#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cfh n LYS 67 N 0.00 0.28 0.19 -1.46 4.76 -1.26 -1.88 118.16 118.79 3cfh n LYS 67 Ca 0.00 0.09 0.06 0.00 -2.87 0.00 0.00 58.31 55.58 3cfh n LYS 67 Cb 0.00 -1.50 0.31 0.00 -1.84 0.00 0.00 35.03 32.00 3cfh n LYS 67 CO 0.00 0.00 0.00 1.15 -1.37 0.00 0.00 177.40 177.18 3cfh h THR 68 N 0.00 0.84 -2.77 -0.18 2.02 -2.03 -3.37 112.91 107.42 3cfh h THR 68 Ca 0.00 -1.57 -0.79 0.00 0.77 0.00 0.00 66.41 64.82 3cfh h THR 68 Cb 0.22 1.97 -0.25 0.00 -1.74 0.00 0.00 68.15 68.35 3cfh h THR 68 CO 0.00 0.37 0.95 0.49 0.37 0.00 0.00 175.52 177.69 3cfh n PHE 69 N -3.47 3.26 -4.35 3.16 3.72 -0.79 -4.88 117.46 114.11 3cfh n PHE 69 Ca 0.00 -2.98 -0.19 0.00 -0.05 0.00 0.00 57.45 54.23 3cfh n PHE 69 Cb 0.53 -1.54 -0.15 0.00 -0.94 0.00 0.00 39.48 37.38 3cfh n PHE 69 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 3cfh s ILE 70 N -1.64 0.72 -0.42 4.37 1.01 -1.26 -4.49 121.20 119.48 3cfh s ILE 70 Ca 0.33 -0.34 -0.24 0.00 0.00 0.00 0.00 60.65 60.40 3cfh s ILE 70 Cb 0.02 -0.63 0.02 0.00 0.01 0.00 0.00 42.46 41.87 3cfh s ILE 70 CO 0.04 0.22 0.82 -0.75 0.00 0.00 0.00 174.94 175.27 3cfh s LYS 71 N 0.09 3.56 -0.23 2.79 2.20 -0.66 -4.93 119.74 122.56 3cfh s LYS 71 Ca -0.01 0.11 -0.16 0.00 -0.36 0.00 0.00 55.97 55.55 3cfh s LYS 71 Cb -0.07 -3.89 -0.04 0.00 -1.51 0.00 0.00 37.83 32.32 3cfh s LYS 71 CO 0.00 -1.06 0.40 0.71 -0.36 0.00 0.00 175.35 175.04 3cfh s TYR 72 N 3.35 3.32 0.46 4.03 1.51 -1.26 -0.48 117.35 128.28 3cfh s TYR 72 Ca 0.32 0.55 0.07 0.00 -1.01 0.00 0.00 57.07 57.00 3cfh s TYR 72 Cb -0.12 -2.55 -0.01 0.00 -0.11 0.00 0.00 41.96 39.17 3cfh s TYR 72 CO 0.22 -0.10 0.36 0.14 -1.11 0.00 0.00 175.55 175.05 3cfh s VAL 73 N 1.64 2.29 -1.90 0.71 -7.23 -0.79 -4.73 120.40 110.39 3cfh s VAL 73 Ca 0.18 -1.45 0.00 0.00 -1.81 0.00 0.00 61.98 58.90 3cfh s VAL 73 Cb -0.15 -2.74 0.00 0.00 0.56 0.00 0.00 36.38 34.05 3cfh s VAL 73 CO 0.09 0.00 0.00 -1.20 -0.31 0.00 0.00 175.10 173.68 3cfh n SER 74 N -1.56 -5.07 -0.82 4.85 7.64 -1.26 -2.48 113.62 114.91 3cfh n SER 74 Ca 0.01 0.36 -0.10 0.00 1.01 0.00 0.00 58.87 60.15 3cfh n SER 74 Cb 0.63 -4.45 -0.04 0.00 -1.01 0.00 0.00 64.21 59.34 3cfh n SER 74 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3cfh n GLY 75 N -0.50 1.08 3.69 0.23 0.00 -1.26 -4.98 105.19 103.45 3cfh n GLY 75 Ca -0.20 -0.55 -0.42 0.00 0.00 0.00 0.00 46.02 44.85 3cfh n GLY 75 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3cfh s ILE 76 N -2.39 3.32 0.42 -0.61 1.01 -1.03 -4.97 121.20 116.94 3cfh s ILE 76 Ca 0.00 0.75 -0.26 0.00 0.00 0.00 0.00 60.65 61.14 3cfh s ILE 76 Cb 0.00 -3.48 -0.10 0.00 0.01 0.00 0.00 42.46 38.89 3cfh s ILE 76 CO 0.00 -0.00 1.34 -2.65 0.00 0.00 0.00 174.94 173.63 3cfh n PRO 77 N 5.44 2.11 -3.41 2.79 -0.02 -1.26 -4.83 135.00 135.83 3cfh n PRO 77 Ca 0.15 0.75 -0.45 0.00 -2.02 0.00 0.00 63.50 61.93 3cfh n PRO 77 Cb 0.42 -2.48 -0.04 0.00 -0.02 0.00 0.00 33.50 31.38 3cfh n PRO 77 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3cfh s ASP 78 N -0.46 6.43 0.39 2.55 -1.08 -1.26 -4.55 116.67 118.70 3cfh s ASP 78 Ca 0.60 -2.69 0.16 0.00 -0.52 0.00 0.00 52.55 50.10 3cfh s ASP 78 Cb -0.49 -2.14 1.05 0.00 -1.46 0.00 0.00 42.92 39.88 3cfh s ASP 78 CO 0.59 -0.54 1.80 0.22 0.52 0.00 0.00 175.17 177.75 3cfh h TYR 79 N 7.67 0.67 0.00 -5.34 3.20 -1.93 -0.76 116.97 120.49 3cfh h TYR 79 Ca 0.07 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.95 3cfh h TYR 79 Cb 1.03 -0.20 -0.00 0.00 1.54 0.00 0.00 36.73 39.09 3cfh h TYR 79 CO 0.96 0.12 -0.02 0.74 -1.64 0.00 0.00 178.16 178.32 3cfh h PHE 80 N 0.45 0.00 -0.25 -3.82 0.04 -1.91 -3.12 116.94 108.33 3cfh h PHE 80 Ca 0.55 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 61.27 3cfh h PHE 80 Cb 1.31 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.45 3cfh h PHE 80 CO -0.00 0.84 -0.05 0.87 -0.60 0.00 0.00 178.31 179.36 3cfh h LYS 81 N -1.00 0.39 0.00 1.51 1.57 -1.84 -1.58 116.57 115.62 3cfh h LYS 81 Ca -0.00 -0.08 -0.00 0.00 -1.87 0.00 0.00 60.65 58.69 3cfh h LYS 81 Cb 0.84 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 33.09 3cfh h LYS 81 CO -0.00 0.46 -0.02 1.96 -0.57 0.00 0.00 179.45 181.28 3cfh h GLN 82 N 0.37 0.00 0.00 3.15 4.20 -1.23 -3.18 115.11 118.43 3cfh h GLN 82 Ca 0.08 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.79 3cfh h GLN 82 Cb 0.33 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.11 3cfh h GLN 82 CO 0.01 0.02 -0.21 0.77 -0.67 0.00 0.00 178.83 178.76 3cfh h SER 83 N 0.00 0.00 -4.15 1.46 0.02 -1.21 -3.46 113.55 106.21 3cfh h SER 83 Ca -0.00 -0.02 -0.47 0.00 -0.84 0.00 0.00 61.79 60.46 3cfh h SER 83 Cb 0.17 0.00 0.02 0.00 0.14 0.00 0.00 62.40 62.72 3cfh h SER 83 CO 0.00 0.01 0.37 -0.36 -1.14 0.00 0.00 176.83 175.71 3cfh s PHE 84 N -3.20 3.29 -0.25 3.45 0.08 -1.20 -1.16 117.98 118.99 3cfh s PHE 84 Ca 0.07 1.52 0.28 0.00 0.12 0.00 0.00 56.93 58.92 3cfh s PHE 84 Cb 0.09 -2.87 0.89 0.00 -0.57 0.00 0.00 43.02 40.55 3cfh s PHE 84 CO 0.67 -0.49 1.79 -1.00 -0.10 0.00 0.00 175.22 176.10 3cfh h PRO 85 N 1.14 0.00 -0.57 0.24 0.13 -1.91 -3.45 132.00 127.57 3cfh h PRO 85 Ca -0.48 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.72 3cfh h PRO 85 Cb 1.19 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.27 3cfh h PRO 85 CO 0.60 0.00 0.27 0.93 -0.23 0.00 0.00 178.00 179.57 3cfh h GLU 86 N 0.00 0.49 0.00 0.86 3.07 -1.89 -3.36 114.58 113.75 3cfh h GLU 86 Ca 0.00 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.83 3cfh h GLU 86 Cb 0.70 -0.11 0.00 0.00 -0.84 0.00 0.00 28.75 28.50 3cfh h GLU 86 CO 0.00 0.32 0.00 0.41 -1.40 0.00 0.00 179.01 178.34 3cfh n GLY 87 N -1.27 -1.82 3.66 -3.84 0.00 -0.31 -4.69 105.19 96.93 3cfh n GLY 87 Ca 0.07 -1.93 -0.09 0.00 0.00 0.00 0.00 46.02 44.07 3cfh n GLY 87 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3cfh s PHE 88 N 0.00 0.06 0.25 1.61 -0.12 -0.90 -1.50 117.98 117.38 3cfh s PHE 88 Ca 0.00 -0.45 0.10 0.00 -0.05 0.00 0.00 56.93 56.53 3cfh s PHE 88 Cb 0.00 0.41 -0.05 0.00 -0.63 0.00 0.00 43.02 42.75 3cfh s PHE 88 CO 0.00 -1.05 -0.17 0.95 -0.05 0.00 0.00 175.22 174.90 3cfh s THR 89 N -3.95 2.14 0.06 -4.49 -4.23 0.31 -0.47 115.64 105.01 3cfh s THR 89 Ca 0.15 -2.31 0.01 0.00 -1.18 0.00 0.00 61.69 58.36 3cfh s THR 89 Cb -0.02 -2.21 -0.03 0.00 1.34 0.00 0.00 72.50 71.57 3cfh s THR 89 CO 0.05 -0.47 -0.05 -1.66 -0.54 0.00 0.00 174.62 171.95 3cfh s TRP 90 N -2.72 0.66 -0.00 3.99 1.48 -0.60 -0.40 118.94 121.34 3cfh s TRP 90 Ca 0.27 -0.82 -0.00 0.00 -1.06 0.00 0.00 56.10 54.48 3cfh s TRP 90 Cb -0.03 -0.41 -0.00 0.00 -1.16 0.00 0.00 33.47 31.87 3cfh s TRP 90 CO 0.12 -0.21 0.01 -1.83 -4.06 0.00 0.00 176.95 170.98 3cfh s GLU 91 N -3.09 0.07 -0.14 3.25 -1.05 -0.54 -0.68 118.70 116.52 3cfh s GLU 91 Ca 0.02 -0.08 -0.17 0.00 -0.15 0.00 0.00 54.97 54.58 3cfh s GLU 91 Cb 0.01 0.03 0.04 0.00 -0.44 0.00 0.00 34.13 33.77 3cfh s GLU 91 CO -0.05 -0.01 0.46 0.50 0.95 0.00 0.00 175.26 177.12 3cfh s ARG 92 N -0.24 0.62 -0.12 -4.83 3.52 -0.31 -1.29 118.95 116.30 3cfh s ARG 92 Ca -0.03 0.48 0.03 0.00 -0.13 0.00 0.00 55.73 56.07 3cfh s ARG 92 Cb -0.02 0.30 0.01 0.00 -1.56 0.00 0.00 34.95 33.68 3cfh s ARG 92 CO -0.00 -0.11 -0.20 0.99 -0.81 0.00 0.00 175.30 175.17 3cfh s THR 93 N -0.15 1.84 -0.25 4.11 2.01 -0.81 -0.91 115.64 121.48 3cfh s THR 93 Ca -0.03 -0.86 -0.08 0.00 0.31 0.00 0.00 61.69 61.02 3cfh s THR 93 Cb -0.03 -1.64 -0.04 0.00 0.01 0.00 0.00 72.50 70.80 3cfh s THR 93 CO 0.02 0.51 0.11 -0.89 -0.69 0.00 0.00 174.62 173.68 3cfh s THR 94 N 0.74 4.67 -0.25 -0.82 2.01 0.53 -1.56 115.64 120.96 3cfh s THR 94 Ca -0.10 -0.05 -0.09 0.00 0.31 0.00 0.00 61.69 61.75 3cfh s THR 94 Cb -0.16 -3.19 -0.04 0.00 0.01 0.00 0.00 72.50 69.12 3cfh s THR 94 CO 0.01 0.32 0.13 0.42 -0.69 0.00 0.00 174.62 174.82 3cfh s THR 95 N 1.55 5.01 0.09 -0.82 -4.23 -0.25 -0.94 115.64 116.03 3cfh s THR 95 Ca 0.06 0.06 -0.11 0.00 -1.18 0.00 0.00 61.69 60.52 3cfh s THR 95 Cb -0.15 -3.34 -0.06 0.00 1.34 0.00 0.00 72.50 70.29 3cfh s THR 95 CO 0.06 0.33 0.43 -0.31 -0.54 0.00 0.00 174.62 174.58 3cfh s TYR 96 N 1.32 3.59 0.18 3.99 2.02 0.39 -1.11 117.35 127.73 3cfh s TYR 96 Ca 0.06 0.84 0.35 0.00 -0.37 0.00 0.00 57.07 57.96 3cfh s TYR 96 Cb -0.15 -2.20 1.63 0.00 -0.40 0.00 0.00 41.96 40.85 3cfh s TYR 96 CO 0.06 0.51 2.05 1.05 -1.57 0.00 0.00 175.55 177.64 3cfh h GLU 97 N 3.73 0.00 -0.65 -0.62 4.11 -1.53 -1.41 114.58 118.20 3cfh h GLU 97 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.94 3cfh h GLU 97 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 3cfh h GLU 97 CO 0.66 0.00 0.00 -0.40 0.07 0.00 0.00 179.01 179.34 3cfh n ASP 98 N -2.92 3.66 0.00 3.06 5.75 -1.26 -4.93 116.55 119.90 3cfh n ASP 98 Ca -0.00 -2.08 0.00 0.00 -0.01 0.00 0.00 54.79 52.70 3cfh n ASP 98 Cb 0.21 -0.46 0.00 0.00 -1.03 0.00 0.00 41.12 39.84 3cfh n ASP 98 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3cfh n GLY 99 N 1.44 0.59 3.78 6.12 0.00 -0.53 -4.59 105.19 112.01 3cfh n GLY 99 Ca 0.22 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.90 3cfh n GLY 99 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3cfh s GLY 100 N -1.56 2.55 -0.03 -0.02 0.00 -1.22 -4.57 107.32 102.47 3cfh s GLY 100 Ca 0.00 0.71 0.03 0.00 0.00 0.00 0.00 44.72 45.46 3cfh s GLY 100 CO 0.00 1.05 -0.12 -1.36 0.00 0.00 0.00 173.10 172.67 3cfh s PHE 101 N -1.90 1.21 -0.19 1.90 0.08 -0.18 -0.46 117.98 118.44 3cfh s PHE 101 Ca 0.70 -0.31 -0.01 0.00 0.12 0.00 0.00 56.93 57.44 3cfh s PHE 101 Cb -0.20 -0.83 0.05 0.00 -0.57 0.00 0.00 43.02 41.47 3cfh s PHE 101 CO 0.25 -0.10 -0.04 -1.17 -0.10 0.00 0.00 175.22 174.06 3cfh s LEU 102 N 0.05 1.82 -0.09 -0.37 1.98 -0.12 -1.03 118.68 120.93 3cfh s LEU 102 Ca -0.02 -0.84 -0.00 0.00 -2.89 0.00 0.00 54.13 50.38 3cfh s LEU 102 Cb -0.09 -0.94 -0.03 0.00 0.66 0.00 0.00 46.19 45.80 3cfh s LEU 102 CO 0.01 -0.22 -0.06 -0.89 -1.89 0.00 0.00 176.35 173.30 3cfh s THR 103 N 1.60 3.78 -0.01 3.68 2.01 0.67 -0.35 115.64 127.03 3cfh s THR 103 Ca -0.01 -0.44 -0.01 0.00 0.31 0.00 0.00 61.69 61.53 3cfh s THR 103 Cb -0.17 -2.57 -0.00 0.00 0.01 0.00 0.00 72.50 69.77 3cfh s THR 103 CO -0.07 0.58 0.03 0.00 -0.69 0.00 0.00 174.62 174.46 3cfh s ALA 104 N -0.54 -0.06 -0.03 7.40 0.00 -0.08 -0.42 121.76 128.03 3cfh s ALA 104 Ca 0.08 -0.05 0.06 0.00 0.00 0.00 0.00 51.96 52.05 3cfh s ALA 104 Cb -0.12 -0.01 -0.01 0.00 0.00 0.00 0.00 23.12 22.98 3cfh s ALA 104 CO 0.02 -0.06 -0.22 -1.58 0.00 0.00 0.00 175.76 173.92 3cfh s HIS 105 N -0.37 2.05 -0.01 0.00 5.65 -0.51 -1.17 115.29 120.94 3cfh s HIS 105 Ca -0.04 -0.45 0.03 0.00 0.25 0.00 0.00 55.06 54.85 3cfh s HIS 105 Cb -0.03 -1.33 -0.01 0.00 -1.18 0.00 0.00 32.58 30.03 3cfh s HIS 105 CO -0.00 -0.08 -0.09 -1.14 -0.65 0.00 0.00 174.74 172.78 3cfh s GLN 106 N -0.40 0.76 -0.11 2.88 -0.44 0.15 -0.68 119.66 121.82 3cfh s GLN 106 Ca 0.05 -0.33 0.01 0.00 -2.50 0.00 0.00 55.36 52.59 3cfh s GLN 106 Cb -0.10 -0.74 -0.02 0.00 -1.64 0.00 0.00 33.01 30.52 3cfh s GLN 106 CO 0.00 0.19 -0.14 0.34 0.50 0.00 0.00 175.29 176.19 3cfh s ASP 107 N -0.19 3.96 -0.18 6.67 -1.08 0.10 -1.56 116.67 124.39 3cfh s ASP 107 Ca 0.03 -0.31 0.00 0.00 -0.52 0.00 0.00 52.55 51.75 3cfh s ASP 107 Cb -0.04 -1.45 0.01 0.00 -1.46 0.00 0.00 42.92 39.98 3cfh s ASP 107 CO -0.00 0.20 -0.16 -0.89 0.52 0.00 0.00 175.17 174.83 3cfh s THR 108 N 0.14 2.42 0.17 1.71 2.01 0.38 -1.37 115.64 121.10 3cfh s THR 108 Ca -0.07 -0.83 0.07 0.00 0.31 0.00 0.00 61.69 61.17 3cfh s THR 108 Cb -0.15 -2.03 -0.04 0.00 0.01 0.00 0.00 72.50 70.29 3cfh s THR 108 CO 0.05 0.51 -0.14 -0.94 -0.69 0.00 0.00 174.62 173.42 3cfh s SER 109 N 1.18 2.28 -0.32 3.53 1.04 -0.51 -2.12 113.70 118.78 3cfh s SER 109 Ca 0.02 -0.96 -0.06 0.00 0.48 0.00 0.00 55.95 55.44 3cfh s SER 109 Cb -0.14 -0.09 0.03 0.00 0.10 0.00 0.00 66.02 65.92 3cfh s SER 109 CO -0.07 -0.19 0.08 -0.22 0.98 0.00 0.00 173.24 173.81 3cfh s LEU 110 N -3.02 4.11 -0.59 2.42 2.96 -1.26 -0.36 118.68 122.94 3cfh s LEU 110 Ca 0.17 -1.07 -0.08 0.00 -0.22 0.00 0.00 54.13 52.93 3cfh s LEU 110 Cb -0.01 -1.84 0.15 0.00 0.50 0.00 0.00 46.19 44.99 3cfh s LEU 110 CO 0.04 -0.28 0.45 -0.62 -1.32 0.00 0.00 176.35 174.62 3cfh s ASP 111 N 1.39 5.74 1.02 3.68 2.15 -1.26 -4.94 116.67 124.45 3cfh s ASP 111 Ca -0.01 -2.37 0.00 0.00 0.43 0.00 0.00 52.55 50.59 3cfh s ASP 111 Cb -0.19 -1.99 0.00 0.00 -0.30 0.00 0.00 42.92 40.44 3cfh s ASP 111 CO 0.02 -0.56 0.00 0.61 -0.17 0.00 0.00 175.17 175.07 3cfh n GLY 112 N 4.25 1.57 2.80 2.66 0.00 -1.26 -4.73 105.19 110.48 3cfh n GLY 112 Ca 0.02 -0.03 -0.28 0.00 0.00 0.00 0.00 46.02 45.73 3cfh n GLY 112 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3cfh n ASP 113 N 9.68 2.50 -3.79 1.61 5.75 -1.26 -5.19 116.55 125.85 3cfh n ASP 113 Ca 0.00 -3.09 -0.13 0.00 -0.01 0.00 0.00 54.79 51.56 3cfh n ASP 113 Cb 0.00 -0.72 -0.14 0.00 -1.03 0.00 0.00 41.12 39.23 3cfh n ASP 113 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 3cfh s LEU 115 N -1.28 1.13 -0.18 -2.12 1.43 -1.26 -5.17 118.68 111.23 3cfh s LEU 115 Ca 0.27 0.21 -0.00 0.00 -1.03 0.00 0.00 54.13 53.58 3cfh s LEU 115 Cb -0.02 0.27 0.01 0.00 0.03 0.00 0.00 46.19 46.48 3cfh s LEU 115 CO -0.17 -0.10 -0.16 -0.69 0.23 0.00 0.00 176.35 175.46 3cfh s VAL 116 N 0.73 2.46 -0.16 -1.59 1.01 0.51 -4.95 120.40 118.40 3cfh s VAL 116 Ca -0.06 -0.82 -0.03 0.00 0.00 0.00 0.00 61.98 61.07 3cfh s VAL 116 Cb -0.08 -2.05 -0.03 0.00 0.00 0.00 0.00 36.38 34.23 3cfh s VAL 116 CO -0.03 0.51 -0.04 -0.31 0.00 0.00 0.00 175.10 175.23 3cfh s TYR 117 N 1.19 3.01 -0.18 5.22 2.02 -1.26 -1.42 117.35 125.92 3cfh s TYR 117 Ca 0.02 -0.33 0.01 0.00 -0.37 0.00 0.00 57.07 56.40 3cfh s TYR 117 Cb -0.14 -1.95 0.03 0.00 -0.40 0.00 0.00 41.96 39.50 3cfh s TYR 117 CO -0.07 -0.06 -0.15 0.15 -1.57 0.00 0.00 175.55 173.86 3cfh s LYS 118 N 0.38 2.42 -0.06 -0.62 1.02 -0.47 -4.98 119.74 117.44 3cfh s LYS 118 Ca -0.04 -0.77 0.06 0.00 0.02 0.00 0.00 55.97 55.23 3cfh s LYS 118 Cb -0.14 -2.38 -0.01 0.00 -0.52 0.00 0.00 37.83 34.78 3cfh s LYS 118 CO 0.03 -0.30 -0.24 0.14 -0.92 0.00 0.00 175.35 174.06 3cfh s VAL 119 N 1.38 1.95 -0.12 3.17 -7.23 -1.26 -0.72 120.40 117.56 3cfh s VAL 119 Ca 0.02 -1.01 0.01 0.00 -1.81 0.00 0.00 61.98 59.20 3cfh s VAL 119 Cb -0.14 -1.65 -0.01 0.00 0.56 0.00 0.00 36.38 35.13 3cfh s VAL 119 CO -0.10 0.54 -0.16 -0.54 -0.31 0.00 0.00 175.10 174.53 3cfh s LYS 120 N -0.11 3.31 -0.07 4.82 -0.14 0.14 -4.99 119.74 122.70 3cfh s LYS 120 Ca -0.04 -0.73 0.04 0.00 -1.36 0.00 0.00 55.97 53.88 3cfh s LYS 120 Cb -0.14 -2.55 -0.00 0.00 -1.68 0.00 0.00 37.83 33.46 3cfh s LYS 120 CO 0.04 0.21 -0.20 0.42 -0.76 0.00 0.00 175.35 175.06 3cfh s ILE 121 N 0.34 1.68 -0.14 2.17 -1.09 -1.26 -1.42 121.20 121.48 3cfh s ILE 121 Ca -0.13 -0.82 -0.01 0.00 -2.23 0.00 0.00 60.65 57.45 3cfh s ILE 121 Cb -0.16 -1.45 0.04 0.00 -1.58 0.00 0.00 42.46 39.30 3cfh s ILE 121 CO 0.07 0.47 -0.02 -0.76 -1.23 0.00 0.00 174.94 173.47 3cfh s LEU 122 N 0.22 1.12 0.05 2.97 1.43 0.44 -5.01 118.68 119.91 3cfh s LEU 122 Ca -0.11 -0.47 0.09 0.00 -1.03 0.00 0.00 54.13 52.62 3cfh s LEU 122 Cb -0.15 -0.67 -0.03 0.00 0.03 0.00 0.00 46.19 45.37 3cfh s LEU 122 CO 0.05 -0.21 -0.26 -0.83 0.23 0.00 0.00 176.35 175.33 3cfh s GLY 123 N 1.81 1.43 0.22 -3.19 0.00 -1.26 -0.23 107.32 106.09 3cfh s GLY 123 Ca 0.02 -1.29 -0.18 0.00 0.00 0.00 0.00 44.72 43.27 3cfh s GLY 123 CO -0.07 -1.19 0.58 0.54 0.00 0.00 0.00 173.10 172.96 3cfh s ASN 124 N -1.34 -0.27 -1.02 1.64 2.20 -0.20 -4.96 114.94 110.99 3cfh s ASN 124 Ca 0.12 -0.53 0.00 0.00 -0.94 0.00 0.00 52.86 51.51 3cfh s ASN 124 Cb -0.10 0.62 0.00 0.00 -2.00 0.00 0.00 41.25 39.77 3cfh s ASN 124 CO 0.03 -1.14 0.00 0.59 -2.94 0.00 0.00 177.10 173.64 3cfh n ASN 125 N -0.38 -5.42 -4.70 3.54 3.02 -1.26 -1.01 115.26 109.04 3cfh n ASN 125 Ca -0.08 0.24 -0.42 0.00 -0.03 0.00 0.00 54.58 54.29 3cfh n ASN 125 Cb 0.62 -3.77 -0.03 0.00 -0.61 0.00 0.00 39.78 35.99 3cfh n ASN 125 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3cfh s PHE 126 N -1.94 2.87 0.36 3.10 0.08 -1.26 -3.40 117.98 117.79 3cfh s PHE 126 Ca 0.00 0.70 -0.29 0.00 0.12 0.00 0.00 56.93 57.47 3cfh s PHE 126 Cb 0.00 -3.78 -0.11 0.00 -0.57 0.00 0.00 43.02 38.56 3cfh s PHE 126 CO 0.00 -2.91 1.52 -2.14 -0.10 0.00 0.00 175.22 171.59 3cfh s PRO 127 N 1.96 4.10 0.41 0.24 0.02 -1.26 -4.89 135.00 135.58 3cfh s PRO 127 Ca 0.67 2.59 0.07 0.00 0.02 0.00 0.00 61.00 64.35 3cfh s PRO 127 Cb -0.36 -2.98 0.86 0.00 0.02 0.00 0.00 34.50 32.04 3cfh s PRO 127 CO 0.30 -0.57 2.05 0.00 -0.33 0.00 0.00 177.00 178.45 3cfh h ALA 128 N 3.49 1.72 -0.07 -1.55 0.00 -1.97 -2.23 119.26 118.65 3cfh h ALA 128 Ca -0.50 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.38 3cfh h ALA 128 Cb 1.23 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.86 3cfh h ALA 128 CO 0.68 0.25 0.00 -0.40 0.00 0.00 0.00 179.25 179.78 3cfh n ASP 129 N -4.47 1.97 -4.88 0.00 5.75 -1.26 -4.22 116.55 109.43 3cfh n ASP 129 Ca 0.04 -1.67 -0.30 0.00 -0.01 0.00 0.00 54.79 52.84 3cfh n ASP 129 Cb 0.08 -0.04 0.06 0.00 -1.03 0.00 0.00 41.12 40.18 3cfh n ASP 129 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 3cfh s GLY 130 N -1.89 1.62 0.56 6.12 0.00 -0.84 -4.84 107.32 108.06 3cfh s GLY 130 Ca 0.35 -0.38 0.26 0.00 0.00 0.00 0.00 44.72 44.95 3cfh s GLY 130 CO 0.31 0.02 2.19 -0.56 0.00 0.00 0.00 173.10 175.06 3cfh h PRO 131 N -0.75 0.00 0.16 2.90 0.13 -1.93 -1.09 132.00 131.43 3cfh h PRO 131 Ca -0.45 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.67 3cfh h PRO 131 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 3cfh h PRO 131 CO 0.64 0.03 -0.08 0.28 -0.23 0.00 0.00 178.00 178.64 3cfh h VAL 132 N 0.00 0.92 0.00 1.56 2.07 -1.93 0.28 116.25 119.16 3cfh h VAL 132 Ca -0.00 -1.04 -0.08 0.00 0.82 0.00 0.00 66.70 66.40 3cfh h VAL 132 Cb 0.08 1.49 -0.01 0.00 -1.52 0.00 0.00 31.29 31.33 3cfh h VAL 132 CO 0.00 0.22 -0.38 0.24 0.02 0.00 0.00 177.57 177.67 3cfh h MET 133 N -0.78 0.00 -0.00 1.57 2.86 -1.73 -2.70 114.93 114.15 3cfh h MET 133 Ca -0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 3cfh h MET 133 Cb 0.52 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.18 3cfh h MET 133 CO 0.04 0.38 -0.08 1.04 1.06 0.00 0.00 176.91 179.35 3cfh n GLN 134 N -3.31 0.58 -3.63 1.72 1.13 -0.42 -4.95 117.38 108.50 3cfh n GLN 134 Ca 0.01 -0.14 -0.23 0.00 -1.94 0.00 0.00 57.00 54.70 3cfh n GLN 134 Cb 0.61 -1.50 0.07 0.00 0.11 0.00 0.00 30.24 29.52 3cfh n GLN 134 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 3cfh n ASN 135 N -1.08 -4.21 -0.21 1.08 2.85 -0.88 -4.92 115.26 107.88 3cfh n ASN 135 Ca 0.14 -0.65 0.09 0.00 -0.11 0.00 0.00 54.58 54.06 3cfh n ASN 135 Cb 0.26 -4.71 0.16 0.00 1.24 0.00 0.00 39.78 36.73 3cfh n ASN 135 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 3cfh n LYS 136 N -4.62 1.37 -2.74 1.20 5.02 0.04 -5.04 118.16 113.38 3cfh n LYS 136 Ca -0.11 -2.77 -0.35 0.00 -2.02 0.00 0.00 58.31 53.07 3cfh n LYS 136 Cb 0.60 -1.53 -0.06 0.00 -0.02 0.00 0.00 35.03 34.02 3cfh n LYS 136 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3cfh s ALA 137 N -2.97 3.09 -0.23 7.82 0.00 -1.22 -4.17 121.76 124.09 3cfh s ALA 137 Ca 0.34 0.51 0.16 0.00 0.00 0.00 0.00 51.96 52.97 3cfh s ALA 137 Cb 0.30 -3.19 0.52 0.00 0.00 0.00 0.00 23.12 20.75 3cfh s ALA 137 CO 0.01 0.05 1.41 0.41 0.00 0.00 0.00 175.76 177.64 3cfh n GLY 138 N -0.04 3.96 0.00 0.00 0.00 0.96 -5.01 105.19 105.06 3cfh n GLY 138 Ca 0.05 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 45.07 3cfh n GLY 138 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cfh n GLY 139 N -0.45 0.10 3.90 -0.02 0.00 -1.26 -4.75 105.19 102.71 3cfh n GLY 139 Ca 0.21 -1.91 -0.32 0.00 0.00 0.00 0.00 46.02 43.99 3cfh n GLY 139 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3cfh s TRP 140 N -1.40 3.53 0.73 1.61 0.52 -1.26 -0.68 118.94 121.99 3cfh s TRP 140 Ca 0.00 0.41 -0.11 0.00 0.02 0.00 0.00 56.10 56.43 3cfh s TRP 140 Cb 0.00 -1.88 0.03 0.00 -1.15 0.00 0.00 33.47 30.47 3cfh s TRP 140 CO 0.00 0.57 1.07 -1.21 0.02 0.00 0.00 176.95 177.41 3cfh s GLU 141 N -2.24 2.61 0.86 4.98 0.41 -0.63 -4.78 118.70 119.91 3cfh s GLU 141 Ca 0.33 0.93 -0.11 0.00 -0.41 0.00 0.00 54.97 55.71 3cfh s GLU 141 Cb -0.13 -1.95 0.11 0.00 -1.78 0.00 0.00 34.13 30.38 3cfh s GLU 141 CO 0.23 -1.33 1.14 -2.14 -0.49 0.00 0.00 175.26 172.67 3cfh s PRO 142 N -5.04 1.41 0.15 0.39 0.02 -1.26 -4.72 135.00 125.95 3cfh s PRO 142 Ca 0.59 1.50 -0.04 0.00 0.02 0.00 0.00 61.00 63.07 3cfh s PRO 142 Cb -0.15 -1.78 -0.03 0.00 0.02 0.00 0.00 34.50 32.57 3cfh s PRO 142 CO 0.55 -2.33 0.15 0.20 -0.33 0.00 0.00 177.00 175.23 3cfh s GLY 143 N -2.74 0.86 -0.05 0.52 0.00 -0.31 -4.86 107.32 100.74 3cfh s GLY 143 Ca 0.67 -1.29 0.05 0.00 0.00 0.00 0.00 44.72 44.14 3cfh s GLY 143 CO 0.56 -1.18 -0.21 0.00 0.00 0.00 0.00 173.10 172.27 3cfh s GLU 145 N -0.01 2.57 -0.13 0.00 2.12 -0.00 -4.16 118.70 119.09 3cfh s GLU 145 Ca -0.05 -0.74 -0.09 0.00 0.36 0.00 0.00 54.97 54.45 3cfh s GLU 145 Cb -0.13 -2.35 -0.04 0.00 0.26 0.00 0.00 34.13 31.87 3cfh s GLU 145 CO 0.03 0.54 0.18 0.96 -0.54 0.00 0.00 175.26 176.44 3cfh s ILE 146 N -0.53 5.42 -0.02 -3.70 -4.36 0.11 -0.70 121.20 117.42 3cfh s ILE 146 Ca 0.07 0.30 0.03 0.00 -0.26 0.00 0.00 60.65 60.79 3cfh s ILE 146 Cb -0.11 -3.47 -0.00 0.00 1.25 0.00 0.00 42.46 40.12 3cfh s ILE 146 CO 0.01 0.55 -0.10 -0.76 0.24 0.00 0.00 174.94 174.89 3cfh s LEU 147 N -0.57 1.92 0.01 0.37 1.02 -0.22 -0.99 118.68 120.22 3cfh s LEU 147 Ca 0.14 -0.19 -0.28 0.00 0.02 0.00 0.00 54.13 53.83 3cfh s LEU 147 Cb -0.12 -0.54 0.09 0.00 0.02 0.00 0.00 46.19 45.63 3cfh s LEU 147 CO 0.03 0.10 0.75 -0.72 0.02 0.00 0.00 176.35 176.54 3cfh s TYR 148 N -0.06 -0.50 0.22 0.29 -0.85 -0.65 -1.59 117.35 114.20 3cfh s TYR 148 Ca 0.01 0.58 -0.30 0.00 -0.52 0.00 0.00 57.07 56.84 3cfh s TYR 148 Cb -0.06 0.49 -0.09 0.00 0.38 0.00 0.00 41.96 42.69 3cfh s TYR 148 CO -0.00 -0.63 1.24 -2.00 -1.52 0.00 0.00 175.55 172.64 3cfh s GLU 149 N -2.44 4.46 -0.07 -3.49 2.12 -1.26 -1.09 118.70 116.93 3cfh s GLU 149 Ca -0.02 1.97 -0.03 0.00 0.36 0.00 0.00 54.97 57.24 3cfh s GLU 149 Cb -0.01 -3.20 0.04 0.00 0.26 0.00 0.00 34.13 31.22 3cfh s GLU 149 CO -0.03 -0.12 0.16 0.54 -0.54 0.00 0.00 175.26 175.27 3cfh s VAL 150 N -0.25 -0.04 -1.73 3.70 0.11 -0.59 -4.89 120.40 116.71 3cfh s VAL 150 Ca 0.53 0.15 0.00 0.00 -2.93 0.00 0.00 61.98 59.73 3cfh s VAL 150 Cb -0.35 -0.26 0.00 0.00 -1.53 0.00 0.00 36.38 34.25 3cfh s VAL 150 CO 0.40 0.06 0.00 0.47 -3.33 0.00 0.00 175.10 172.70 3cfh n ASP 151 N 4.03 -5.57 -0.01 3.54 8.00 -1.26 -2.42 116.55 122.86 3cfh n ASP 151 Ca -0.24 0.05 -0.00 0.00 0.71 0.00 0.00 54.79 55.31 3cfh n ASP 151 Cb 0.53 -4.63 -0.00 0.00 -0.02 0.00 0.00 41.12 37.00 3cfh n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3cfh n GLY 152 N -0.96 0.47 3.50 0.44 0.00 -1.26 -5.03 105.19 102.35 3cfh n GLY 152 Ca -0.23 -0.16 -0.25 0.00 0.00 0.00 0.00 46.02 45.39 3cfh n GLY 152 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3cfh s VAL 153 N -1.97 0.71 -0.24 1.61 -7.23 -1.02 -4.77 120.40 107.49 3cfh s VAL 153 Ca 0.00 -2.00 -0.09 0.00 -1.81 0.00 0.00 61.98 58.08 3cfh s VAL 153 Cb 0.00 -2.44 -0.04 0.00 0.56 0.00 0.00 36.38 34.46 3cfh s VAL 153 CO 0.00 0.00 0.12 -0.22 -0.31 0.00 0.00 175.10 174.69 3cfh s LEU 154 N -3.58 3.79 -0.01 1.32 2.96 -0.96 -1.54 118.68 120.67 3cfh s LEU 154 Ca 0.26 -0.04 -0.01 0.00 -0.22 0.00 0.00 54.13 54.12 3cfh s LEU 154 Cb 0.04 -2.02 -0.04 0.00 0.50 0.00 0.00 46.19 44.67 3cfh s LEU 154 CO 0.14 0.02 0.10 0.00 -1.32 0.00 0.00 176.35 175.29 3cfh s GLY 156 N -1.76 0.65 -0.02 0.00 0.00 -0.37 -1.64 107.32 104.19 3cfh s GLY 156 Ca 0.23 -0.64 0.00 0.00 0.00 0.00 0.00 44.72 44.32 3cfh s GLY 156 CO 0.15 -0.59 0.00 1.20 0.00 0.00 0.00 173.10 173.86 3cfh s GLN 157 N -0.69 0.13 0.03 2.90 -1.52 -0.17 -1.39 119.66 118.95 3cfh s GLN 157 Ca 0.02 0.06 -0.17 0.00 -1.95 0.00 0.00 55.36 53.32 3cfh s GLN 157 Cb -0.06 -0.27 0.03 0.00 -0.22 0.00 0.00 33.01 32.49 3cfh s GLN 157 CO 0.00 -0.08 0.37 -1.54 -0.25 0.00 0.00 175.29 173.80 3cfh s SER 158 N 0.62 -0.24 -0.10 5.90 1.04 -0.97 -0.71 113.70 119.24 3cfh s SER 158 Ca -0.06 -0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.36 3cfh s SER 158 Cb -0.08 0.39 -0.03 0.00 0.10 0.00 0.00 66.02 66.40 3cfh s SER 158 CO -0.01 -0.61 -0.09 -0.76 0.98 0.00 0.00 173.24 172.75 3cfh s LEU 159 N -1.87 3.02 0.21 2.42 1.43 -1.26 -0.07 118.68 122.55 3cfh s LEU 159 Ca -0.07 -0.14 0.09 0.00 -1.03 0.00 0.00 54.13 52.98 3cfh s LEU 159 Cb -0.02 -1.67 -0.05 0.00 0.03 0.00 0.00 46.19 44.49 3cfh s LEU 159 CO -0.01 0.27 -0.16 -0.04 0.23 0.00 0.00 176.35 176.64 3cfh s MET 160 N -0.29 1.37 -0.10 1.70 -1.94 -0.51 -4.50 119.30 115.04 3cfh s MET 160 Ca 0.03 -1.57 -0.01 0.00 -1.71 0.00 0.00 55.69 52.44 3cfh s MET 160 Cb -0.13 -1.28 0.03 0.00 2.01 0.00 0.00 34.83 35.46 3cfh s MET 160 CO 0.03 0.23 -0.05 0.00 -0.01 0.00 0.00 175.02 175.22 3cfh s ALA 161 N -2.66 1.13 -0.10 3.03 0.00 -1.26 -1.28 121.76 120.62 3cfh s ALA 161 Ca 0.22 -0.43 -0.21 0.00 0.00 0.00 0.00 51.96 51.54 3cfh s ALA 161 Cb -0.03 -0.87 -0.04 0.00 0.00 0.00 0.00 23.12 22.18 3cfh s ALA 161 CO 0.08 -0.45 0.59 -1.17 0.00 0.00 0.00 175.76 174.81 3cfh s LEU 162 N 1.79 4.29 0.09 0.00 2.96 0.57 -1.60 118.68 126.78 3cfh s LEU 162 Ca 0.05 1.00 -0.30 0.00 -0.22 0.00 0.00 54.13 54.65 3cfh s LEU 162 Cb -0.13 -2.89 -0.06 0.00 0.50 0.00 0.00 46.19 43.61 3cfh s LEU 162 CO -0.07 -0.07 1.18 -0.54 -1.32 0.00 0.00 176.35 175.53 3cfh s LYS 163 N 0.76 4.46 0.22 1.98 1.02 0.15 -0.93 119.74 127.40 3cfh s LYS 163 Ca 0.32 1.77 0.09 0.00 0.02 0.00 0.00 55.97 58.17 3cfh s LYS 163 Cb -0.16 -3.32 -0.05 0.00 -0.52 0.00 0.00 37.83 33.78 3cfh s LYS 163 CO 0.14 -0.19 -0.16 0.00 -0.92 0.00 0.00 175.35 174.22 3cfh n PRO 165 N -0.41 1.67 -0.91 0.00 -0.02 -1.26 -2.82 135.00 131.25 3cfh n PRO 165 Ca -0.07 0.59 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 3cfh n PRO 165 Cb 0.60 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 32.01 3cfh n PRO 165 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3cfh n GLY 166 N 1.24 0.50 2.20 -1.23 0.00 -1.26 -3.93 105.19 102.72 3cfh n GLY 166 Ca 0.09 -0.89 -0.10 0.00 0.00 0.00 0.00 46.02 45.12 3cfh n GLY 166 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cfh n GLY 167 N -2.65 0.20 3.93 -0.02 0.00 -1.15 -5.03 105.19 100.48 3cfh n GLY 167 Ca 0.00 -0.50 -0.20 0.00 0.00 0.00 0.00 46.02 45.32 3cfh n GLY 167 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3cfh s ARG 168 N -4.15 2.95 0.07 1.61 0.52 -1.13 -4.96 118.95 113.86 3cfh s ARG 168 Ca 0.00 -1.13 0.06 0.00 -0.52 0.00 0.00 55.73 54.14 3cfh s ARG 168 Cb 0.00 -2.67 -0.03 0.00 0.52 0.00 0.00 34.95 32.77 3cfh s ARG 168 CO 0.00 0.08 -0.16 -1.01 0.02 0.00 0.00 175.30 174.23 3cfh s HIS 169 N -2.23 1.39 -0.20 -0.53 3.76 -1.26 -0.41 115.29 115.80 3cfh s HIS 169 Ca 0.43 -0.42 0.02 0.00 -0.15 0.00 0.00 55.06 54.93 3cfh s HIS 169 Cb -0.08 -0.79 0.03 0.00 1.11 0.00 0.00 32.58 32.86 3cfh s HIS 169 CO 0.29 0.09 -0.17 -1.17 -0.85 0.00 0.00 174.74 172.93 3cfh s LEU 170 N -1.61 2.51 0.44 0.89 2.96 -0.11 -4.93 118.68 118.83 3cfh s LEU 170 Ca 0.01 -0.87 -0.01 0.00 -0.22 0.00 0.00 54.13 53.03 3cfh s LEU 170 Cb -0.09 -1.48 -0.02 0.00 0.50 0.00 0.00 46.19 45.09 3cfh s LEU 170 CO 0.02 -0.06 0.68 0.54 -1.32 0.00 0.00 176.35 176.21 3cfh s ASN 171 N 1.24 6.07 0.14 3.68 2.20 -1.26 -0.32 114.94 126.69 3cfh s ASN 171 Ca 0.01 0.53 -0.14 0.00 -0.94 0.00 0.00 52.86 52.32 3cfh s ASN 171 Cb -0.15 -1.89 0.02 0.00 -2.00 0.00 0.00 41.25 37.23 3cfh s ASN 171 CO -0.10 -0.57 0.37 0.00 -2.94 0.00 0.00 177.10 173.86 3cfh s ARG 173 N -3.85 2.81 -0.25 0.00 3.52 -0.27 -1.42 118.95 119.50 3cfh s ARG 173 Ca 0.06 -0.88 -0.09 0.00 -0.13 0.00 0.00 55.73 54.69 3cfh s ARG 173 Cb 0.02 -2.22 -0.04 0.00 -1.56 0.00 0.00 34.95 31.15 3cfh s ARG 173 CO -0.09 0.27 0.12 -0.51 -0.81 0.00 0.00 175.30 174.28 3cfh s LEU 174 N 0.12 3.78 -0.35 -0.88 1.02 0.89 -1.09 118.68 122.17 3cfh s LEU 174 Ca -0.12 -0.05 -0.06 0.00 0.02 0.00 0.00 54.13 53.91 3cfh s LEU 174 Cb -0.16 -2.02 0.05 0.00 0.02 0.00 0.00 46.19 44.08 3cfh s LEU 174 CO 0.07 0.01 0.12 -1.00 0.02 0.00 0.00 176.35 175.57 3cfh s HIS 175 N 1.39 3.29 0.01 0.29 3.76 -0.60 -2.29 115.29 121.14 3cfh s HIS 175 Ca 0.06 -1.55 0.07 0.00 -0.15 0.00 0.00 55.06 53.49 3cfh s HIS 175 Cb -0.15 -2.42 -0.02 0.00 1.11 0.00 0.00 32.58 31.10 3cfh s HIS 175 CO 0.06 -0.77 -0.21 0.99 -0.85 0.00 0.00 174.74 173.96 3cfh s THR 176 N 1.37 1.66 -0.10 1.30 2.01 -0.48 -1.93 115.64 119.47 3cfh s THR 176 Ca -0.01 -1.04 0.03 0.00 0.31 0.00 0.00 61.69 60.98 3cfh s THR 176 Cb -0.20 -1.41 0.01 0.00 0.01 0.00 0.00 72.50 70.91 3cfh s THR 176 CO 0.02 0.34 -0.18 -0.89 -0.69 0.00 0.00 174.62 173.22 3cfh s THR 177 N -0.64 1.63 -0.19 -0.82 2.01 -0.41 -1.23 115.64 115.99 3cfh s THR 177 Ca 0.08 -0.75 -0.07 0.00 0.31 0.00 0.00 61.69 61.26 3cfh s THR 177 Cb -0.08 -1.45 -0.04 0.00 0.01 0.00 0.00 72.50 70.94 3cfh s THR 177 CO 0.00 0.47 0.04 -0.31 -0.69 0.00 0.00 174.62 174.13 3cfh s TYR 178 N 0.67 3.18 -0.23 4.92 2.02 0.14 -1.47 117.35 126.58 3cfh s TYR 178 Ca -0.13 -0.07 0.02 0.00 -0.37 0.00 0.00 57.07 56.52 3cfh s TYR 178 Cb -0.16 -2.08 0.05 0.00 -0.40 0.00 0.00 41.96 39.37 3cfh s TYR 178 CO 0.03 0.05 -0.10 1.03 -1.57 0.00 0.00 175.55 174.99 3cfh s ARG 179 N 0.55 2.05 0.52 -0.62 0.52 0.47 -2.26 118.95 120.17 3cfh s ARG 179 Ca 0.02 -1.06 -0.21 0.00 -0.52 0.00 0.00 55.73 53.96 3cfh s ARG 179 Cb -0.13 -2.64 -0.06 0.00 0.52 0.00 0.00 34.95 32.64 3cfh s ARG 179 CO 0.01 -0.51 1.18 0.45 0.02 0.00 0.00 175.30 176.45 3cfh s SER 180 N 1.29 5.76 0.00 0.23 0.15 -1.26 -0.53 113.70 119.33 3cfh s SER 180 Ca -0.05 2.32 0.26 0.00 0.70 0.00 0.00 55.95 59.19 3cfh s SER 180 Cb -0.18 -2.60 0.74 0.00 -1.71 0.00 0.00 66.02 62.27 3cfh s SER 180 CO -0.07 -1.20 1.57 0.29 1.20 0.00 0.00 173.24 175.03 3cfh n LYS 181 N -1.01 0.18 -2.87 5.44 5.02 -0.56 -4.81 118.16 119.56 3cfh n LYS 181 Ca 0.10 -0.09 -0.33 0.00 -2.02 0.00 0.00 58.31 55.97 3cfh n LYS 181 Cb 0.49 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 33.93 3cfh n LYS 181 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3cfh s LYS 182 N -2.88 4.22 0.57 1.97 1.02 -1.26 -4.97 119.74 118.41 3cfh s LYS 182 Ca 0.15 1.06 -0.19 0.00 0.02 0.00 0.00 55.97 57.02 3cfh s LYS 182 Cb 0.18 -2.27 -0.04 0.00 -0.52 0.00 0.00 37.83 35.18 3cfh s LYS 182 CO 0.62 0.02 1.14 -1.25 -0.92 0.00 0.00 175.35 174.97 3cfh s PRO 183 N -3.06 3.19 0.42 -1.68 0.04 -1.26 -4.92 135.00 127.72 3cfh s PRO 183 Ca 0.60 1.61 0.14 0.00 0.04 0.00 0.00 61.00 63.39 3cfh s PRO 183 Cb -0.10 -1.98 1.00 0.00 0.04 0.00 0.00 34.50 33.46 3cfh s PRO 183 CO 0.14 -0.98 1.92 0.00 0.04 0.00 0.00 177.00 178.13 3cfh h ALA 184 N 0.95 2.04 0.00 8.56 0.00 -1.95 -0.65 119.26 128.22 3cfh h ALA 184 Ca -0.50 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.41 3cfh h ALA 184 Cb 1.27 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.98 3cfh h ALA 184 CO 0.56 -0.23 0.00 0.66 0.00 0.00 0.00 179.25 180.24 3cfh h SER 185 N 0.47 0.00 0.25 0.00 4.64 -1.96 -2.44 113.55 114.50 3cfh h SER 185 Ca 0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.68 3cfh h SER 185 Cb 0.75 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.84 3cfh h SER 185 CO -0.12 0.00 -0.64 0.00 -0.87 0.00 0.00 176.83 175.19 3cfh n ALA 186 N -2.05 3.92 -2.75 5.18 0.00 -0.25 -4.94 120.51 119.62 3cfh n ALA 186 Ca -0.02 -0.47 -0.29 0.00 0.00 0.00 0.00 53.44 52.66 3cfh n ALA 186 Cb 0.10 -0.97 -0.07 0.00 0.00 0.00 0.00 19.45 18.51 3cfh n ALA 186 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3cfh s LEU 187 N -2.89 3.66 -0.37 0.00 2.01 -0.92 -5.04 118.68 115.13 3cfh s LEU 187 Ca 0.12 -0.13 -0.18 0.00 0.01 0.00 0.00 54.13 53.95 3cfh s LEU 187 Cb 0.17 -2.33 0.00 0.00 0.01 0.00 0.00 46.19 44.04 3cfh s LEU 187 CO 0.73 0.14 0.51 -0.75 1.01 0.00 0.00 176.35 177.98 3cfh s LYS 188 N -2.62 3.52 0.00 1.70 2.36 -1.26 -5.01 119.74 118.44 3cfh s LYS 188 Ca 0.29 -0.26 -0.30 0.00 -2.55 0.00 0.00 55.97 53.14 3cfh s LYS 188 Cb -0.11 -3.84 -0.04 0.00 -1.05 0.00 0.00 37.83 32.79 3cfh s LYS 188 CO 0.21 -0.70 1.12 -1.64 1.55 0.00 0.00 175.35 175.89 3cfh s MET 189 N 2.40 4.45 0.60 4.03 -1.94 -1.26 -4.70 119.30 122.88 3cfh s MET 189 Ca 0.18 1.61 -0.17 0.00 -1.71 0.00 0.00 55.69 55.60 3cfh s MET 189 Cb -0.16 -3.44 -0.03 0.00 2.01 0.00 0.00 34.83 33.21 3cfh s MET 189 CO 0.14 -0.24 1.12 -1.25 -0.01 0.00 0.00 175.02 174.78 3cfh s PRO 190 N 1.37 3.08 0.92 2.03 0.04 -1.26 -4.91 135.00 136.27 3cfh s PRO 190 Ca 0.55 1.51 -0.13 0.00 0.04 0.00 0.00 61.00 62.97 3cfh s PRO 190 Cb -0.25 -1.98 0.15 0.00 0.04 0.00 0.00 34.50 32.46 3cfh s PRO 190 CO 0.26 -1.05 1.16 -1.21 0.04 0.00 0.00 177.00 176.21 3cfh s GLU 191 N -3.68 1.06 -0.01 4.56 0.41 -1.26 -4.51 118.70 115.27 3cfh s GLU 191 Ca 0.70 0.15 -0.38 0.00 -0.41 0.00 0.00 54.97 55.03 3cfh s GLU 191 Cb -0.22 -1.84 -0.17 0.00 -1.78 0.00 0.00 34.13 30.12 3cfh s GLU 191 CO 0.34 -2.22 1.42 0.34 -0.49 0.00 0.00 175.26 174.65 3cfh n PHE 192 N -3.76 1.58 -3.95 1.61 7.35 -1.26 -4.78 117.46 114.26 3cfh n PHE 192 Ca 0.08 0.65 -0.11 0.00 -0.76 0.00 0.00 57.45 57.32 3cfh n PHE 192 Cb 0.60 -2.34 -0.02 0.00 0.35 0.00 0.00 39.48 38.06 3cfh n PHE 192 CO 0.00 0.00 0.00 -3.38 -0.76 0.00 0.00 176.76 172.62 3cfh s HIS 193 N 1.19 0.49 0.10 -5.13 -3.43 -0.62 -4.94 115.29 102.94 3cfh s HIS 193 Ca 0.88 -0.92 0.08 0.00 -0.80 0.00 0.00 55.06 54.31 3cfh s HIS 193 Cb -1.01 0.36 -0.04 0.00 -1.43 0.00 0.00 32.58 30.46 3cfh s HIS 193 CO 0.52 -1.27 -0.15 -0.06 -2.00 0.00 0.00 174.74 171.78 3cfh s PHE 194 N -3.07 2.61 -0.16 0.38 0.08 -0.30 -1.06 117.98 116.45 3cfh s PHE 194 Ca 0.22 -0.22 0.00 0.00 0.12 0.00 0.00 56.93 57.05 3cfh s PHE 194 Cb -0.03 -1.39 0.03 0.00 -0.57 0.00 0.00 43.02 41.07 3cfh s PHE 194 CO 0.14 0.38 -0.10 -2.00 -0.10 0.00 0.00 175.22 173.54 3cfh s GLU 195 N -2.07 1.88 0.06 0.44 2.12 0.12 -0.90 118.70 120.35 3cfh s GLU 195 Ca 0.19 -0.58 -0.22 0.00 0.36 0.00 0.00 54.97 54.71 3cfh s GLU 195 Cb -0.11 -2.08 -0.06 0.00 0.26 0.00 0.00 34.13 32.14 3cfh s GLU 195 CO 0.11 -0.35 0.66 -0.51 -0.54 0.00 0.00 175.26 174.63 3cfh s ASP 196 N 1.53 7.13 0.02 -1.70 1.01 0.54 -0.82 116.67 124.39 3cfh s ASP 196 Ca 0.02 1.34 0.02 0.00 0.71 0.00 0.00 52.55 54.64 3cfh s ASP 196 Cb -0.14 -2.41 -0.02 0.00 1.01 0.00 0.00 42.92 41.36 3cfh s ASP 196 CO -0.09 0.14 -0.07 -1.00 0.21 0.00 0.00 175.17 174.36 3cfh s HIS 197 N -0.54 0.61 -0.05 4.23 3.76 -0.22 -1.35 115.29 121.73 3cfh s HIS 197 Ca 0.33 -0.34 -0.01 0.00 -0.15 0.00 0.00 55.06 54.89 3cfh s HIS 197 Cb -0.20 -0.37 0.03 0.00 1.11 0.00 0.00 32.58 33.15 3cfh s HIS 197 CO 0.21 -0.05 0.02 0.50 -0.85 0.00 0.00 174.74 174.56 3cfh s ARG 198 N -1.02 0.34 -0.13 1.40 3.52 -0.44 -1.16 118.95 121.45 3cfh s ARG 198 Ca -0.05 0.17 -0.00 0.00 -0.13 0.00 0.00 55.73 55.72 3cfh s ARG 198 Cb -0.07 -0.70 -0.01 0.00 -1.56 0.00 0.00 34.95 32.61 3cfh s ARG 198 CO 0.00 -0.26 -0.13 0.42 -0.81 0.00 0.00 175.30 174.52 3cfh s ILE 199 N 1.73 3.03 -0.04 4.11 1.01 -1.26 -1.99 121.20 127.78 3cfh s ILE 199 Ca 0.00 -0.67 0.03 0.00 0.00 0.00 0.00 60.65 60.02 3cfh s ILE 199 Cb -0.13 -2.27 0.00 0.00 0.01 0.00 0.00 42.46 40.08 3cfh s ILE 199 CO -0.03 0.52 -0.13 -1.61 0.00 0.00 0.00 174.94 173.69 3cfh s GLU 200 N 0.40 1.47 -0.01 2.79 2.02 -0.03 -4.44 118.70 120.90 3cfh s GLU 200 Ca -0.10 -0.45 0.07 0.00 0.02 0.00 0.00 54.97 54.51 3cfh s GLU 200 Cb -0.16 -1.29 -0.02 0.00 0.10 0.00 0.00 34.13 32.77 3cfh s GLU 200 CO 0.05 0.14 -0.22 0.08 0.02 0.00 0.00 175.26 175.33 3cfh s VAL 201 N 0.26 1.78 -0.10 2.63 1.01 -1.26 -0.48 120.40 124.23 3cfh s VAL 201 Ca -0.06 -0.98 0.02 0.00 0.00 0.00 0.00 61.98 60.96 3cfh s VAL 201 Cb -0.12 -1.48 0.01 0.00 0.00 0.00 0.00 36.38 34.80 3cfh s VAL 201 CO 0.02 0.48 -0.18 -0.54 0.00 0.00 0.00 175.10 174.89 3cfh s LYS 202 N -0.58 2.42 -0.58 2.72 1.02 0.34 -4.98 119.74 120.10 3cfh s LYS 202 Ca 0.09 -0.65 -0.23 0.00 0.02 0.00 0.00 55.97 55.20 3cfh s LYS 202 Cb -0.09 -1.96 0.05 0.00 -0.52 0.00 0.00 37.83 35.31 3cfh s LYS 202 CO -0.01 0.02 0.91 -2.00 -0.92 0.00 0.00 175.35 173.35 3cfh s GLU 203 N 0.74 3.23 -0.06 1.68 2.12 -1.26 -0.38 118.70 124.78 3cfh s GLU 203 Ca -0.11 -0.52 -0.25 0.00 0.36 0.00 0.00 54.97 54.45 3cfh s GLU 203 Cb -0.16 -4.11 -0.20 0.00 0.26 0.00 0.00 34.13 29.92 3cfh s GLU 203 CO 0.02 -1.55 1.02 0.28 -0.54 0.00 0.00 175.26 174.49 3cfh h VAL 204 N 5.98 1.26 -3.68 3.70 2.07 -1.11 -3.45 116.25 121.03 3cfh h VAL 204 Ca -0.27 -1.38 -0.47 0.00 0.82 0.00 0.00 66.70 65.41 3cfh h VAL 204 Cb 1.08 2.12 -0.32 0.00 -1.52 0.00 0.00 31.29 32.65 3cfh h VAL 204 CO 1.10 0.33 -0.80 -1.58 0.02 0.00 0.00 177.57 176.64 3cfh s GLN 205 N -3.53 1.25 -0.46 1.57 0.74 -0.60 -4.96 119.66 113.68 3cfh s GLN 205 Ca -0.15 -0.35 -0.42 0.00 0.05 0.00 0.00 55.36 54.49 3cfh s GLN 205 Cb 0.00 -1.12 -0.17 0.00 1.10 0.00 0.00 33.01 32.83 3cfh s GLN 205 CO 0.60 0.09 2.15 1.63 -0.55 0.00 0.00 175.29 179.20 3cfh n LYS 206 N 3.50 0.29 -0.94 1.67 4.76 -1.26 -1.39 118.16 124.79 3cfh n LYS 206 Ca -0.20 0.08 0.00 0.00 -2.87 0.00 0.00 58.31 55.31 3cfh n LYS 206 Cb 0.53 -1.75 0.00 0.00 -1.84 0.00 0.00 35.03 31.96 3cfh n LYS 206 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3cfh n GLY 207 N 7.21 0.18 1.20 0.72 0.00 -1.26 -4.72 105.19 108.53 3cfh n GLY 207 Ca 0.51 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.53 3cfh n GLY 207 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3cfh n LYS 208 N -0.56 0.00 -4.83 1.61 4.76 -0.48 -5.08 118.16 113.58 3cfh n LYS 208 Ca 0.00 0.00 -0.29 0.00 -2.87 0.00 0.00 58.31 55.15 3cfh n LYS 208 Cb 0.28 -0.39 -0.17 0.00 -1.84 0.00 0.00 35.03 32.92 3cfh n LYS 208 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 3cfh s HIS 209 N -1.98 2.12 0.06 2.13 3.76 -0.67 -4.96 115.29 115.76 3cfh s HIS 209 Ca 0.00 -0.90 0.02 0.00 -0.15 0.00 0.00 55.06 54.04 3cfh s HIS 209 Cb 0.00 -1.47 -0.03 0.00 1.11 0.00 0.00 32.58 32.19 3cfh s HIS 209 CO 0.00 -0.41 -0.08 0.71 -0.85 0.00 0.00 174.74 174.12 3cfh s TYR 210 N 0.61 0.77 -0.00 1.40 2.02 -1.26 -0.46 117.35 120.42 3cfh s TYR 210 Ca -0.14 -0.62 0.08 0.00 -0.37 0.00 0.00 57.07 56.02 3cfh s TYR 210 Cb -0.17 -0.45 -0.02 0.00 -0.40 0.00 0.00 41.96 40.92 3cfh s TYR 210 CO 0.04 -0.09 -0.24 -1.21 -1.57 0.00 0.00 175.55 172.48 3cfh s GLU 211 N -2.24 1.86 -0.03 -0.62 2.02 0.49 -4.89 118.70 115.30 3cfh s GLU 211 Ca -0.03 -0.91 0.01 0.00 0.02 0.00 0.00 54.97 54.06 3cfh s GLU 211 Cb -0.06 -1.86 0.01 0.00 0.10 0.00 0.00 34.13 32.33 3cfh s GLU 211 CO -0.01 0.50 -0.04 -1.14 0.02 0.00 0.00 175.26 174.59 3cfh s GLN 212 N -0.74 0.62 -0.03 1.61 0.74 -1.26 -0.51 119.66 120.09 3cfh s GLN 212 Ca 0.09 -0.11 0.06 0.00 0.05 0.00 0.00 55.36 55.46 3cfh s GLN 212 Cb -0.09 -0.64 -0.02 0.00 1.10 0.00 0.00 33.01 33.35 3cfh s GLN 212 CO -0.00 -0.02 -0.21 -0.47 -0.55 0.00 0.00 175.29 174.04 3cfh s TYR 213 N 0.56 2.48 -0.03 1.67 5.04 0.37 -4.99 117.35 122.45 3cfh s TYR 213 Ca -0.07 -0.32 -0.01 0.00 -2.44 0.00 0.00 57.07 54.22 3cfh s TYR 213 Cb -0.10 -1.54 0.02 0.00 0.35 0.00 0.00 41.96 40.68 3cfh s TYR 213 CO -0.00 0.07 0.06 -2.00 -1.34 0.00 0.00 175.55 172.34 3cfh s GLU 214 N -0.72 0.04 -0.07 4.97 2.12 -1.26 -0.85 118.70 122.94 3cfh s GLU 214 Ca 0.11 0.16 0.04 0.00 0.36 0.00 0.00 54.97 55.64 3cfh s GLU 214 Cb -0.10 -0.09 -0.02 0.00 0.26 0.00 0.00 34.13 34.18 3cfh s GLU 214 CO -0.00 -0.08 -0.17 0.00 -0.54 0.00 0.00 175.26 174.46 3cfh s ALA 215 N 0.55 2.51 -0.04 6.30 0.00 -0.84 -4.98 121.76 125.25 3cfh s ALA 215 Ca -0.04 -0.99 -0.02 0.00 0.00 0.00 0.00 51.96 50.91 3cfh s ALA 215 Cb -0.06 -0.93 0.02 0.00 0.00 0.00 0.00 23.12 22.16 3cfh s ALA 215 CO -0.02 0.46 0.10 0.00 0.00 0.00 0.00 175.76 176.30 3cfh s ALA 216 N -0.36 -0.18 -0.04 0.00 0.00 -1.26 -1.33 121.76 118.60 3cfh s ALA 216 Ca 0.03 0.43 0.02 0.00 0.00 0.00 0.00 51.96 52.44 3cfh s ALA 216 Cb -0.12 -0.29 0.01 0.00 0.00 0.00 0.00 23.12 22.72 3cfh s ALA 216 CO 0.02 -0.10 -0.08 0.08 0.00 0.00 0.00 175.76 175.68 3cfh s VAL 217 N 0.69 0.77 -0.16 0.00 1.01 -0.45 -1.66 120.40 120.59 3cfh s VAL 217 Ca -0.05 -0.31 -0.06 0.00 0.00 0.00 0.00 61.98 61.55 3cfh s VAL 217 Cb -0.07 -0.71 -0.04 0.00 0.00 0.00 0.00 36.38 35.56 3cfh s VAL 217 CO -0.03 0.26 0.06 0.00 0.00 0.00 0.00 175.10 175.38 3cfh s ALA 218 N 0.45 3.42 0.23 5.51 0.00 0.37 -0.34 121.76 131.40 3cfh s ALA 218 Ca -0.07 -0.74 -0.17 0.00 0.00 0.00 0.00 51.96 50.98 3cfh s ALA 218 Cb -0.11 -1.85 0.01 0.00 0.00 0.00 0.00 23.12 21.17 3cfh s ALA 218 CO 0.01 0.28 0.55 -0.98 0.00 0.00 0.00 175.76 175.62 3cfh s ARG 219 N 0.08 1.53 0.00 0.00 1.70 -0.08 -1.88 118.95 120.30 3cfh s ARG 219 Ca 0.05 -1.03 0.00 0.00 -0.47 0.00 0.00 55.73 54.28 3cfh s ARG 219 Cb -0.12 0.52 0.00 0.00 -0.57 0.00 0.00 34.95 34.78 3cfh s ARG 219 CO 0.01 -0.66 0.00 0.66 -1.08 0.00 0.00 175.30 174.23 3cfh n TYR 220 N -0.38 0.00 0.00 5.89 4.01 -1.26 -1.15 117.16 124.27 3cfh n TYR 220 Ca -0.06 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.68 3cfh n TYR 220 Cb 0.61 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.64 3cfh n TYR 220 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 3cfh n ASP 222 N 0.00 0.00 -0.25 7.72 10.43 -1.26 -4.91 116.55 128.28 3cfh n ASP 222 Ca 0.00 0.00 -0.06 0.00 2.57 0.00 0.00 54.79 57.30 3cfh n ASP 222 Cb 0.00 0.00 0.05 0.00 1.84 0.00 0.00 41.12 43.01 3cfh n ASP 222 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3cfh h ALA 223 N 0.00 0.90 -3.24 2.24 0.00 -2.05 -3.37 119.26 113.74 3cfh h ALA 223 Ca 0.00 -0.12 -0.69 0.00 0.00 0.00 0.00 54.91 54.10 3cfh h ALA 223 Cb 0.00 -0.28 -0.34 0.00 0.00 0.00 0.00 17.79 17.17 3cfh h ALA 223 CO 0.00 0.43 -0.60 0.00 0.00 0.00 0.00 179.25 179.09 3cfh s ALA 224 N -5.80 3.05 0.56 0.00 0.00 -1.26 -5.10 121.76 113.21 3cfh s ALA 224 Ca -0.13 -2.26 -0.15 0.00 0.00 0.00 0.00 51.96 49.42 3cfh s ALA 224 Cb 0.14 -2.27 -0.06 0.00 0.00 0.00 0.00 23.12 20.93 3cfh s ALA 224 CO 0.80 -1.62 1.01 -1.25 0.00 0.00 0.00 175.76 174.70 3cfh s PRO 225 N 1.19 3.70 0.24 0.00 0.04 -1.26 -5.06 135.00 133.85 3cfh s PRO 225 Ca 0.04 0.99 -0.11 0.00 0.04 0.00 0.00 61.00 61.96 3cfh s PRO 225 Cb -0.22 -2.10 -0.07 0.00 0.04 0.00 0.00 34.50 32.15 3cfh s PRO 225 CO -0.03 -0.48 0.58 0.45 0.04 0.00 0.00 177.00 177.56 3cfh s SER 226 N -3.18 6.65 0.01 6.66 0.15 -1.26 -5.00 113.70 117.74 3cfh s SER 226 Ca 0.59 0.98 0.22 0.00 0.70 0.00 0.00 55.95 58.45 3cfh s SER 226 Cb -0.12 -2.25 -0.26 0.00 -1.71 0.00 0.00 66.02 61.68 3cfh s SER 226 CO 0.37 -0.09 0.59 0.29 1.20 0.00 0.00 173.24 175.59 3cfh n LYS 227 N -0.15 0.65 0.00 5.44 5.02 -1.26 -4.28 118.16 123.58 3cfh n LYS 227 Ca 0.01 -0.12 0.14 0.00 -2.02 0.00 0.00 58.31 56.31 3cfh n LYS 227 Cb 0.52 -1.59 0.49 0.00 -0.02 0.00 0.00 35.03 34.44 3cfh n LYS 227 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3cfh n LEU 228 N -2.37 1.17 -0.41 -0.35 4.77 -1.26 -4.96 117.00 113.59 3cfh n LEU 228 Ca -0.04 -0.34 -0.04 0.00 -0.03 0.00 0.00 56.01 55.56 3cfh n LEU 228 Cb 0.59 -0.06 -0.00 0.00 -2.33 0.00 0.00 43.42 41.61 3cfh n LEU 228 CO 0.45 0.20 -0.05 0.61 -1.33 0.00 0.00 177.39 177.27 3cfh n GLY 229 N 1.24 0.23 3.94 -0.72 0.00 -1.26 -5.06 105.19 103.56 3cfh n GLY 229 Ca 0.16 -0.74 -0.25 0.00 0.00 0.00 0.00 46.02 45.19 3cfh n GLY 229 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3cfh s HIS 230 N -2.18 3.48 -2.00 1.61 5.04 -1.26 -5.09 115.29 114.89 3cfh s HIS 230 Ca 0.00 0.22 0.20 0.00 -1.54 0.00 0.00 55.06 53.94 3cfh s HIS 230 Cb 0.00 -1.76 1.20 0.00 0.04 0.00 0.00 32.58 32.06 3cfh s HIS 230 CO 0.00 0.35 1.59 -2.39 -2.34 0.00 0.00 174.74 171.95