#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cfa n LYS 67 N 0.00 0.31 0.25 -1.46 4.76 -1.26 -2.76 118.16 118.00 3cfa n LYS 67 Ca 0.00 0.04 0.13 0.00 -2.87 0.00 0.00 58.31 55.62 3cfa n LYS 67 Cb 0.00 -1.50 0.56 0.00 -1.84 0.00 0.00 35.03 32.25 3cfa n LYS 67 CO 0.00 0.00 0.00 1.15 -1.37 0.00 0.00 177.40 177.18 3cfa h THR 68 N 0.00 0.32 -3.05 -0.18 2.02 -2.03 -3.36 112.91 106.62 3cfa h THR 68 Ca 0.00 -0.84 -0.81 0.00 0.77 0.00 0.00 66.41 65.53 3cfa h THR 68 Cb 0.27 1.65 -0.28 0.00 -1.74 0.00 0.00 68.15 68.05 3cfa h THR 68 CO 0.00 0.12 0.73 0.49 0.37 0.00 0.00 175.52 177.23 3cfa n PHE 69 N -3.28 3.06 -4.42 3.16 3.72 -1.11 -4.90 117.46 113.70 3cfa n PHE 69 Ca 0.00 -2.93 -0.21 0.00 -0.05 0.00 0.00 57.45 54.26 3cfa n PHE 69 Cb 0.37 -1.39 -0.16 0.00 -0.94 0.00 0.00 39.48 37.37 3cfa n PHE 69 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 3cfa s ILE 70 N -2.33 0.83 -0.40 4.37 1.01 -1.26 -4.45 121.20 118.97 3cfa s ILE 70 Ca 0.31 -0.38 -0.23 0.00 0.00 0.00 0.00 60.65 60.35 3cfa s ILE 70 Cb 0.01 -0.75 0.02 0.00 0.01 0.00 0.00 42.46 41.75 3cfa s ILE 70 CO 0.06 0.26 0.80 -0.75 0.00 0.00 0.00 174.94 175.31 3cfa s LYS 71 N 0.25 3.61 -0.26 2.79 2.20 -0.82 -4.94 119.74 122.57 3cfa s LYS 71 Ca -0.04 0.15 -0.15 0.00 -0.36 0.00 0.00 55.97 55.57 3cfa s LYS 71 Cb -0.09 -3.87 -0.04 0.00 -1.51 0.00 0.00 37.83 32.32 3cfa s LYS 71 CO 0.01 -0.98 0.36 0.71 -0.36 0.00 0.00 175.35 175.09 3cfa s TYR 72 N 3.23 3.26 0.44 4.03 1.51 -1.26 -0.52 117.35 128.05 3cfa s TYR 72 Ca 0.31 0.42 0.07 0.00 -1.01 0.00 0.00 57.07 56.87 3cfa s TYR 72 Cb -0.12 -2.55 -0.01 0.00 -0.11 0.00 0.00 41.96 39.17 3cfa s TYR 72 CO 0.20 -0.19 0.40 0.14 -1.11 0.00 0.00 175.55 174.99 3cfa s VAL 73 N 1.93 2.46 -2.04 0.71 -7.23 -0.74 -4.68 120.40 110.81 3cfa s VAL 73 Ca 0.15 -1.36 0.00 0.00 -1.81 0.00 0.00 61.98 58.96 3cfa s VAL 73 Cb -0.16 -2.82 0.00 0.00 0.56 0.00 0.00 36.38 33.96 3cfa s VAL 73 CO 0.09 0.00 0.00 -1.20 -0.31 0.00 0.00 175.10 173.68 3cfa n SER 74 N -1.61 -5.20 -0.44 4.85 7.64 -1.26 -2.35 113.62 115.25 3cfa n SER 74 Ca 0.03 0.44 -0.06 0.00 1.01 0.00 0.00 58.87 60.30 3cfa n SER 74 Cb 0.62 -4.60 -0.02 0.00 -1.01 0.00 0.00 64.21 59.20 3cfa n SER 74 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3cfa n GLY 75 N -0.42 0.80 3.69 0.23 0.00 -1.26 -4.98 105.19 103.25 3cfa n GLY 75 Ca -0.20 -0.51 -0.42 0.00 0.00 0.00 0.00 46.02 44.89 3cfa n GLY 75 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3cfa s ILE 76 N -2.11 2.82 0.42 -0.61 1.01 -0.99 -4.94 121.20 116.79 3cfa s ILE 76 Ca 0.00 0.30 -0.26 0.00 0.00 0.00 0.00 60.65 60.69 3cfa s ILE 76 Cb 0.00 -3.19 -0.09 0.00 0.01 0.00 0.00 42.46 39.18 3cfa s ILE 76 CO 0.00 -0.00 1.46 -2.65 0.00 0.00 0.00 174.94 173.75 3cfa n PRO 77 N 5.60 2.43 -3.31 2.79 -0.02 -1.26 -4.81 135.00 136.41 3cfa n PRO 77 Ca 0.17 0.86 -0.46 0.00 -2.02 0.00 0.00 63.50 62.04 3cfa n PRO 77 Cb 0.39 -2.66 -0.04 0.00 -0.02 0.00 0.00 33.50 31.18 3cfa n PRO 77 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3cfa s ASP 78 N -0.33 6.39 0.41 2.55 -1.08 -1.26 -4.50 116.67 118.85 3cfa s ASP 78 Ca 0.58 -2.10 0.12 0.00 -0.52 0.00 0.00 52.55 50.63 3cfa s ASP 78 Cb -0.46 -2.21 0.96 0.00 -1.46 0.00 0.00 42.92 39.75 3cfa s ASP 78 CO 0.60 -0.77 1.96 0.22 0.52 0.00 0.00 175.17 177.70 3cfa h TYR 79 N 8.51 0.53 0.03 -5.34 3.20 -1.93 -2.07 116.97 119.91 3cfa h TYR 79 Ca -0.16 0.01 -0.10 0.00 3.14 0.00 0.00 58.73 61.63 3cfa h TYR 79 Cb 1.08 -0.17 -0.00 0.00 1.54 0.00 0.00 36.73 39.17 3cfa h TYR 79 CO 0.84 0.25 -0.51 0.74 -1.64 0.00 0.00 178.16 177.84 3cfa h PHE 80 N 0.50 0.13 -0.30 -3.82 0.04 -1.92 -3.16 116.94 108.41 3cfa h PHE 80 Ca 0.31 -0.09 -0.05 0.00 2.80 0.00 0.00 57.97 60.93 3cfa h PHE 80 Cb 0.55 -0.01 -0.02 0.00 2.20 0.00 0.00 35.95 38.67 3cfa h PHE 80 CO -0.00 1.20 -0.05 0.87 -0.60 0.00 0.00 178.31 179.73 3cfa h LYS 81 N -0.83 0.48 0.00 1.51 1.57 -1.88 -1.93 116.57 115.48 3cfa h LYS 81 Ca -0.12 -0.11 -0.01 0.00 -1.87 0.00 0.00 60.65 58.54 3cfa h LYS 81 Cb 1.23 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 33.48 3cfa h LYS 81 CO -0.01 0.54 -0.06 1.96 -0.57 0.00 0.00 179.45 181.31 3cfa h GLN 82 N 0.45 0.00 0.00 3.15 4.20 -1.48 -3.09 115.11 118.34 3cfa h GLN 82 Ca 0.09 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.77 3cfa h GLN 82 Cb 0.37 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.15 3cfa h GLN 82 CO 0.02 0.06 -0.15 0.77 -0.67 0.00 0.00 178.83 178.86 3cfa h SER 83 N 0.00 0.00 -4.03 1.46 0.02 -1.31 -3.45 113.55 106.25 3cfa h SER 83 Ca -0.00 0.00 -0.48 0.00 -0.84 0.00 0.00 61.79 60.47 3cfa h SER 83 Cb 0.20 0.00 0.02 0.00 0.14 0.00 0.00 62.40 62.76 3cfa h SER 83 CO 0.01 0.15 0.40 -0.36 -1.14 0.00 0.00 176.83 175.89 3cfa s PHE 84 N -3.31 3.10 -0.84 3.45 0.08 -1.17 -1.12 117.98 118.17 3cfa s PHE 84 Ca 0.04 1.60 0.26 0.00 0.12 0.00 0.00 56.93 58.96 3cfa s PHE 84 Cb 0.07 -3.10 0.98 0.00 -0.57 0.00 0.00 43.02 40.40 3cfa s PHE 84 CO 0.66 -0.78 1.81 -0.35 -0.10 0.00 0.00 175.22 176.46 3cfa n PRO 85 N -0.59 0.13 -0.16 0.24 -0.04 -1.26 -4.85 135.00 128.48 3cfa n PRO 85 Ca 0.07 0.15 -0.02 0.00 -0.04 0.00 0.00 63.50 63.66 3cfa n PRO 85 Cb 0.51 -1.67 0.20 0.00 -0.04 0.00 0.00 33.50 32.50 3cfa n PRO 85 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 3cfa h GLU 86 N 0.00 0.88 0.00 0.54 3.07 -1.78 -3.40 114.58 113.89 3cfa h GLU 86 Ca 0.00 -0.15 0.00 0.00 -0.50 0.00 0.00 59.36 58.71 3cfa h GLU 86 Cb 0.57 -0.15 0.00 0.00 -0.84 0.00 0.00 28.75 28.34 3cfa h GLU 86 CO 0.00 0.74 0.00 0.41 -1.40 0.00 0.00 179.01 178.76 3cfa n GLY 87 N -0.98 -1.81 3.74 -3.84 0.00 -0.27 -4.80 105.19 97.22 3cfa n GLY 87 Ca 0.05 -1.68 -0.08 0.00 0.00 0.00 0.00 46.02 44.31 3cfa n GLY 87 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3cfa s PHE 88 N 0.00 0.08 0.28 1.61 -0.12 -0.90 -1.25 117.98 117.67 3cfa s PHE 88 Ca 0.00 -0.50 0.07 0.00 -0.05 0.00 0.00 56.93 56.46 3cfa s PHE 88 Cb 0.00 0.48 -0.06 0.00 -0.63 0.00 0.00 43.02 42.81 3cfa s PHE 88 CO 0.00 -1.14 -0.08 0.95 -0.05 0.00 0.00 175.22 174.90 3cfa s THR 89 N -3.90 1.79 0.06 -4.49 -4.23 0.21 -0.63 115.64 104.45 3cfa s THR 89 Ca 0.16 -2.16 -0.00 0.00 -1.18 0.00 0.00 61.69 58.51 3cfa s THR 89 Cb -0.04 -2.43 -0.04 0.00 1.34 0.00 0.00 72.50 71.33 3cfa s THR 89 CO 0.08 -0.32 -0.04 -1.66 -0.54 0.00 0.00 174.62 172.14 3cfa s TRP 90 N -2.92 0.63 -0.02 3.99 1.48 -0.57 -0.94 118.94 120.59 3cfa s TRP 90 Ca 0.29 -1.00 -0.04 0.00 -1.06 0.00 0.00 56.10 54.29 3cfa s TRP 90 Cb 0.03 -0.42 0.00 0.00 -1.16 0.00 0.00 33.47 31.92 3cfa s TRP 90 CO 0.12 -0.30 0.09 -1.83 -4.06 0.00 0.00 176.95 170.97 3cfa s GLU 91 N -3.80 0.23 -0.19 3.25 -1.05 -0.52 -0.64 118.70 115.98 3cfa s GLU 91 Ca 0.08 -0.09 -0.24 0.00 -0.15 0.00 0.00 54.97 54.57 3cfa s GLU 91 Cb 0.06 0.10 0.06 0.00 -0.44 0.00 0.00 34.13 33.92 3cfa s GLU 91 CO -0.08 -0.04 0.63 0.50 0.95 0.00 0.00 175.26 177.22 3cfa s ARG 92 N -0.49 0.81 -0.11 -4.83 3.52 -0.74 -1.34 118.95 115.77 3cfa s ARG 92 Ca -0.06 0.71 0.03 0.00 -0.13 0.00 0.00 55.73 56.29 3cfa s ARG 92 Cb -0.04 0.39 0.00 0.00 -1.56 0.00 0.00 34.95 33.75 3cfa s ARG 92 CO 0.00 -0.14 -0.23 0.99 -0.81 0.00 0.00 175.30 175.11 3cfa s THR 93 N -0.05 2.01 -0.23 4.11 2.01 -0.88 -0.97 115.64 121.64 3cfa s THR 93 Ca -0.03 -0.98 -0.08 0.00 0.31 0.00 0.00 61.69 60.92 3cfa s THR 93 Cb -0.04 -1.76 -0.04 0.00 0.01 0.00 0.00 72.50 70.68 3cfa s THR 93 CO 0.03 0.55 0.08 -0.89 -0.69 0.00 0.00 174.62 173.70 3cfa s THR 94 N 0.53 4.59 -0.23 -0.82 2.01 0.48 -1.32 115.64 120.89 3cfa s THR 94 Ca -0.14 -0.09 -0.08 0.00 0.31 0.00 0.00 61.69 61.69 3cfa s THR 94 Cb -0.17 -3.12 -0.04 0.00 0.01 0.00 0.00 72.50 69.18 3cfa s THR 94 CO 0.05 0.37 0.09 0.42 -0.69 0.00 0.00 174.62 174.85 3cfa s THR 95 N 1.20 4.61 0.16 -0.82 -4.23 -0.05 -0.93 115.64 115.59 3cfa s THR 95 Ca 0.05 -0.08 -0.10 0.00 -1.18 0.00 0.00 61.69 60.38 3cfa s THR 95 Cb -0.14 -3.14 -0.07 0.00 1.34 0.00 0.00 72.50 70.49 3cfa s THR 95 CO 0.04 0.36 0.50 -0.31 -0.54 0.00 0.00 174.62 174.66 3cfa s TYR 96 N 1.25 3.51 0.32 3.99 2.02 0.40 -1.12 117.35 127.73 3cfa s TYR 96 Ca 0.05 0.86 0.37 0.00 -0.37 0.00 0.00 57.07 57.99 3cfa s TYR 96 Cb -0.14 -2.23 1.76 0.00 -0.40 0.00 0.00 41.96 40.94 3cfa s TYR 96 CO 0.04 0.39 2.13 1.05 -1.57 0.00 0.00 175.55 177.59 3cfa h GLU 97 N 3.10 0.00 -0.67 -0.62 4.11 -1.63 -2.10 114.58 116.77 3cfa h GLU 97 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.95 3cfa h GLU 97 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 3cfa h GLU 97 CO 0.68 0.01 0.00 -0.40 0.07 0.00 0.00 179.01 179.37 3cfa n ASP 98 N -3.12 3.62 0.00 3.06 5.75 -1.26 -4.94 116.55 119.66 3cfa n ASP 98 Ca -0.01 -2.03 0.00 0.00 -0.01 0.00 0.00 54.79 52.74 3cfa n ASP 98 Cb 0.22 -0.45 0.00 0.00 -1.03 0.00 0.00 41.12 39.86 3cfa n ASP 98 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3cfa n GLY 99 N 1.52 0.65 3.78 6.12 0.00 -0.79 -4.57 105.19 111.91 3cfa n GLY 99 Ca 0.22 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.90 3cfa n GLY 99 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3cfa s GLY 100 N -1.81 2.48 -0.03 -0.02 0.00 -1.20 -4.62 107.32 102.13 3cfa s GLY 100 Ca 0.00 0.68 0.03 0.00 0.00 0.00 0.00 44.72 45.42 3cfa s GLY 100 CO 0.00 1.02 -0.10 -1.36 0.00 0.00 0.00 173.10 172.66 3cfa s PHE 101 N -1.98 1.03 -0.20 1.90 0.08 -0.27 -0.45 117.98 118.09 3cfa s PHE 101 Ca 0.69 -0.26 0.00 0.00 0.12 0.00 0.00 56.93 57.49 3cfa s PHE 101 Cb -0.20 -0.72 0.05 0.00 -0.57 0.00 0.00 43.02 41.57 3cfa s PHE 101 CO 0.28 -0.10 -0.06 -1.17 -0.10 0.00 0.00 175.22 174.07 3cfa s LEU 102 N 0.15 2.04 -0.08 -0.37 1.98 -0.11 -1.11 118.68 121.18 3cfa s LEU 102 Ca -0.03 -0.89 0.01 0.00 -2.89 0.00 0.00 54.13 50.33 3cfa s LEU 102 Cb -0.09 -1.05 -0.03 0.00 0.66 0.00 0.00 46.19 45.69 3cfa s LEU 102 CO 0.01 -0.20 -0.08 -0.89 -1.89 0.00 0.00 176.35 173.29 3cfa s THR 103 N 1.52 3.57 0.00 3.68 2.01 0.39 -0.39 115.64 126.43 3cfa s THR 103 Ca -0.02 -0.52 -0.04 0.00 0.31 0.00 0.00 61.69 61.42 3cfa s THR 103 Cb -0.17 -2.46 -0.00 0.00 0.01 0.00 0.00 72.50 69.88 3cfa s THR 103 CO -0.07 0.58 0.07 0.00 -0.69 0.00 0.00 174.62 174.51 3cfa s ALA 104 N -0.60 -0.16 -0.03 7.40 0.00 -0.15 -0.57 121.76 127.66 3cfa s ALA 104 Ca 0.09 -0.23 0.05 0.00 0.00 0.00 0.00 51.96 51.86 3cfa s ALA 104 Cb -0.12 0.08 -0.01 0.00 0.00 0.00 0.00 23.12 23.08 3cfa s ALA 104 CO 0.02 -0.17 -0.17 -1.58 0.00 0.00 0.00 175.76 173.86 3cfa s HIS 105 N -1.19 1.59 -0.01 0.00 2.46 -0.40 -1.79 115.29 115.95 3cfa s HIS 105 Ca -0.13 -0.38 0.04 0.00 0.47 0.00 0.00 55.06 55.06 3cfa s HIS 105 Cb -0.07 -1.05 -0.01 0.00 -0.13 0.00 0.00 32.58 31.32 3cfa s HIS 105 CO 0.00 -0.10 -0.12 -1.14 -2.47 0.00 0.00 174.74 170.91 3cfa s GLN 106 N -0.16 1.05 -0.11 2.88 -0.44 0.19 -1.23 119.66 121.84 3cfa s GLN 106 Ca 0.01 -0.44 0.02 0.00 -2.50 0.00 0.00 55.36 52.44 3cfa s GLN 106 Cb -0.09 -1.00 -0.01 0.00 -1.64 0.00 0.00 33.01 30.26 3cfa s GLN 106 CO 0.01 0.26 -0.17 0.34 0.50 0.00 0.00 175.29 176.22 3cfa s ASP 107 N -0.24 3.68 -0.17 6.67 -1.08 -0.07 -1.51 116.67 123.96 3cfa s ASP 107 Ca 0.04 -0.40 0.01 0.00 -0.52 0.00 0.00 52.55 51.69 3cfa s ASP 107 Cb -0.05 -1.43 0.02 0.00 -1.46 0.00 0.00 42.92 39.99 3cfa s ASP 107 CO -0.00 0.18 -0.20 -0.89 0.52 0.00 0.00 175.17 174.78 3cfa s THR 108 N 0.22 2.05 0.16 1.71 2.01 0.20 -1.25 115.64 120.74 3cfa s THR 108 Ca -0.11 -0.94 0.07 0.00 0.31 0.00 0.00 61.69 61.02 3cfa s THR 108 Cb -0.16 -1.84 -0.04 0.00 0.01 0.00 0.00 72.50 70.46 3cfa s THR 108 CO 0.06 0.54 -0.15 -0.94 -0.69 0.00 0.00 174.62 173.44 3cfa s SER 109 N 1.23 2.37 -0.27 3.53 1.04 -0.46 -2.13 113.70 119.01 3cfa s SER 109 Ca 0.03 -0.91 -0.06 0.00 0.48 0.00 0.00 55.95 55.49 3cfa s SER 109 Cb -0.13 -0.11 -0.01 0.00 0.10 0.00 0.00 66.02 65.87 3cfa s SER 109 CO -0.11 -0.14 0.05 -0.22 0.98 0.00 0.00 173.24 173.80 3cfa s LEU 110 N -2.86 3.54 -0.47 2.42 2.96 -1.26 -0.28 118.68 122.72 3cfa s LEU 110 Ca 0.16 -0.49 0.03 0.00 -0.22 0.00 0.00 54.13 53.62 3cfa s LEU 110 Cb -0.03 -1.87 0.12 0.00 0.50 0.00 0.00 46.19 44.91 3cfa s LEU 110 CO 0.05 -0.11 0.21 -0.62 -1.32 0.00 0.00 176.35 174.56 3cfa s ASP 111 N 1.53 4.53 1.55 3.68 2.15 -1.26 -5.00 116.67 123.86 3cfa s ASP 111 Ca 0.04 -2.73 0.00 0.00 0.43 0.00 0.00 52.55 50.30 3cfa s ASP 111 Cb -0.16 -1.65 0.00 0.00 -0.30 0.00 0.00 42.92 40.81 3cfa s ASP 111 CO 0.02 -0.29 0.00 0.61 -0.17 0.00 0.00 175.17 175.34 3cfa n GLY 112 N 3.50 2.09 2.88 2.66 0.00 -1.26 -4.72 105.19 110.34 3cfa n GLY 112 Ca 0.05 0.03 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 3cfa n GLY 112 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3cfa n ASP 113 N 10.44 7.47 -3.78 1.61 5.75 -1.26 -5.19 116.55 131.59 3cfa n ASP 113 Ca 0.00 -3.79 -0.14 0.00 -0.01 0.00 0.00 54.79 50.84 3cfa n ASP 113 Cb 0.00 -1.08 -0.15 0.00 -1.03 0.00 0.00 41.12 38.86 3cfa n ASP 113 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 3cfa s LEU 115 N -3.94 1.16 -0.17 -2.12 1.43 -1.26 -5.19 118.68 108.59 3cfa s LEU 115 Ca 0.53 0.08 -0.00 0.00 -1.03 0.00 0.00 54.13 53.71 3cfa s LEU 115 Cb 0.44 0.02 0.00 0.00 0.03 0.00 0.00 46.19 46.69 3cfa s LEU 115 CO -0.40 -0.11 -0.15 -0.69 0.23 0.00 0.00 176.35 175.23 3cfa s VAL 116 N 0.91 2.57 -0.13 -1.59 1.01 0.61 -4.95 120.40 118.82 3cfa s VAL 116 Ca -0.07 -0.79 -0.03 0.00 0.00 0.00 0.00 61.98 61.09 3cfa s VAL 116 Cb -0.11 -2.10 -0.03 0.00 0.00 0.00 0.00 36.38 34.15 3cfa s VAL 116 CO -0.03 0.51 -0.03 -0.31 0.00 0.00 0.00 175.10 175.24 3cfa s TYR 117 N 1.05 3.05 -0.17 5.22 2.02 -1.26 -1.35 117.35 125.90 3cfa s TYR 117 Ca -0.01 -0.16 0.01 0.00 -0.37 0.00 0.00 57.07 56.54 3cfa s TYR 117 Cb -0.15 -1.90 0.02 0.00 -0.40 0.00 0.00 41.96 39.53 3cfa s TYR 117 CO -0.04 0.11 -0.18 0.15 -1.57 0.00 0.00 175.55 174.01 3cfa s LYS 118 N 0.00 2.76 0.01 -0.62 1.02 -0.38 -4.98 119.74 117.55 3cfa s LYS 118 Ca 0.01 -0.76 0.06 0.00 0.02 0.00 0.00 55.97 55.31 3cfa s LYS 118 Cb -0.13 -2.43 -0.02 0.00 -0.52 0.00 0.00 37.83 34.73 3cfa s LYS 118 CO 0.02 -0.23 -0.19 0.14 -0.92 0.00 0.00 175.35 174.18 3cfa s VAL 119 N 1.35 1.53 -0.07 3.17 -7.23 -1.26 -0.89 120.40 117.00 3cfa s VAL 119 Ca 0.05 -0.97 0.05 0.00 -1.81 0.00 0.00 61.98 59.30 3cfa s VAL 119 Cb -0.13 -1.30 -0.00 0.00 0.56 0.00 0.00 36.38 35.50 3cfa s VAL 119 CO -0.12 0.31 -0.22 -0.54 -0.31 0.00 0.00 175.10 174.22 3cfa s LYS 120 N -0.77 2.56 -0.06 4.82 1.02 -0.36 -5.00 119.74 121.95 3cfa s LYS 120 Ca 0.07 -0.81 0.04 0.00 0.02 0.00 0.00 55.97 55.28 3cfa s LYS 120 Cb -0.08 -2.06 0.00 0.00 -0.52 0.00 0.00 37.83 35.17 3cfa s LYS 120 CO 0.00 0.25 -0.16 0.42 -0.92 0.00 0.00 175.35 174.95 3cfa s ILE 121 N 0.13 1.39 -0.15 2.17 -1.09 -1.26 -1.28 121.20 121.11 3cfa s ILE 121 Ca -0.10 -0.66 -0.01 0.00 -2.23 0.00 0.00 60.65 57.64 3cfa s ILE 121 Cb -0.15 -1.21 0.04 0.00 -1.58 0.00 0.00 42.46 39.55 3cfa s ILE 121 CO 0.06 0.41 -0.02 -0.76 -1.23 0.00 0.00 174.94 173.39 3cfa s LEU 122 N 0.28 1.27 -0.01 2.97 1.43 0.27 -5.01 118.68 119.88 3cfa s LEU 122 Ca -0.09 -0.55 0.07 0.00 -1.03 0.00 0.00 54.13 52.53 3cfa s LEU 122 Cb -0.14 -0.74 -0.02 0.00 0.03 0.00 0.00 46.19 45.32 3cfa s LEU 122 CO 0.03 -0.21 -0.23 -0.83 0.23 0.00 0.00 176.35 175.35 3cfa s GLY 123 N 1.76 1.37 0.19 -3.19 0.00 -1.26 -0.46 107.32 105.73 3cfa s GLY 123 Ca 0.02 -1.12 -0.14 0.00 0.00 0.00 0.00 44.72 43.47 3cfa s GLY 123 CO -0.07 -0.94 0.44 0.54 0.00 0.00 0.00 173.10 173.06 3cfa s ASN 124 N -0.81 -0.15 -1.94 1.64 2.20 -0.27 -4.96 114.94 110.66 3cfa s ASN 124 Ca 0.11 -0.64 0.00 0.00 -0.94 0.00 0.00 52.86 51.39 3cfa s ASN 124 Cb -0.10 0.53 0.00 0.00 -2.00 0.00 0.00 41.25 39.68 3cfa s ASN 124 CO 0.00 -1.00 0.00 0.59 -2.94 0.00 0.00 177.10 173.75 3cfa n ASN 125 N -0.30 -5.31 -4.71 3.54 3.02 -1.26 -1.12 115.26 109.12 3cfa n ASN 125 Ca -0.09 0.45 -0.42 0.00 -0.03 0.00 0.00 54.58 54.49 3cfa n ASN 125 Cb 0.63 -4.42 -0.03 0.00 -0.61 0.00 0.00 39.78 35.34 3cfa n ASN 125 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3cfa s PHE 126 N -2.64 3.17 0.30 3.10 0.08 -1.26 -3.23 117.98 117.51 3cfa s PHE 126 Ca 0.00 1.00 -0.30 0.00 0.12 0.00 0.00 56.93 57.76 3cfa s PHE 126 Cb 0.00 -3.61 -0.12 0.00 -0.57 0.00 0.00 43.02 38.73 3cfa s PHE 126 CO 0.00 -2.10 1.54 -2.30 -0.10 0.00 0.00 175.22 172.26 3cfa n PRO 127 N 4.41 2.59 0.06 0.24 -0.02 -1.26 -4.88 135.00 136.14 3cfa n PRO 127 Ca 0.11 0.92 0.06 0.00 -2.02 0.00 0.00 63.50 62.57 3cfa n PRO 127 Cb 0.44 -2.67 0.49 0.00 -0.02 0.00 0.00 33.50 31.74 3cfa n PRO 127 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3cfa h ALA 128 N 4.28 1.82 -0.24 3.55 0.00 -1.97 -2.24 119.26 124.45 3cfa h ALA 128 Ca -0.47 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3cfa h ALA 128 Cb 1.24 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3cfa h ALA 128 CO 0.75 0.16 0.00 -0.40 0.00 0.00 0.00 179.25 179.76 3cfa n ASP 129 N -4.49 2.55 -4.90 0.00 5.75 -1.26 -4.21 116.55 110.00 3cfa n ASP 129 Ca 0.02 -1.85 -0.29 0.00 -0.01 0.00 0.00 54.79 52.66 3cfa n ASP 129 Cb 0.10 -0.15 0.05 0.00 -1.03 0.00 0.00 41.12 40.08 3cfa n ASP 129 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 3cfa s GLY 130 N -1.59 1.62 0.56 6.12 0.00 -0.84 -4.85 107.32 108.34 3cfa s GLY 130 Ca 0.35 -0.54 0.25 0.00 0.00 0.00 0.00 44.72 44.79 3cfa s GLY 130 CO 0.29 -0.18 2.21 -0.56 0.00 0.00 0.00 173.10 174.87 3cfa h PRO 131 N -0.53 0.00 0.28 2.90 0.13 -1.91 -0.86 132.00 132.01 3cfa h PRO 131 Ca -0.45 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.66 3cfa h PRO 131 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 3cfa h PRO 131 CO 0.63 0.01 -0.13 0.28 -0.23 0.00 0.00 178.00 178.55 3cfa h VAL 132 N 0.00 0.69 0.00 1.56 2.07 -1.93 -0.07 116.25 118.57 3cfa h VAL 132 Ca -0.00 -0.76 -0.09 0.00 0.82 0.00 0.00 66.70 66.68 3cfa h VAL 132 Cb 0.02 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.83 3cfa h VAL 132 CO 0.00 0.14 -0.41 0.24 0.02 0.00 0.00 177.57 177.56 3cfa h MET 133 N -0.82 0.00 -0.00 1.57 2.86 -1.73 -2.65 114.93 114.16 3cfa h MET 133 Ca -0.04 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 3cfa h MET 133 Cb 0.51 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.17 3cfa h MET 133 CO 0.06 0.41 -0.03 1.04 1.06 0.00 0.00 176.91 179.46 3cfa n GLN 134 N -3.34 0.44 -3.74 1.72 1.13 -0.34 -4.94 117.38 108.31 3cfa n GLN 134 Ca 0.01 -0.04 -0.24 0.00 -1.94 0.00 0.00 57.00 54.79 3cfa n GLN 134 Cb 0.61 -1.50 0.04 0.00 0.11 0.00 0.00 30.24 29.51 3cfa n GLN 134 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 3cfa n ASN 135 N -1.25 -3.14 -0.97 1.08 2.85 -0.88 -4.92 115.26 108.02 3cfa n ASN 135 Ca 0.14 -0.75 0.00 0.00 -0.11 0.00 0.00 54.58 53.86 3cfa n ASN 135 Cb 0.26 -4.23 0.16 0.00 1.24 0.00 0.00 39.78 37.21 3cfa n ASN 135 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 3cfa n LYS 136 N -4.49 1.84 -3.28 1.20 5.02 -0.09 -5.05 118.16 113.30 3cfa n LYS 136 Ca -0.14 -3.37 -0.32 0.00 -2.02 0.00 0.00 58.31 52.46 3cfa n LYS 136 Cb 0.61 -1.61 -0.06 0.00 -0.02 0.00 0.00 35.03 33.95 3cfa n LYS 136 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3cfa s ALA 137 N -3.06 3.46 -0.17 7.82 0.00 -1.23 -4.21 121.76 124.38 3cfa s ALA 137 Ca 0.40 -0.16 0.17 0.00 0.00 0.00 0.00 51.96 52.37 3cfa s ALA 137 Cb 0.38 -2.57 0.42 0.00 0.00 0.00 0.00 23.12 21.35 3cfa s ALA 137 CO -0.06 0.41 1.30 0.41 0.00 0.00 0.00 175.76 177.83 3cfa n GLY 138 N -0.30 4.35 0.00 0.00 0.00 0.88 -5.01 105.19 105.11 3cfa n GLY 138 Ca 0.02 -1.06 0.00 0.00 0.00 0.00 0.00 46.02 44.98 3cfa n GLY 138 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cfa n GLY 139 N -0.87 0.07 3.89 -0.02 0.00 -1.26 -4.73 105.19 102.26 3cfa n GLY 139 Ca 0.19 -1.90 -0.33 0.00 0.00 0.00 0.00 46.02 43.97 3cfa n GLY 139 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3cfa s TRP 140 N -1.41 3.54 0.73 1.61 0.52 -1.26 -1.03 118.94 121.65 3cfa s TRP 140 Ca 0.00 0.56 -0.11 0.00 0.02 0.00 0.00 56.10 56.58 3cfa s TRP 140 Cb 0.00 -1.99 0.03 0.00 -1.15 0.00 0.00 33.47 30.36 3cfa s TRP 140 CO 0.00 0.55 1.07 -1.21 0.02 0.00 0.00 176.95 177.38 3cfa s GLU 141 N -2.10 2.60 0.85 4.98 0.41 -0.58 -4.81 118.70 120.05 3cfa s GLU 141 Ca 0.33 0.92 -0.12 0.00 -0.41 0.00 0.00 54.97 55.69 3cfa s GLU 141 Cb -0.13 -1.95 0.11 0.00 -1.78 0.00 0.00 34.13 30.37 3cfa s GLU 141 CO 0.20 -1.33 1.17 -2.14 -0.49 0.00 0.00 175.26 172.67 3cfa s PRO 142 N -5.04 1.44 0.12 0.39 0.02 -1.26 -4.74 135.00 125.92 3cfa s PRO 142 Ca 0.59 1.61 -0.04 0.00 0.02 0.00 0.00 61.00 63.18 3cfa s PRO 142 Cb -0.15 -1.77 -0.03 0.00 0.02 0.00 0.00 34.50 32.58 3cfa s PRO 142 CO 0.55 -2.33 0.11 -1.54 -0.33 0.00 0.00 177.00 173.46 3cfa s SER 143 N -2.50 0.25 -0.11 2.53 1.04 0.39 -4.88 113.70 110.42 3cfa s SER 143 Ca 0.69 -1.01 0.02 0.00 0.48 0.00 0.00 55.95 56.13 3cfa s SER 143 Cb -0.25 0.32 0.01 0.00 0.10 0.00 0.00 66.02 66.20 3cfa s SER 143 CO 0.54 -0.74 -0.16 0.00 0.98 0.00 0.00 173.24 173.85 3cfa s GLU 145 N 0.92 3.23 -0.09 0.00 2.12 0.55 -4.22 118.70 121.21 3cfa s GLU 145 Ca -0.07 -0.53 -0.11 0.00 0.36 0.00 0.00 54.97 54.61 3cfa s GLU 145 Cb -0.15 -2.76 -0.05 0.00 0.26 0.00 0.00 34.13 31.44 3cfa s GLU 145 CO -0.01 0.44 0.26 0.96 -0.54 0.00 0.00 175.26 176.38 3cfa s ILE 146 N -0.20 5.30 -0.01 -3.70 -4.36 0.19 -0.34 121.20 118.07 3cfa s ILE 146 Ca 0.03 0.49 0.03 0.00 -0.26 0.00 0.00 60.65 60.94 3cfa s ILE 146 Cb -0.13 -3.56 -0.00 0.00 1.25 0.00 0.00 42.46 40.02 3cfa s ILE 146 CO 0.03 0.55 -0.10 -0.76 0.24 0.00 0.00 174.94 174.89 3cfa s LEU 147 N -0.66 1.94 0.13 0.37 1.02 -0.51 -1.21 118.68 119.76 3cfa s LEU 147 Ca 0.18 -0.19 -0.24 0.00 0.02 0.00 0.00 54.13 53.90 3cfa s LEU 147 Cb -0.14 -0.54 0.07 0.00 0.02 0.00 0.00 46.19 45.61 3cfa s LEU 147 CO 0.07 0.11 0.69 -0.72 0.02 0.00 0.00 176.35 176.51 3cfa s TYR 148 N -0.10 -0.46 0.12 0.29 -0.85 -0.80 -1.78 117.35 113.78 3cfa s TYR 148 Ca 0.02 0.25 -0.30 0.00 -0.52 0.00 0.00 57.07 56.51 3cfa s TYR 148 Cb -0.06 0.57 -0.07 0.00 0.38 0.00 0.00 41.96 42.79 3cfa s TYR 148 CO -0.00 -0.80 1.17 -2.00 -1.52 0.00 0.00 175.55 172.40 3cfa s GLU 149 N -3.59 4.49 -0.09 -3.49 2.12 -1.26 -0.82 118.70 116.07 3cfa s GLU 149 Ca 0.03 1.77 -0.06 0.00 0.36 0.00 0.00 54.97 57.07 3cfa s GLU 149 Cb -0.01 -3.31 0.03 0.00 0.26 0.00 0.00 34.13 31.10 3cfa s GLU 149 CO -0.10 -0.12 0.21 0.54 -0.54 0.00 0.00 175.26 175.25 3cfa s VAL 150 N 0.45 -0.02 -1.65 3.70 0.11 -0.39 -4.90 120.40 117.69 3cfa s VAL 150 Ca 0.55 0.09 -0.01 0.00 -2.93 0.00 0.00 61.98 59.67 3cfa s VAL 150 Cb -0.30 -0.32 0.00 0.00 -1.53 0.00 0.00 36.38 34.23 3cfa s VAL 150 CO 0.32 0.04 0.09 0.47 -3.33 0.00 0.00 175.10 172.69 3cfa n ASP 151 N 3.66 -5.65 -0.03 3.54 8.00 -1.26 -2.08 116.55 122.73 3cfa n ASP 151 Ca -0.20 -0.03 -0.00 0.00 0.71 0.00 0.00 54.79 55.27 3cfa n ASP 151 Cb 0.55 -4.69 -0.00 0.00 -0.02 0.00 0.00 41.12 36.96 3cfa n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3cfa n GLY 152 N -1.06 0.39 3.60 0.44 0.00 -1.26 -5.01 105.19 102.30 3cfa n GLY 152 Ca -0.21 -0.05 -0.28 0.00 0.00 0.00 0.00 46.02 45.47 3cfa n GLY 152 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3cfa s VAL 153 N -1.76 0.75 -0.25 1.61 -7.23 -0.88 -4.75 120.40 107.88 3cfa s VAL 153 Ca 0.00 -2.00 -0.08 0.00 -1.81 0.00 0.00 61.98 58.09 3cfa s VAL 153 Cb 0.00 -2.25 -0.04 0.00 0.56 0.00 0.00 36.38 34.66 3cfa s VAL 153 CO 0.00 0.00 0.10 -0.22 -0.31 0.00 0.00 175.10 174.67 3cfa s LEU 154 N -3.71 3.64 0.01 1.32 2.96 -1.02 -1.27 118.68 120.62 3cfa s LEU 154 Ca 0.17 -0.12 -0.10 0.00 -0.22 0.00 0.00 54.13 53.86 3cfa s LEU 154 Cb 0.02 -1.98 -0.05 0.00 0.50 0.00 0.00 46.19 44.67 3cfa s LEU 154 CO 0.11 -0.01 0.33 0.00 -1.32 0.00 0.00 176.35 175.45 3cfa s GLY 156 N -1.47 0.67 -0.02 0.00 0.00 0.15 -1.90 107.32 104.76 3cfa s GLY 156 Ca 0.27 -0.58 -0.00 0.00 0.00 0.00 0.00 44.72 44.40 3cfa s GLY 156 CO 0.14 -0.47 0.03 1.20 0.00 0.00 0.00 173.10 174.01 3cfa s GLN 157 N -0.29 -0.02 0.05 2.90 -1.52 -0.35 -0.50 119.66 119.94 3cfa s GLN 157 Ca 0.05 0.14 -0.16 0.00 -1.95 0.00 0.00 55.36 53.44 3cfa s GLN 157 Cb -0.06 -0.17 0.03 0.00 -0.22 0.00 0.00 33.01 32.60 3cfa s GLN 157 CO -0.00 -0.12 0.37 -1.54 -0.25 0.00 0.00 175.29 173.75 3cfa s SER 158 N 0.75 -0.22 -0.09 5.90 1.04 -1.06 -0.63 113.70 119.38 3cfa s SER 158 Ca -0.06 -0.11 -0.01 0.00 0.48 0.00 0.00 55.95 56.25 3cfa s SER 158 Cb -0.09 0.41 -0.03 0.00 0.10 0.00 0.00 66.02 66.41 3cfa s SER 158 CO -0.02 -0.67 -0.05 -0.76 0.98 0.00 0.00 173.24 172.72 3cfa s LEU 159 N -2.13 3.28 0.20 2.42 1.43 -1.26 -0.51 118.68 122.10 3cfa s LEU 159 Ca -0.04 -0.00 0.07 0.00 -1.03 0.00 0.00 54.13 53.13 3cfa s LEU 159 Cb -0.00 -1.74 -0.05 0.00 0.03 0.00 0.00 46.19 44.43 3cfa s LEU 159 CO -0.04 0.33 -0.13 -0.04 0.23 0.00 0.00 176.35 176.70 3cfa s MET 160 N -0.62 1.29 -0.12 1.70 -1.94 -0.51 -4.50 119.30 114.61 3cfa s MET 160 Ca 0.09 -1.57 -0.02 0.00 -1.71 0.00 0.00 55.69 52.48 3cfa s MET 160 Cb -0.12 -1.03 0.04 0.00 2.01 0.00 0.00 34.83 35.74 3cfa s MET 160 CO 0.02 0.16 -0.00 0.00 -0.01 0.00 0.00 175.02 175.18 3cfa s ALA 161 N -3.04 0.92 -0.11 3.03 0.00 -1.26 -1.18 121.76 120.11 3cfa s ALA 161 Ca 0.22 -0.40 -0.23 0.00 0.00 0.00 0.00 51.96 51.55 3cfa s ALA 161 Cb 0.00 -0.92 -0.03 0.00 0.00 0.00 0.00 23.12 22.17 3cfa s ALA 161 CO 0.06 -0.69 0.70 -1.17 0.00 0.00 0.00 175.76 174.66 3cfa s LEU 162 N 1.88 4.25 0.12 0.00 2.96 0.56 -1.53 118.68 126.93 3cfa s LEU 162 Ca 0.03 1.10 -0.30 0.00 -0.22 0.00 0.00 54.13 54.74 3cfa s LEU 162 Cb -0.14 -3.06 -0.07 0.00 0.50 0.00 0.00 46.19 43.42 3cfa s LEU 162 CO -0.07 -0.20 1.24 -0.54 -1.32 0.00 0.00 176.35 175.47 3cfa s LYS 163 N 1.26 4.43 0.38 1.98 1.02 -0.20 -0.60 119.74 128.02 3cfa s LYS 163 Ca 0.35 1.88 0.08 0.00 0.02 0.00 0.00 55.97 58.31 3cfa s LYS 163 Cb -0.17 -3.28 -0.07 0.00 -0.52 0.00 0.00 37.83 33.79 3cfa s LYS 163 CO 0.15 -0.23 -0.02 0.00 -0.92 0.00 0.00 175.35 174.33 3cfa s PRO 165 N -3.69 3.86 0.00 0.00 0.02 -1.26 -3.30 135.00 130.63 3cfa s PRO 165 Ca 0.34 2.16 0.00 0.00 0.02 0.00 0.00 61.00 63.52 3cfa s PRO 165 Cb 0.05 -2.68 0.00 0.00 0.02 0.00 0.00 34.50 31.90 3cfa s PRO 165 CO 0.18 -0.59 0.00 0.41 -0.33 0.00 0.00 177.00 176.67 3cfa n GLY 166 N 0.64 0.65 2.34 0.52 0.00 -1.26 -4.03 105.19 104.06 3cfa n GLY 166 Ca 0.05 -0.75 -0.12 0.00 0.00 0.00 0.00 46.02 45.20 3cfa n GLY 166 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cfa n GLY 167 N -1.87 1.27 3.97 -0.02 0.00 -1.21 -5.01 105.19 102.31 3cfa n GLY 167 Ca 0.00 -0.47 -0.21 0.00 0.00 0.00 0.00 46.02 45.33 3cfa n GLY 167 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3cfa s ARG 168 N -3.05 3.00 0.05 1.61 0.52 -1.21 -4.94 118.95 114.94 3cfa s ARG 168 Ca 0.00 -0.68 0.04 0.00 -0.52 0.00 0.00 55.73 54.57 3cfa s ARG 168 Cb 0.00 -2.62 -0.03 0.00 0.52 0.00 0.00 34.95 32.83 3cfa s ARG 168 CO 0.00 -0.25 -0.12 -1.01 0.02 0.00 0.00 175.30 173.94 3cfa s HIS 169 N -2.48 1.02 -0.19 -0.53 3.76 -1.26 -0.21 115.29 115.39 3cfa s HIS 169 Ca 0.49 -0.44 -0.01 0.00 -0.15 0.00 0.00 55.06 54.96 3cfa s HIS 169 Cb -0.10 -0.59 0.01 0.00 1.11 0.00 0.00 32.58 33.01 3cfa s HIS 169 CO 0.36 0.01 -0.14 -1.17 -0.85 0.00 0.00 174.74 172.95 3cfa s LEU 170 N -1.52 2.41 0.37 0.89 2.96 0.24 -4.92 118.68 119.11 3cfa s LEU 170 Ca -0.04 -0.55 0.01 0.00 -0.22 0.00 0.00 54.13 53.34 3cfa s LEU 170 Cb -0.09 -1.57 -0.02 0.00 0.50 0.00 0.00 46.19 45.00 3cfa s LEU 170 CO 0.01 0.00 0.57 0.54 -1.32 0.00 0.00 176.35 176.15 3cfa s ASN 171 N 1.30 6.13 0.17 3.68 2.20 -1.26 -0.32 114.94 126.84 3cfa s ASN 171 Ca 0.04 0.32 -0.14 0.00 -0.94 0.00 0.00 52.86 52.14 3cfa s ASN 171 Cb -0.14 -1.81 0.02 0.00 -2.00 0.00 0.00 41.25 37.32 3cfa s ASN 171 CO -0.08 -0.41 0.41 0.00 -2.94 0.00 0.00 177.10 174.08 3cfa s ARG 173 N -3.88 2.41 -0.24 0.00 3.52 -0.28 -1.42 118.95 119.05 3cfa s ARG 173 Ca 0.10 -0.67 -0.11 0.00 -0.13 0.00 0.00 55.73 54.92 3cfa s ARG 173 Cb 0.01 -1.88 -0.05 0.00 -1.56 0.00 0.00 34.95 31.47 3cfa s ARG 173 CO -0.04 0.12 0.19 -0.51 -0.81 0.00 0.00 175.30 174.25 3cfa s LEU 174 N 0.47 4.10 -0.37 -0.88 1.02 0.33 -0.87 118.68 122.48 3cfa s LEU 174 Ca -0.16 0.14 -0.06 0.00 0.02 0.00 0.00 54.13 54.07 3cfa s LEU 174 Cb -0.17 -2.16 0.07 0.00 0.02 0.00 0.00 46.19 43.95 3cfa s LEU 174 CO 0.06 0.03 0.15 -1.00 0.02 0.00 0.00 176.35 175.61 3cfa s HIS 175 N 1.21 3.35 -0.00 0.29 3.76 -0.43 -2.56 115.29 120.92 3cfa s HIS 175 Ca 0.09 -1.75 0.08 0.00 -0.15 0.00 0.00 55.06 53.32 3cfa s HIS 175 Cb -0.14 -2.65 -0.02 0.00 1.11 0.00 0.00 32.58 30.87 3cfa s HIS 175 CO 0.06 -0.83 -0.26 0.99 -0.85 0.00 0.00 174.74 173.85 3cfa s THR 176 N 1.32 2.03 -0.12 1.30 2.01 0.35 -2.08 115.64 120.45 3cfa s THR 176 Ca 0.01 -1.15 0.03 0.00 0.31 0.00 0.00 61.69 60.88 3cfa s THR 176 Cb -0.21 -1.70 0.01 0.00 0.01 0.00 0.00 72.50 70.61 3cfa s THR 176 CO 0.00 0.52 -0.20 -0.89 -0.69 0.00 0.00 174.62 173.36 3cfa s THR 177 N -0.65 1.88 -0.19 -0.82 2.01 -0.45 -0.68 115.64 116.75 3cfa s THR 177 Ca 0.10 -0.88 -0.08 0.00 0.31 0.00 0.00 61.69 61.14 3cfa s THR 177 Cb -0.10 -1.66 -0.04 0.00 0.01 0.00 0.00 72.50 70.70 3cfa s THR 177 CO -0.00 0.52 0.08 -0.31 -0.69 0.00 0.00 174.62 174.22 3cfa s TYR 178 N 0.74 3.30 -0.23 4.92 2.02 0.11 -1.44 117.35 126.77 3cfa s TYR 178 Ca -0.10 0.15 0.00 0.00 -0.37 0.00 0.00 57.07 56.75 3cfa s TYR 178 Cb -0.16 -2.10 0.06 0.00 -0.40 0.00 0.00 41.96 39.36 3cfa s TYR 178 CO 0.01 0.20 -0.04 1.03 -1.57 0.00 0.00 175.55 175.19 3cfa s ARG 179 N 0.34 1.48 0.56 -0.62 0.52 -0.11 -2.42 118.95 118.70 3cfa s ARG 179 Ca 0.05 -0.95 -0.19 0.00 -0.52 0.00 0.00 55.73 54.12 3cfa s ARG 179 Cb -0.12 -2.53 -0.05 0.00 0.52 0.00 0.00 34.95 32.77 3cfa s ARG 179 CO -0.00 -0.62 1.16 0.45 0.02 0.00 0.00 175.30 176.30 3cfa s SER 180 N 1.44 5.51 0.00 0.23 0.15 -1.26 -0.62 113.70 119.15 3cfa s SER 180 Ca -0.05 2.26 0.25 0.00 0.70 0.00 0.00 55.95 59.11 3cfa s SER 180 Cb -0.19 -2.59 0.82 0.00 -1.71 0.00 0.00 66.02 62.36 3cfa s SER 180 CO -0.07 -1.37 1.61 0.29 1.20 0.00 0.00 173.24 174.90 3cfa n LYS 181 N -1.41 1.81 -3.31 5.44 5.02 -0.38 -4.80 118.16 120.52 3cfa n LYS 181 Ca 0.12 -1.19 -0.33 0.00 -2.02 0.00 0.00 58.31 54.89 3cfa n LYS 181 Cb 0.50 -1.45 -0.06 0.00 -0.02 0.00 0.00 35.03 34.01 3cfa n LYS 181 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3cfa s LYS 182 N -1.89 3.91 0.57 1.97 1.02 -1.26 -4.93 119.74 119.13 3cfa s LYS 182 Ca 0.35 0.45 -0.19 0.00 0.02 0.00 0.00 55.97 56.60 3cfa s LYS 182 Cb 0.20 -2.64 -0.04 0.00 -0.52 0.00 0.00 37.83 34.83 3cfa s LYS 182 CO 0.30 0.30 1.14 -1.25 -0.92 0.00 0.00 175.35 174.92 3cfa s PRO 183 N -2.70 3.18 0.54 -1.68 0.04 -1.26 -4.92 135.00 128.20 3cfa s PRO 183 Ca 0.48 1.62 0.24 0.00 0.04 0.00 0.00 61.00 63.38 3cfa s PRO 183 Cb -0.12 -1.98 1.40 0.00 0.04 0.00 0.00 34.50 33.84 3cfa s PRO 183 CO 0.20 -0.99 2.03 0.00 0.04 0.00 0.00 177.00 178.28 3cfa h ALA 184 N 0.94 2.35 0.00 8.56 0.00 -1.94 -0.46 119.26 128.71 3cfa h ALA 184 Ca -0.50 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.39 3cfa h ALA 184 Cb 1.27 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.09 3cfa h ALA 184 CO 0.56 -0.52 -0.04 0.66 0.00 0.00 0.00 179.25 179.91 3cfa h SER 185 N 0.00 0.00 -0.27 0.00 4.64 -1.96 -2.36 113.55 113.59 3cfa h SER 185 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 3cfa h SER 185 Cb 0.81 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.90 3cfa h SER 185 CO -0.00 0.04 0.00 0.00 -0.87 0.00 0.00 176.83 176.00 3cfa n ALA 186 N -2.30 2.45 -2.54 5.18 0.00 -0.18 -4.94 120.51 118.17 3cfa n ALA 186 Ca -0.03 -0.83 -0.29 0.00 0.00 0.00 0.00 53.44 52.29 3cfa n ALA 186 Cb 0.13 -0.92 -0.10 0.00 0.00 0.00 0.00 19.45 18.56 3cfa n ALA 186 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3cfa s LEU 187 N -1.61 2.91 -0.39 0.00 2.01 -0.89 -5.01 118.68 115.70 3cfa s LEU 187 Ca 0.36 -0.46 -0.16 0.00 0.01 0.00 0.00 54.13 53.87 3cfa s LEU 187 Cb 0.21 -1.72 0.01 0.00 0.01 0.00 0.00 46.19 44.70 3cfa s LEU 187 CO 0.30 0.17 0.40 -0.75 1.01 0.00 0.00 176.35 177.49 3cfa s LYS 188 N -2.22 3.27 0.09 1.70 2.47 -1.26 -5.00 119.74 118.79 3cfa s LYS 188 Ca 0.20 -0.64 -0.30 0.00 -1.56 0.00 0.00 55.97 53.67 3cfa s LYS 188 Cb -0.11 -3.90 -0.06 0.00 -1.46 0.00 0.00 37.83 32.30 3cfa s LYS 188 CO 0.12 -0.72 1.08 -1.64 0.16 0.00 0.00 175.35 174.36 3cfa s MET 189 N 2.06 4.55 0.56 4.03 -1.94 -1.26 -4.71 119.30 122.59 3cfa s MET 189 Ca 0.11 1.62 -0.19 0.00 -1.71 0.00 0.00 55.69 55.52 3cfa s MET 189 Cb -0.17 -3.36 -0.05 0.00 2.01 0.00 0.00 34.83 33.26 3cfa s MET 189 CO 0.13 -0.04 1.14 -1.25 -0.01 0.00 0.00 175.02 174.98 3cfa s PRO 190 N 0.49 3.24 0.95 2.03 0.04 -1.26 -4.90 135.00 135.58 3cfa s PRO 190 Ca 0.53 1.61 -0.14 0.00 0.04 0.00 0.00 61.00 63.04 3cfa s PRO 190 Cb -0.26 -1.99 0.16 0.00 0.04 0.00 0.00 34.50 32.45 3cfa s PRO 190 CO 0.31 -0.94 1.16 -1.21 0.04 0.00 0.00 177.00 176.35 3cfa s GLU 191 N -3.40 0.79 0.04 4.56 0.41 -1.26 -4.53 118.70 115.31 3cfa s GLU 191 Ca 0.73 0.14 -0.37 0.00 -0.41 0.00 0.00 54.97 55.06 3cfa s GLU 191 Cb -0.24 -1.81 -0.17 0.00 -1.78 0.00 0.00 34.13 30.13 3cfa s GLU 191 CO 0.29 -2.41 1.40 0.34 -0.49 0.00 0.00 175.26 174.40 3cfa n PHE 192 N -3.88 1.59 -3.91 1.61 7.35 -1.26 -4.79 117.46 114.17 3cfa n PHE 192 Ca 0.09 0.62 -0.12 0.00 -0.76 0.00 0.00 57.45 57.28 3cfa n PHE 192 Cb 0.59 -2.35 0.00 0.00 0.35 0.00 0.00 39.48 38.07 3cfa n PHE 192 CO 0.00 0.00 0.00 -2.39 -0.76 0.00 0.00 176.76 173.61 3cfa n HIS 193 N 2.92 -1.94 -4.51 -5.13 1.44 -0.73 -4.94 115.22 102.32 3cfa n HIS 193 Ca 0.19 -2.08 -0.29 0.00 -2.01 0.00 0.00 57.72 53.53 3cfa n HIS 193 Cb 0.18 0.75 -0.13 0.00 0.12 0.00 0.00 29.99 30.91 3cfa n HIS 193 CO 0.00 0.00 0.00 -0.06 -2.81 0.00 0.00 176.34 173.47 3cfa s PHE 194 N -2.57 2.37 -0.16 -1.40 0.08 0.04 -1.43 117.98 114.91 3cfa s PHE 194 Ca 0.22 -0.36 0.01 0.00 0.12 0.00 0.00 56.93 56.92 3cfa s PHE 194 Cb -0.03 -1.32 0.02 0.00 -0.57 0.00 0.00 43.02 41.12 3cfa s PHE 194 CO 0.16 0.29 -0.18 -1.21 -0.10 0.00 0.00 175.22 174.19 3cfa s GLU 195 N -1.84 2.70 -0.06 0.44 2.02 0.53 -0.57 118.70 121.91 3cfa s GLU 195 Ca 0.14 -0.72 -0.21 0.00 0.02 0.00 0.00 54.97 54.20 3cfa s GLU 195 Cb -0.10 -2.35 -0.04 0.00 0.10 0.00 0.00 34.13 31.73 3cfa s GLU 195 CO 0.06 -0.20 0.61 -0.51 0.02 0.00 0.00 175.26 175.24 3cfa s ASP 196 N 1.31 6.90 -0.01 -0.19 1.01 0.38 -0.33 116.67 125.72 3cfa s ASP 196 Ca 0.03 1.07 0.05 0.00 0.71 0.00 0.00 52.55 54.42 3cfa s ASP 196 Cb -0.13 -2.36 -0.01 0.00 1.01 0.00 0.00 42.92 41.42 3cfa s ASP 196 CO -0.11 -0.02 -0.17 -1.00 0.21 0.00 0.00 175.17 174.08 3cfa s HIS 197 N 0.48 1.51 -0.09 4.23 3.76 0.51 -1.66 115.29 124.03 3cfa s HIS 197 Ca 0.32 -0.29 0.00 0.00 -0.15 0.00 0.00 55.06 54.95 3cfa s HIS 197 Cb -0.17 -0.97 0.02 0.00 1.11 0.00 0.00 32.58 32.57 3cfa s HIS 197 CO 0.16 -0.03 -0.07 0.50 -0.85 0.00 0.00 174.74 174.45 3cfa s ARG 198 N -0.38 1.34 -0.14 1.40 3.52 -0.64 -0.47 118.95 123.58 3cfa s ARG 198 Ca 0.06 -0.22 0.01 0.00 -0.13 0.00 0.00 55.73 55.46 3cfa s ARG 198 Cb -0.07 -1.35 -0.00 0.00 -1.56 0.00 0.00 34.95 31.97 3cfa s ARG 198 CO -0.01 -0.18 -0.17 0.42 -0.81 0.00 0.00 175.30 174.55 3cfa s ILE 199 N 1.41 2.52 -0.08 4.11 1.01 -1.26 -2.07 121.20 126.84 3cfa s ILE 199 Ca -0.02 -0.83 0.02 0.00 0.00 0.00 0.00 60.65 59.83 3cfa s ILE 199 Cb -0.13 -2.04 0.01 0.00 0.01 0.00 0.00 42.46 40.31 3cfa s ILE 199 CO -0.04 0.53 -0.13 -1.61 0.00 0.00 0.00 174.94 173.68 3cfa s GLU 200 N 0.69 1.89 -0.07 2.79 2.02 -0.09 -4.46 118.70 121.48 3cfa s GLU 200 Ca -0.08 -0.47 0.05 0.00 0.02 0.00 0.00 54.97 54.49 3cfa s GLU 200 Cb -0.16 -1.57 -0.01 0.00 0.10 0.00 0.00 34.13 32.50 3cfa s GLU 200 CO 0.02 0.01 -0.23 0.08 0.02 0.00 0.00 175.26 175.15 3cfa s VAL 201 N 0.75 1.94 -0.16 2.63 1.01 -1.26 -0.68 120.40 124.63 3cfa s VAL 201 Ca -0.13 -0.98 -0.02 0.00 0.00 0.00 0.00 61.98 60.85 3cfa s VAL 201 Cb -0.16 -1.65 -0.02 0.00 0.00 0.00 0.00 36.38 34.55 3cfa s VAL 201 CO 0.03 0.54 -0.08 -0.54 0.00 0.00 0.00 175.10 175.05 3cfa s LYS 202 N 0.03 3.49 -0.61 2.72 3.01 0.27 -4.98 119.74 123.67 3cfa s LYS 202 Ca -0.08 -0.61 -0.23 0.00 -1.01 0.00 0.00 55.97 54.04 3cfa s LYS 202 Cb -0.15 -2.82 0.06 0.00 -1.01 0.00 0.00 37.83 33.91 3cfa s LYS 202 CO 0.05 0.13 0.92 -2.00 0.51 0.00 0.00 175.35 174.96 3cfa s GLU 203 N 0.61 3.18 -0.07 1.68 2.12 -1.26 -1.05 118.70 123.92 3cfa s GLU 203 Ca -0.05 -0.66 -0.26 0.00 0.36 0.00 0.00 54.97 54.37 3cfa s GLU 203 Cb -0.15 -4.16 -0.23 0.00 0.26 0.00 0.00 34.13 29.85 3cfa s GLU 203 CO 0.03 -1.64 1.01 0.28 -0.54 0.00 0.00 175.26 174.39 3cfa h VAL 204 N 5.98 1.58 -3.41 3.70 2.07 -1.37 -3.44 116.25 121.36 3cfa h VAL 204 Ca -0.28 -1.87 -0.49 0.00 0.82 0.00 0.00 66.70 64.88 3cfa h VAL 204 Cb 1.07 2.80 -0.34 0.00 -1.52 0.00 0.00 31.29 33.31 3cfa h VAL 204 CO 1.13 0.50 -0.80 -1.58 0.02 0.00 0.00 177.57 176.84 3cfa s GLN 205 N -3.13 1.46 -0.49 1.57 0.74 -0.84 -4.96 119.66 114.00 3cfa s GLN 205 Ca -0.17 -0.32 -0.42 0.00 0.05 0.00 0.00 55.36 54.51 3cfa s GLN 205 Cb -0.00 -1.27 -0.18 0.00 1.10 0.00 0.00 33.01 32.66 3cfa s GLN 205 CO 0.71 -0.03 2.17 1.63 -0.55 0.00 0.00 175.29 179.23 3cfa n LYS 206 N 3.98 0.19 -1.25 1.67 4.76 -1.26 -1.02 118.16 125.22 3cfa n LYS 206 Ca -0.22 0.05 -0.09 0.00 -2.87 0.00 0.00 58.31 55.18 3cfa n LYS 206 Cb 0.51 -1.67 -0.04 0.00 -1.84 0.00 0.00 35.03 31.99 3cfa n LYS 206 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3cfa n GLY 207 N 7.29 0.94 1.45 0.72 0.00 -1.26 -4.76 105.19 109.57 3cfa n GLY 207 Ca 0.53 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.40 3cfa n GLY 207 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3cfa n LYS 208 N -1.40 0.00 -4.70 1.61 4.76 -0.19 -5.08 118.16 113.16 3cfa n LYS 208 Ca -0.09 0.00 -0.27 0.00 -2.87 0.00 0.00 58.31 55.08 3cfa n LYS 208 Cb 0.46 -0.26 -0.17 0.00 -1.84 0.00 0.00 35.03 33.22 3cfa n LYS 208 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 3cfa s HIS 209 N -1.96 1.80 0.06 2.13 3.76 -0.72 -4.96 115.29 115.40 3cfa s HIS 209 Ca 0.00 -0.73 0.03 0.00 -0.15 0.00 0.00 55.06 54.22 3cfa s HIS 209 Cb 0.00 -1.28 -0.03 0.00 1.11 0.00 0.00 32.58 32.38 3cfa s HIS 209 CO 0.00 -0.35 -0.10 0.71 -0.85 0.00 0.00 174.74 174.15 3cfa s TYR 210 N 0.66 0.91 -0.05 1.40 2.02 -1.26 -0.89 117.35 120.14 3cfa s TYR 210 Ca -0.14 -0.51 0.07 0.00 -0.37 0.00 0.00 57.07 56.12 3cfa s TYR 210 Cb -0.16 -0.52 -0.01 0.00 -0.40 0.00 0.00 41.96 40.86 3cfa s TYR 210 CO 0.04 -0.03 -0.25 -1.21 -1.57 0.00 0.00 175.55 172.53 3cfa s GLU 211 N -1.80 2.41 -0.06 -0.62 2.02 -0.21 -4.92 118.70 115.52 3cfa s GLU 211 Ca -0.05 -0.90 0.02 0.00 0.02 0.00 0.00 54.97 54.05 3cfa s GLU 211 Cb -0.09 -2.11 0.02 0.00 0.10 0.00 0.00 34.13 32.05 3cfa s GLU 211 CO 0.01 0.42 -0.10 -1.14 0.02 0.00 0.00 175.26 174.47 3cfa s GLN 212 N -0.28 1.44 -0.07 1.61 0.74 -1.26 -0.57 119.66 121.27 3cfa s GLN 212 Ca -0.00 -0.32 0.02 0.00 0.05 0.00 0.00 55.36 55.11 3cfa s GLN 212 Cb -0.13 -1.24 -0.02 0.00 1.10 0.00 0.00 33.01 32.72 3cfa s GLN 212 CO 0.02 -0.01 -0.13 -0.47 -0.55 0.00 0.00 175.29 174.15 3cfa s TYR 213 N 0.76 2.75 -0.00 1.67 5.04 0.14 -4.98 117.35 122.73 3cfa s TYR 213 Ca -0.13 -0.28 0.02 0.00 -2.44 0.00 0.00 57.07 54.24 3cfa s TYR 213 Cb -0.15 -1.70 -0.01 0.00 0.35 0.00 0.00 41.96 40.45 3cfa s TYR 213 CO 0.02 0.08 -0.08 -2.00 -1.34 0.00 0.00 175.55 172.24 3cfa s GLU 214 N -0.43 0.60 -0.02 4.97 2.12 -1.26 -0.91 118.70 123.77 3cfa s GLU 214 Ca 0.05 -0.30 0.07 0.00 0.36 0.00 0.00 54.97 55.16 3cfa s GLU 214 Cb -0.12 -0.57 -0.02 0.00 0.26 0.00 0.00 34.13 33.68 3cfa s GLU 214 CO 0.02 0.15 -0.25 0.00 -0.54 0.00 0.00 175.26 174.65 3cfa s ALA 215 N -0.25 2.22 -0.02 6.30 0.00 -0.88 -5.00 121.76 124.13 3cfa s ALA 215 Ca 0.02 -1.10 -0.01 0.00 0.00 0.00 0.00 51.96 50.87 3cfa s ALA 215 Cb -0.03 -0.60 0.02 0.00 0.00 0.00 0.00 23.12 22.50 3cfa s ALA 215 CO -0.00 0.53 0.04 0.00 0.00 0.00 0.00 175.76 176.33 3cfa s ALA 216 N -0.62 -0.05 -0.05 0.00 0.00 -1.26 -1.61 121.76 118.17 3cfa s ALA 216 Ca 0.10 0.22 0.00 0.00 0.00 0.00 0.00 51.96 52.29 3cfa s ALA 216 Cb -0.10 -0.16 0.02 0.00 0.00 0.00 0.00 23.12 22.88 3cfa s ALA 216 CO -0.01 -0.06 -0.02 0.08 0.00 0.00 0.00 175.76 175.75 3cfa s VAL 217 N 0.47 0.38 -0.19 0.00 1.01 -0.66 -1.95 120.40 119.46 3cfa s VAL 217 Ca -0.04 0.01 -0.09 0.00 0.00 0.00 0.00 61.98 61.86 3cfa s VAL 217 Cb -0.05 -0.46 -0.05 0.00 0.00 0.00 0.00 36.38 35.82 3cfa s VAL 217 CO -0.02 0.21 0.13 0.00 0.00 0.00 0.00 175.10 175.42 3cfa s ALA 218 N 1.22 3.70 0.22 5.51 0.00 0.32 -0.47 121.76 132.25 3cfa s ALA 218 Ca -0.07 -0.69 -0.18 0.00 0.00 0.00 0.00 51.96 51.03 3cfa s ALA 218 Cb -0.14 -2.12 0.03 0.00 0.00 0.00 0.00 23.12 20.89 3cfa s ALA 218 CO -0.02 0.24 0.56 -0.98 0.00 0.00 0.00 175.76 175.56 3cfa s ARG 219 N 0.13 1.47 0.00 0.00 1.70 0.26 -1.80 118.95 120.72 3cfa s ARG 219 Ca 0.09 -0.91 0.00 0.00 -0.47 0.00 0.00 55.73 54.44 3cfa s ARG 219 Cb -0.11 0.54 0.00 0.00 -0.57 0.00 0.00 34.95 34.80 3cfa s ARG 219 CO -0.01 -0.64 0.00 0.66 -1.08 0.00 0.00 175.30 174.24 3cfa n TYR 220 N -0.37 0.00 0.00 5.89 4.01 -1.26 -0.78 117.16 124.64 3cfa n TYR 220 Ca -0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.66 3cfa n TYR 220 Cb 0.62 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.65 3cfa n TYR 220 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 3cfa n ASP 222 N 0.00 0.00 -0.07 7.72 9.92 -1.26 -4.91 116.55 127.95 3cfa n ASP 222 Ca 0.00 0.00 -0.13 0.00 -0.53 0.00 0.00 54.79 54.13 3cfa n ASP 222 Cb 0.00 0.00 -0.06 0.00 -0.64 0.00 0.00 41.12 40.42 3cfa n ASP 222 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3cfa h ALA 223 N 0.00 0.29 -3.26 2.24 0.00 -2.04 -3.37 119.26 113.12 3cfa h ALA 223 Ca 0.00 -0.34 -0.68 0.00 0.00 0.00 0.00 54.91 53.89 3cfa h ALA 223 Cb 0.00 -0.06 -0.37 0.00 0.00 0.00 0.00 17.79 17.36 3cfa h ALA 223 CO 0.00 0.19 -0.51 0.00 0.00 0.00 0.00 179.25 178.93 3cfa s ALA 224 N -4.38 3.33 0.57 0.00 0.00 -1.26 -5.10 121.76 114.92 3cfa s ALA 224 Ca -0.14 -2.98 -0.10 0.00 0.00 0.00 0.00 51.96 48.75 3cfa s ALA 224 Cb 0.06 -2.42 -0.04 0.00 0.00 0.00 0.00 23.12 20.72 3cfa s ALA 224 CO 0.77 -1.96 0.96 -1.25 0.00 0.00 0.00 175.76 174.29 3cfa s PRO 225 N 0.34 3.61 0.50 0.00 0.04 -1.26 -5.06 135.00 133.18 3cfa s PRO 225 Ca 0.14 0.62 -0.09 0.00 0.04 0.00 0.00 61.00 61.71 3cfa s PRO 225 Cb -0.22 -2.16 -0.05 0.00 0.04 0.00 0.00 34.50 32.11 3cfa s PRO 225 CO -0.04 -0.45 0.86 0.45 0.04 0.00 0.00 177.00 177.87 3cfa s SER 226 N -4.06 6.34 -0.19 6.66 0.15 -1.26 -5.01 113.70 116.33 3cfa s SER 226 Ca 0.53 1.15 0.10 0.00 0.70 0.00 0.00 55.95 58.43 3cfa s SER 226 Cb -0.11 -2.34 -0.22 0.00 -1.71 0.00 0.00 66.02 61.64 3cfa s SER 226 CO 0.50 -0.62 0.09 0.29 1.20 0.00 0.00 173.24 174.69 3cfa n LYS 227 N -2.13 0.68 0.00 5.44 5.02 -1.26 -4.63 118.16 121.28 3cfa n LYS 227 Ca 0.03 0.11 0.14 0.00 -2.02 0.00 0.00 58.31 56.57 3cfa n LYS 227 Cb 0.54 -1.58 0.64 0.00 -0.02 0.00 0.00 35.03 34.62 3cfa n LYS 227 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3cfa n LEU 228 N -3.02 0.77 0.00 -0.35 4.77 -1.26 -4.93 117.00 112.98 3cfa n LEU 228 Ca -0.35 -0.20 0.00 0.00 -0.03 0.00 0.00 56.01 55.43 3cfa n LEU 228 Cb 1.08 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 42.11 3cfa n LEU 228 CO 0.38 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 3cfa n GLY 229 N 1.18 0.76 3.96 -0.72 0.00 -1.26 -5.09 105.19 104.02 3cfa n GLY 229 Ca 0.18 -0.63 -0.22 0.00 0.00 0.00 0.00 46.02 45.35 3cfa n GLY 229 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3cfa s HIS 230 N -2.00 3.10 -2.00 1.61 5.04 -1.26 -5.13 115.29 114.65 3cfa s HIS 230 Ca 0.00 0.15 0.09 0.00 -1.54 0.00 0.00 55.06 53.76 3cfa s HIS 230 Cb 0.00 -2.46 0.54 0.00 0.04 0.00 0.00 32.58 30.70 3cfa s HIS 230 CO 0.00 -0.53 0.99 0.72 -2.34 0.00 0.00 174.74 173.57