272 N 1.59 4.60 -0.04 2.90 1.70 -0.40 0.11 118.95 129.40 3frn s ARG 272 Ca -0.09 1.22 -0.30 0.00 -0.47 0.00 0.00 55.73 56.09 3frn s ARG 272 Cb -0.08 -3.33 -0.05 0.00 -0.57 0.00 0.00 34.95 30.92 3frn s ARG 272 CO -0.14 0.36 1.47 0.08 -1.08 0.00 0.00 175.30 175.99 3frn s VAL 273 N -0.43 3.73 0.25 4.99 1.01 0.11 -1.02 120.40 129.04 3frn s VAL 273 Ca 0.40 1.01 0.10 0.00 0.00 0.00 0.00 61.98 63.49 3frn s VAL 273 Cb -0.22 -3.65 -0.04 0.00 0.00 0.00 0.00 36.38 32.46 3frn s VAL 273 CO 0.26 -0.05 -0.06 -1.61 0.00 0.00 0.00 175.10 173.65 3frn s GLU 274 N 3.12 2.13 -0.45 2.72 2.02 0.32 -0.58 118.70 127.98 3frn s GLU 274 Ca 0.66 -1.44 -0.42 0.00 0.02 0.00 0.00 54.97 53.78 3frn s GLU 274 Cb -0.31 -2.09 -0.18 0.00 0.10 0.00 0.00 34.13 31.65 3frn s GLU 274 CO 0.26 0.37 1.55 -2.13 0.02 0.00 0.00 175.26 175.33 3frn n ARG 275 N -0.63 0.00 0.00 1.61 0.63 -1.26 -2.95 116.66 114.06 3frn n ARG 275 Ca -0.07 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.86 3frn n ARG 275 Cb 0.58 -1.36 0.00 0.00 0.45 0.00 0.00 32.46 32.13 3frn n ARG 275 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3frn n GLY 276 N 4.26 -1.77 3.35 5.14 0.00 -1.26 -4.13 105.19 110.79 3frn n GLY 276 Ca 0.32 0.65 -0.37 0.00 0.00 0.00 0.00 46.02 46.63 3frn n GLY 276 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3frn s PRO 277 N 0.00 3.21 0.17 1.61 0.04 -1.26 -5.20 135.00 133.57 3frn s PRO 277 Ca 0.00 -0.77 0.04 0.00 0.04 0.00 0.00 61.00 60.31 3frn s PRO 277 Cb 0.00 -3.30 -0.04 0.00 0.04 0.00 0.00 34.50 31.20 3frn s PRO 277 CO 0.00 -0.37 0.23 0.14 0.04 0.00 0.00 177.00 177.05 3frn s VAL 278 N 1.51 4.98 0.12 -0.36 -7.23 -1.15 -4.47 120.40 113.79 3frn s VAL 278 Ca 0.04 -0.89 -0.18 0.00 -1.81 0.00 0.00 61.98 59.13 3frn s VAL 278 Cb -0.16 -3.58 -0.07 0.00 0.56 0.00 0.00 36.38 33.13 3frn s VAL 278 CO 0.02 -0.13 0.60 -0.76 -0.31 0.00 0.00 175.10 174.51 3frn s LEU 279 N -3.29 4.44 -0.29 1.32 1.43 -0.31 -0.52 118.68 121.47 3frn s LEU 279 Ca 0.33 1.25 -0.05 0.00 -1.03 0.00 0.00 54.13 54.64 3frn s LEU 279 Cb -0.10 -3.14 0.02 0.00 0.03 0.00 0.00 46.19 43.00 3frn s LEU 279 CO 0.27 0.18 0.03 -0.60 0.23 0.00 0.00 176.35 176.45 3frn s ARG 280 N -1.52 2.88 -0.20 1.70 3.52 -0.19 -1.55 118.95 123.60 3frn s ARG 280 Ca 0.34 -0.98 -0.29 0.00 -0.13 0.00 0.00 55.73 54.67 3frn s ARG 280 Cb -0.18 -3.24 -0.00 0.00 -1.56 0.00 0.00 34.95 29.97 3frn s ARG 280 CO 0.20 -0.48 1.16 0.42 -0.81 0.00 0.00 175.30 175.79 3frn s ILE 281 N 1.40 4.47 0.03 4.11 1.01 0.15 -1.28 121.20 131.10 3frn s ILE 281 Ca 0.00 1.78 -0.30 0.00 0.00 0.00 0.00 60.65 62.13 3frn s ILE 281 Cb -0.18 -4.15 -0.05 0.00 0.01 0.00 0.00 42.46 38.09 3frn s ILE 281 CO -0.00 -0.16 1.31 -0.76 0.00 0.00 0.00 174.94 175.33 3frn s LEU 282 N 3.35 4.33 0.00 2.97 1.43 -0.71 -4.60 118.68 125.46 3frn s LEU 282 Ca 0.50 2.06 0.00 0.00 -1.03 0.00 0.00 54.13 55.66 3frn s LEU 282 Cb -0.18 -3.57 0.00 0.00 0.03 0.00 0.00 46.19 42.47 3frn s LEU 282 CO 0.11 -0.61 0.00 -0.62 0.23 0.00 0.00 176.35 175.45