#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fpa s GLN -2 N 0.00 4.31 0.00 -4.13 -0.21 -1.26 -4.94 119.66 113.43 3fpa s GLN -2 Ca 0.00 1.87 0.27 0.00 0.02 0.00 0.00 55.36 57.52 3fpa s GLN -2 Cb 0.00 -3.54 0.90 0.00 1.00 0.00 0.00 33.01 31.37 3fpa s GLN -2 CO 0.00 -0.51 1.65 -1.13 -2.12 0.00 0.00 175.29 173.18 3fpa n SER -1 N 5.17 0.97 -4.19 5.90 3.41 -1.26 -3.54 113.62 120.08 3fpa n SER -1 Ca 0.12 -0.92 -0.12 0.00 -0.26 0.00 0.00 58.87 57.70 3fpa n SER -1 Cb 0.44 0.07 -0.10 0.00 -0.26 0.00 0.00 64.21 64.37 3fpa n SER -1 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 3fpa s HIS 0 N -2.42 1.09 0.75 7.33 3.76 -1.26 -4.23 115.29 120.30 3fpa s HIS 0 Ca 0.27 -1.33 -0.11 0.00 -0.15 0.00 0.00 55.06 53.74 3fpa s HIS 0 Cb 0.20 -0.55 0.04 0.00 1.11 0.00 0.00 32.58 33.38 3fpa s HIS 0 CO 0.48 -0.59 1.09 0.00 -0.85 0.00 0.00 174.74 174.88 3fpa s MET 1 N -4.12 2.41 -0.19 1.40 0.00 -0.91 -3.25 119.30 114.64 3fpa s MET 1 Ca 0.34 1.19 -0.14 0.00 0.00 0.00 0.00 55.69 57.08 3fpa s MET 1 Cb 0.07 -1.91 -0.04 0.00 0.00 0.00 0.00 34.83 32.94 3fpa s MET 1 CO 0.09 -1.53 0.33 0.99 0.00 0.00 0.00 175.02 174.90 3fpa s THR 2 N -2.81 5.26 -0.21 3.16 2.01 -0.18 -4.94 115.64 117.93 3fpa s THR 2 Ca 0.62 0.59 -0.07 0.00 0.31 0.00 0.00 61.69 63.14 3fpa s THR 2 Cb -0.17 -3.66 -0.03 0.00 0.01 0.00 0.00 72.50 68.64 3fpa s THR 2 CO 0.53 0.32 0.06 -0.63 -0.69 0.00 0.00 174.62 174.21 3fpa s ILE 3 N 0.89 4.45 -0.14 1.82 1.01 -1.26 -0.48 121.20 127.49 3fpa s ILE 3 Ca 0.17 -0.14 -0.00 0.00 0.00 0.00 0.00 60.65 60.68 3fpa s ILE 3 Cb -0.14 -3.04 -0.01 0.00 0.01 0.00 0.00 42.46 39.28 3fpa s ILE 3 CO 0.06 0.40 -0.13 -0.76 0.00 0.00 0.00 174.94 174.51 3fpa s LEU 4 N 1.00 2.66 -0.22 2.97 1.43 0.88 -2.95 118.68 124.44 3fpa s LEU 4 Ca 0.04 -0.37 -0.19 0.00 -1.03 0.00 0.00 54.13 52.57 3fpa s LEU 4 Cb -0.14 -1.60 -0.03 0.00 0.03 0.00 0.00 46.19 44.45 3fpa s LEU 4 CO 0.03 0.13 0.58 -0.69 0.23 0.00 0.00 176.35 176.63 3fpa s VAL 5 N 0.55 5.04 -0.45 -1.59 1.01 -0.64 0.06 120.40 124.38 3fpa s VAL 5 Ca -0.08 1.05 -0.11 0.00 0.00 0.00 0.00 61.98 62.83 3fpa s VAL 5 Cb -0.16 -3.89 0.08 0.00 0.00 0.00 0.00 36.38 32.42 3fpa s VAL 5 CO 0.04 0.10 0.33 -0.69 0.00 0.00 0.00 175.10 174.87 3fpa s VAL 6 N 2.06 4.59 0.07 2.92 1.01 0.15 -0.11 120.40 131.09 3fpa s VAL 6 Ca 0.25 -1.35 0.01 0.00 0.00 0.00 0.00 61.98 60.89 3fpa s VAL 6 Cb -0.16 -3.82 0.01 0.00 0.00 0.00 0.00 36.38 32.41 3fpa s VAL 6 CO 0.09 -0.58 0.07 1.07 0.00 0.00 0.00 175.10 175.75 3fpa n THR 7 N 5.02 0.00 -3.90 3.92 5.66 0.54 -2.54 114.28 122.98 3fpa n THR 7 Ca -0.11 -0.27 -0.08 0.00 -3.05 0.00 0.00 64.05 60.54 3fpa n THR 7 Cb 0.43 -0.63 -0.04 0.00 -1.55 0.00 0.00 70.33 68.54 3fpa n THR 7 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 3fpa s GLY 8 N -2.04 0.17 0.00 1.09 0.00 -1.26 -1.45 107.32 103.83 3fpa s GLY 8 Ca 0.05 -0.53 0.22 0.00 0.00 0.00 0.00 44.72 44.47 3fpa s GLY 8 CO 0.03 -0.34 1.72 -1.30 0.00 0.00 0.00 173.10 173.22 3fpa n THR 9 N -0.41 0.37 -2.29 0.90 -2.24 -0.44 -3.34 114.28 106.83 3fpa n THR 9 Ca -0.04 0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 3fpa n THR 9 Cb 0.61 -0.72 0.00 0.00 -2.10 0.00 0.00 70.33 68.12 3fpa n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3fpa n GLY 10 N 0.69 -0.62 3.88 3.38 0.00 -1.26 -4.77 105.19 106.49 3fpa n GLY 10 Ca 0.08 -0.52 -0.34 0.00 0.00 0.00 0.00 46.02 45.24 3fpa n GLY 10 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3fpa s THR 11 N -3.24 5.18 0.00 2.61 -1.32 -1.26 -3.67 115.64 113.94 3fpa s THR 11 Ca 0.00 0.29 0.00 0.00 -1.21 0.00 0.00 61.69 60.77 3fpa s THR 11 Cb 0.00 -3.62 0.00 0.00 -1.51 0.00 0.00 72.50 67.37 3fpa s THR 11 CO 0.00 0.28 0.00 0.61 -2.21 0.00 0.00 174.62 173.30 3fpa n GLY 12 N 0.87 0.68 0.67 6.08 0.00 -1.26 -4.94 105.19 107.28 3fpa n GLY 12 Ca -0.08 -0.17 0.12 0.00 0.00 0.00 0.00 46.02 45.89 3fpa n GLY 12 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3fpa n VAL 13 N -2.60 0.00 0.00 1.61 0.24 -1.26 -4.98 118.33 111.34 3fpa n VAL 13 Ca 0.00 -0.35 0.00 0.00 -2.04 0.00 0.00 64.34 61.95 3fpa n VAL 13 Cb 0.00 1.31 0.00 0.00 -1.47 0.00 0.00 33.84 33.68 3fpa n VAL 13 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3fpa n GLY 14 N 1.39 1.03 0.22 7.63 0.00 -1.26 -3.93 105.19 110.26 3fpa n GLY 14 Ca 0.11 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.13 3fpa n GLY 14 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3fpa h LYS 15 N 0.50 0.19 -0.19 1.61 1.57 -1.93 -0.63 116.57 117.69 3fpa h LYS 15 Ca 0.00 -0.01 -0.06 0.00 -1.87 0.00 0.00 60.65 58.71 3fpa h LYS 15 Cb 0.00 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.26 3fpa h LYS 15 CO 0.00 0.13 -0.12 1.15 -0.57 0.00 0.00 179.45 180.04 3fpa h THR 16 N 0.20 1.31 0.00 -0.16 2.02 -1.96 -0.48 112.91 113.84 3fpa h THR 16 Ca 0.29 -1.20 -0.08 0.00 0.77 0.00 0.00 66.41 66.18 3fpa h THR 16 Cb 0.43 1.69 -0.01 0.00 -1.74 0.00 0.00 68.15 68.52 3fpa h THR 16 CO -0.41 0.36 -0.39 1.62 0.37 0.00 0.00 175.52 177.08 3fpa h VAL 17 N 0.11 1.27 -0.26 3.16 3.04 -1.93 -1.74 116.25 119.89 3fpa h VAL 17 Ca 0.04 -1.33 -0.15 0.00 -1.01 0.00 0.00 66.70 64.25 3fpa h VAL 17 Cb 0.62 1.72 -0.00 0.00 -2.01 0.00 0.00 31.29 31.61 3fpa h VAL 17 CO 0.03 0.38 -0.42 0.58 -1.01 0.00 0.00 177.57 177.14 3fpa h VAL 18 N 0.00 1.30 -0.05 1.51 2.07 -0.96 -0.55 116.25 119.58 3fpa h VAL 18 Ca -0.00 -1.61 0.03 0.00 0.82 0.00 0.00 66.70 65.94 3fpa h VAL 18 Cb 0.69 1.69 -0.04 0.00 -1.52 0.00 0.00 31.29 32.11 3fpa h VAL 18 CO 0.05 0.51 -0.19 0.00 0.02 0.00 0.00 177.57 177.96 3fpa h ALA 20 N 0.65 0.60 -0.33 0.00 0.00 -1.33 0.29 119.26 119.14 3fpa h ALA 20 Ca 0.07 0.11 -0.15 0.00 0.00 0.00 0.00 54.91 54.94 3fpa h ALA 20 Cb 0.39 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 3fpa h ALA 20 CO -0.22 -0.29 -0.38 0.00 0.00 0.00 0.00 179.25 178.36 3fpa h ALA 21 N 1.40 0.71 -0.13 0.00 0.00 -0.94 -1.13 119.26 119.17 3fpa h ALA 21 Ca 0.26 -0.44 -0.12 0.00 0.00 0.00 0.00 54.91 54.61 3fpa h ALA 21 Cb 0.36 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3fpa h ALA 21 CO -0.33 0.66 -0.39 1.25 0.00 0.00 0.00 179.25 180.43 3fpa h LEU 22 N 0.64 0.57 -0.66 0.00 5.85 -0.77 0.24 115.31 121.17 3fpa h LEU 22 Ca 0.06 -0.60 0.13 0.00 0.84 0.00 0.00 57.88 58.30 3fpa h LEU 22 Cb 0.93 -0.17 -0.09 0.00 0.37 0.00 0.00 40.66 41.70 3fpa h LEU 22 CO 0.09 1.07 0.18 0.00 -0.34 0.00 0.00 178.44 179.43 3fpa h ALA 23 N 0.51 0.83 0.01 1.25 0.00 -0.45 0.15 119.26 121.57 3fpa h ALA 23 Ca -0.01 0.13 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 3fpa h ALA 23 Cb 1.02 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3fpa h ALA 23 CO 0.08 -0.28 -0.01 1.03 0.00 0.00 0.00 179.25 180.08 3fpa h SER 24 N 0.31 -0.01 -0.68 0.00 0.87 -1.12 -0.08 113.55 112.84 3fpa h SER 24 Ca 0.35 -0.26 0.04 0.00 -1.23 0.00 0.00 61.79 60.69 3fpa h SER 24 Cb 0.54 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.46 3fpa h SER 24 CO -0.42 0.26 0.45 0.00 -0.53 0.00 0.00 176.83 176.58 3fpa h ALA 25 N 0.70 1.64 0.02 6.23 0.00 -0.67 -2.36 119.26 124.83 3fpa h ALA 25 Ca -0.00 -0.03 -0.24 0.00 0.00 0.00 0.00 54.91 54.64 3fpa h ALA 25 Cb 0.28 -0.22 0.02 0.00 0.00 0.00 0.00 17.79 17.87 3fpa h ALA 25 CO 0.00 0.28 -0.94 0.00 0.00 0.00 0.00 179.25 178.59 3fpa h ALA 26 N 1.61 0.09 -0.43 0.00 0.00 -0.57 -2.91 119.26 117.05 3fpa h ALA 26 Ca 0.27 -0.67 0.02 0.00 0.00 0.00 0.00 54.91 54.54 3fpa h ALA 26 Cb 0.10 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 3fpa h ALA 26 CO -0.08 0.59 0.29 0.00 0.00 0.00 0.00 179.25 180.04 3fpa h ARG 27 N 0.23 0.48 0.00 0.00 3.08 -0.89 -0.88 114.38 116.40 3fpa h ARG 27 Ca -0.12 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.90 3fpa h ARG 27 Cb 1.62 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 31.56 3fpa h ARG 27 CO 0.18 0.32 0.00 1.04 -1.07 0.00 0.00 179.97 180.44 3fpa n GLN 28 N -4.48 0.16 -0.23 0.04 6.02 -0.90 -2.00 117.38 116.00 3fpa n GLN 28 Ca 0.04 0.17 0.10 0.00 -0.01 0.00 0.00 57.00 57.31 3fpa n GLN 28 Cb 0.13 -1.70 0.26 0.00 1.02 0.00 0.00 30.24 29.95 3fpa n GLN 28 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3fpa n ALA 29 N -1.68 2.43 -0.60 -1.58 0.00 -0.61 -4.95 120.51 113.53 3fpa n ALA 29 Ca 0.06 -0.92 0.00 0.00 0.00 0.00 0.00 53.44 52.58 3fpa n ALA 29 Cb 0.37 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.86 3fpa n ALA 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fpa n GLY 30 N 1.39 0.73 3.71 0.00 0.00 -0.85 -5.05 105.19 105.13 3fpa n GLY 30 Ca 0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 3fpa n GLY 30 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fpa s ILE 31 N -2.41 5.15 0.19 -0.61 1.01 -0.44 -4.98 121.20 119.11 3fpa s ILE 31 Ca 0.00 1.06 -0.30 0.00 0.00 0.00 0.00 60.65 61.41 3fpa s ILE 31 Cb 0.00 -3.87 -0.08 0.00 0.01 0.00 0.00 42.46 38.52 3fpa s ILE 31 CO 0.00 0.29 1.26 -0.62 0.00 0.00 0.00 174.94 175.87 3fpa s ASP 32 N 0.71 6.99 -0.08 3.58 2.15 -1.26 -3.34 116.67 125.41 3fpa s ASP 32 Ca 0.28 2.32 0.03 0.00 0.43 0.00 0.00 52.55 55.61 3fpa s ASP 32 Cb -0.16 -2.61 0.00 0.00 -0.30 0.00 0.00 42.92 39.86 3fpa s ASP 32 CO 0.12 -0.46 -0.19 -0.69 -0.17 0.00 0.00 175.17 173.78 3fpa s VAL 33 N 0.05 1.69 -0.01 1.11 1.01 -1.26 -0.37 120.40 122.62 3fpa s VAL 33 Ca 0.55 -0.81 0.04 0.00 0.00 0.00 0.00 61.98 61.76 3fpa s VAL 33 Cb -0.35 -1.48 -0.03 0.00 0.00 0.00 0.00 36.38 34.52 3fpa s VAL 33 CO 0.37 0.48 -0.10 0.00 0.00 0.00 0.00 175.10 175.85 3fpa s ALA 34 N 0.43 2.86 -0.07 5.51 0.00 0.01 -4.64 121.76 125.87 3fpa s ALA 34 Ca -0.16 -1.02 0.05 0.00 0.00 0.00 0.00 51.96 50.83 3fpa s ALA 34 Cb -0.17 -1.04 -0.00 0.00 0.00 0.00 0.00 23.12 21.91 3fpa s ALA 34 CO 0.07 0.59 -0.22 0.08 0.00 0.00 0.00 175.76 176.28 3fpa s VAL 35 N -0.89 1.82 -0.04 0.00 1.01 -0.81 -0.90 120.40 120.58 3fpa s VAL 35 Ca 0.15 -0.91 0.04 0.00 0.00 0.00 0.00 61.98 61.25 3fpa s VAL 35 Cb -0.11 -1.56 -0.00 0.00 0.00 0.00 0.00 36.38 34.71 3fpa s VAL 35 CO 0.04 0.51 -0.16 0.00 0.00 0.00 0.00 175.10 175.50 3fpa s LYS 37 N 0.04 1.29 0.50 0.00 2.47 0.46 -1.07 119.74 123.43 3fpa s LYS 37 Ca -0.03 -2.29 0.15 0.00 -1.56 0.00 0.00 55.97 52.24 3fpa s LYS 37 Cb -0.11 -2.03 1.18 0.00 -1.46 0.00 0.00 37.83 35.42 3fpa s LYS 37 CO 0.02 -1.31 2.10 -1.00 0.16 0.00 0.00 175.35 175.32 3fpa h PRO 38 N 5.92 0.01 -3.73 4.03 0.13 -1.77 -3.30 132.00 133.28 3fpa h PRO 38 Ca 0.17 -0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.78 3fpa h PRO 38 Cb 0.88 -0.00 -0.39 0.00 0.13 0.00 0.00 31.00 31.62 3fpa h PRO 38 CO 0.46 0.06 -0.77 0.08 -0.23 0.00 0.00 178.00 177.60 3fpa s VAL 39 N -4.94 0.68 -0.21 1.56 1.01 -1.26 -1.58 120.40 115.66 3fpa s VAL 39 Ca -0.05 -0.54 -0.02 0.00 0.00 0.00 0.00 61.98 61.37 3fpa s VAL 39 Cb 0.17 -1.07 0.00 0.00 0.00 0.00 0.00 36.38 35.47 3fpa s VAL 39 CO 0.68 -0.09 -0.09 -1.58 0.00 0.00 0.00 175.10 174.02 3fpa s GLN 40 N 1.80 3.24 0.54 2.72 2.00 -0.41 -4.42 119.66 125.12 3fpa s GLN 40 Ca -0.00 -0.70 0.05 0.00 -2.00 0.00 0.00 55.36 52.71 3fpa s GLN 40 Cb -0.16 -2.88 0.04 0.00 0.80 0.00 0.00 33.01 30.80 3fpa s GLN 40 CO -0.07 -0.21 0.39 0.95 -0.50 0.00 0.00 175.29 175.85 3fpa s THR 41 N 1.42 1.66 -1.27 -0.34 -4.23 -1.26 -0.59 115.64 111.03 3fpa s THR 41 Ca 0.05 -1.50 0.00 0.00 -1.18 0.00 0.00 61.69 59.06 3fpa s THR 41 Cb -0.14 -2.16 0.00 0.00 1.34 0.00 0.00 72.50 71.54 3fpa s THR 41 CO -0.06 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.63 3fpa n GLY 42 N -1.75 0.96 0.24 3.99 0.00 -0.12 -4.75 105.19 103.76 3fpa n GLY 42 Ca -0.02 -0.42 0.11 0.00 0.00 0.00 0.00 46.02 45.69 3fpa n GLY 42 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3fpa h THR 43 N 0.00 0.53 0.00 2.61 1.35 -1.13 -1.51 112.91 114.76 3fpa h THR 43 Ca -0.27 -0.93 0.00 0.00 -0.55 0.00 0.00 66.41 64.66 3fpa h THR 43 Cb 0.93 1.63 0.00 0.00 -1.73 0.00 0.00 68.15 68.98 3fpa h THR 43 CO 0.37 0.18 0.00 0.00 -0.25 0.00 0.00 175.52 175.83 3fpa n ALA 44 N -2.23 2.30 0.57 6.62 0.00 -0.68 -1.36 120.51 125.73 3fpa n ALA 44 Ca -0.00 -0.12 0.10 0.00 0.00 0.00 0.00 53.44 53.41 3fpa n ALA 44 Cb 0.37 -1.43 0.12 0.00 0.00 0.00 0.00 19.45 18.50 3fpa n ALA 44 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3fpa n ARG 45 N -1.34 1.89 -0.50 0.00 0.63 -0.69 -4.97 116.66 111.69 3fpa n ARG 45 Ca 0.11 -1.81 0.00 0.00 -0.92 0.00 0.00 57.85 55.23 3fpa n ARG 45 Cb 0.23 -1.39 0.00 0.00 0.45 0.00 0.00 32.46 31.76 3fpa n ARG 45 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3fpa n GLY 46 N 1.11 0.75 3.68 5.14 0.00 -0.46 -5.03 105.19 110.39 3fpa n GLY 46 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 3fpa n GLY 46 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3fpa s ASP 47 N -2.51 6.62 -0.30 1.61 -0.00 -0.66 -4.95 116.67 116.48 3fpa s ASP 47 Ca 0.00 2.44 0.04 0.00 -0.00 0.00 0.00 52.55 55.02 3fpa s ASP 47 Cb 0.00 -2.56 0.17 0.00 -0.00 0.00 0.00 42.92 40.54 3fpa s ASP 47 CO 0.00 -0.89 0.48 -0.62 -0.00 0.00 0.00 175.17 174.14 3fpa s ASP 48 N 2.60 -0.36 0.18 0.27 3.68 -1.26 -4.03 116.67 117.75 3fpa s ASP 48 Ca 0.74 -0.25 0.02 0.00 2.13 0.00 0.00 52.55 55.19 3fpa s ASP 48 Cb -0.38 1.44 0.05 0.00 -1.45 0.00 0.00 42.92 42.57 3fpa s ASP 48 CO 0.32 -0.33 1.42 0.44 0.13 0.00 0.00 175.17 177.15 3fpa h ASP 49 N 8.02 0.29 -0.03 -0.34 3.45 -1.95 -2.30 116.42 123.56 3fpa h ASP 49 Ca -0.05 -0.22 0.00 0.00 0.43 0.00 0.00 57.03 57.20 3fpa h ASP 49 Cb 1.14 -0.09 -0.00 0.00 -0.56 0.00 0.00 39.33 39.82 3fpa h ASP 49 CO 0.22 0.98 0.00 -0.07 -1.57 0.00 0.00 179.24 178.80 3fpa h LEU 50 N 0.14 -0.00 -0.73 1.55 4.07 -1.96 -1.67 115.31 116.71 3fpa h LEU 50 Ca -0.04 0.01 -0.01 0.00 0.08 0.00 0.00 57.88 57.92 3fpa h LEU 50 Cb 1.41 0.01 -0.03 0.00 1.08 0.00 0.00 40.66 43.12 3fpa h LEU 50 CO 0.13 0.01 0.42 0.00 -1.08 0.00 0.00 178.44 177.91 3fpa h ALA 51 N 1.02 0.93 -0.61 1.53 0.00 -1.98 -2.08 119.26 118.09 3fpa h ALA 51 Ca 0.01 -0.10 0.10 0.00 0.00 0.00 0.00 54.91 54.92 3fpa h ALA 51 Cb 0.01 -0.29 -0.07 0.00 0.00 0.00 0.00 17.79 17.44 3fpa h ALA 51 CO -0.02 0.43 0.22 1.49 0.00 0.00 0.00 179.25 181.36 3fpa h GLU 52 N 1.00 0.38 -0.56 0.00 4.81 -1.19 -0.72 114.58 118.30 3fpa h GLU 52 Ca 0.26 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.40 3fpa h GLU 52 Cb 0.00 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.27 3fpa h GLU 52 CO -0.05 0.25 0.10 0.28 -0.73 0.00 0.00 179.01 178.87 3fpa h VAL 53 N 0.39 1.25 -0.66 0.32 2.07 -0.90 -2.01 116.25 116.72 3fpa h VAL 53 Ca 0.31 -0.94 -0.00 0.00 0.82 0.00 0.00 66.70 66.88 3fpa h VAL 53 Cb 0.39 0.79 -0.03 0.00 -1.52 0.00 0.00 31.29 30.91 3fpa h VAL 53 CO -0.31 0.34 0.40 1.23 0.02 0.00 0.00 177.57 179.25 3fpa h GLY 54 N 0.81 0.96 0.59 2.17 0.00 -1.12 0.95 103.07 107.42 3fpa h GLY 54 Ca 0.17 -0.40 0.08 0.00 0.00 0.00 0.00 47.33 47.18 3fpa h GLY 54 CO 0.01 0.39 0.43 3.21 0.00 0.00 0.00 176.54 180.57 3fpa h ARG 55 N 0.90 0.73 0.08 4.80 3.08 -0.94 0.60 114.38 123.62 3fpa h ARG 55 Ca 0.24 -0.04 -0.29 0.00 0.07 0.00 0.00 59.98 59.95 3fpa h ARG 55 Cb -0.02 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 29.84 3fpa h ARG 55 CO -0.04 0.48 -1.55 -0.07 -1.07 0.00 0.00 179.97 177.71 3fpa h LEU 56 N 0.75 0.27 0.00 3.04 3.38 -1.02 -3.40 115.31 118.33 3fpa h LEU 56 Ca 0.36 -0.78 0.00 0.00 0.09 0.00 0.00 57.88 57.54 3fpa h LEU 56 Cb 0.28 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.95 3fpa h LEU 56 CO -0.22 1.66 -1.07 0.00 0.09 0.00 0.00 178.44 178.89 3fpa n ALA 57 N -3.11 3.82 -1.00 1.53 0.00 0.30 -4.64 120.51 117.40 3fpa n ALA 57 Ca -0.29 -0.47 0.00 0.00 0.00 0.00 0.00 53.44 52.68 3fpa n ALA 57 Cb 0.88 -0.62 0.00 0.00 0.00 0.00 0.00 19.45 19.71 3fpa n ALA 57 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fpa n GLY 58 N 1.43 0.55 3.77 0.00 0.00 0.20 -4.80 105.19 106.35 3fpa n GLY 58 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 3fpa n GLY 58 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fpa s VAL 59 N -2.20 2.33 0.00 1.61 1.01 -1.25 -4.91 120.40 116.98 3fpa s VAL 59 Ca 0.00 0.33 0.00 0.00 0.00 0.00 0.00 61.98 62.31 3fpa s VAL 59 Cb 0.00 -3.21 0.00 0.00 0.00 0.00 0.00 36.38 33.17 3fpa s VAL 59 CO 0.00 0.08 0.00 1.07 0.00 0.00 0.00 175.10 176.25 3fpa n THR 60 N 0.53 0.00 -2.32 3.92 5.66 -1.26 -4.06 114.28 116.75 3fpa n THR 60 Ca 0.01 0.00 -0.35 0.00 -3.05 0.00 0.00 64.05 60.66 3fpa n THR 60 Cb 0.41 -0.38 -0.03 0.00 -1.55 0.00 0.00 70.33 68.77 3fpa n THR 60 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 175.07 170.92 3fpa s GLN 61 N -1.58 3.17 -0.15 1.09 -0.21 -1.26 -4.93 119.66 115.79 3fpa s GLN 61 Ca 0.00 -1.19 0.01 0.00 0.02 0.00 0.00 55.36 54.20 3fpa s GLN 61 Cb 0.00 -5.31 0.02 0.00 1.00 0.00 0.00 33.01 28.72 3fpa s GLN 61 CO 0.00 -2.97 -0.17 -0.51 -2.12 0.00 0.00 175.29 169.52 3fpa s LEU 62 N 7.57 1.84 -0.21 2.90 1.43 -1.26 -1.93 118.68 129.02 3fpa s LEU 62 Ca 0.60 -0.52 0.00 0.00 -1.03 0.00 0.00 54.13 53.17 3fpa s LEU 62 Cb -0.01 -1.26 0.02 0.00 0.03 0.00 0.00 46.19 44.98 3fpa s LEU 62 CO 0.03 -0.01 -0.15 0.00 0.23 0.00 0.00 176.35 176.45 3fpa s ALA 63 N 1.26 2.48 0.49 4.21 0.00 0.17 -5.00 121.76 125.37 3fpa s ALA 63 Ca 0.01 -1.31 0.04 0.00 0.00 0.00 0.00 51.96 50.70 3fpa s ALA 63 Cb -0.14 -1.38 -0.01 0.00 0.00 0.00 0.00 23.12 21.59 3fpa s ALA 63 CO -0.08 -0.53 0.15 0.20 0.00 0.00 0.00 175.76 175.50 3fpa s GLY 64 N 1.30 2.64 0.00 0.00 0.00 -1.26 -0.41 107.32 109.60 3fpa s GLY 64 Ca 0.03 -1.20 0.00 0.00 0.00 0.00 0.00 44.72 43.55 3fpa s GLY 64 CO -0.09 -2.05 0.00 -0.10 0.00 0.00 0.00 173.10 170.85 3fpa n LEU 65 N -1.37 0.00 -4.81 0.66 0.00 -1.24 -4.92 117.00 105.31 3fpa n LEU 65 Ca -0.09 0.00 -0.37 0.00 0.00 0.00 0.00 56.01 55.55 3fpa n LEU 65 Cb 0.66 0.04 -0.06 0.00 0.00 0.00 0.00 43.42 44.05 3fpa n LEU 65 CO 0.41 -0.12 -0.06 0.00 0.00 0.00 0.00 177.39 177.62 3fpa s ALA 66 N -1.70 3.74 -0.09 1.96 0.00 -0.62 -5.04 121.76 120.01 3fpa s ALA 66 Ca 0.00 -0.48 -0.01 0.00 0.00 0.00 0.00 51.96 51.47 3fpa s ALA 66 Cb 0.00 -2.21 0.03 0.00 0.00 0.00 0.00 23.12 20.93 3fpa s ALA 66 CO 0.00 0.39 -0.04 1.03 0.00 0.00 0.00 175.76 177.14 3fpa s ARG 67 N -0.50 1.13 -0.06 0.00 0.52 -1.25 -1.29 118.95 117.49 3fpa s ARG 67 Ca 0.17 -0.10 0.05 0.00 -0.52 0.00 0.00 55.73 55.33 3fpa s ARG 67 Cb -0.13 -1.32 -0.02 0.00 0.52 0.00 0.00 34.95 34.00 3fpa s ARG 67 CO 0.06 -0.28 -0.21 0.71 0.02 0.00 0.00 175.30 175.60 3fpa s TYR 68 N 1.82 2.55 0.14 -0.53 2.02 0.24 -5.01 117.35 118.59 3fpa s TYR 68 Ca 0.05 -0.53 -0.14 0.00 -0.37 0.00 0.00 57.07 56.07 3fpa s TYR 68 Cb -0.12 -1.63 0.01 0.00 -0.40 0.00 0.00 41.96 39.81 3fpa s TYR 68 CO -0.07 -0.09 1.64 -1.35 -1.57 0.00 0.00 175.55 174.11 3fpa h PRO 69 N 5.91 0.72 -6.67 -1.71 0.11 -1.88 -0.10 132.00 128.38 3fpa h PRO 69 Ca -0.36 -0.18 -0.52 0.00 0.11 0.00 0.00 66.00 65.06 3fpa h PRO 69 Cb 1.17 -0.09 0.01 0.00 0.11 0.00 0.00 31.00 32.20 3fpa h PRO 69 CO 0.49 0.72 0.50 -1.14 -0.21 0.00 0.00 178.00 178.36 3fpa s GLN 70 N -5.28 4.57 -1.17 1.05 2.00 -1.26 -1.69 119.66 117.87 3fpa s GLN 70 Ca -0.13 1.77 -0.12 0.00 -2.00 0.00 0.00 55.36 54.88 3fpa s GLN 70 Cb 0.11 -3.26 -0.07 0.00 0.80 0.00 0.00 33.01 30.59 3fpa s GLN 70 CO 0.78 0.05 2.31 -0.35 -0.50 0.00 0.00 175.29 177.59 3fpa n PRO 71 N 2.28 2.53 -3.76 1.67 -0.04 -1.26 -1.61 135.00 134.79 3fpa n PRO 71 Ca 0.03 -1.95 -0.17 0.00 -0.04 0.00 0.00 63.50 61.36 3fpa n PRO 71 Cb 0.46 -2.81 -0.06 0.00 -0.04 0.00 0.00 33.50 31.05 3fpa n PRO 71 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3fpa n MET 72 N 5.02 0.50 -1.64 0.54 0.00 -1.26 -4.90 117.12 115.37 3fpa n MET 72 Ca 0.56 -2.58 -0.39 0.00 0.00 0.00 0.00 57.70 55.29 3fpa n MET 72 Cb 0.27 1.73 0.04 0.00 0.00 0.00 0.00 33.22 35.25 3fpa n MET 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3fpa n ALA 73 N -1.41 0.51 -0.31 3.17 0.00 -1.26 -4.59 120.51 116.61 3fpa n ALA 73 Ca -0.11 0.11 0.02 0.00 0.00 0.00 0.00 53.44 53.47 3fpa n ALA 73 Cb 0.46 -2.15 0.10 0.00 0.00 0.00 0.00 19.45 17.86 3fpa n ALA 73 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3fpa h PRO 74 N 1.10 -0.01 -0.78 0.00 0.11 -1.95 0.31 132.00 130.77 3fpa h PRO 74 Ca -0.48 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.61 3fpa h PRO 74 Cb 1.34 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.42 3fpa h PRO 74 CO 0.54 -0.01 0.40 0.00 -0.21 0.00 0.00 178.00 178.72 3fpa h ALA 75 N 1.74 1.24 0.23 -0.75 0.00 -1.90 -0.05 119.26 119.76 3fpa h ALA 75 Ca 0.40 -0.14 -0.31 0.00 0.00 0.00 0.00 54.91 54.86 3fpa h ALA 75 Cb 0.63 -0.31 0.03 0.00 0.00 0.00 0.00 17.79 18.14 3fpa h ALA 75 CO -0.90 0.60 -1.37 0.00 0.00 0.00 0.00 179.25 177.59 3fpa h ALA 76 N 1.34 -0.13 -0.69 0.00 0.00 -1.74 -2.58 119.26 115.46 3fpa h ALA 76 Ca 0.27 -0.85 0.06 0.00 0.00 0.00 0.00 54.91 54.39 3fpa h ALA 76 Cb 0.07 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 3fpa h ALA 76 CO -0.04 0.65 0.45 0.00 0.00 0.00 0.00 179.25 180.31 3fpa h ALA 77 N 0.13 1.71 0.30 0.00 0.00 -0.21 -1.18 119.26 120.00 3fpa h ALA 77 Ca -0.24 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 3fpa h ALA 77 Cb 2.06 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.66 3fpa h ALA 77 CO 0.24 0.19 -0.14 0.00 0.00 0.00 0.00 179.25 179.55 3fpa h ALA 78 N 1.62 -0.40 -0.80 0.00 0.00 -1.03 -2.81 119.26 115.84 3fpa h ALA 78 Ca 0.29 -0.19 0.18 0.00 0.00 0.00 0.00 54.91 55.19 3fpa h ALA 78 Cb 0.22 0.15 -0.12 0.00 0.00 0.00 0.00 17.79 18.04 3fpa h ALA 78 CO -0.09 -0.49 0.24 0.93 0.00 0.00 0.00 179.25 179.83 3fpa h GLU 79 N -0.86 0.30 -0.44 0.00 5.08 -1.37 0.01 114.58 117.30 3fpa h GLU 79 Ca -0.04 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 3fpa h GLU 79 Cb 0.52 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 3fpa h GLU 79 CO 0.07 0.20 0.25 1.25 -1.00 0.00 0.00 179.01 179.77 3fpa h HIS 80 N 0.30 0.59 -0.12 4.33 2.76 -1.18 -2.44 115.15 119.39 3fpa h HIS 80 Ca 0.47 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.64 3fpa h HIS 80 Cb 0.83 -0.19 0.00 0.00 1.55 0.00 0.00 27.41 29.60 3fpa h HIS 80 CO -0.23 0.41 0.00 0.00 -1.30 0.00 0.00 177.93 176.81 3fpa n ALA 81 N -2.47 2.52 -1.82 5.26 0.00 -0.25 -4.90 120.51 118.86 3fpa n ALA 81 Ca 0.03 -0.56 -0.15 0.00 0.00 0.00 0.00 53.44 52.76 3fpa n ALA 81 Cb 0.09 -1.06 -0.04 0.00 0.00 0.00 0.00 19.45 18.44 3fpa n ALA 81 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fpa n GLY 82 N 1.21 0.76 4.01 0.00 0.00 -0.84 -5.01 105.19 105.33 3fpa n GLY 82 Ca 0.17 -0.27 -0.20 0.00 0.00 0.00 0.00 46.02 45.73 3fpa n GLY 82 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3fpa s MET 83 N -3.95 2.42 0.35 1.61 -1.94 -0.17 -4.99 119.30 112.63 3fpa s MET 83 Ca 0.00 -1.58 0.09 0.00 -1.71 0.00 0.00 55.69 52.48 3fpa s MET 83 Cb 0.00 -2.62 -0.05 0.00 2.01 0.00 0.00 34.83 34.17 3fpa s MET 83 CO 0.00 -0.69 0.07 0.00 -0.01 0.00 0.00 175.02 174.38 3fpa s ALA 84 N -2.60 3.32 0.47 3.03 0.00 -1.26 -4.09 121.76 120.63 3fpa s ALA 84 Ca 0.58 -1.95 -0.19 0.00 0.00 0.00 0.00 51.96 50.40 3fpa s ALA 84 Cb -0.06 -0.46 -0.09 0.00 0.00 0.00 0.00 23.12 22.51 3fpa s ALA 84 CO 0.36 0.03 0.97 -0.51 0.00 0.00 0.00 175.76 176.61 3fpa s LEU 85 N -3.77 3.79 0.92 0.00 1.43 -1.26 -4.95 118.68 114.84 3fpa s LEU 85 Ca 0.36 1.65 -0.12 0.00 -1.03 0.00 0.00 54.13 54.99 3fpa s LEU 85 Cb -0.00 -4.53 0.15 0.00 0.03 0.00 0.00 46.19 41.84 3fpa s LEU 85 CO 0.21 -0.49 1.12 -2.16 0.23 0.00 0.00 176.35 175.26 3fpa s PRO 86 N -3.60 1.03 0.47 1.29 0.04 -1.26 -4.79 135.00 128.19 3fpa s PRO 86 Ca 0.61 0.38 -0.07 0.00 0.04 0.00 0.00 61.00 61.96 3fpa s PRO 86 Cb -0.10 -1.82 -0.04 0.00 0.04 0.00 0.00 34.50 32.58 3fpa s PRO 86 CO 0.22 -2.29 0.80 0.00 0.04 0.00 0.00 177.00 175.77 3fpa s ALA 87 N -3.18 3.36 0.32 8.56 0.00 -1.26 -4.03 121.76 125.53 3fpa s ALA 87 Ca 0.64 -0.39 0.09 0.00 0.00 0.00 0.00 51.96 52.30 3fpa s ALA 87 Cb -0.16 -2.66 0.89 0.00 0.00 0.00 0.00 23.12 21.19 3fpa s ALA 87 CO 0.55 -0.29 1.69 -0.09 0.00 0.00 0.00 175.76 177.62 3fpa h ARG 88 N 0.46 0.39 -0.22 0.00 2.43 -1.93 -2.27 114.38 113.24 3fpa h ARG 88 Ca -0.47 -0.02 -0.20 0.00 -0.81 0.00 0.00 59.98 58.48 3fpa h ARG 88 Cb 1.20 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.67 3fpa h ARG 88 CO 0.62 0.26 -0.66 -0.44 -1.51 0.00 0.00 179.97 178.24 3fpa h ASP 89 N 0.40 0.94 -0.73 -3.80 3.32 -1.99 -1.93 116.42 112.63 3fpa h ASP 89 Ca 0.64 -0.56 0.01 0.00 0.02 0.00 0.00 57.03 57.15 3fpa h ASP 89 Cb 1.32 -0.27 -0.04 0.00 0.22 0.00 0.00 39.33 40.56 3fpa h ASP 89 CO -0.56 1.35 0.49 1.56 -1.72 0.00 0.00 179.24 180.36 3fpa h GLN 90 N 0.60 0.95 -0.08 3.56 4.20 -1.80 -0.61 115.11 121.93 3fpa h GLN 90 Ca -0.02 -0.06 -0.04 0.00 0.06 0.00 0.00 58.65 58.60 3fpa h GLN 90 Cb 1.27 -0.21 -0.00 0.00 0.30 0.00 0.00 27.48 28.84 3fpa h GLN 90 CO 0.14 0.63 -0.10 0.82 -0.67 0.00 0.00 178.83 179.65 3fpa h ILE 91 N 0.97 1.38 -0.75 2.54 2.04 -1.17 -0.58 117.51 121.95 3fpa h ILE 91 Ca 0.27 -1.30 -0.01 0.00 1.00 0.00 0.00 64.86 64.82 3fpa h ILE 91 Cb -0.08 2.07 -0.04 0.00 -0.74 0.00 0.00 36.82 38.04 3fpa h ILE 91 CO -0.06 0.36 0.41 0.58 0.00 0.00 0.00 178.15 179.44 3fpa h VAL 92 N -0.25 1.22 -0.21 1.67 2.07 -1.19 -1.94 116.25 117.62 3fpa h VAL 92 Ca 0.01 -0.54 -0.08 0.00 0.82 0.00 0.00 66.70 66.91 3fpa h VAL 92 Cb 0.63 0.21 -0.00 0.00 -1.52 0.00 0.00 31.29 30.60 3fpa h VAL 92 CO 0.02 0.24 -0.17 -0.09 0.02 0.00 0.00 177.57 177.60 3fpa h ARG 93 N 1.04 0.48 -0.84 1.57 2.43 -1.12 0.19 114.38 118.13 3fpa h ARG 93 Ca 0.27 -0.24 0.17 0.00 -0.81 0.00 0.00 59.98 59.37 3fpa h ARG 93 Cb 0.02 0.00 -0.11 0.00 -0.42 0.00 0.00 29.97 29.46 3fpa h ARG 93 CO -0.04 0.81 0.38 1.25 -1.51 0.00 0.00 179.97 180.85 3fpa h LEU 94 N 0.17 0.37 0.16 3.80 5.85 -0.84 -0.97 115.31 123.85 3fpa h LEU 94 Ca 0.04 0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 3fpa h LEU 94 Cb 0.70 0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.82 3fpa h LEU 94 CO 0.04 0.10 -0.08 0.40 -0.34 0.00 0.00 178.44 178.57 3fpa h ILE 95 N 0.48 0.86 -0.64 4.05 2.04 -1.01 -3.34 117.51 119.95 3fpa h ILE 95 Ca 0.49 -1.13 0.11 0.00 1.00 0.00 0.00 64.86 65.33 3fpa h ILE 95 Cb 0.80 1.44 -0.04 0.00 -0.74 0.00 0.00 36.82 38.28 3fpa h ILE 95 CO -0.44 0.22 0.43 0.00 0.00 0.00 0.00 178.15 178.36 3fpa h ALA 96 N -0.28 2.06 -0.05 1.87 0.00 -0.45 -0.70 119.26 121.72 3fpa h ALA 96 Ca -0.02 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.89 3fpa h ALA 96 Cb 0.53 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 3fpa h ALA 96 CO 0.04 -0.22 0.12 -0.44 0.00 0.00 0.00 179.25 178.74 3fpa h ASP 97 N 0.39 0.00 0.74 0.00 3.32 -1.29 -2.43 116.42 117.15 3fpa h ASP 97 Ca 0.30 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.35 3fpa h ASP 97 Cb 0.64 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.19 3fpa h ASP 97 CO -0.08 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.62 3fpa n LEU 98 N -3.35 0.00 -4.67 1.55 4.77 -0.27 -4.93 117.00 110.09 3fpa n LEU 98 Ca -0.02 0.38 -0.47 0.00 -0.03 0.00 0.00 56.01 55.88 3fpa n LEU 98 Cb 0.20 -0.38 -0.04 0.00 -2.33 0.00 0.00 43.42 40.86 3fpa n LEU 98 CO 0.22 -0.01 1.32 -0.67 -1.33 0.00 0.00 177.39 176.91 3fpa n ASP 99 N -1.38 3.28 -3.74 -1.43 4.64 -0.92 -5.00 116.55 112.00 3fpa n ASP 99 Ca 0.11 1.04 -0.13 0.00 -1.38 0.00 0.00 54.79 54.43 3fpa n ASP 99 Cb 0.28 -1.42 -0.08 0.00 -1.04 0.00 0.00 41.12 38.86 3fpa n ASP 99 CO 0.00 0.00 0.00 -0.13 -0.82 0.00 0.00 177.20 176.25 3fpa s ARG 100 N 2.14 0.74 0.24 -0.67 1.81 -1.26 -4.96 118.95 116.99 3fpa s ARG 100 Ca 0.84 -0.29 -0.30 0.00 -1.72 0.00 0.00 55.73 54.26 3fpa s ARG 100 Cb -0.67 0.33 -0.10 0.00 -0.45 0.00 0.00 34.95 34.06 3fpa s ARG 100 CO 0.43 -0.22 1.47 -2.14 -0.68 0.00 0.00 175.30 174.16 3fpa s PRO 101 N -1.79 4.24 -0.51 3.54 0.02 -1.26 -2.14 135.00 137.10 3fpa s PRO 101 Ca -0.10 2.34 0.00 0.00 0.02 0.00 0.00 61.00 63.26 3fpa s PRO 101 Cb -0.03 -3.11 0.00 0.00 0.02 0.00 0.00 34.50 31.38 3fpa s PRO 101 CO 0.02 -0.47 0.00 0.41 -0.33 0.00 0.00 177.00 176.63 3fpa n GLY 102 N 2.42 0.66 3.79 0.52 0.00 -1.20 -4.87 105.19 106.51 3fpa n GLY 102 Ca 0.08 -0.20 -0.37 0.00 0.00 0.00 0.00 46.02 45.53 3fpa n GLY 102 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3fpa s ARG 103 N -1.89 4.50 -0.27 1.61 6.06 -1.13 -4.36 118.95 123.48 3fpa s ARG 103 Ca 0.00 1.22 -0.10 0.00 -2.50 0.00 0.00 55.73 54.35 3fpa s ARG 103 Cb 0.00 -2.80 -0.04 0.00 0.06 0.00 0.00 34.95 32.17 3fpa s ARG 103 CO 0.00 0.30 0.15 -1.17 -2.50 0.00 0.00 175.30 172.07 3fpa s LEU 104 N -2.07 3.82 -0.20 -0.88 2.96 0.50 -1.01 118.68 121.80 3fpa s LEU 104 Ca 0.49 -0.07 -0.05 0.00 -0.22 0.00 0.00 54.13 54.28 3fpa s LEU 104 Cb -0.18 -2.05 -0.02 0.00 0.50 0.00 0.00 46.19 44.44 3fpa s LEU 104 CO 0.23 -0.03 -0.01 -0.89 -1.32 0.00 0.00 176.35 174.32 3fpa s THR 105 N 1.65 3.83 -0.22 3.68 2.01 0.37 -0.81 115.64 126.14 3fpa s THR 105 Ca 0.07 -0.36 -0.06 0.00 0.31 0.00 0.00 61.69 61.65 3fpa s THR 105 Cb -0.16 -2.73 -0.02 0.00 0.01 0.00 0.00 72.50 69.61 3fpa s THR 105 CO 0.08 0.43 0.02 -0.76 -0.69 0.00 0.00 174.62 173.70 3fpa s LEU 106 N 1.04 3.26 -0.35 4.42 1.43 -0.08 -0.08 118.68 128.32 3fpa s LEU 106 Ca 0.02 -0.24 -0.06 0.00 -1.03 0.00 0.00 54.13 52.82 3fpa s LEU 106 Cb -0.14 -1.85 0.05 0.00 0.03 0.00 0.00 46.19 44.28 3fpa s LEU 106 CO 0.01 0.01 0.13 -0.69 0.23 0.00 0.00 176.35 176.04 3fpa s VAL 107 N 1.34 3.73 -0.19 -1.59 1.01 0.11 -0.35 120.40 124.45 3fpa s VAL 107 Ca 0.04 -1.28 -0.23 0.00 0.00 0.00 0.00 61.98 60.52 3fpa s VAL 107 Cb -0.15 -3.18 -0.02 0.00 0.00 0.00 0.00 36.38 33.04 3fpa s VAL 107 CO 0.01 -0.26 0.74 -0.70 0.00 0.00 0.00 175.10 174.89 3fpa s GLU 108 N 1.37 4.24 1.06 2.72 2.12 -0.23 0.29 118.70 130.27 3fpa s GLU 108 Ca -0.00 0.82 -0.14 0.00 0.36 0.00 0.00 54.97 56.00 3fpa s GLU 108 Cb -0.20 -3.59 0.22 0.00 0.26 0.00 0.00 34.13 30.82 3fpa s GLU 108 CO 0.02 -0.32 1.10 0.20 -0.54 0.00 0.00 175.26 175.72 3fpa s GLY 109 N 1.21 1.57 -0.31 -1.50 0.00 -1.05 -4.36 107.32 102.87 3fpa s GLY 109 Ca 0.33 -0.55 -0.12 0.00 0.00 0.00 0.00 44.72 44.38 3fpa s GLY 109 CO 0.11 0.14 0.21 0.00 0.00 0.00 0.00 173.10 173.56 3fpa s ALA 110 N -3.00 3.49 0.00 3.20 0.00 -1.26 -4.98 121.76 119.21 3fpa s ALA 110 Ca 0.67 -1.26 0.00 0.00 0.00 0.00 0.00 51.96 51.37 3fpa s ALA 110 Cb -0.16 -2.56 0.00 0.00 0.00 0.00 0.00 23.12 20.40 3fpa s ALA 110 CO 0.57 -0.79 0.00 0.41 0.00 0.00 0.00 175.76 175.95 3fpa n GLY 111 N 5.07 1.01 4.01 0.00 0.00 -1.26 -4.65 105.19 109.38 3fpa n GLY 111 Ca -0.13 -0.74 -0.22 0.00 0.00 0.00 0.00 46.02 44.92 3fpa n GLY 111 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3fpa s GLY 112 N -0.83 1.74 0.31 -0.02 0.00 -1.24 -4.10 107.32 103.18 3fpa s GLY 112 Ca 0.00 -1.96 0.06 0.00 0.00 0.00 0.00 44.72 42.82 3fpa s GLY 112 CO 0.00 -1.39 1.79 -2.00 0.00 0.00 0.00 173.10 171.51 3fpa h LEU 113 N -0.35 0.77 -3.55 0.66 5.85 -1.89 -2.56 115.31 114.24 3fpa h LEU 113 Ca -0.33 0.08 -0.05 0.00 0.84 0.00 0.00 57.88 58.43 3fpa h LEU 113 Cb 1.27 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 42.21 3fpa h LEU 113 CO 0.39 0.30 0.06 0.18 -0.34 0.00 0.00 178.44 179.02 3fpa n LEU 114 N -4.71 5.50 -4.77 2.25 4.77 -1.26 -3.68 117.00 115.10 3fpa n LEU 114 Ca 0.22 -3.03 -0.41 0.00 -0.03 0.00 0.00 56.01 52.77 3fpa n LEU 114 Cb 0.55 -0.68 -0.02 0.00 -2.33 0.00 0.00 43.42 40.94 3fpa n LEU 114 CO 0.23 0.69 0.98 -0.69 -1.33 0.00 0.00 177.39 177.27 3fpa s VAL 115 N -2.84 2.74 -0.21 4.08 1.01 -0.97 -4.94 120.40 119.26 3fpa s VAL 115 Ca 0.53 0.73 -0.29 0.00 0.00 0.00 0.00 61.98 62.94 3fpa s VAL 115 Cb 0.41 -3.46 0.01 0.00 0.00 0.00 0.00 36.38 33.33 3fpa s VAL 115 CO 0.14 0.17 1.04 -0.70 0.00 0.00 0.00 175.10 175.75 3fpa s GLU 116 N -1.64 4.28 -0.02 2.72 2.12 -1.26 -4.25 118.70 120.65 3fpa s GLU 116 Ca 0.50 1.37 0.14 0.00 0.36 0.00 0.00 54.97 57.35 3fpa s GLU 116 Cb -0.40 -3.63 -0.22 0.00 0.26 0.00 0.00 34.13 30.14 3fpa s GLU 116 CO 0.52 -0.60 0.32 1.28 -0.54 0.00 0.00 175.26 176.24 3fpa n LEU 117 N 6.19 0.01 -3.72 2.70 4.77 0.27 -4.33 117.00 122.88 3fpa n LEU 117 Ca 0.12 -0.01 -0.11 0.00 -0.03 0.00 0.00 56.01 55.98 3fpa n LEU 117 Cb 0.46 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.49 3fpa n LEU 117 CO 0.52 0.00 0.07 0.00 -1.33 0.00 0.00 177.39 176.66 3fpa s ALA 118 N -2.99 -0.76 0.22 -1.18 0.00 -1.08 -4.12 121.76 111.85 3fpa s ALA 118 Ca -0.05 -0.01 -0.17 0.00 0.00 0.00 0.00 51.96 51.73 3fpa s ALA 118 Cb 0.09 0.43 -0.08 0.00 0.00 0.00 0.00 23.12 23.57 3fpa s ALA 118 CO 0.60 -0.49 0.67 -1.21 0.00 0.00 0.00 175.76 175.33 3fpa s GLU 119 N -2.99 4.10 -0.31 0.00 2.02 -1.26 -1.28 118.70 118.99 3fpa s GLU 119 Ca -0.02 0.69 -0.09 0.00 0.02 0.00 0.00 54.97 55.57 3fpa s GLU 119 Cb 0.01 -2.78 -0.00 0.00 0.10 0.00 0.00 34.13 31.45 3fpa s GLU 119 CO -0.06 0.36 0.14 -1.25 0.02 0.00 0.00 175.26 174.47 3fpa s PRO 120 N -2.24 3.30 -1.35 0.39 0.04 -1.26 -4.73 135.00 129.15 3fpa s PRO 120 Ca 0.44 -0.74 -0.02 0.00 0.04 0.00 0.00 61.00 60.72 3fpa s PRO 120 Cb -0.14 -3.53 0.00 0.00 0.04 0.00 0.00 34.50 30.87 3fpa s PRO 120 CO 0.20 -0.42 0.28 0.41 0.04 0.00 0.00 177.00 177.51 3fpa n GLY 121 N 4.96 -0.31 3.71 0.56 0.00 -1.21 -4.99 105.19 107.90 3fpa n GLY 121 Ca -0.14 -0.10 -0.41 0.00 0.00 0.00 0.00 46.02 45.38 3fpa n GLY 121 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fpa s VAL 122 N -2.97 4.97 0.38 1.61 1.01 -0.40 -4.97 120.40 120.04 3fpa s VAL 122 Ca 0.14 1.65 0.06 0.00 0.00 0.00 0.00 61.98 63.83 3fpa s VAL 122 Cb -0.06 -4.14 -0.07 0.00 0.00 0.00 0.00 36.38 32.11 3fpa s VAL 122 CO 0.17 0.20 0.02 0.42 0.00 0.00 0.00 175.10 175.91 3fpa s THR 123 N 1.03 1.77 0.66 3.92 -4.23 -1.26 0.94 115.64 118.47 3fpa s THR 123 Ca 0.42 -2.01 0.37 0.00 -1.18 0.00 0.00 61.69 59.29 3fpa s THR 123 Cb -0.19 -2.92 0.37 0.00 1.34 0.00 0.00 72.50 71.11 3fpa s THR 123 CO 0.20 -0.01 2.14 0.25 -0.54 0.00 0.00 174.62 176.66 3fpa h LEU 124 N 1.89 0.00 -0.11 4.79 6.46 -1.74 -1.74 115.31 124.86 3fpa h LEU 124 Ca -0.43 0.00 -0.23 0.00 -0.12 0.00 0.00 57.88 57.10 3fpa h LEU 124 Cb 1.24 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.17 3fpa h LEU 124 CO 0.77 0.00 -1.01 -0.09 -0.62 0.00 0.00 178.44 177.49 3fpa h ARG 125 N 0.00 0.33 -0.15 1.25 2.43 -1.94 -2.14 114.38 114.17 3fpa h ARG 125 Ca 0.01 -0.41 -0.18 0.00 -0.81 0.00 0.00 59.98 58.59 3fpa h ARG 125 Cb 0.35 0.13 0.01 0.00 -0.42 0.00 0.00 29.97 30.04 3fpa h ARG 125 CO -0.00 1.11 -0.61 -0.44 -1.51 0.00 0.00 179.97 178.52 3fpa h ASP 126 N 0.16 0.79 -0.82 -3.80 3.32 -1.71 -2.59 116.42 111.78 3fpa h ASP 126 Ca -0.09 -0.62 0.14 0.00 0.02 0.00 0.00 57.03 56.49 3fpa h ASP 126 Cb 1.67 -0.23 -0.09 0.00 0.22 0.00 0.00 39.33 40.90 3fpa h ASP 126 CO 0.17 1.28 0.39 0.58 -1.72 0.00 0.00 179.24 179.94 3fpa h VAL 127 N 0.35 0.71 -0.14 -1.35 2.07 -1.50 -0.94 116.25 115.45 3fpa h VAL 127 Ca -0.03 -0.19 -0.09 0.00 0.82 0.00 0.00 66.70 67.20 3fpa h VAL 127 Cb 1.24 0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 3fpa h VAL 127 CO 0.13 0.10 -0.30 0.00 0.02 0.00 0.00 177.57 177.52 3fpa h ALA 128 N 1.55 1.23 -0.38 1.67 0.00 -1.26 -1.88 119.26 120.19 3fpa h ALA 128 Ca 0.44 -0.34 -0.12 0.00 0.00 0.00 0.00 54.91 54.89 3fpa h ALA 128 Cb 0.64 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 3fpa h ALA 128 CO -0.37 0.51 -0.25 0.28 0.00 0.00 0.00 179.25 179.43 3fpa h VAL 129 N 0.24 1.28 -0.32 0.00 2.07 -1.00 0.35 116.25 118.87 3fpa h VAL 129 Ca 0.03 -1.40 -0.10 0.00 0.82 0.00 0.00 66.70 66.06 3fpa h VAL 129 Cb 0.66 1.36 -0.01 0.00 -1.52 0.00 0.00 31.29 31.77 3fpa h VAL 129 CO 0.05 0.46 -0.21 0.44 0.02 0.00 0.00 177.57 178.33 3fpa h ASP 130 N 0.63 0.60 -0.57 0.57 3.45 -0.71 -3.05 116.42 117.34 3fpa h ASP 130 Ca 0.08 -0.20 0.00 0.00 0.43 0.00 0.00 57.03 57.34 3fpa h ASP 130 Cb 0.81 -0.16 0.00 0.00 -0.56 0.00 0.00 39.33 39.42 3fpa h ASP 130 CO 0.07 0.81 0.00 1.33 -1.57 0.00 0.00 179.24 179.88 3fpa n VAL 131 N -4.13 0.93 -3.99 -1.35 0.24 -0.75 -4.97 118.33 104.31 3fpa n VAL 131 Ca 0.00 -0.97 -0.27 0.00 -2.04 0.00 0.00 64.34 61.06 3fpa n VAL 131 Cb 0.40 0.56 -0.02 0.00 -1.47 0.00 0.00 33.84 33.31 3fpa n VAL 131 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3fpa n ALA 132 N 1.26 -1.86 -2.06 2.33 0.00 -0.86 -4.93 120.51 114.39 3fpa n ALA 132 Ca 0.20 -0.20 -0.35 0.00 0.00 0.00 0.00 53.44 53.08 3fpa n ALA 132 Cb 0.55 -1.94 -0.06 0.00 0.00 0.00 0.00 19.45 18.00 3fpa n ALA 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fpa s ALA 133 N -3.82 3.35 0.40 0.00 0.00 0.06 -4.84 121.76 116.90 3fpa s ALA 133 Ca 0.15 0.19 -0.06 0.00 0.00 0.00 0.00 51.96 52.24 3fpa s ALA 133 Cb -0.08 -2.86 -0.05 0.00 0.00 0.00 0.00 23.12 20.13 3fpa s ALA 133 CO 0.89 0.30 0.69 0.00 0.00 0.00 0.00 175.76 177.64 3fpa s ALA 134 N -1.68 3.49 -0.13 0.00 0.00 -1.15 -4.44 121.76 117.84 3fpa s ALA 134 Ca 0.48 -0.51 -0.04 0.00 0.00 0.00 0.00 51.96 51.89 3fpa s ALA 134 Cb -0.15 -2.48 -0.03 0.00 0.00 0.00 0.00 23.12 20.46 3fpa s ALA 134 CO 0.20 -0.08 -0.00 0.00 0.00 0.00 0.00 175.76 175.88 3fpa s ALA 135 N -2.43 3.19 -0.21 0.00 0.00 0.28 -1.62 121.76 120.96 3fpa s ALA 135 Ca 0.46 -0.80 -0.06 0.00 0.00 0.00 0.00 51.96 51.57 3fpa s ALA 135 Cb -0.10 -1.59 -0.03 0.00 0.00 0.00 0.00 23.12 21.40 3fpa s ALA 135 CO 0.37 0.36 0.02 -1.17 0.00 0.00 0.00 175.76 175.34 3fpa s LEU 136 N -0.16 3.35 -0.14 0.00 2.96 0.84 -0.54 118.68 124.99 3fpa s LEU 136 Ca 0.05 -0.17 -0.02 0.00 -0.22 0.00 0.00 54.13 53.76 3fpa s LEU 136 Cb -0.13 -1.86 -0.02 0.00 0.50 0.00 0.00 46.19 44.69 3fpa s LEU 136 CO 0.02 0.06 -0.08 0.54 -1.32 0.00 0.00 176.35 175.57 3fpa s VAL 137 N 1.04 3.46 -0.18 1.68 0.11 -0.51 -0.34 120.40 125.66 3fpa s VAL 137 Ca 0.02 -0.51 -0.12 0.00 -2.93 0.00 0.00 61.98 58.44 3fpa s VAL 137 Cb -0.14 -2.49 -0.05 0.00 -1.53 0.00 0.00 36.38 32.17 3fpa s VAL 137 CO 0.02 0.51 0.22 -0.69 -3.33 0.00 0.00 175.10 171.83 3fpa s VAL 138 N 0.36 5.35 0.23 2.04 1.01 -0.53 -0.78 120.40 128.08 3fpa s VAL 138 Ca -0.08 0.39 0.05 0.00 0.00 0.00 0.00 61.98 62.34 3fpa s VAL 138 Cb -0.15 -3.56 -0.05 0.00 0.00 0.00 0.00 36.38 32.62 3fpa s VAL 138 CO 0.04 0.42 -0.04 0.68 0.00 0.00 0.00 175.10 176.20 3fpa s VAL 139 N 0.39 1.26 0.54 2.92 -7.23 -0.41 -1.32 120.40 116.55 3fpa s VAL 139 Ca 0.13 -2.07 0.05 0.00 -1.81 0.00 0.00 61.98 58.28 3fpa s VAL 139 Cb -0.12 -2.30 0.06 0.00 0.56 0.00 0.00 36.38 34.57 3fpa s VAL 139 CO 0.01 -0.38 0.75 0.42 -0.31 0.00 0.00 175.10 175.60 3fpa s THR 140 N -3.27 2.55 -2.26 5.32 -4.23 -1.26 -1.23 115.64 111.25 3fpa s THR 140 Ca 0.27 -0.85 0.23 0.00 -1.18 0.00 0.00 61.69 60.16 3fpa s THR 140 Cb 0.04 -2.70 0.51 0.00 1.34 0.00 0.00 72.50 71.69 3fpa s THR 140 CO 0.09 0.00 1.45 0.00 -0.54 0.00 0.00 174.62 175.62 3fpa n ALA 141 N -2.24 2.40 -1.92 3.99 0.00 -1.26 -4.83 120.51 116.64 3fpa n ALA 141 Ca 0.11 -1.12 -0.28 0.00 0.00 0.00 0.00 53.44 52.15 3fpa n ALA 141 Cb 0.60 -0.88 0.07 0.00 0.00 0.00 0.00 19.45 19.23 3fpa n ALA 141 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3fpa s ASP 142 N -1.29 4.97 0.14 0.00 -0.00 -1.26 -4.19 116.67 115.03 3fpa s ASP 142 Ca 0.43 0.80 -0.33 0.00 -0.00 0.00 0.00 52.55 53.45 3fpa s ASP 142 Cb 0.24 -1.47 -0.13 0.00 -0.00 0.00 0.00 42.92 41.56 3fpa s ASP 142 CO 0.32 -1.58 1.70 0.18 -0.00 0.00 0.00 175.17 175.79 3fpa n LEU 143 N -3.06 3.56 0.00 1.23 4.77 -1.26 -1.26 117.00 120.98 3fpa n LEU 143 Ca 0.07 1.05 0.00 0.00 -0.03 0.00 0.00 56.01 57.10 3fpa n LEU 143 Cb 0.59 -1.48 0.00 0.00 -2.33 0.00 0.00 43.42 40.20 3fpa n LEU 143 CO 0.56 -0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 3fpa n GLY 144 N 3.83 1.71 0.23 -0.72 0.00 -1.26 -4.98 105.19 104.00 3fpa n GLY 144 Ca 0.18 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.20 3fpa n GLY 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fpa h THR 145 N 0.00 1.22 -0.05 2.61 1.03 -1.50 -2.48 112.91 113.75 3fpa h THR 145 Ca 0.00 -1.03 -0.21 0.00 -0.01 0.00 0.00 66.41 65.16 3fpa h THR 145 Cb 0.00 1.35 0.01 0.00 -1.07 0.00 0.00 68.15 68.44 3fpa h THR 145 CO 0.00 0.32 -0.78 -0.07 -0.01 0.00 0.00 175.52 174.98 3fpa h LEU 146 N 0.24 0.77 -0.40 0.00 -0.00 -1.93 -0.19 115.31 113.80 3fpa h LEU 146 Ca 0.04 -0.71 -0.02 0.00 -0.00 0.00 0.00 57.88 57.19 3fpa h LEU 146 Cb 0.52 -0.23 -0.02 0.00 -0.00 0.00 0.00 40.66 40.93 3fpa h LEU 146 CO 0.03 1.36 0.16 -1.13 -0.00 0.00 0.00 178.44 178.87 3fpa h ASN 147 N 0.24 0.56 -0.41 -0.43 -1.24 -1.97 -1.58 115.58 110.74 3fpa h ASN 147 Ca -0.08 -0.17 -0.09 0.00 0.71 0.00 0.00 56.30 56.67 3fpa h ASN 147 Cb 1.44 -0.14 -0.01 0.00 0.73 0.00 0.00 38.32 40.33 3fpa h ASN 147 CO 0.16 0.57 -0.08 0.45 -1.29 0.00 0.00 177.43 177.23 3fpa h HIS 148 N 0.51 0.88 -0.50 0.67 3.86 -1.39 -0.70 115.15 118.48 3fpa h HIS 148 Ca 0.13 -0.18 -0.10 0.00 -1.16 0.00 0.00 60.37 59.06 3fpa h HIS 148 Cb 0.19 -0.22 -0.02 0.00 1.06 0.00 0.00 27.41 28.42 3fpa h HIS 148 CO -0.00 0.90 -0.08 0.00 0.86 0.00 0.00 177.93 179.61 3fpa h THR 149 N 0.61 1.27 -0.57 2.45 1.03 -1.04 -1.83 112.91 114.83 3fpa h THR 149 Ca 0.11 -1.21 -0.03 0.00 -0.01 0.00 0.00 66.41 65.27 3fpa h THR 149 Cb 0.61 1.03 -0.03 0.00 -1.07 0.00 0.00 68.15 68.69 3fpa h THR 149 CO 0.04 0.42 0.23 0.11 -0.01 0.00 0.00 175.52 176.31 3fpa h LYS 150 N 0.80 0.82 -0.62 0.00 1.57 -1.21 0.11 116.57 118.04 3fpa h LYS 150 Ca 0.13 -0.12 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 3fpa h LYS 150 Cb 0.63 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.77 3fpa h LYS 150 CO 0.04 0.67 0.30 -0.07 -0.57 0.00 0.00 179.45 179.82 3fpa h LEU 151 N 0.81 0.81 -0.06 2.94 4.07 -0.92 -2.27 115.31 120.69 3fpa h LEU 151 Ca 0.19 -0.13 -0.02 0.00 0.08 0.00 0.00 57.88 58.00 3fpa h LEU 151 Cb 0.16 -0.21 -0.00 0.00 1.08 0.00 0.00 40.66 41.69 3fpa h LEU 151 CO -0.02 0.71 -0.05 0.74 -1.08 0.00 0.00 178.44 178.74 3fpa h THR 152 N 0.85 1.36 -0.92 0.22 2.02 -0.58 -2.56 112.91 113.29 3fpa h THR 152 Ca 0.21 -1.18 0.12 0.00 0.77 0.00 0.00 66.41 66.33 3fpa h THR 152 Cb 0.11 2.02 -0.08 0.00 -1.74 0.00 0.00 68.15 68.46 3fpa h THR 152 CO -0.03 0.32 0.55 -0.07 0.37 0.00 0.00 175.52 176.67 3fpa h LEU 153 N -0.29 0.78 -0.42 2.58 4.07 -0.83 -1.83 115.31 119.37 3fpa h LEU 153 Ca 0.01 0.06 -0.17 0.00 0.08 0.00 0.00 57.88 57.86 3fpa h LEU 153 Cb 0.55 -0.09 -0.00 0.00 1.08 0.00 0.00 40.66 42.19 3fpa h LEU 153 CO 0.01 0.41 -0.48 -0.08 -1.08 0.00 0.00 178.44 177.22 3fpa h GLU 154 N 0.86 0.79 -0.57 1.13 4.81 -1.37 -1.66 114.58 118.57 3fpa h GLU 154 Ca 0.46 -0.46 -0.09 0.00 -0.13 0.00 0.00 59.36 59.15 3fpa h GLU 154 Cb 0.49 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.89 3fpa h GLU 154 CO -0.28 1.09 0.01 0.00 -0.73 0.00 0.00 179.01 179.10 3fpa h ALA 155 N 0.83 0.93 -0.42 2.92 0.00 -1.24 -2.01 119.26 120.28 3fpa h ALA 155 Ca 0.03 -0.29 0.03 0.00 0.00 0.00 0.00 54.91 54.67 3fpa h ALA 155 Cb 1.06 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 3fpa h ALA 155 CO 0.10 0.64 0.22 -0.07 0.00 0.00 0.00 179.25 180.15 3fpa h LEU 156 N 0.91 0.33 -1.56 0.00 3.38 -1.18 -2.87 115.31 114.32 3fpa h LEU 156 Ca 0.17 0.02 -0.05 0.00 0.09 0.00 0.00 57.88 58.11 3fpa h LEU 156 Cb 0.51 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 3fpa h LEU 156 CO 0.03 0.24 -0.23 0.00 0.09 0.00 0.00 178.44 178.57 3fpa h ALA 157 N 1.21 1.39 0.00 1.53 0.00 -1.09 -1.57 119.26 120.73 3fpa h ALA 157 Ca 0.18 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 3fpa h ALA 157 Cb 0.06 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 3fpa h ALA 157 CO -0.11 0.29 -0.06 0.00 0.00 0.00 0.00 179.25 179.37 3fpa h ALA 158 N 1.77 1.30 -0.20 0.00 0.00 -1.13 -1.73 119.26 119.27 3fpa h ALA 158 Ca -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3fpa h ALA 158 Cb 0.48 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.26 3fpa h ALA 158 CO 0.03 0.07 0.00 1.04 0.00 0.00 0.00 179.25 180.39 3fpa n GLN 159 N -3.59 2.91 -2.90 0.00 1.13 -1.01 -4.99 117.38 108.93 3fpa n GLN 159 Ca -0.02 -1.85 -0.22 0.00 -1.94 0.00 0.00 57.00 52.97 3fpa n GLN 159 Cb 0.17 -1.17 0.03 0.00 0.11 0.00 0.00 30.24 29.37 3fpa n GLN 159 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 3fpa n GLN 160 N 0.06 -4.29 -2.83 -1.09 6.02 -0.65 -4.96 117.38 109.65 3fpa n GLN 160 Ca 0.07 0.93 -0.42 0.00 -0.01 0.00 0.00 57.00 57.57 3fpa n GLN 160 Cb 0.37 -5.74 -0.04 0.00 1.02 0.00 0.00 30.24 25.85 3fpa n GLN 160 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3fpa s VAL 161 N -3.15 4.74 0.00 5.09 1.01 -0.63 -5.01 120.40 122.45 3fpa s VAL 161 Ca 0.25 1.56 0.00 0.00 0.00 0.00 0.00 61.98 63.79 3fpa s VAL 161 Cb -0.11 -4.21 0.00 0.00 0.00 0.00 0.00 36.38 32.06 3fpa s VAL 161 CO 0.30 -0.21 0.00 -1.54 0.00 0.00 0.00 175.10 173.65 3fpa n SER 162 N 6.26 0.00 0.00 3.32 3.41 -1.26 -4.30 113.62 121.05 3fpa n SER 162 Ca 0.07 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.68 3fpa n SER 162 Cb 0.47 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.42 3fpa n SER 162 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3fpa n ALA 164 N -3.00 0.00 0.00 7.33 0.00 0.30 -0.56 120.51 124.58 3fpa n ALA 164 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3fpa n ALA 164 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3fpa n ALA 164 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fpa n GLY 165 N 0.00 0.95 3.80 0.00 0.00 -1.24 -4.95 105.19 103.76 3fpa n GLY 165 Ca 0.00 -2.02 -0.31 0.00 0.00 0.00 0.00 46.02 43.68 3fpa n GLY 165 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fpa s LEU 166 N 0.00 3.93 -0.10 0.99 1.02 0.48 -1.43 118.68 123.58 3fpa s LEU 166 Ca 0.00 0.10 -0.01 0.00 0.02 0.00 0.00 54.13 54.24 3fpa s LEU 166 Cb 0.00 -2.48 0.03 0.00 0.02 0.00 0.00 46.19 43.75 3fpa s LEU 166 CO 0.00 0.21 -0.06 -0.69 0.02 0.00 0.00 176.35 175.83 3fpa s VAL 167 N -1.34 0.83 -0.20 -1.59 1.01 0.04 0.56 120.40 119.72 3fpa s VAL 167 Ca 0.28 -0.17 -0.29 0.00 0.00 0.00 0.00 61.98 61.79 3fpa s VAL 167 Cb -0.12 -0.88 -0.03 0.00 0.00 0.00 0.00 36.38 35.34 3fpa s VAL 167 CO 0.20 0.33 1.68 -0.63 0.00 0.00 0.00 175.10 176.69 3fpa s ILE 168 N 1.71 3.60 0.06 2.22 1.01 -0.34 -1.28 121.20 128.17 3fpa s ILE 168 Ca 0.04 0.68 0.21 0.00 0.00 0.00 0.00 60.65 61.57 3fpa s ILE 168 Cb -0.13 -3.60 0.18 0.00 0.01 0.00 0.00 42.46 38.92 3fpa s ILE 168 CO -0.07 -0.24 1.72 1.23 0.00 0.00 0.00 174.94 177.58 3fpa h GLY 169 N 11.81 0.00 -6.39 6.18 0.00 -1.29 0.12 103.07 113.51 3fpa h GLY 169 Ca -0.35 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 46.79 3fpa h GLY 169 CO 0.99 0.00 -0.49 -0.45 0.00 0.00 0.00 176.54 176.59 3fpa s SER 170 N -6.30 0.32 -0.22 0.19 0.15 -1.24 -4.47 113.70 102.13 3fpa s SER 170 Ca 0.01 0.50 -0.00 0.00 0.70 0.00 0.00 55.95 57.16 3fpa s SER 170 Cb 0.10 0.91 0.02 0.00 -1.71 0.00 0.00 66.02 65.34 3fpa s SER 170 CO 0.67 -0.26 -0.11 0.86 1.20 0.00 0.00 173.24 175.59 3fpa s TRP 171 N 2.48 2.97 0.52 3.44 -0.11 0.24 -4.39 118.94 124.10 3fpa s TRP 171 Ca 0.04 -1.58 -0.19 0.00 1.22 0.00 0.00 56.10 55.58 3fpa s TRP 171 Cb -0.13 -2.00 -0.07 0.00 -1.50 0.00 0.00 33.47 29.77 3fpa s TRP 171 CO -0.12 -0.75 1.07 -2.14 -4.62 0.00 0.00 176.95 170.39 3fpa s PRO 172 N 1.31 3.59 -0.14 5.86 0.02 -1.26 -0.27 135.00 144.11 3fpa s PRO 172 Ca 0.02 1.41 0.01 0.00 0.02 0.00 0.00 61.00 62.45 3fpa s PRO 172 Cb -0.15 -2.06 0.02 0.00 0.02 0.00 0.00 34.50 32.33 3fpa s PRO 172 CO -0.07 -0.61 -0.15 0.34 -0.33 0.00 0.00 177.00 176.17 3fpa s ASP 173 N -2.05 2.68 0.80 2.53 -1.08 -1.26 -2.77 116.67 115.51 3fpa s ASP 173 Ca 0.68 -0.49 -0.07 0.00 -0.52 0.00 0.00 52.55 52.15 3fpa s ASP 173 Cb -0.18 -1.18 0.13 0.00 -1.46 0.00 0.00 42.92 40.23 3fpa s ASP 173 CO 0.25 -0.04 1.11 -2.16 0.52 0.00 0.00 175.17 174.84 3fpa s PRO 174 N 1.41 1.46 0.24 4.34 0.04 -1.26 -5.10 135.00 136.13 3fpa s PRO 174 Ca 0.03 -0.65 -0.30 0.00 0.04 0.00 0.00 61.00 60.12 3fpa s PRO 174 Cb -0.13 -2.13 -0.09 0.00 0.04 0.00 0.00 34.50 32.20 3fpa s PRO 174 CO -0.10 -1.72 1.10 -1.25 0.04 0.00 0.00 177.00 175.07 3fpa s PRO 175 N -5.42 4.63 0.00 0.56 0.04 -1.12 -5.06 135.00 128.63 3fpa s PRO 175 Ca 0.67 1.76 0.00 0.00 0.04 0.00 0.00 61.00 63.47 3fpa s PRO 175 Cb -0.06 -3.23 0.00 0.00 0.04 0.00 0.00 34.50 31.25 3fpa s PRO 175 CO 0.47 0.16 0.00 0.41 0.04 0.00 0.00 177.00 178.09 3fpa n GLY 176 N 1.57 -0.72 0.14 0.56 0.00 -1.26 -4.82 105.19 100.67 3fpa n GLY 176 Ca 0.00 -1.66 -0.15 0.00 0.00 0.00 0.00 46.02 44.21 3fpa n GLY 176 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3fpa h LEU 177 N 0.00 0.55 0.00 0.99 3.38 -1.98 -2.21 115.31 116.04 3fpa h LEU 177 Ca 0.00 -0.49 -0.00 0.00 0.09 0.00 0.00 57.88 57.48 3fpa h LEU 177 Cb 0.00 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.58 3fpa h LEU 177 CO 0.00 1.32 -0.00 0.58 0.09 0.00 0.00 178.44 180.43 3fpa h VAL 178 N 0.19 1.31 -0.30 1.22 2.07 -1.94 -1.85 116.25 116.95 3fpa h VAL 178 Ca -0.11 -0.94 0.06 0.00 0.82 0.00 0.00 66.70 66.53 3fpa h VAL 178 Cb 1.74 1.95 -0.05 0.00 -1.52 0.00 0.00 31.29 33.41 3fpa h VAL 178 CO 0.19 0.24 -0.03 0.00 0.02 0.00 0.00 177.57 177.99 3fpa h ALA 179 N 0.58 0.24 -0.88 1.67 0.00 -1.73 0.17 119.26 119.32 3fpa h ALA 179 Ca -0.00 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 3fpa h ALA 179 Cb 0.40 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 3fpa h ALA 179 CO 0.00 -0.43 0.49 0.00 0.00 0.00 0.00 179.25 179.31 3fpa h ALA 180 N 1.28 1.21 0.01 0.00 0.00 -1.38 -1.48 119.26 118.88 3fpa h ALA 180 Ca 0.14 -0.12 -0.19 0.00 0.00 0.00 0.00 54.91 54.74 3fpa h ALA 180 Cb 0.21 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 3fpa h ALA 180 CO -0.27 0.65 -0.89 0.66 0.00 0.00 0.00 179.25 179.40 3fpa h SER 181 N 1.23 0.05 -0.62 0.00 4.64 -0.86 -2.64 113.55 115.34 3fpa h SER 181 Ca 0.31 -0.05 -0.01 0.00 -0.47 0.00 0.00 61.79 61.57 3fpa h SER 181 Cb 0.01 -0.02 -0.03 0.00 -0.31 0.00 0.00 62.40 62.06 3fpa h SER 181 CO -0.05 0.91 0.35 0.78 -0.87 0.00 0.00 176.83 177.96 3fpa h ASN 182 N 0.02 0.77 -0.54 4.97 2.35 -0.35 -1.23 115.58 121.56 3fpa h ASN 182 Ca -0.02 -0.08 -0.07 0.00 -0.55 0.00 0.00 56.30 55.58 3fpa h ASN 182 Cb 1.56 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 39.71 3fpa h ASN 182 CO 0.12 0.63 0.09 -0.09 -1.65 0.00 0.00 177.43 176.53 3fpa h ARG 183 N 0.85 0.94 -0.27 0.81 2.43 -1.25 0.91 114.38 118.80 3fpa h ARG 183 Ca 0.22 -0.23 -0.09 0.00 -0.81 0.00 0.00 59.98 59.07 3fpa h ARG 183 Cb 0.02 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.45 3fpa h ARG 183 CO -0.04 0.87 -0.17 0.77 -1.51 0.00 0.00 179.97 179.89 3fpa h SER 184 N 0.89 0.61 -0.72 -3.80 0.02 -1.34 -1.83 113.55 107.38 3fpa h SER 184 Ca 0.18 -0.43 -0.04 0.00 -0.84 0.00 0.00 61.79 60.65 3fpa h SER 184 Cb 0.40 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.73 3fpa h SER 184 CO 0.01 0.91 0.28 0.00 -1.14 0.00 0.00 176.83 176.89 3fpa h ALA 185 N 0.72 0.94 -0.81 3.77 0.00 -1.08 -2.74 119.26 120.06 3fpa h ALA 185 Ca 0.05 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 3fpa h ALA 185 Cb 0.70 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 3fpa h ALA 185 CO 0.05 0.58 0.39 -0.07 0.00 0.00 0.00 179.25 180.20 3fpa h LEU 186 N 1.05 1.05 0.00 0.00 3.38 -0.75 -1.88 115.31 118.16 3fpa h LEU 186 Ca 0.24 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.09 3fpa h LEU 186 Cb 0.23 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.71 3fpa h LEU 186 CO -0.02 0.88 0.00 0.00 0.09 0.00 0.00 178.44 179.40 3fpa n ALA 187 N -2.42 1.77 0.08 1.53 0.00 -0.69 -2.46 120.51 118.31 3fpa n ALA 187 Ca 0.08 -0.06 0.11 0.00 0.00 0.00 0.00 53.44 53.57 3fpa n ALA 187 Cb 0.14 -1.24 -0.05 0.00 0.00 0.00 0.00 19.45 18.30 3fpa n ALA 187 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3fpa n ARG 188 N -1.36 0.62 0.01 0.00 1.74 -0.71 -4.32 116.66 112.63 3fpa n ARG 188 Ca 0.06 0.03 0.11 0.00 -0.77 0.00 0.00 57.85 57.27 3fpa n ARG 188 Cb 0.14 -1.73 -0.08 0.00 -1.02 0.00 0.00 32.46 29.76 3fpa n ARG 188 CO 0.00 0.00 0.00 0.44 -1.52 0.00 0.00 177.63 176.55 3fpa n ILE 189 N -2.54 0.07 -3.56 0.55 -5.35 -1.03 -5.03 119.36 102.46 3fpa n ILE 189 Ca -0.01 -0.24 -0.06 0.00 -0.27 0.00 0.00 62.75 62.17 3fpa n ILE 189 Cb 0.55 0.40 -0.02 0.00 -1.74 0.00 0.00 39.64 38.84 3fpa n ILE 189 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3fpa s ALA 190 N -3.23 -1.93 -0.05 -1.28 0.00 -1.11 -5.12 121.76 109.05 3fpa s ALA 190 Ca 0.02 1.15 -0.30 0.00 0.00 0.00 0.00 51.96 52.83 3fpa s ALA 190 Cb 0.15 0.23 -0.06 0.00 0.00 0.00 0.00 23.12 23.43 3fpa s ALA 190 CO 0.85 -0.70 1.78 -1.64 0.00 0.00 0.00 175.76 176.05 3fpa s MET 191 N -2.82 4.07 -0.36 0.00 -1.94 -1.26 -4.33 119.30 112.67 3fpa s MET 191 Ca 0.08 2.26 -0.20 0.00 -1.71 0.00 0.00 55.69 56.12 3fpa s MET 191 Cb -0.01 -4.07 0.00 0.00 2.01 0.00 0.00 34.83 32.77 3fpa s MET 191 CO -0.06 -0.99 0.64 0.08 -0.01 0.00 0.00 175.02 174.67 3fpa s VAL 192 N 4.51 4.89 -0.02 -6.03 1.01 -1.26 -0.39 120.40 123.11 3fpa s VAL 192 Ca 0.79 0.57 0.12 0.00 0.00 0.00 0.00 61.98 63.46 3fpa s VAL 192 Cb -0.35 -4.08 -0.15 0.00 0.00 0.00 0.00 36.38 31.80 3fpa s VAL 192 CO 0.34 -0.32 1.05 0.03 0.00 0.00 0.00 175.10 176.20 3fpa h ARG 193 N 8.48 0.00 -1.52 2.72 -0.00 -0.24 -3.47 114.38 120.34 3fpa h ARG 193 Ca -0.26 0.00 0.32 0.00 -0.50 0.00 0.00 59.98 59.53 3fpa h ARG 193 Cb 1.11 0.00 -0.12 0.00 0.00 0.00 0.00 29.97 30.96 3fpa h ARG 193 CO 0.84 0.63 0.81 0.00 0.00 0.00 0.00 179.97 182.24 3fpa s ALA 194 N -2.77 -2.20 -0.32 0.04 0.00 -1.24 -4.21 121.76 111.06 3fpa s ALA 194 Ca -0.01 0.64 0.01 0.00 0.00 0.00 0.00 51.96 52.61 3fpa s ALA 194 Cb 0.09 0.39 0.15 0.00 0.00 0.00 0.00 23.12 23.74 3fpa s ALA 194 CO 0.81 -1.06 0.35 0.00 0.00 0.00 0.00 175.76 175.86 3fpa s ALA 195 N -2.47 -0.60 0.22 0.00 0.00 -1.26 -1.20 121.76 116.45 3fpa s ALA 195 Ca 0.14 -0.48 -0.30 0.00 0.00 0.00 0.00 51.96 51.32 3fpa s ALA 195 Cb 0.04 -1.96 -0.09 0.00 0.00 0.00 0.00 23.12 21.11 3fpa s ALA 195 CO -0.03 -1.89 1.29 -0.51 0.00 0.00 0.00 175.76 174.61 3fpa s LEU 196 N 2.02 4.43 0.43 0.00 1.43 0.42 -4.71 118.68 122.71 3fpa s LEU 196 Ca 0.12 2.42 -0.25 0.00 -1.03 0.00 0.00 54.13 55.39 3fpa s LEU 196 Cb -0.14 -3.62 -0.09 0.00 0.03 0.00 0.00 46.19 42.37 3fpa s LEU 196 CO -0.21 -0.49 1.34 -2.65 0.23 0.00 0.00 176.35 174.57 3fpa n PRO 197 N 2.27 2.06 -1.66 1.29 -0.02 -1.26 0.82 135.00 138.50 3fpa n PRO 197 Ca 0.05 0.73 -0.44 0.00 -2.02 0.00 0.00 63.50 61.82 3fpa n PRO 197 Cb 0.43 -2.48 -0.02 0.00 -0.02 0.00 0.00 33.50 31.41 3fpa n PRO 197 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3fpa n ALA 198 N -0.21 0.76 -1.05 3.55 0.00 0.63 -2.32 120.51 121.87 3fpa n ALA 198 Ca 0.06 0.39 -0.02 0.00 0.00 0.00 0.00 53.44 53.87 3fpa n ALA 198 Cb 0.40 -2.19 -0.01 0.00 0.00 0.00 0.00 19.45 17.66 3fpa n ALA 198 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fpa n GLY 199 N 1.37 0.51 0.26 0.00 0.00 -1.26 -4.94 105.19 101.13 3fpa n GLY 199 Ca 0.09 -0.89 -0.02 0.00 0.00 0.00 0.00 46.02 45.19 3fpa n GLY 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fpa h ALA 200 N 0.00 1.20 0.00 4.61 0.00 -1.82 -2.96 119.26 120.29 3fpa h ALA 200 Ca -0.03 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.61 3fpa h ALA 200 Cb 0.11 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3fpa h ALA 200 CO 0.05 0.52 0.00 0.00 0.00 0.00 0.00 179.25 179.81 3fpa n ALA 201 N -2.48 1.94 0.09 0.00 0.00 -1.26 -1.80 120.51 117.00 3fpa n ALA 201 Ca 0.01 -0.07 0.01 0.00 0.00 0.00 0.00 53.44 53.39 3fpa n ALA 201 Cb 0.32 -1.17 -0.00 0.00 0.00 0.00 0.00 19.45 18.60 3fpa n ALA 201 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3fpa n SER 202 N -0.93 0.58 -4.82 0.00 2.88 -1.12 -5.03 113.62 105.18 3fpa n SER 202 Ca 0.08 -0.79 -0.31 0.00 -1.33 0.00 0.00 58.87 56.52 3fpa n SER 202 Cb 0.04 0.56 0.04 0.00 -0.75 0.00 0.00 64.21 64.10 3fpa n SER 202 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 3fpa s LEU 203 N -1.24 3.17 0.78 2.46 1.43 -0.74 -5.05 118.68 119.48 3fpa s LEU 203 Ca 0.02 1.63 -0.13 0.00 -1.03 0.00 0.00 54.13 54.61 3fpa s LEU 203 Cb 0.02 -4.50 0.07 0.00 0.03 0.00 0.00 46.19 41.81 3fpa s LEU 203 CO 0.06 -1.39 1.18 -1.81 0.23 0.00 0.00 176.35 174.61 3fpa s ASP 204 N -3.71 3.91 0.33 2.29 1.01 -1.26 -4.69 116.67 114.55 3fpa s ASP 204 Ca 0.58 2.27 0.10 0.00 0.71 0.00 0.00 52.55 56.21 3fpa s ASP 204 Cb -0.14 -2.58 0.87 0.00 1.01 0.00 0.00 42.92 42.08 3fpa s ASP 204 CO 0.53 -2.45 1.75 0.00 0.21 0.00 0.00 175.17 175.22 3fpa h ALA 205 N -0.76 1.82 -0.02 5.23 0.00 -1.84 0.52 119.26 124.20 3fpa h ALA 205 Ca -0.46 0.10 -0.23 0.00 0.00 0.00 0.00 54.91 54.32 3fpa h ALA 205 Cb 1.28 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 19.06 3fpa h ALA 205 CO 0.48 -0.25 -0.92 0.78 0.00 0.00 0.00 179.25 179.34 3fpa h GLY 206 N 0.62 0.56 0.63 0.00 0.00 -1.91 -1.79 103.07 101.18 3fpa h GLY 206 Ca 0.61 -0.94 -0.03 0.00 0.00 0.00 0.00 47.33 46.97 3fpa h GLY 206 CO -0.41 0.83 -0.08 -0.55 0.00 0.00 0.00 176.54 176.33 3fpa h ASP 207 N 0.30 0.20 -0.79 0.19 3.45 -1.69 -2.87 116.42 115.20 3fpa h ASP 207 Ca -0.08 -0.49 0.10 0.00 0.43 0.00 0.00 57.03 56.99 3fpa h ASP 207 Cb 1.55 -0.06 -0.05 0.00 -0.56 0.00 0.00 39.33 40.21 3fpa h ASP 207 CO 0.17 0.65 0.52 0.15 -1.57 0.00 0.00 179.24 179.15 3fpa h PHE 208 N -0.25 0.77 -0.30 4.55 3.57 -0.02 -0.29 116.94 124.98 3fpa h PHE 208 Ca 0.01 0.02 -0.18 0.00 3.53 0.00 0.00 57.97 61.36 3fpa h PHE 208 Cb 0.59 -0.25 -0.00 0.00 2.79 0.00 0.00 35.95 39.08 3fpa h PHE 208 CO 0.09 0.36 -0.51 0.00 -2.23 0.00 0.00 178.31 176.02 3fpa h ALA 209 N 1.60 0.53 -0.29 2.41 0.00 -1.31 -0.57 119.26 121.63 3fpa h ALA 209 Ca 0.37 -0.50 -0.06 0.00 0.00 0.00 0.00 54.91 54.71 3fpa h ALA 209 Cb 0.46 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3fpa h ALA 209 CO -0.14 0.68 -0.07 0.00 0.00 0.00 0.00 179.25 179.72 3fpa h ALA 210 N 0.75 0.40 -0.05 0.00 0.00 -1.18 -2.62 119.26 116.56 3fpa h ALA 210 Ca 0.02 -0.28 0.03 0.00 0.00 0.00 0.00 54.91 54.68 3fpa h ALA 210 Cb 1.11 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.76 3fpa h ALA 210 CO 0.11 0.22 -0.18 1.98 0.00 0.00 0.00 179.25 181.39 3fpa h MET 211 N 0.32 -0.25 -0.27 0.00 -1.53 -0.99 -2.41 114.93 109.80 3fpa h MET 211 Ca 0.07 0.02 -0.05 0.00 -3.44 0.00 0.00 59.70 56.30 3fpa h MET 211 Cb 0.56 0.06 -0.02 0.00 -0.55 0.00 0.00 31.60 31.65 3fpa h MET 211 CO 0.03 -0.17 -0.04 0.77 0.14 0.00 0.00 176.91 177.64 3fpa h SER 212 N -0.26 0.38 -0.41 1.39 0.02 -1.02 0.17 113.55 113.81 3fpa h SER 212 Ca 0.07 -0.07 -0.14 0.00 -0.84 0.00 0.00 61.79 60.81 3fpa h SER 212 Cb 0.36 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.79 3fpa h SER 212 CO -0.20 0.48 -0.30 0.00 -1.14 0.00 0.00 176.83 175.67 3fpa h ALA 213 N 1.57 0.66 -0.03 3.77 0.00 -1.41 -3.09 119.26 120.74 3fpa h ALA 213 Ca 0.08 -0.42 -0.12 0.00 0.00 0.00 0.00 54.91 54.45 3fpa h ALA 213 Cb 0.33 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 3fpa h ALA 213 CO 0.01 0.67 -0.55 0.00 0.00 0.00 0.00 179.25 179.39 3fpa h ALA 214 N 0.85 1.03 -0.46 0.00 0.00 -0.87 -3.35 119.26 116.46 3fpa h ALA 214 Ca 0.09 -0.50 -0.05 0.00 0.00 0.00 0.00 54.91 54.44 3fpa h ALA 214 Cb 0.88 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 3fpa h ALA 214 CO 0.08 0.69 0.10 0.00 0.00 0.00 0.00 179.25 180.12 3fpa h ALA 215 N 1.37 0.61 -2.97 0.00 0.00 -0.61 -3.45 119.26 114.21 3fpa h ALA 215 Ca -0.00 -0.21 -0.61 0.00 0.00 0.00 0.00 54.91 54.08 3fpa h ALA 215 Cb 1.00 -0.17 -0.07 0.00 0.00 0.00 0.00 17.79 18.55 3fpa h ALA 215 CO 0.08 0.30 -0.55 -0.06 0.00 0.00 0.00 179.25 179.02 3fpa s PHE 216 N -5.26 3.31 -0.06 0.00 0.08 -1.22 -4.52 117.98 110.31 3fpa s PHE 216 Ca -0.13 0.12 -0.30 0.00 0.12 0.00 0.00 56.93 56.74 3fpa s PHE 216 Cb 0.11 -1.65 -0.05 0.00 -0.57 0.00 0.00 43.02 40.86 3fpa s PHE 216 CO 0.79 0.54 1.53 0.34 -0.10 0.00 0.00 175.22 178.31 3fpa s ASP 217 N -2.61 6.75 0.50 1.36 3.68 -1.26 -4.90 116.67 120.19 3fpa s ASP 217 Ca 0.32 2.12 0.18 0.00 2.13 0.00 0.00 52.55 57.29 3fpa s ASP 217 Cb -0.12 -2.54 1.26 0.00 -1.45 0.00 0.00 42.92 40.06 3fpa s ASP 217 CO 0.25 -0.85 2.10 0.08 0.13 0.00 0.00 175.17 176.88 3fpa h ARG 218 N 8.87 0.00 0.00 4.34 -0.00 -1.97 -0.93 114.38 124.69 3fpa h ARG 218 Ca -0.37 0.00 -0.11 0.00 -0.00 0.00 0.00 59.98 59.51 3fpa h ARG 218 Cb 1.16 0.00 -0.02 0.00 -0.00 0.00 0.00 29.97 31.12 3fpa h ARG 218 CO 0.95 0.07 -0.50 -0.91 -0.00 0.00 0.00 179.97 179.58 3fpa h ASN 219 N 0.00 0.00 -0.00 0.08 2.35 -1.98 -0.36 115.58 115.67 3fpa h ASN 219 Ca -0.00 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3fpa h ASN 219 Cb 0.14 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.51 3fpa h ASN 219 CO 0.01 0.50 -0.01 -0.25 -1.65 0.00 0.00 177.43 176.03 3fpa h TRP 220 N 0.00 0.01 -0.70 1.19 7.01 -1.59 -2.78 115.95 119.09 3fpa h TRP 220 Ca -0.01 -0.01 0.03 0.00 2.11 0.00 0.00 58.89 61.02 3fpa h TRP 220 Cb 1.09 -0.00 -0.04 0.00 -2.10 0.00 0.00 29.16 28.11 3fpa h TRP 220 CO 0.00 0.75 0.44 0.28 -2.79 0.00 0.00 178.44 177.11 3fpa h VAL 221 N -0.72 1.09 -0.33 2.65 2.07 -1.40 -2.60 116.25 117.00 3fpa h VAL 221 Ca -0.00 -0.29 -0.06 0.00 0.82 0.00 0.00 66.70 67.17 3fpa h VAL 221 Cb 0.75 0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 3fpa h VAL 221 CO 0.00 0.16 -0.03 0.00 0.02 0.00 0.00 177.57 177.71 3fpa h ALA 222 N 1.30 1.33 -0.20 1.67 0.00 -1.12 -2.35 119.26 119.88 3fpa h ALA 222 Ca 0.28 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3fpa h ALA 222 Cb 0.02 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.66 3fpa h ALA 222 CO -0.11 0.46 0.00 0.41 0.00 0.00 0.00 179.25 180.01 3fpa n GLY 223 N -0.81 0.04 0.19 0.00 0.00 -0.99 -4.04 105.19 99.57 3fpa n GLY 223 Ca 0.01 -0.27 0.04 0.00 0.00 0.00 0.00 46.02 45.80 3fpa n GLY 223 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3fpa h LEU 224 N 1.39 0.00 -4.84 0.99 3.38 -1.29 -3.32 115.31 111.62 3fpa h LEU 224 Ca 0.00 0.00 -0.43 0.00 0.09 0.00 0.00 57.88 57.54 3fpa h LEU 224 Cb 0.32 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 40.66 3fpa h LEU 224 CO 0.00 0.38 -1.04 1.33 0.09 0.00 0.00 178.44 179.20 3fpa n VAL 225 N -3.86 1.46 0.00 1.22 0.24 -1.26 -4.76 118.33 111.37 3fpa n VAL 225 Ca -0.01 -3.66 0.00 0.00 -2.04 0.00 0.00 64.34 58.63 3fpa n VAL 225 Cb 0.44 0.05 0.00 0.00 -1.47 0.00 0.00 33.84 32.87 3fpa n VAL 225 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30