#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f5s n ASP 6 N 0.00 2.49 -0.33 2.61 5.75 -1.26 -4.35 116.55 121.46 3f5s n ASP 6 Ca 0.00 -3.56 0.24 0.00 -0.01 0.00 0.00 54.79 51.47 3f5s n ASP 6 Cb 0.00 -0.56 0.48 0.00 -1.03 0.00 0.00 41.12 40.01 3f5s n ASP 6 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 3f5s h LEU 7 N 0.95 0.44 -3.13 -2.12 5.85 -1.96 -2.22 115.31 113.13 3f5s h LEU 7 Ca 0.09 0.20 0.00 0.00 0.84 0.00 0.00 57.88 59.01 3f5s h LEU 7 Cb 1.34 0.17 0.00 0.00 0.37 0.00 0.00 40.66 42.53 3f5s h LEU 7 CO 0.19 -0.18 0.00 0.18 -0.34 0.00 0.00 178.44 178.29 3f5s n LEU 8 N -5.10 3.31 -4.63 2.25 4.77 -0.13 -4.70 117.00 112.77 3f5s n LEU 8 Ca 0.32 -2.79 -0.47 0.00 -0.03 0.00 0.00 56.01 53.05 3f5s n LEU 8 Cb 1.01 -0.43 -0.03 0.00 -2.33 0.00 0.00 43.42 41.63 3f5s n LEU 8 CO 0.08 0.68 0.89 0.59 -1.33 0.00 0.00 177.39 178.30 3f5s n ASN 9 N -0.50 2.10 -1.79 -1.43 3.02 -0.84 -1.85 115.26 113.98 3f5s n ASN 9 Ca 0.17 1.14 -0.17 0.00 -0.03 0.00 0.00 54.58 55.69 3f5s n ASN 9 Cb 0.72 -1.32 -0.02 0.00 -0.61 0.00 0.00 39.78 38.54 3f5s n ASN 9 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3f5s n ASP 10 N 2.17 -5.03 -4.41 6.41 8.00 -1.25 -4.94 116.55 117.50 3f5s n ASP 10 Ca 0.14 0.09 -0.33 0.00 0.71 0.00 0.00 54.79 55.40 3f5s n ASP 10 Cb 0.28 -4.10 -0.14 0.00 -0.02 0.00 0.00 41.12 37.14 3f5s n ASP 10 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 3f5s s ARG 11 N -4.50 3.49 -0.32 -1.24 1.81 -0.77 -5.00 118.95 112.41 3f5s s ARG 11 Ca 0.00 -0.62 -0.12 0.00 -1.72 0.00 0.00 55.73 53.27 3f5s s ARG 11 Cb 0.00 -2.76 -0.03 0.00 -0.45 0.00 0.00 34.95 31.71 3f5s s ARG 11 CO 0.00 0.19 0.22 0.42 -0.68 0.00 0.00 175.30 175.45 3f5s s ILE 12 N 0.44 5.23 -0.09 1.52 1.01 -1.26 -0.62 121.20 127.43 3f5s s ILE 12 Ca -0.07 -0.13 0.02 0.00 0.00 0.00 0.00 60.65 60.47 3f5s s ILE 12 Cb -0.15 -3.63 0.02 0.00 0.01 0.00 0.00 42.46 38.70 3f5s s ILE 12 CO 0.04 0.07 -0.12 -0.63 0.00 0.00 0.00 174.94 174.30 3f5s s ILE 13 N 1.72 1.23 -0.14 2.92 1.01 -0.12 -0.15 121.20 127.67 3f5s s ILE 13 Ca 0.06 -0.49 -0.15 0.00 0.00 0.00 0.00 60.65 60.07 3f5s s ILE 13 Cb -0.17 -1.14 -0.05 0.00 0.01 0.00 0.00 42.46 41.11 3f5s s ILE 13 CO 0.10 0.39 0.34 -0.22 0.00 0.00 0.00 174.94 175.55 3f5s s LEU 14 N 0.99 4.27 -0.16 2.97 0.20 -0.43 -1.06 118.68 125.46 3f5s s LEU 14 Ca -0.08 0.61 0.01 0.00 0.69 0.00 0.00 54.13 55.37 3f5s s LEU 14 Cb -0.15 -2.46 0.02 0.00 -0.43 0.00 0.00 46.19 43.17 3f5s s LEU 14 CO -0.00 0.09 -0.18 -0.69 -0.29 0.00 0.00 176.35 175.28 3f5s s VAL 15 N 0.38 1.85 0.47 1.68 1.01 -0.08 -0.90 120.40 124.80 3f5s s VAL 15 Ca 0.19 -0.82 -0.04 0.00 0.00 0.00 0.00 61.98 61.32 3f5s s VAL 15 Cb -0.14 -1.68 -0.03 0.00 0.00 0.00 0.00 36.38 34.53 3f5s s VAL 15 CO 0.06 0.51 0.75 0.42 0.00 0.00 0.00 175.10 176.84 3f5s s THR 16 N 1.26 4.70 -1.62 3.92 -4.23 -0.45 -1.27 115.64 117.94 3f5s s THR 16 Ca 0.02 -0.00 -0.02 0.00 -1.18 0.00 0.00 61.69 60.51 3f5s s THR 16 Cb -0.13 -3.78 0.00 0.00 1.34 0.00 0.00 72.50 69.93 3f5s s THR 16 CO -0.10 -0.70 0.29 0.61 -0.54 0.00 0.00 174.62 174.18 3f5s n GLY 17 N -2.20 -0.47 0.00 3.99 0.00 -0.97 -3.61 105.19 101.93 3f5s n GLY 17 Ca 0.00 0.03 0.11 0.00 0.00 0.00 0.00 46.02 46.16 3f5s n GLY 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3f5s n ALA 18 N -2.73 2.09 0.93 4.61 0.00 -0.82 -3.50 120.51 121.10 3f5s n ALA 18 Ca -0.18 -0.09 0.12 0.00 0.00 0.00 0.00 53.44 53.29 3f5s n ALA 18 Cb 0.65 -1.37 0.26 0.00 0.00 0.00 0.00 19.45 19.00 3f5s n ALA 18 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3f5s n SER 19 N -1.40 0.49 -3.90 0.00 3.41 -1.26 -2.99 113.62 107.98 3f5s n SER 19 Ca 0.08 -0.15 -0.08 0.00 -0.26 0.00 0.00 58.87 58.46 3f5s n SER 19 Cb 0.22 0.20 -0.03 0.00 -0.26 0.00 0.00 64.21 64.34 3f5s n SER 19 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 3f5s s ASP 20 N -3.18 -0.16 1.07 4.04 1.47 -1.23 -4.85 116.67 113.83 3f5s s ASP 20 Ca 0.10 -0.79 0.00 0.00 1.18 0.00 0.00 52.55 53.05 3f5s s ASP 20 Cb 0.17 0.66 0.00 0.00 -0.34 0.00 0.00 42.92 43.41 3f5s s ASP 20 CO 0.69 -1.26 0.00 0.61 0.68 0.00 0.00 175.17 175.90 3f5s n GLY 21 N -0.43 2.95 0.29 2.12 0.00 -1.26 -1.93 105.19 106.93 3f5s n GLY 21 Ca -0.03 -0.15 -0.07 0.00 0.00 0.00 0.00 46.02 45.77 3f5s n GLY 21 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3f5s h ILE 22 N 0.00 1.26 -0.61 -0.61 2.04 -1.93 -2.29 117.51 115.37 3f5s h ILE 22 Ca 0.00 -1.13 0.02 0.00 1.00 0.00 0.00 64.86 64.75 3f5s h ILE 22 Cb 0.00 0.90 -0.04 0.00 -0.74 0.00 0.00 36.82 36.94 3f5s h ILE 22 CO 0.00 0.40 0.38 1.23 0.00 0.00 0.00 178.15 180.16 3f5s h GLY 23 N 0.98 0.86 0.95 5.37 0.00 -1.61 0.12 103.07 109.74 3f5s h GLY 23 Ca 0.15 -0.29 -0.05 0.00 0.00 0.00 0.00 47.33 47.13 3f5s h GLY 23 CO 0.03 0.26 0.06 -0.09 0.00 0.00 0.00 176.54 176.81 3f5s h ARG 24 N 0.77 0.70 -0.63 4.80 2.43 -1.20 -0.46 114.38 120.79 3f5s h ARG 24 Ca 0.24 -0.19 -0.05 0.00 -0.81 0.00 0.00 59.98 59.17 3f5s h ARG 24 Cb -0.02 -0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 29.42 3f5s h ARG 24 CO -0.08 0.74 0.21 1.49 -1.51 0.00 0.00 179.97 180.82 3f5s h GLU 25 N 0.56 0.97 -0.47 0.20 4.57 -1.10 -1.49 114.58 117.80 3f5s h GLU 25 Ca 0.13 -0.20 -0.03 0.00 -1.18 0.00 0.00 59.36 58.07 3f5s h GLU 25 Cb 0.38 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 28.81 3f5s h GLU 25 CO 0.01 0.85 0.16 0.00 -1.18 0.00 0.00 179.01 178.85 3f5s h ALA 26 N 1.07 0.61 -0.49 2.92 0.00 -0.61 -0.02 119.26 122.74 3f5s h ALA 26 Ca 0.20 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.96 3f5s h ALA 26 Cb 0.28 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3f5s h ALA 26 CO -0.01 0.25 0.31 0.00 0.00 0.00 0.00 179.25 179.80 3f5s h ALA 27 N 1.01 0.62 -0.59 0.00 0.00 -0.88 0.30 119.26 119.72 3f5s h ALA 27 Ca 0.15 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 3f5s h ALA 27 Cb 0.24 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 3f5s h ALA 27 CO -0.01 0.03 -0.02 0.52 0.00 0.00 0.00 179.25 179.77 3f5s h MET 28 N 0.62 1.06 -0.19 0.00 2.07 -1.08 -2.13 114.93 115.28 3f5s h MET 28 Ca 0.19 -0.34 -0.03 0.00 -2.07 0.00 0.00 59.70 57.44 3f5s h MET 28 Cb -0.04 -0.09 -0.01 0.00 -1.87 0.00 0.00 31.60 29.59 3f5s h MET 28 CO -0.06 1.04 -0.00 1.15 1.07 0.00 0.00 176.91 180.11 3f5s h THR 29 N 0.96 1.25 -0.90 2.22 2.02 -0.75 -0.90 112.91 116.82 3f5s h THR 29 Ca 0.17 -0.87 0.02 0.00 0.77 0.00 0.00 66.41 66.50 3f5s h THR 29 Cb 0.58 1.45 -0.05 0.00 -1.74 0.00 0.00 68.15 68.39 3f5s h THR 29 CO 0.03 0.26 0.59 1.88 0.37 0.00 0.00 175.52 178.66 3f5s h TYR 30 N 0.10 1.12 -0.63 3.16 0.05 -0.89 -1.38 116.97 118.49 3f5s h TYR 30 Ca 0.05 0.03 -0.09 0.00 0.05 0.00 0.00 58.73 58.77 3f5s h TYR 30 Cb 0.39 -0.37 -0.02 0.00 1.01 0.00 0.00 36.73 37.74 3f5s h TYR 30 CO 0.03 0.67 0.03 0.00 -1.05 0.00 0.00 178.16 177.84 3f5s h ALA 31 N 1.35 0.85 -0.00 3.88 0.00 -1.19 -1.36 119.26 122.79 3f5s h ALA 31 Ca 0.35 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 3f5s h ALA 31 Cb -0.06 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.49 3f5s h ALA 31 CO -0.10 0.68 -0.11 0.00 0.00 0.00 0.00 179.25 179.72 3f5s h ARG 32 N 1.01 0.01 -0.61 0.00 3.08 -0.47 -1.03 114.38 116.36 3f5s h ARG 32 Ca 0.18 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.23 3f5s h ARG 32 Cb 0.54 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.59 3f5s h ARG 32 CO 0.03 0.12 0.00 0.66 -1.07 0.00 0.00 179.97 179.70 3f5s n TYR 33 N -4.41 0.92 0.00 3.04 4.02 -0.58 -4.77 117.16 115.38 3f5s n TYR 33 Ca -0.03 -0.36 0.00 0.00 -0.01 0.00 0.00 57.90 57.51 3f5s n TYR 33 Cb 0.19 -0.19 0.00 0.00 -0.02 0.00 0.00 39.34 39.32 3f5s n TYR 33 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3f5s n GLY 34 N 0.72 0.40 3.77 2.72 0.00 -0.39 -0.95 105.19 111.46 3f5s n GLY 34 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 3f5s n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3f5s s ALA 35 N -2.00 2.64 -0.40 4.61 0.00 -0.58 -3.78 121.76 122.25 3f5s s ALA 35 Ca 0.00 0.73 -0.22 0.00 0.00 0.00 0.00 51.96 52.46 3f5s s ALA 35 Cb 0.00 -3.34 0.02 0.00 0.00 0.00 0.00 23.12 19.80 3f5s s ALA 35 CO 0.00 -0.89 0.74 0.99 0.00 0.00 0.00 175.76 176.60 3f5s s THR 36 N -1.95 4.74 -0.06 0.00 2.01 0.20 -4.45 115.64 116.13 3f5s s THR 36 Ca 0.71 0.56 -0.04 0.00 0.31 0.00 0.00 61.69 63.23 3f5s s THR 36 Cb -0.22 -4.23 -0.04 0.00 0.01 0.00 0.00 72.50 68.02 3f5s s THR 36 CO 0.31 -0.54 0.15 -0.69 -0.69 0.00 0.00 174.62 173.15 3f5s s VAL 37 N 3.08 5.35 -0.16 3.82 1.01 -1.26 -0.95 120.40 131.29 3f5s s VAL 37 Ca 0.29 -0.02 0.01 0.00 0.00 0.00 0.00 61.98 62.26 3f5s s VAL 37 Cb -0.13 -3.41 0.01 0.00 0.00 0.00 0.00 36.38 32.85 3f5s s VAL 37 CO 0.19 0.47 -0.19 -0.63 0.00 0.00 0.00 175.10 174.94 3f5s s ILE 38 N -1.16 2.26 -0.21 2.22 1.01 -0.22 -3.78 121.20 121.32 3f5s s ILE 38 Ca 0.21 -0.90 -0.12 0.00 0.00 0.00 0.00 60.65 59.84 3f5s s ILE 38 Cb -0.12 -1.94 -0.05 0.00 0.01 0.00 0.00 42.46 40.36 3f5s s ILE 38 CO 0.11 0.53 0.22 -0.76 0.00 0.00 0.00 174.94 175.04 3f5s s LEU 39 N 1.00 4.17 -0.05 2.97 1.43 -0.43 -0.90 118.68 126.86 3f5s s LEU 39 Ca -0.02 0.29 0.04 0.00 -1.03 0.00 0.00 54.13 53.41 3f5s s LEU 39 Cb -0.15 -2.23 -0.02 0.00 0.03 0.00 0.00 46.19 43.83 3f5s s LEU 39 CO -0.05 0.08 -0.17 -0.22 0.23 0.00 0.00 176.35 176.21 3f5s s LEU 40 N 0.81 2.54 0.07 1.79 0.20 -0.40 -0.75 118.68 122.94 3f5s s LEU 40 Ca 0.11 -0.29 -0.26 0.00 0.69 0.00 0.00 54.13 54.38 3f5s s LEU 40 Cb -0.13 -1.50 0.09 0.00 -0.43 0.00 0.00 46.19 44.22 3f5s s LEU 40 CO 0.03 0.31 1.17 -0.83 -0.29 0.00 0.00 176.35 176.74 3f5s s GLY 41 N -0.52 -0.11 0.16 7.98 0.00 -1.03 -1.94 107.32 111.86 3f5s s GLY 41 Ca 0.07 0.05 0.21 0.00 0.00 0.00 0.00 44.72 45.05 3f5s s GLY 41 CO 0.01 2.81 0.97 -0.96 0.00 0.00 0.00 173.10 175.93 3f5s n ARG 42 N -0.70 0.61 -3.82 2.90 1.85 -1.22 -1.14 116.66 115.14 3f5s n ARG 42 Ca -0.02 0.15 -0.36 0.00 -1.00 0.00 0.00 57.85 56.61 3f5s n ARG 42 Cb 0.60 -1.82 -0.13 0.00 -1.05 0.00 0.00 32.46 30.06 3f5s n ARG 42 CO 0.00 0.00 0.00 1.21 -0.01 0.00 0.00 177.63 178.83 3f5s s ASN 43 N -5.47 5.14 0.19 2.89 3.84 -1.26 -4.86 114.94 115.41 3f5s s ASN 43 Ca -0.01 -1.38 -0.12 0.00 0.21 0.00 0.00 52.86 51.55 3f5s s ASN 43 Cb 0.09 -1.80 0.13 0.00 -0.55 0.00 0.00 41.25 39.12 3f5s s ASN 43 CO 0.80 -0.35 1.84 -0.08 -2.79 0.00 0.00 177.10 176.52 3f5s h GLU 44 N 8.10 0.76 -0.34 0.43 4.81 -1.99 -1.34 114.58 125.02 3f5s h GLU 44 Ca -0.20 -0.05 0.03 0.00 -0.13 0.00 0.00 59.36 59.01 3f5s h GLU 44 Cb 1.07 -0.17 -0.03 0.00 0.63 0.00 0.00 28.75 30.24 3f5s h GLU 44 CO 0.60 0.51 0.14 1.49 -0.73 0.00 0.00 179.01 181.01 3f5s h GLU 45 N 0.79 0.29 -0.45 1.92 4.81 -1.99 0.04 114.58 119.98 3f5s h GLU 45 Ca 0.24 -0.02 -0.13 0.00 -0.13 0.00 0.00 59.36 59.32 3f5s h GLU 45 Cb -0.04 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.27 3f5s h GLU 45 CO -0.08 0.19 -0.23 0.87 -0.73 0.00 0.00 179.01 179.04 3f5s h LYS 46 N 0.30 0.92 -0.47 1.92 1.57 -1.87 -1.34 116.57 117.60 3f5s h LYS 46 Ca 0.15 -0.39 -0.05 0.00 -1.87 0.00 0.00 60.65 58.48 3f5s h LYS 46 Cb 0.10 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.36 3f5s h LYS 46 CO -0.13 1.05 0.08 -0.07 -0.57 0.00 0.00 179.45 179.81 3f5s h LEU 47 N 0.79 0.74 -0.62 2.94 3.38 -0.99 -0.64 115.31 120.91 3f5s h LEU 47 Ca 0.10 -0.26 0.06 0.00 0.09 0.00 0.00 57.88 57.88 3f5s h LEU 47 Cb 0.79 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 41.29 3f5s h LEU 47 CO 0.07 0.81 0.32 0.03 0.09 0.00 0.00 178.44 179.75 3f5s h ARG 48 N 0.64 0.58 -0.05 1.13 3.08 -0.85 -0.02 114.38 118.89 3f5s h ARG 48 Ca 0.14 -0.03 0.02 0.00 0.07 0.00 0.00 59.98 60.18 3f5s h ARG 48 Cb 0.38 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.28 3f5s h ARG 48 CO 0.01 0.38 -0.06 0.37 -1.07 0.00 0.00 179.97 179.60 3f5s h GLN 49 N 0.60 -0.08 -0.49 0.04 4.15 -0.86 -0.44 115.11 118.03 3f5s h GLN 49 Ca 0.28 0.01 -0.00 0.00 0.77 0.00 0.00 58.65 59.70 3f5s h GLN 49 Cb 0.20 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 27.89 3f5s h GLN 49 CO -0.19 -0.05 0.30 0.28 -1.93 0.00 0.00 178.83 177.23 3f5s h VAL 50 N -0.08 1.15 -0.89 2.39 2.07 -0.87 -1.13 116.25 118.90 3f5s h VAL 50 Ca 0.04 -0.33 0.04 0.00 0.82 0.00 0.00 66.70 67.27 3f5s h VAL 50 Cb 0.13 0.49 -0.05 0.00 -1.52 0.00 0.00 31.29 30.34 3f5s h VAL 50 CO -0.09 0.15 0.58 0.00 0.02 0.00 0.00 177.57 178.23 3f5s h ALA 51 N 1.14 1.46 -0.47 1.67 0.00 -0.83 -0.70 119.26 121.55 3f5s h ALA 51 Ca 0.18 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 3f5s h ALA 51 Cb -0.01 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 3f5s h ALA 51 CO -0.03 0.44 0.04 1.03 0.00 0.00 0.00 179.25 180.73 3f5s h SER 52 N 1.08 0.77 -0.48 0.00 0.87 -0.17 -1.34 113.55 114.29 3f5s h SER 52 Ca 0.36 -0.28 -0.03 0.00 -1.23 0.00 0.00 61.79 60.61 3f5s h SER 52 Cb 0.06 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 61.79 3f5s h SER 52 CO -0.11 0.87 0.20 0.45 -0.53 0.00 0.00 176.83 177.70 3f5s h HIS 53 N 0.66 0.72 -0.83 2.24 3.86 -0.84 -1.39 115.15 119.57 3f5s h HIS 53 Ca 0.14 -0.05 0.02 0.00 -1.16 0.00 0.00 60.37 59.31 3f5s h HIS 53 Cb 0.44 -0.22 -0.04 0.00 1.06 0.00 0.00 27.41 28.65 3f5s h HIS 53 CO 0.03 0.60 0.54 0.82 0.86 0.00 0.00 177.93 180.79 3f5s h ILE 54 N 0.63 1.19 -0.74 2.45 2.04 -0.99 -2.26 117.51 119.83 3f5s h ILE 54 Ca 0.16 -0.38 -0.01 0.00 1.00 0.00 0.00 64.86 65.63 3f5s h ILE 54 Cb 0.18 -0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.23 3f5s h ILE 54 CO -0.01 0.20 0.41 -1.13 0.00 0.00 0.00 178.15 177.61 3f5s h ASN 55 N 1.09 0.93 -0.82 1.72 -1.24 -0.89 -1.17 115.58 115.20 3f5s h ASN 55 Ca 0.31 -0.10 0.05 0.00 0.71 0.00 0.00 56.30 57.28 3f5s h ASN 55 Cb -0.09 -0.24 -0.05 0.00 0.73 0.00 0.00 38.32 38.68 3f5s h ASN 55 CO -0.08 0.76 0.54 -0.33 -1.29 0.00 0.00 177.43 177.02 3f5s h GLU 56 N 1.03 0.93 0.00 6.67 5.08 -0.82 0.17 114.58 127.63 3f5s h GLU 56 Ca 0.26 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 3f5s h GLU 56 Cb 0.03 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.07 3f5s h GLU 56 CO -0.04 0.61 -0.51 0.93 -1.00 0.00 0.00 179.01 179.00 3f5s h GLU 57 N 0.95 0.00 0.00 2.33 5.08 -0.84 -3.40 114.58 118.70 3f5s h GLU 57 Ca 0.34 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.70 3f5s h GLU 57 Cb 0.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.38 3f5s h GLU 57 CO -0.11 0.00 -0.19 0.25 -1.00 0.00 0.00 179.01 177.95 3f5s n THR 58 N -2.28 0.00 -0.89 1.13 -2.24 -0.50 -4.99 114.28 104.51 3f5s n THR 58 Ca 0.03 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 3f5s n THR 58 Cb 0.46 0.52 0.00 0.00 -2.10 0.00 0.00 70.33 69.21 3f5s n THR 58 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3f5s n GLY 59 N 0.63 0.82 3.31 3.38 0.00 0.57 -4.99 105.19 108.90 3f5s n GLY 59 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 3f5s n GLY 59 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3f5s s ARG 60 N -0.20 3.26 -0.30 1.61 3.52 -1.26 -5.02 118.95 120.56 3f5s s ARG 60 Ca 0.00 -0.75 -0.15 0.00 -0.13 0.00 0.00 55.73 54.70 3f5s s ARG 60 Cb 0.00 -2.54 -0.03 0.00 -1.56 0.00 0.00 34.95 30.83 3f5s s ARG 60 CO 0.00 0.17 0.37 -1.14 -0.81 0.00 0.00 175.30 173.89 3f5s s GLN 61 N 0.43 3.81 0.44 5.12 2.00 -1.26 -3.66 119.66 126.54 3f5s s GLN 61 Ca -0.12 -0.17 -0.23 0.00 -2.00 0.00 0.00 55.36 52.84 3f5s s GLN 61 Cb -0.16 -3.73 -0.08 0.00 0.80 0.00 0.00 33.01 29.84 3f5s s GLN 61 CO 0.06 -0.40 1.11 -1.25 -0.50 0.00 0.00 175.29 174.31 3f5s s PRO 62 N 2.06 3.91 0.47 1.67 0.04 -1.26 -5.03 135.00 136.86 3f5s s PRO 62 Ca 0.14 1.65 -0.12 0.00 0.04 0.00 0.00 61.00 62.71 3f5s s PRO 62 Cb -0.16 -2.44 -0.06 0.00 0.04 0.00 0.00 34.50 31.88 3f5s s PRO 62 CO 0.11 -0.40 0.86 -0.65 0.04 0.00 0.00 177.00 176.97 3f5s s GLN 63 N -2.66 3.78 0.10 4.56 -0.21 -1.25 -4.87 119.66 119.12 3f5s s GLN 63 Ca 0.62 0.61 0.06 0.00 0.02 0.00 0.00 55.36 56.67 3f5s s GLN 63 Cb -0.25 -2.28 -0.03 0.00 1.00 0.00 0.00 33.01 31.44 3f5s s GLN 63 CO 0.31 -0.18 -0.15 1.67 -2.12 0.00 0.00 175.29 174.82 3f5s s TRP 64 N -2.57 1.38 0.02 0.91 1.48 -1.26 -1.32 118.94 117.57 3f5s s TRP 64 Ca 0.53 -0.50 0.03 0.00 -1.06 0.00 0.00 56.10 55.10 3f5s s TRP 64 Cb -0.10 -0.75 -0.01 0.00 -1.16 0.00 0.00 33.47 31.45 3f5s s TRP 64 CO 0.35 0.12 -0.09 -0.06 -4.06 0.00 0.00 176.95 173.21 3f5s s PHE 65 N -1.70 0.81 -0.12 1.66 0.08 0.07 -4.94 117.98 113.84 3f5s s PHE 65 Ca 0.05 -0.26 -0.21 0.00 0.12 0.00 0.00 56.93 56.62 3f5s s PHE 65 Cb -0.07 -0.50 -0.03 0.00 -0.57 0.00 0.00 43.02 41.84 3f5s s PHE 65 CO 0.03 -0.02 0.63 0.42 -0.10 0.00 0.00 175.22 176.18 3f5s s ILE 66 N -0.60 5.07 -0.17 0.64 -1.09 -1.26 -2.45 121.20 121.34 3f5s s ILE 66 Ca -0.00 1.25 -0.09 0.00 -2.23 0.00 0.00 60.65 59.58 3f5s s ILE 66 Cb -0.06 -3.96 0.06 0.00 -1.58 0.00 0.00 42.46 36.93 3f5s s ILE 66 CO 0.00 0.23 0.41 -0.22 -1.23 0.00 0.00 174.94 174.13 3f5s s LEU 67 N 1.07 -0.12 -0.35 2.97 2.96 -0.29 -4.91 118.68 120.02 3f5s s LEU 67 Ca 0.32 0.89 -0.09 0.00 -0.22 0.00 0.00 54.13 55.04 3f5s s LEU 67 Cb -0.16 1.34 0.03 0.00 0.50 0.00 0.00 46.19 47.89 3f5s s LEU 67 CO 0.14 -0.20 0.15 -0.62 -1.32 0.00 0.00 176.35 174.50 3f5s s ASP 68 N 1.46 5.49 0.47 3.68 3.68 -1.26 -3.46 116.67 126.73 3f5s s ASP 68 Ca -0.09 -0.99 0.32 0.00 2.13 0.00 0.00 52.55 53.91 3f5s s ASP 68 Cb -0.09 -1.95 1.39 0.00 -1.45 0.00 0.00 42.92 40.83 3f5s s ASP 68 CO -0.13 -0.33 1.94 -0.07 0.13 0.00 0.00 175.17 176.71 3f5s h LEU 69 N 8.32 0.00 -0.99 -1.34 4.07 -1.95 0.00 115.31 123.42 3f5s h LEU 69 Ca -0.26 0.00 -0.11 0.00 0.08 0.00 0.00 57.88 57.60 3f5s h LEU 69 Cb 1.10 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.83 3f5s h LEU 69 CO 0.63 0.00 -0.48 0.25 -1.08 0.00 0.00 178.44 177.76 3f5s h LEU 70 N 0.00 0.05 0.00 1.67 5.85 -1.93 -3.37 115.31 117.58 3f5s h LEU 70 Ca 0.00 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.70 3f5s h LEU 70 Cb 0.37 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.39 3f5s h LEU 70 CO 0.00 0.53 -0.77 0.35 -0.34 0.00 0.00 178.44 178.20 3f5s n THR 71 N -3.96 0.00 -2.06 1.05 -2.24 -0.84 -4.87 114.28 101.36 3f5s n THR 71 Ca -0.02 -0.17 -0.36 0.00 -2.27 0.00 0.00 64.05 61.23 3f5s n THR 71 Cb 0.51 0.63 0.02 0.00 -2.10 0.00 0.00 70.33 69.39 3f5s n THR 71 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3f5s s THR 73 N -1.59 2.65 0.23 0.00 -4.23 -1.26 -4.96 115.64 106.48 3f5s s THR 73 Ca 0.75 -1.13 -0.07 0.00 -1.18 0.00 0.00 61.69 60.05 3f5s s THR 73 Cb -0.30 -2.78 0.19 0.00 1.34 0.00 0.00 72.50 70.95 3f5s s THR 73 CO 0.33 0.00 1.86 -1.28 -0.54 0.00 0.00 174.62 175.00 3f5s h SER 74 N 0.67 0.85 -0.91 3.99 0.87 -1.96 -2.02 113.55 115.04 3f5s h SER 74 Ca -0.38 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.16 3f5s h SER 74 Cb 1.28 -0.18 -0.04 0.00 -0.44 0.00 0.00 62.40 63.01 3f5s h SER 74 CO 0.49 0.58 0.51 -0.08 -0.53 0.00 0.00 176.83 177.80 3f5s h GLU 75 N 1.00 1.26 -1.00 2.24 4.57 -1.98 -0.47 114.58 120.20 3f5s h GLU 75 Ca 0.33 -0.14 0.04 0.00 -1.18 0.00 0.00 59.36 58.42 3f5s h GLU 75 Cb 0.04 -0.25 -0.06 0.00 -0.16 0.00 0.00 28.75 28.32 3f5s h GLU 75 CO -0.13 0.91 0.65 -0.91 -1.18 0.00 0.00 179.01 178.36 3f5s h ASN 76 N 1.27 1.08 -0.25 1.04 -0.26 -1.83 0.05 115.58 116.69 3f5s h ASN 76 Ca 0.32 -0.01 -0.15 0.00 -0.56 0.00 0.00 56.30 55.91 3f5s h ASN 76 Cb 0.00 -0.24 -0.01 0.00 -1.06 0.00 0.00 38.32 37.01 3f5s h ASN 76 CO -0.05 0.73 -0.40 0.00 -1.06 0.00 0.00 177.43 176.64 3f5s h GLN 78 N 0.65 1.12 -0.43 0.00 1.08 -0.62 -1.16 115.11 115.75 3f5s h GLN 78 Ca 0.05 -0.17 -0.09 0.00 -1.45 0.00 0.00 58.65 56.99 3f5s h GLN 78 Cb 0.96 -0.20 -0.02 0.00 -0.05 0.00 0.00 27.48 28.18 3f5s h GLN 78 CO 0.09 0.88 -0.12 1.96 -0.95 0.00 0.00 178.83 180.69 3f5s h GLN 79 N 1.10 0.77 -0.38 1.46 4.20 -0.85 -1.16 115.11 120.25 3f5s h GLN 79 Ca 0.26 -0.26 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 3f5s h GLN 79 Cb 0.13 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.83 3f5s h GLN 79 CO -0.03 0.86 0.23 1.25 -0.67 0.00 0.00 178.83 180.46 3f5s h LEU 80 N 0.70 0.45 -1.16 1.46 5.85 -0.89 -1.92 115.31 119.79 3f5s h LEU 80 Ca 0.12 -0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 3f5s h LEU 80 Cb 0.60 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.48 3f5s h LEU 80 CO 0.04 0.38 0.31 0.00 -0.34 0.00 0.00 178.44 178.83 3f5s h ALA 81 N 1.10 1.35 -0.96 1.25 0.00 -0.89 -1.13 119.26 119.98 3f5s h ALA 81 Ca 0.14 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3f5s h ALA 81 Cb 0.01 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 17.49 3f5s h ALA 81 CO -0.03 0.51 0.61 1.96 0.00 0.00 0.00 179.25 182.31 3f5s h GLN 82 N 0.90 1.28 -0.43 0.00 4.20 -0.76 -0.01 115.11 120.29 3f5s h GLN 82 Ca 0.22 -0.09 -0.08 0.00 0.06 0.00 0.00 58.65 58.76 3f5s h GLN 82 Cb 0.08 -0.28 -0.02 0.00 0.30 0.00 0.00 27.48 27.56 3f5s h GLN 82 CO -0.03 0.87 -0.05 0.00 -0.67 0.00 0.00 178.83 178.95 3f5s h ARG 83 N 1.31 0.72 -0.36 1.46 3.08 -0.51 -2.46 114.38 117.62 3f5s h ARG 83 Ca 0.35 -0.20 -0.06 0.00 0.07 0.00 0.00 59.98 60.13 3f5s h ARG 83 Cb -0.11 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 29.85 3f5s h ARG 83 CO -0.07 0.77 -0.01 0.82 -1.07 0.00 0.00 179.97 180.40 3f5s h ILE 84 N 0.67 1.26 -0.63 2.04 2.04 -0.62 -2.78 117.51 119.48 3f5s h ILE 84 Ca 0.13 -1.01 0.10 0.00 1.00 0.00 0.00 64.86 65.08 3f5s h ILE 84 Cb 0.49 1.20 -0.04 0.00 -0.74 0.00 0.00 36.82 37.72 3f5s h ILE 84 CO 0.03 0.34 0.42 0.58 0.00 0.00 0.00 178.15 179.51 3f5s h VAL 85 N 0.46 0.89 -0.14 1.67 2.07 -0.81 0.14 116.25 120.54 3f5s h VAL 85 Ca 0.10 -0.15 -0.03 0.00 0.82 0.00 0.00 66.70 67.43 3f5s h VAL 85 Cb 0.48 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.65 3f5s h VAL 85 CO 0.02 0.08 -0.07 0.58 0.02 0.00 0.00 177.57 178.20 3f5s h VAL 86 N 0.44 1.14 0.00 2.57 2.07 -1.15 -3.28 116.25 118.04 3f5s h VAL 86 Ca 0.29 -0.59 -0.07 0.00 0.82 0.00 0.00 66.70 67.16 3f5s h VAL 86 Cb 0.56 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 3f5s h VAL 86 CO -0.09 0.19 -1.85 0.59 0.02 0.00 0.00 177.57 176.43 3f5s n ASN 87 N -4.34 1.09 -3.95 0.57 3.02 -0.30 -5.01 115.26 106.35 3f5s n ASN 87 Ca -0.01 0.00 -0.12 0.00 -0.03 0.00 0.00 54.58 54.42 3f5s n ASN 87 Cb 0.22 1.57 -0.13 0.00 -0.61 0.00 0.00 39.78 40.82 3f5s n ASN 87 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 3f5s s TYR 88 N -2.99 0.28 -0.70 3.10 2.02 0.34 -5.06 117.35 114.33 3f5s s TYR 88 Ca -0.07 -0.23 0.25 0.00 -0.37 0.00 0.00 57.07 56.65 3f5s s TYR 88 Cb 0.09 -0.18 0.62 0.00 -0.40 0.00 0.00 41.96 42.09 3f5s s TYR 88 CO 0.70 -0.06 1.58 -0.35 -1.57 0.00 0.00 175.55 175.85 3f5s n PRO 89 N 2.42 0.27 -3.71 -1.71 -0.04 -1.26 -4.36 135.00 126.60 3f5s n PRO 89 Ca -0.17 0.16 -0.02 0.00 -0.04 0.00 0.00 63.50 63.43 3f5s n PRO 89 Cb 0.57 -1.75 -0.01 0.00 -0.04 0.00 0.00 33.50 32.28 3f5s n PRO 89 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 3f5s s ARG 90 N -3.13 0.93 -0.12 0.54 1.70 -1.26 -4.95 118.95 112.67 3f5s s ARG 90 Ca 0.09 -0.52 0.03 0.00 -0.47 0.00 0.00 55.73 54.86 3f5s s ARG 90 Cb 0.13 0.32 0.01 0.00 -0.57 0.00 0.00 34.95 34.84 3f5s s ARG 90 CO 0.65 -0.43 -0.22 -0.51 -1.08 0.00 0.00 175.30 173.71 3f5s s LEU 91 N -2.95 2.08 0.22 -1.89 1.43 -0.69 -4.90 118.68 111.97 3f5s s LEU 91 Ca 0.13 -0.58 0.18 0.00 -1.03 0.00 0.00 54.13 52.83 3f5s s LEU 91 Cb 0.01 -1.41 0.02 0.00 0.03 0.00 0.00 46.19 44.84 3f5s s LEU 91 CO 0.00 0.10 1.21 0.44 0.23 0.00 0.00 176.35 178.33 3f5s h ASP 92 N 7.13 0.00 -4.55 2.29 3.32 -0.84 -3.35 116.42 120.42 3f5s h ASP 92 Ca -0.28 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.65 3f5s h ASP 92 Cb 1.20 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 40.54 3f5s h ASP 92 CO 0.52 0.40 -0.27 -0.83 -1.72 0.00 0.00 179.24 177.34 3f5s s GLY 93 N -4.52 -0.21 -0.08 2.75 0.00 -0.82 -1.24 107.32 103.19 3f5s s GLY 93 Ca 0.01 0.62 0.01 0.00 0.00 0.00 0.00 44.72 45.36 3f5s s GLY 93 CO 0.76 0.43 -0.08 0.14 0.00 0.00 0.00 173.10 174.35 3f5s s VAL 94 N -0.73 0.95 -0.29 1.40 1.01 -0.35 -1.32 120.40 121.07 3f5s s VAL 94 Ca -0.08 -0.30 -0.04 0.00 0.00 0.00 0.00 61.98 61.56 3f5s s VAL 94 Cb -0.04 -0.94 0.03 0.00 0.00 0.00 0.00 36.38 35.43 3f5s s VAL 94 CO 0.03 0.34 0.02 -0.22 0.00 0.00 0.00 175.10 175.26 3f5s s LEU 95 N 1.26 3.71 -0.67 3.92 2.96 -0.08 -1.00 118.68 128.79 3f5s s LEU 95 Ca -0.04 -0.98 -0.22 0.00 -0.22 0.00 0.00 54.13 52.67 3f5s s LEU 95 Cb -0.14 -1.76 0.07 0.00 0.50 0.00 0.00 46.19 44.86 3f5s s LEU 95 CO -0.03 -0.21 0.96 -1.00 -1.32 0.00 0.00 176.35 174.75 3f5s s HIS 96 N 1.36 2.70 -0.18 5.38 3.76 0.01 -1.35 115.29 126.98 3f5s s HIS 96 Ca -0.01 -0.60 0.15 0.00 -0.15 0.00 0.00 55.06 54.45 3f5s s HIS 96 Cb -0.18 -4.28 -0.24 0.00 1.11 0.00 0.00 32.58 28.99 3f5s s HIS 96 CO -0.01 -1.63 0.14 0.09 -0.85 0.00 0.00 174.74 172.48 3f5s n ASN 97 N 7.60 0.40 -4.61 1.40 3.02 -1.24 -2.83 115.26 119.01 3f5s n ASN 97 Ca -0.03 0.06 -0.44 0.00 -0.03 0.00 0.00 54.58 54.14 3f5s n ASN 97 Cb 0.45 0.64 -0.01 0.00 -0.61 0.00 0.00 39.78 40.25 3f5s n ASN 97 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3f5s n ALA 98 N -2.78 0.04 -3.63 5.41 0.00 -1.25 -4.87 120.51 113.44 3f5s n ALA 98 Ca -0.32 0.35 -0.03 0.00 0.00 0.00 0.00 53.44 53.45 3f5s n ALA 98 Cb 1.12 -2.06 -0.01 0.00 0.00 0.00 0.00 19.45 18.50 3f5s n ALA 98 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3f5s s GLY 99 N -0.56 -0.35 -0.05 0.00 0.00 -1.26 -4.85 107.32 100.24 3f5s s GLY 99 Ca 0.59 0.85 0.04 0.00 0.00 0.00 0.00 44.72 46.20 3f5s s GLY 99 CO 0.60 0.23 -0.18 -2.27 0.00 0.00 0.00 173.10 171.48 3f5s s LEU 100 N -2.69 1.90 -0.03 0.66 2.96 -1.26 -5.04 118.68 115.18 3f5s s LEU 100 Ca 0.11 -0.38 -0.22 0.00 -0.22 0.00 0.00 54.13 53.42 3f5s s LEU 100 Cb 0.01 -1.03 -0.27 0.00 0.50 0.00 0.00 46.19 45.41 3f5s s LEU 100 CO -0.03 0.14 0.99 0.25 -1.32 0.00 0.00 176.35 176.37 3f5s h LEU 101 N 6.41 0.41 0.00 -0.68 5.85 -2.00 -3.46 115.31 121.85 3f5s h LEU 101 Ca -0.31 -0.85 0.00 0.00 0.84 0.00 0.00 57.88 57.56 3f5s h LEU 101 Cb 1.18 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.08 3f5s h LEU 101 CO 0.48 1.22 0.00 0.61 -0.34 0.00 0.00 178.44 180.40 3f5s n GLY 102 N 1.32 -0.00 3.73 3.75 0.00 -1.26 -4.21 105.19 108.52 3f5s n GLY 102 Ca -0.11 -0.96 -0.41 0.00 0.00 0.00 0.00 46.02 44.53 3f5s n GLY 102 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3f5s s ASP 103 N -4.00 7.46 -0.48 1.61 1.01 -1.26 -5.02 116.67 115.98 3f5s s ASP 103 Ca 0.00 1.74 -0.04 0.00 0.71 0.00 0.00 52.55 54.96 3f5s s ASP 103 Cb 0.00 -2.57 0.13 0.00 1.01 0.00 0.00 42.92 41.49 3f5s s ASP 103 CO 0.00 -0.05 0.30 -0.69 0.21 0.00 0.00 175.17 174.94 3f5s s VAL 104 N -0.05 3.58 -0.08 -1.27 1.01 -1.26 -4.65 120.40 117.69 3f5s s VAL 104 Ca 0.45 -2.27 -0.32 0.00 0.00 0.00 0.00 61.98 59.85 3f5s s VAL 104 Cb -0.23 -3.40 0.13 0.00 0.00 0.00 0.00 36.38 32.87 3f5s s VAL 104 CO 0.29 -0.76 1.24 0.00 0.00 0.00 0.00 175.10 175.87 3f5s s PRO 106 N -2.46 1.99 0.38 0.00 0.02 -1.26 -4.30 135.00 129.37 3f5s s PRO 106 Ca 0.12 1.69 0.12 0.00 0.02 0.00 0.00 61.00 62.96 3f5s s PRO 106 Cb 0.02 -1.82 0.93 0.00 0.02 0.00 0.00 34.50 33.65 3f5s s PRO 106 CO -0.04 -1.94 1.87 0.52 -0.33 0.00 0.00 177.00 177.08 3f5s h MET 107 N -0.57 0.55 0.00 5.54 2.86 -1.97 0.15 114.93 121.49 3f5s h MET 107 Ca -0.47 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.14 3f5s h MET 107 Cb 1.29 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.82 3f5s h MET 107 CO 0.49 0.37 0.00 0.66 1.06 0.00 0.00 176.91 179.48 3f5s h SER 108 N 0.57 0.00 0.00 1.22 4.64 -2.04 -3.01 113.55 114.92 3f5s h SER 108 Ca 0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.77 3f5s h SER 108 Cb 0.88 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.97 3f5s h SER 108 CO -0.19 0.00 -0.74 -0.62 -0.87 0.00 0.00 176.83 174.41 3f5s n GLU 109 N -2.96 2.42 -1.66 4.77 -0.58 0.44 -5.01 120.64 118.06 3f5s n GLU 109 Ca -0.01 -0.02 -0.46 0.00 -0.42 0.00 0.00 57.16 56.25 3f5s n GLU 109 Cb 0.17 -1.14 -0.04 0.00 -0.57 0.00 0.00 31.44 29.86 3f5s n GLU 109 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 3f5s n GLN 110 N -1.39 2.05 -2.56 3.49 1.13 -0.65 -4.93 117.38 114.52 3f5s n GLN 110 Ca 0.02 0.74 -0.43 0.00 -1.94 0.00 0.00 57.00 55.39 3f5s n GLN 110 Cb 0.22 -2.48 -0.02 0.00 0.11 0.00 0.00 30.24 28.06 3f5s n GLN 110 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 3f5s s ASN 111 N 0.80 7.11 0.54 1.08 3.84 -1.26 -4.92 114.94 122.13 3f5s s ASN 111 Ca 0.78 1.65 0.31 0.00 0.21 0.00 0.00 52.86 55.81 3f5s s ASN 111 Cb -0.70 -2.55 1.44 0.00 -0.55 0.00 0.00 41.25 38.88 3f5s s ASN 111 CO 0.40 -0.57 2.03 1.55 -2.79 0.00 0.00 177.10 177.71 3f5s h PRO 112 N 7.43 0.00 -0.11 0.43 0.13 -1.99 -0.74 132.00 137.15 3f5s h PRO 112 Ca -0.30 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.62 3f5s h PRO 112 Cb 1.14 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.28 3f5s h PRO 112 CO 0.90 0.08 -0.74 0.37 -0.23 0.00 0.00 178.00 178.38 3f5s h GLN 113 N 0.00 0.68 -0.57 0.86 -0.00 -1.99 -1.52 115.11 112.58 3f5s h GLN 113 Ca -0.00 -0.60 -0.11 0.00 -0.00 0.00 0.00 58.65 57.94 3f5s h GLN 113 Cb 0.45 0.14 -0.02 0.00 0.00 0.00 0.00 27.48 28.05 3f5s h GLN 113 CO 0.01 1.21 -0.08 0.28 0.00 0.00 0.00 178.83 180.25 3f5s h VAL 114 N 0.36 1.27 -0.19 2.39 2.07 -1.85 -1.82 116.25 118.48 3f5s h VAL 114 Ca -0.06 -1.24 0.04 0.00 0.82 0.00 0.00 66.70 66.26 3f5s h VAL 114 Cb 1.38 0.92 -0.04 0.00 -1.52 0.00 0.00 31.29 32.02 3f5s h VAL 114 CO 0.15 0.44 -0.09 -0.25 0.02 0.00 0.00 177.57 177.84 3f5s h TRP 115 N 0.94 -0.21 -0.70 1.57 2.91 -1.06 0.19 115.95 119.59 3f5s h TRP 115 Ca 0.15 0.02 -0.01 0.00 1.13 0.00 0.00 58.89 60.18 3f5s h TRP 115 Cb 0.65 0.12 -0.03 0.00 -0.51 0.00 0.00 29.16 29.39 3f5s h TRP 115 CO 0.05 -0.14 0.39 1.96 -1.03 0.00 0.00 178.44 179.66 3f5s h GLN 116 N -0.07 0.95 -0.28 2.65 4.20 -1.07 -1.75 115.11 119.75 3f5s h GLN 116 Ca 0.10 -0.10 -0.14 0.00 0.06 0.00 0.00 58.65 58.58 3f5s h GLN 116 Cb 0.22 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.80 3f5s h GLN 116 CO -0.24 0.69 -0.39 -0.44 -0.67 0.00 0.00 178.83 177.79 3f5s h ASP 117 N 0.97 0.69 -0.42 1.46 3.32 -0.43 0.11 116.42 122.11 3f5s h ASP 117 Ca 0.25 -0.30 -0.02 0.00 0.02 0.00 0.00 57.03 56.98 3f5s h ASP 117 Cb 0.01 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.35 3f5s h ASP 117 CO -0.04 1.00 0.20 0.58 -1.72 0.00 0.00 179.24 179.26 3f5s h VAL 118 N 0.53 1.18 -0.45 -1.35 2.07 -0.65 -1.39 116.25 116.19 3f5s h VAL 118 Ca 0.05 -0.51 -0.08 0.00 0.82 0.00 0.00 66.70 66.98 3f5s h VAL 118 Cb 0.91 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 3f5s h VAL 118 CO 0.08 0.19 -0.07 0.24 0.02 0.00 0.00 177.57 178.04 3f5s h MET 119 N 0.54 0.78 -0.27 1.57 2.86 -1.15 -0.22 114.93 119.04 3f5s h MET 119 Ca 0.15 -0.24 -0.06 0.00 -2.06 0.00 0.00 59.70 57.49 3f5s h MET 119 Cb 0.12 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.70 3f5s h MET 119 CO -0.02 0.83 -0.07 0.37 1.06 0.00 0.00 176.91 179.09 3f5s h GLN 120 N 0.71 0.53 0.13 1.72 5.75 -0.56 -0.69 115.11 122.71 3f5s h GLN 120 Ca 0.13 -0.20 -0.01 0.00 -0.15 0.00 0.00 58.65 58.42 3f5s h GLN 120 Cb 0.53 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 29.05 3f5s h GLN 120 CO 0.03 0.74 -0.06 0.82 -2.65 0.00 0.00 178.83 177.71 3f5s h ILE 121 N 0.28 1.02 -0.00 2.39 2.04 -1.25 0.30 117.51 122.30 3f5s h ILE 121 Ca 0.07 -1.16 -0.16 0.00 1.00 0.00 0.00 64.86 64.60 3f5s h ILE 121 Cb 0.54 1.68 -0.02 0.00 -0.74 0.00 0.00 36.82 38.28 3f5s h ILE 121 CO 0.03 0.25 -0.76 0.78 0.00 0.00 0.00 178.15 178.45 3f5s h ASN 122 N -0.77 0.01 0.00 1.72 4.21 -1.09 -3.10 115.58 116.56 3f5s h ASN 122 Ca -0.02 -0.01 0.00 0.00 1.21 0.00 0.00 56.30 57.49 3f5s h ASN 122 Cb 0.55 -0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.74 3f5s h ASN 122 CO 0.03 0.76 -0.24 0.52 -1.29 0.00 0.00 177.43 177.22 3f5s n VAL 123 N -3.64 0.77 -0.02 2.81 0.31 -0.34 -4.56 118.33 113.66 3f5s n VAL 123 Ca -0.01 0.26 -0.12 0.00 -0.01 0.00 0.00 64.34 64.46 3f5s n VAL 123 Cb 0.73 -1.61 -0.08 0.00 -0.91 0.00 0.00 33.84 31.98 3f5s n VAL 123 CO 0.00 0.00 0.00 0.78 -1.32 0.00 0.00 176.83 176.29 3f5s h ASN 124 N -0.24 0.10 0.28 4.52 2.35 -1.17 0.22 115.58 121.64 3f5s h ASN 124 Ca 0.00 -0.34 -0.16 0.00 -0.55 0.00 0.00 56.30 55.25 3f5s h ASN 124 Cb 0.24 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.57 3f5s h ASN 124 CO 0.00 0.42 -0.62 0.00 -1.65 0.00 0.00 177.43 175.57 3f5s h ALA 125 N 0.69 0.77 -0.56 -0.83 0.00 -0.54 0.20 119.26 118.98 3f5s h ALA 125 Ca 0.01 -0.55 -0.02 0.00 0.00 0.00 0.00 54.91 54.35 3f5s h ALA 125 Cb 0.37 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 3f5s h ALA 125 CO 0.00 0.73 0.27 1.15 0.00 0.00 0.00 179.25 181.41 3f5s h THR 126 N 0.24 1.20 -0.05 0.00 2.02 -1.45 -0.01 112.91 114.87 3f5s h THR 126 Ca -0.01 -0.57 0.01 0.00 0.77 0.00 0.00 66.41 66.61 3f5s h THR 126 Cb 1.15 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 68.10 3f5s h THR 126 CO 0.10 0.23 0.00 0.15 0.37 0.00 0.00 175.52 176.37 3f5s h PHE 127 N 0.76 0.00 -0.62 3.16 3.57 -0.67 -1.54 116.94 121.60 3f5s h PHE 127 Ca 0.19 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.66 3f5s h PHE 127 Cb 0.11 0.01 -0.03 0.00 2.79 0.00 0.00 35.95 38.83 3f5s h PHE 127 CO -0.00 -0.00 0.24 0.52 -2.23 0.00 0.00 178.31 176.83 3f5s h MET 128 N 0.02 0.91 -0.18 1.11 2.86 -0.64 0.61 114.93 119.62 3f5s h MET 128 Ca 0.02 -0.15 -0.13 0.00 -2.06 0.00 0.00 59.70 57.38 3f5s h MET 128 Cb 0.02 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 31.53 3f5s h MET 128 CO -0.04 0.75 -0.41 1.25 1.06 0.00 0.00 176.91 179.52 3f5s h LEU 129 N 0.90 0.67 -0.37 1.22 5.85 -0.98 -2.05 115.31 120.54 3f5s h LEU 129 Ca 0.21 -0.57 0.07 0.00 0.84 0.00 0.00 57.88 58.43 3f5s h LEU 129 Cb 0.19 -0.19 -0.06 0.00 0.37 0.00 0.00 40.66 40.97 3f5s h LEU 129 CO -0.02 1.12 -0.02 0.74 -0.34 0.00 0.00 178.44 179.92 3f5s h THR 130 N 0.26 0.70 -0.48 1.05 2.02 -0.86 -1.98 112.91 113.61 3f5s h THR 130 Ca -0.00 -0.03 0.06 0.00 0.77 0.00 0.00 66.41 67.22 3f5s h THR 130 Cb 1.02 0.61 -0.05 0.00 -1.74 0.00 0.00 68.15 67.99 3f5s h THR 130 CO 0.09 0.01 0.18 -0.61 0.37 0.00 0.00 175.52 175.56 3f5s h GLN 131 N 0.07 0.35 -0.01 6.66 4.15 -0.74 -1.37 115.11 124.22 3f5s h GLN 131 Ca 0.18 -0.02 -0.02 0.00 0.77 0.00 0.00 58.65 59.56 3f5s h GLN 131 Cb 0.26 -0.08 -0.00 0.00 0.21 0.00 0.00 27.48 27.87 3f5s h GLN 131 CO -0.33 0.23 -0.11 0.00 -1.93 0.00 0.00 178.83 176.69 3f5s h ALA 132 N 1.32 1.81 -0.01 3.38 0.00 -0.79 -3.06 119.26 121.91 3f5s h ALA 132 Ca 0.23 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3f5s h ALA 132 Cb 0.23 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3f5s h ALA 132 CO -0.23 0.15 -0.53 1.28 0.00 0.00 0.00 179.25 179.91 3f5s n LEU 133 N -4.40 1.52 -0.20 0.00 4.77 -0.65 -4.45 117.00 113.58 3f5s n LEU 133 Ca -0.03 -0.55 -0.03 0.00 -0.03 0.00 0.00 56.01 55.37 3f5s n LEU 133 Cb 0.19 -0.04 0.08 0.00 -2.33 0.00 0.00 43.42 41.31 3f5s n LEU 133 CO 0.36 0.30 1.06 -0.07 -1.33 0.00 0.00 177.39 177.71 3f5s h LEU 134 N 1.55 0.48 -0.94 2.23 3.38 -1.18 -1.78 115.31 119.04 3f5s h LEU 134 Ca 0.00 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3f5s h LEU 134 Cb 0.64 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.28 3f5s h LEU 134 CO 0.00 0.32 0.60 -0.65 0.09 0.00 0.00 178.44 178.80 3f5s h PRO 135 N 0.61 1.26 -0.70 1.13 0.11 -1.80 -0.53 132.00 132.08 3f5s h PRO 135 Ca 0.26 -0.09 -0.03 0.00 0.11 0.00 0.00 66.00 66.25 3f5s h PRO 135 Cb 0.15 -0.27 -0.03 0.00 0.11 0.00 0.00 31.00 30.96 3f5s h PRO 135 CO -0.17 0.86 0.30 -0.07 -0.21 0.00 0.00 178.00 178.71 3f5s h LEU 136 N 1.29 0.94 -1.27 2.35 3.38 -1.76 -2.69 115.31 117.55 3f5s h LEU 136 Ca 0.34 -0.16 -0.04 0.00 0.09 0.00 0.00 57.88 58.11 3f5s h LEU 136 Cb -0.11 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.38 3f5s h LEU 136 CO -0.07 0.84 0.07 -0.07 0.09 0.00 0.00 178.44 179.31 3f5s h LEU 137 N 0.98 0.53 -0.66 1.67 3.38 -0.72 -1.70 115.31 118.78 3f5s h LEU 137 Ca 0.23 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3f5s h LEU 137 Cb 0.18 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.79 3f5s h LEU 137 CO -0.02 0.55 0.00 0.18 0.09 0.00 0.00 178.44 179.23 3f5s n LEU 138 N -4.32 0.56 0.10 1.67 4.77 -0.26 -2.16 117.00 117.36 3f5s n LEU 138 Ca 0.02 0.65 0.12 0.00 -0.03 0.00 0.00 56.01 56.78 3f5s n LEU 138 Cb 0.20 -0.59 0.28 0.00 -2.33 0.00 0.00 43.42 40.99 3f5s n LEU 138 CO 0.38 -0.55 0.64 0.11 -1.33 0.00 0.00 177.39 176.64 3f5s h LYS 139 N 0.00 0.00 -7.17 3.23 1.57 -1.31 -3.46 116.57 109.43 3f5s h LYS 139 Ca 0.00 0.00 -0.51 0.00 -1.87 0.00 0.00 60.65 58.27 3f5s h LYS 139 Cb 0.31 0.00 0.11 0.00 0.08 0.00 0.00 32.23 32.73 3f5s h LYS 139 CO 0.00 0.00 0.39 0.45 -0.57 0.00 0.00 179.45 179.72 3f5s s SER 140 N -4.59 4.95 0.50 0.86 0.15 -0.92 -4.93 113.70 109.73 3f5s s SER 140 Ca 0.08 2.13 0.17 0.00 0.70 0.00 0.00 55.95 59.03 3f5s s SER 140 Cb 0.12 -2.57 1.22 0.00 -1.71 0.00 0.00 66.02 63.08 3f5s s SER 140 CO 0.66 -1.74 2.09 0.44 1.20 0.00 0.00 173.24 175.89 3f5s h ASP 141 N 0.13 0.00 -0.52 5.45 3.32 -1.88 -3.38 116.42 119.54 3f5s h ASP 141 Ca -0.48 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.42 3f5s h ASP 141 Cb 1.26 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 40.66 3f5s h ASP 141 CO 0.53 0.08 -0.42 0.00 -1.72 0.00 0.00 179.24 177.71 3f5s n ALA 142 N -2.50 -2.04 -1.77 3.45 0.00 -1.26 -5.11 120.51 111.29 3f5s n ALA 142 Ca -0.03 -0.99 -0.36 0.00 0.00 0.00 0.00 53.44 52.06 3f5s n ALA 142 Cb 0.16 -1.74 0.01 0.00 0.00 0.00 0.00 19.45 17.87 3f5s n ALA 142 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3f5s s GLY 143 N -0.04 2.74 -0.10 0.00 0.00 -1.26 -4.82 107.32 103.84 3f5s s GLY 143 Ca 0.30 0.96 0.02 0.00 0.00 0.00 0.00 44.72 46.00 3f5s s GLY 143 CO -0.12 1.38 -0.16 -0.45 0.00 0.00 0.00 173.10 173.75 3f5s s SER 144 N -1.48 2.45 -0.15 1.64 0.15 -0.38 -0.97 113.70 114.97 3f5s s SER 144 Ca 0.70 -0.43 0.01 0.00 0.70 0.00 0.00 55.95 56.92 3f5s s SER 144 Cb -0.29 -1.11 0.00 0.00 -1.71 0.00 0.00 66.02 62.92 3f5s s SER 144 CO 0.33 0.04 -0.18 -0.22 1.20 0.00 0.00 173.24 174.41 3f5s s LEU 145 N 0.86 2.32 -0.10 3.45 2.96 0.46 -1.21 118.68 127.42 3f5s s LEU 145 Ca -0.09 -0.53 0.01 0.00 -0.22 0.00 0.00 54.13 53.30 3f5s s LEU 145 Cb -0.15 -1.51 0.02 0.00 0.50 0.00 0.00 46.19 45.04 3f5s s LEU 145 CO 0.00 0.07 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.30 3f5s s VAL 146 N 0.86 1.26 0.18 1.68 1.01 -0.17 -1.83 120.40 123.40 3f5s s VAL 146 Ca -0.05 -0.49 0.04 0.00 0.00 0.00 0.00 61.98 61.48 3f5s s VAL 146 Cb -0.15 -1.19 -0.04 0.00 0.00 0.00 0.00 36.38 35.01 3f5s s VAL 146 CO -0.02 0.40 0.24 -0.36 0.00 0.00 0.00 175.10 175.36 3f5s s PHE 147 N 1.14 3.34 -0.24 5.22 0.08 -0.43 -0.81 117.98 126.27 3f5s s PHE 147 Ca -0.05 0.03 -0.16 0.00 0.12 0.00 0.00 56.93 56.87 3f5s s PHE 147 Cb -0.14 -1.57 -0.04 0.00 -0.57 0.00 0.00 43.02 40.70 3f5s s PHE 147 CO -0.03 0.50 0.41 0.99 -0.10 0.00 0.00 175.22 177.00 3f5s s THR 148 N -1.83 5.16 0.00 0.64 2.01 -1.13 -0.82 115.64 119.67 3f5s s THR 148 Ca 0.33 0.69 0.00 0.00 0.31 0.00 0.00 61.69 63.02 3f5s s THR 148 Cb -0.10 -3.74 0.00 0.00 0.01 0.00 0.00 72.50 68.67 3f5s s THR 148 CO 0.27 0.18 0.00 -0.24 -0.69 0.00 0.00 174.62 174.13 3f5s n SER 149 N 5.05 0.85 -3.57 3.53 2.88 0.44 -4.91 113.62 117.89 3f5s n SER 149 Ca -0.07 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.38 3f5s n SER 149 Cb 0.51 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.95 3f5s n SER 149 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 3f5s s SER 150 N 0.12 -0.39 0.43 -3.46 0.15 -1.26 -4.40 113.70 104.90 3f5s s SER 150 Ca 0.00 -0.17 0.12 0.00 0.70 0.00 0.00 55.95 56.60 3f5s s SER 150 Cb 0.00 0.53 1.00 0.00 -1.71 0.00 0.00 66.02 65.84 3f5s s SER 150 CO 0.00 -0.90 2.02 0.77 1.20 0.00 0.00 173.24 176.32 3f5s h SER 151 N 2.00 0.37 -0.05 5.45 4.64 -1.94 -0.03 113.55 123.98 3f5s h SER 151 Ca -0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 3f5s h SER 151 Cb 1.26 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 3f5s h SER 151 CO 0.31 0.24 0.00 1.33 -0.87 0.00 0.00 176.83 177.84 3f5s n VAL 152 N -4.47 0.07 1.36 0.95 0.24 -1.26 -1.79 118.33 113.43 3f5s n VAL 152 Ca 0.07 -0.10 0.14 0.00 -2.04 0.00 0.00 64.34 62.40 3f5s n VAL 152 Cb 0.26 -0.09 0.48 0.00 -1.47 0.00 0.00 33.84 33.03 3f5s n VAL 152 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3f5s n GLY 153 N 0.86 -0.55 0.00 7.63 0.00 -0.03 -4.30 105.19 108.80 3f5s n GLY 153 Ca 0.13 -0.38 -0.00 0.00 0.00 0.00 0.00 46.02 45.77 3f5s n GLY 153 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3f5s n ARG 154 N -0.53 2.31 -3.75 1.61 3.00 -0.74 -3.98 116.66 114.58 3f5s n ARG 154 Ca 0.15 0.00 -0.27 0.00 -0.01 0.00 0.00 57.85 57.72 3f5s n ARG 154 Cb 0.33 -1.02 -0.17 0.00 0.00 0.00 0.00 32.46 31.60 3f5s n ARG 154 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.63 176.49 3f5s s GLN 155 N -2.02 0.68 0.36 5.56 0.74 -0.77 -5.13 119.66 119.08 3f5s s GLN 155 Ca -0.01 -0.30 -0.27 0.00 0.05 0.00 0.00 55.36 54.83 3f5s s GLN 155 Cb 0.00 -1.83 -0.09 0.00 1.10 0.00 0.00 33.01 32.18 3f5s s GLN 155 CO 0.03 -0.55 1.26 0.20 -0.55 0.00 0.00 175.29 175.68 3f5s s GLY 156 N 1.88 2.97 0.04 2.59 0.00 -1.26 -4.18 107.32 109.35 3f5s s GLY 156 Ca 0.01 1.17 0.04 0.00 0.00 0.00 0.00 44.72 45.94 3f5s s GLY 156 CO -0.07 1.78 -0.13 0.50 0.00 0.00 0.00 173.10 175.17 3f5s s ARG 157 N -1.96 0.84 0.20 2.90 0.52 -1.26 -5.09 118.95 115.10 3f5s s ARG 157 Ca 0.52 -0.77 -0.30 0.00 -0.52 0.00 0.00 55.73 54.66 3f5s s ARG 157 Cb -0.37 -0.82 -0.16 0.00 0.52 0.00 0.00 34.95 34.12 3f5s s ARG 157 CO 0.48 0.20 0.85 0.00 0.02 0.00 0.00 175.30 176.85 3f5s n ALA 158 N 1.78 -1.81 -0.14 2.13 0.00 -1.26 -2.51 120.51 118.70 3f5s n ALA 158 Ca -0.19 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.70 3f5s n ALA 158 Cb 0.55 -1.82 0.00 0.00 0.00 0.00 0.00 19.45 18.17 3f5s n ALA 158 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3f5s n ASN 159 N 1.74 0.00 -0.38 0.00 5.03 -1.26 -4.87 115.26 115.52 3f5s n ASN 159 Ca 0.15 0.00 0.13 0.00 0.87 0.00 0.00 54.58 55.73 3f5s n ASN 159 Cb 0.25 0.00 0.28 0.00 -1.02 0.00 0.00 39.78 39.29 3f5s n ASN 159 CO 0.00 0.00 0.00 0.79 -1.83 0.00 0.00 177.26 176.22 3f5s n TRP 160 N -2.00 0.00 0.00 3.10 7.02 -1.04 -1.07 117.44 123.45 3f5s n TRP 160 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 3f5s n TRP 160 Cb 0.00 -0.07 0.00 0.00 -2.42 0.00 0.00 31.31 28.82 3f5s n TRP 160 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3f5s n GLY 161 N 1.34 1.68 0.35 6.99 0.00 -1.26 -1.49 105.19 112.80 3f5s n GLY 161 Ca 0.12 0.18 -0.02 0.00 0.00 0.00 0.00 46.02 46.31 3f5s n GLY 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3f5s h ALA 162 N 0.00 1.31 -0.37 4.61 0.00 -1.89 -2.22 119.26 120.70 3f5s h ALA 162 Ca 0.00 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.81 3f5s h ALA 162 Cb 0.00 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 3f5s h ALA 162 CO 0.00 0.58 0.24 -0.92 0.00 0.00 0.00 179.25 179.14 3f5s h TYR 163 N 1.09 0.45 -0.30 0.00 3.20 -1.50 0.12 116.97 120.03 3f5s h TYR 163 Ca 0.28 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.16 3f5s h TYR 163 Cb -0.01 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.10 3f5s h TYR 163 CO 0.01 0.28 0.19 0.00 -1.64 0.00 0.00 178.16 177.00 3f5s h ALA 164 N 1.14 0.38 -0.89 1.82 0.00 -0.89 0.28 119.26 121.10 3f5s h ALA 164 Ca 0.14 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.04 3f5s h ALA 164 Cb -0.04 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.58 3f5s h ALA 164 CO -0.04 -0.15 0.59 0.00 0.00 0.00 0.00 179.25 179.65 3f5s h ALA 165 N 1.10 1.14 0.00 0.00 0.00 -1.07 -0.16 119.26 120.27 3f5s h ALA 165 Ca 0.11 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 3f5s h ALA 165 Cb -0.04 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.39 3f5s h ALA 165 CO -0.02 0.50 -0.51 0.66 0.00 0.00 0.00 179.25 179.88 3f5s h SER 166 N 1.18 0.00 0.75 0.00 4.64 -0.29 -1.35 113.55 118.49 3f5s h SER 166 Ca 0.33 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.40 3f5s h SER 166 Cb -0.10 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 61.97 3f5s h SER 166 CO -0.08 0.51 -1.23 0.11 -0.87 0.00 0.00 176.83 175.27 3f5s h LYS 167 N 0.00 0.13 -0.23 4.77 1.79 -0.40 -0.58 116.57 122.05 3f5s h LYS 167 Ca -0.01 -0.21 0.04 0.00 -2.18 0.00 0.00 60.65 58.29 3f5s h LYS 167 Cb 0.93 0.08 -0.03 0.00 -1.58 0.00 0.00 32.23 31.63 3f5s h LYS 167 CO 0.07 1.04 0.01 0.74 -1.08 0.00 0.00 179.45 180.23 3f5s h PHE 168 N 0.03 0.01 -0.83 -1.35 -1.00 -0.99 -1.29 116.94 111.54 3f5s h PHE 168 Ca -0.11 0.02 0.04 0.00 2.81 0.00 0.00 57.97 60.73 3f5s h PHE 168 Cb 1.90 0.03 -0.05 0.00 3.61 0.00 0.00 35.95 41.43 3f5s h PHE 168 CO 0.03 -0.02 0.54 0.00 -1.61 0.00 0.00 178.31 177.26 3f5s h ALA 169 N 1.19 1.52 -0.51 2.45 0.00 -1.13 -1.24 119.26 121.55 3f5s h ALA 169 Ca 0.11 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 3f5s h ALA 169 Cb 0.13 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 3f5s h ALA 169 CO -0.17 0.38 0.23 1.15 0.00 0.00 0.00 179.25 180.84 3f5s h THR 170 N 0.99 1.20 -0.86 0.00 2.02 -0.71 0.17 112.91 115.73 3f5s h THR 170 Ca 0.34 -0.59 -0.00 0.00 0.77 0.00 0.00 66.41 66.92 3f5s h THR 170 Cb 0.09 0.65 -0.04 0.00 -1.74 0.00 0.00 68.15 67.11 3f5s h THR 170 CO -0.11 0.23 0.52 -0.33 0.37 0.00 0.00 175.52 176.21 3f5s h GLU 171 N 0.68 1.16 -0.32 6.66 4.39 -0.65 -0.72 114.58 125.78 3f5s h GLU 171 Ca 0.17 -0.10 -0.06 0.00 0.34 0.00 0.00 59.36 59.71 3f5s h GLU 171 Cb 0.15 -0.25 -0.01 0.00 -0.10 0.00 0.00 28.75 28.54 3f5s h GLU 171 CO -0.02 0.81 -0.05 0.78 -1.16 0.00 0.00 179.01 179.37 3f5s h GLY 172 N 1.18 0.65 0.59 -3.84 0.00 -0.84 -1.20 103.07 99.61 3f5s h GLY 172 Ca 0.31 -0.51 0.06 0.00 0.00 0.00 0.00 47.33 47.18 3f5s h GLY 172 CO -0.06 0.47 0.16 -0.33 0.00 0.00 0.00 176.54 176.78 3f5s h MET 173 N 0.38 0.32 -0.73 4.80 2.86 -0.80 -0.75 114.93 121.01 3f5s h MET 173 Ca 0.08 -0.02 0.04 0.00 -2.06 0.00 0.00 59.70 57.74 3f5s h MET 173 Cb 0.52 -0.07 -0.05 0.00 0.06 0.00 0.00 31.60 32.06 3f5s h MET 173 CO 0.03 0.21 0.45 1.98 1.06 0.00 0.00 176.91 180.64 3f5s h MET 174 N 0.33 0.84 -0.45 1.72 -1.53 -0.91 -0.83 114.93 114.11 3f5s h MET 174 Ca 0.21 -0.05 -0.12 0.00 -3.44 0.00 0.00 59.70 56.30 3f5s h MET 174 Cb 0.21 -0.19 -0.01 0.00 -0.55 0.00 0.00 31.60 31.05 3f5s h MET 174 CO -0.21 0.56 -0.20 1.96 0.14 0.00 0.00 176.91 179.16 3f5s h GLN 175 N 0.87 0.93 0.01 0.39 4.20 -0.64 0.97 115.11 121.84 3f5s h GLN 175 Ca 0.30 -0.40 0.00 0.00 0.06 0.00 0.00 58.65 58.62 3f5s h GLN 175 Cb 0.06 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.80 3f5s h GLN 175 CO -0.13 1.06 -0.04 0.28 -0.67 0.00 0.00 178.83 179.33 3f5s h VAL 176 N 0.76 0.91 -0.66 -0.54 2.07 -0.93 -1.64 116.25 116.23 3f5s h VAL 176 Ca 0.10 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.63 3f5s h VAL 176 Cb 0.77 0.91 -0.03 0.00 -1.52 0.00 0.00 31.29 31.42 3f5s h VAL 176 CO 0.06 0.00 0.43 -0.07 0.02 0.00 0.00 177.57 178.02 3f5s h LEU 177 N -0.07 0.75 -1.15 2.57 3.38 -0.98 -0.17 115.31 119.65 3f5s h LEU 177 Ca 0.01 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 3f5s h LEU 177 Cb 0.08 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 3f5s h LEU 177 CO -0.03 0.55 0.24 0.00 0.09 0.00 0.00 178.44 179.29 3f5s h ALA 178 N 1.24 1.33 -0.27 1.53 0.00 -0.62 -0.61 119.26 121.86 3f5s h ALA 178 Ca 0.24 -0.15 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 3f5s h ALA 178 Cb -0.10 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.45 3f5s h ALA 178 CO -0.05 0.50 -0.25 0.22 0.00 0.00 0.00 179.25 179.67 3f5s h ASP 179 N 0.83 0.69 0.12 0.00 3.58 -0.67 -2.31 116.42 118.66 3f5s h ASP 179 Ca 0.20 -0.47 -0.07 0.00 0.42 0.00 0.00 57.03 57.11 3f5s h ASP 179 Cb 0.15 -0.19 -0.01 0.00 1.72 0.00 0.00 39.33 41.00 3f5s h ASP 179 CO -0.02 1.01 -0.25 -0.33 -2.88 0.00 0.00 179.24 176.77 3f5s h GLU 180 N 0.38 0.23 -0.43 0.28 5.08 -0.56 -3.21 114.58 116.34 3f5s h GLU 180 Ca 0.04 -0.08 -0.17 0.00 -1.00 0.00 0.00 59.36 58.16 3f5s h GLU 180 Cb 0.81 -0.02 -0.10 0.00 0.50 0.00 0.00 28.75 29.94 3f5s h GLU 180 CO 0.06 0.48 0.05 0.66 -1.00 0.00 0.00 179.01 179.27 3f5s n TYR 181 N -4.16 1.38 -1.55 4.33 4.02 -0.28 -4.99 117.16 115.91 3f5s n TYR 181 Ca -0.01 -1.38 -0.54 0.00 -0.01 0.00 0.00 57.90 55.96 3f5s n TYR 181 Cb 0.36 -0.51 -0.06 0.00 -0.02 0.00 0.00 39.34 39.11 3f5s n TYR 181 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 3f5s n GLN 182 N -0.87 0.70 -0.93 -0.72 6.02 -0.87 -0.81 117.38 119.90 3f5s n GLN 182 Ca 0.33 0.25 0.00 0.00 -0.01 0.00 0.00 57.00 57.58 3f5s n GLN 182 Cb 1.09 -1.80 0.00 0.00 1.02 0.00 0.00 30.24 30.56 3f5s n GLN 182 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3f5s n GLN 183 N 1.98 -0.74 0.00 -1.09 10.64 -1.26 -4.75 117.38 122.17 3f5s n GLN 183 Ca 0.18 0.18 0.00 0.00 -1.83 0.00 0.00 57.00 55.54 3f5s n GLN 183 Cb 0.16 -3.88 0.00 0.00 -0.86 0.00 0.00 30.24 25.66 3f5s n GLN 183 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.06 175.77 3f5s n ARG 184 N -1.25 0.52 -4.13 2.61 1.74 0.01 -5.11 116.66 111.05 3f5s n ARG 184 Ca 0.00 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 56.99 3f5s n ARG 184 Cb 0.18 -0.76 -0.10 0.00 -1.02 0.00 0.00 32.46 30.77 3f5s n ARG 184 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3f5s s LEU 185 N -3.64 2.49 -0.24 0.55 1.43 -0.62 -4.45 118.68 114.19 3f5s s LEU 185 Ca 0.00 -0.99 -0.13 0.00 -1.03 0.00 0.00 54.13 51.99 3f5s s LEU 185 Cb 0.00 0.05 -0.04 0.00 0.03 0.00 0.00 46.19 46.23 3f5s s LEU 185 CO 0.00 -0.52 0.27 -0.13 0.23 0.00 0.00 176.35 176.20 3f5s s ARG 186 N -3.78 4.08 -0.09 1.70 0.52 -0.14 -4.67 118.95 116.56 3f5s s ARG 186 Ca 0.09 -0.09 -0.01 0.00 -0.52 0.00 0.00 55.73 55.20 3f5s s ARG 186 Cb 0.06 -3.57 0.03 0.00 0.52 0.00 0.00 34.95 31.98 3f5s s ARG 186 CO -0.07 -0.05 -0.03 0.08 0.02 0.00 0.00 175.30 175.25 3f5s s VAL 187 N 1.39 0.66 0.22 3.52 1.01 -1.26 -0.41 120.40 125.53 3f5s s VAL 187 Ca 0.12 -0.07 -0.10 0.00 0.00 0.00 0.00 61.98 61.92 3f5s s VAL 187 Cb -0.15 -0.77 -0.01 0.00 0.00 0.00 0.00 36.38 35.46 3f5s s VAL 187 CO 0.07 0.29 0.38 0.20 0.00 0.00 0.00 175.10 176.05 3f5s s ASN 188 N 1.86 -0.03 0.16 3.32 0.01 -0.76 0.30 114.94 119.79 3f5s s ASN 188 Ca 0.05 -0.97 0.11 0.00 -0.71 0.00 0.00 52.86 51.34 3f5s s ASN 188 Cb -0.12 0.52 -0.04 0.00 0.41 0.00 0.00 41.25 42.01 3f5s s ASN 188 CO -0.07 -1.03 -0.22 0.00 -1.51 0.00 0.00 177.10 174.27 3f5s s ILE 190 N -1.40 1.99 -0.45 0.00 1.01 -0.00 -1.04 121.20 121.31 3f5s s ILE 190 Ca 0.19 -0.98 -0.16 0.00 0.00 0.00 0.00 60.65 59.71 3f5s s ILE 190 Cb -0.09 -1.72 0.05 0.00 0.01 0.00 0.00 42.46 40.71 3f5s s ILE 190 CO 0.09 0.54 0.37 0.21 0.00 0.00 0.00 174.94 176.16 3f5s s ASN 191 N 0.36 6.14 0.48 3.58 2.47 0.67 -0.42 114.94 128.21 3f5s s ASN 191 Ca -0.19 -1.11 0.31 0.00 0.42 0.00 0.00 52.86 52.29 3f5s s ASN 191 Cb -0.18 -2.18 1.20 0.00 -1.45 0.00 0.00 41.25 38.64 3f5s s ASN 191 CO 0.09 -0.58 1.90 1.55 -3.72 0.00 0.00 177.10 176.33 3f5s h PRO 192 N 8.72 0.00 0.00 0.43 0.13 -1.86 -0.71 132.00 138.71 3f5s h PRO 192 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 3f5s h PRO 192 Cb 1.11 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.24 3f5s h PRO 192 CO 0.82 0.00 -0.00 0.41 -0.23 0.00 0.00 178.00 179.00 3f5s n GLY 193 N 0.14 -1.99 3.65 1.56 0.00 -1.26 -4.63 105.19 102.66 3f5s n GLY 193 Ca 0.01 -1.39 -0.43 0.00 0.00 0.00 0.00 46.02 44.22 3f5s n GLY 193 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3f5s s GLY 194 N -1.55 1.54 0.03 -0.02 0.00 -1.26 -5.00 107.32 101.06 3f5s s GLY 194 Ca 0.00 0.52 -0.00 0.00 0.00 0.00 0.00 44.72 45.24 3f5s s GLY 194 CO 0.00 2.69 -0.03 -1.59 0.00 0.00 0.00 173.10 174.16 3f5s s THR 195 N 3.93 0.19 0.00 0.90 2.01 -1.26 -4.20 115.64 117.21 3f5s s THR 195 Ca 0.61 -1.21 0.00 0.00 0.31 0.00 0.00 61.69 61.40 3f5s s THR 195 Cb -0.24 -0.69 0.00 0.00 0.01 0.00 0.00 72.50 71.58 3f5s s THR 195 CO 0.21 -0.65 0.00 0.54 -0.69 0.00 0.00 174.62 174.03 3f5s n ARG 196 N 1.11 0.00 -0.13 4.92 5.12 -1.14 -5.03 116.66 121.51 3f5s n ARG 196 Ca -0.21 0.00 -0.03 0.00 -1.93 0.00 0.00 57.85 55.68 3f5s n ARG 196 Cb 0.57 0.00 -0.03 0.00 -1.16 0.00 0.00 32.46 31.84 3f5s n ARG 196 CO 0.00 0.00 0.00 2.41 -1.93 0.00 0.00 177.63 178.11 3f5s n THR 197 N 0.00 -0.21 0.00 0.55 -1.04 -1.26 -4.97 114.28 107.35 3f5s n THR 197 Ca 0.00 0.82 0.00 0.00 -2.04 0.00 0.00 64.05 62.83 3f5s n THR 197 Cb 0.00 -1.02 0.00 0.00 -1.82 0.00 0.00 70.33 67.49 3f5s n THR 197 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 3f5s n PRO 209 N -4.18 0.00 0.13 -2.82 -0.04 -1.26 -5.07 135.00 121.76 3f5s n PRO 209 Ca 0.01 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.57 3f5s n PRO 209 Cb 0.08 0.00 0.50 0.00 -0.04 0.00 0.00 33.50 34.04 3f5s n PRO 209 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 3f5s n GLN 210 N 0.00 0.15 0.12 0.54 6.02 -1.26 -2.68 117.38 120.28 3f5s n GLN 210 Ca 0.00 0.51 0.05 0.00 -0.01 0.00 0.00 57.00 57.55 3f5s n GLN 210 Cb 0.00 -1.87 0.02 0.00 1.02 0.00 0.00 30.24 29.40 3f5s n GLN 210 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.06 176.92 3f5s h LYS 211 N 0.00 0.00 -6.91 -1.09 1.79 -2.05 -3.47 116.57 104.83 3f5s h LYS 211 Ca 0.00 0.00 -0.48 0.00 -2.18 0.00 0.00 60.65 57.99 3f5s h LYS 211 Cb 0.19 0.00 0.04 0.00 -1.58 0.00 0.00 32.23 30.88 3f5s h LYS 211 CO 0.00 0.28 0.07 -0.48 -1.08 0.00 0.00 179.45 178.24 3f5s s LEU 212 N -6.06 3.55 0.63 2.94 0.05 -1.09 -5.06 118.68 113.63 3f5s s LEU 212 Ca 0.02 0.73 -0.16 0.00 0.05 0.00 0.00 54.13 54.76 3f5s s LEU 212 Cb 0.08 -3.63 -0.02 0.00 -2.05 0.00 0.00 46.19 40.57 3f5s s LEU 212 CO 0.76 -0.71 1.12 -0.54 -0.55 0.00 0.00 176.35 176.43 3f5s s LYS 213 N -4.75 2.94 0.45 1.48 1.02 -1.26 -4.83 119.74 114.79 3f5s s LYS 213 Ca 0.49 1.48 0.02 0.00 0.02 0.00 0.00 55.97 57.98 3f5s s LYS 213 Cb -0.10 -1.96 0.00 0.00 -0.52 0.00 0.00 37.83 35.25 3f5s s LYS 213 CO 0.43 -1.15 0.66 0.95 -0.92 0.00 0.00 175.35 175.31 3f5s s THR 214 N -2.14 3.76 0.51 2.17 -4.23 -1.26 -2.90 115.64 111.56 3f5s s THR 214 Ca 0.69 -0.61 0.23 0.00 -1.18 0.00 0.00 61.69 60.82 3f5s s THR 214 Cb -0.22 -3.38 0.37 0.00 1.34 0.00 0.00 72.50 70.62 3f5s s THR 214 CO 0.37 -0.24 2.01 -0.65 -0.54 0.00 0.00 174.62 175.56 3f5s h PRO 215 N 0.42 0.06 -0.40 3.99 0.11 -1.94 -0.71 132.00 133.54 3f5s h PRO 215 Ca -0.45 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.61 3f5s h PRO 215 Cb 1.26 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.34 3f5s h PRO 215 CO 0.55 0.04 0.08 0.00 -0.21 0.00 0.00 178.00 178.46 3f5s h ALA 216 N 1.75 1.39 0.00 -0.75 0.00 -1.96 -2.80 119.26 116.90 3f5s h ALA 216 Ca 0.23 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 3f5s h ALA 216 Cb 0.85 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 3f5s h ALA 216 CO -0.02 0.44 -0.18 -0.44 0.00 0.00 0.00 179.25 179.05 3f5s h ASP 217 N 0.59 0.00 -0.38 0.00 3.32 -1.50 -2.80 116.42 115.64 3f5s h ASP 217 Ca 0.13 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.18 3f5s h ASP 217 Cb 0.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.80 3f5s h ASP 217 CO -0.00 0.18 0.00 2.30 -1.72 0.00 0.00 179.24 180.00 3f5s n ILE 218 N -3.42 0.49 0.25 0.35 -5.35 -1.06 -4.52 119.36 106.11 3f5s n ILE 218 Ca -0.00 -0.73 0.11 0.00 -0.27 0.00 0.00 62.75 61.86 3f5s n ILE 218 Cb 0.37 0.96 0.65 0.00 -1.74 0.00 0.00 39.64 39.89 3f5s n ILE 218 CO 0.00 0.00 0.00 0.24 -1.76 0.00 0.00 176.55 175.03 3f5s h MET 219 N 4.40 0.00 -0.85 6.28 2.86 -1.50 -3.27 114.93 122.86 3f5s h MET 219 Ca 0.00 0.00 0.15 0.00 -2.06 0.00 0.00 59.70 57.79 3f5s h MET 219 Cb 0.97 0.00 -0.09 0.00 0.06 0.00 0.00 31.60 32.54 3f5s h MET 219 CO 0.00 0.15 0.43 -1.35 1.06 0.00 0.00 176.91 177.21 3f5s h PRO 220 N 0.00 0.60 -0.40 -0.22 0.11 -1.82 -0.28 132.00 129.99 3f5s h PRO 220 Ca -0.00 -0.04 -0.13 0.00 0.11 0.00 0.00 66.00 65.94 3f5s h PRO 220 Cb 0.39 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 31.35 3f5s h PRO 220 CO 0.02 0.40 -0.27 1.25 -0.21 0.00 0.00 178.00 179.18 3f5s h LEU 221 N 0.62 0.87 -0.85 2.35 5.85 -1.84 -0.65 115.31 121.66 3f5s h LEU 221 Ca 0.46 -0.34 -0.05 0.00 0.84 0.00 0.00 57.88 58.79 3f5s h LEU 221 Cb 0.66 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.42 3f5s h LEU 221 CO -0.37 1.09 0.22 1.88 -0.34 0.00 0.00 178.44 180.92 3f5s h TYR 222 N 0.72 1.10 -0.14 1.25 -1.99 -1.30 -1.84 116.97 114.78 3f5s h TYR 222 Ca 0.09 -0.10 -0.04 0.00 2.00 0.00 0.00 58.73 60.67 3f5s h TYR 222 Cb 0.82 -0.32 -0.00 0.00 2.00 0.00 0.00 36.73 39.22 3f5s h TYR 222 CO 0.05 0.87 -0.07 -0.07 -0.00 0.00 0.00 178.16 178.94 3f5s h LEU 223 N 1.03 0.30 -0.64 3.88 3.38 -0.97 -3.27 115.31 119.03 3f5s h LEU 223 Ca 0.23 -0.41 0.06 0.00 0.09 0.00 0.00 57.88 57.85 3f5s h LEU 223 Cb 0.29 -0.08 -0.06 0.00 0.09 0.00 0.00 40.66 40.90 3f5s h LEU 223 CO -0.01 0.65 0.34 -0.25 0.09 0.00 0.00 178.44 179.26 3f5s h TRP 224 N -0.04 0.61 0.00 1.13 7.01 -0.84 -1.54 115.95 122.28 3f5s h TRP 224 Ca 0.03 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.05 3f5s h TRP 224 Cb 0.54 -0.18 -0.00 0.00 -2.10 0.00 0.00 29.16 27.41 3f5s h TRP 224 CO 0.07 0.28 -0.04 -0.07 -2.79 0.00 0.00 178.44 175.88 3f5s h LEU 225 N 0.62 0.00 0.00 0.65 3.38 -1.43 -2.62 115.31 115.90 3f5s h LEU 225 Ca 0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.26 3f5s h LEU 225 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 3f5s h LEU 225 CO -0.20 0.04 -1.45 0.23 0.09 0.00 0.00 178.44 177.15 3f5s n MET 226 N -3.41 0.53 -2.45 1.13 2.81 -0.68 -4.90 117.12 110.16 3f5s n MET 226 Ca -0.02 -0.05 -0.24 0.00 -1.81 0.00 0.00 57.70 55.58 3f5s n MET 226 Cb 0.17 -1.63 0.09 0.00 -0.71 0.00 0.00 33.22 31.14 3f5s n MET 226 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 3f5s s GLY 227 N -4.22 1.76 0.48 3.03 0.00 -0.67 -4.99 107.32 102.73 3f5s s GLY 227 Ca -0.03 -1.40 0.30 0.00 0.00 0.00 0.00 44.72 43.60 3f5s s GLY 227 CO 0.85 -0.92 1.88 -0.55 0.00 0.00 0.00 173.10 174.36 3f5s h ASP 228 N -0.50 0.00 0.63 1.64 5.19 -1.84 -2.95 116.42 118.59 3f5s h ASP 228 Ca -0.40 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.01 3f5s h ASP 228 Cb 1.28 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.79 3f5s h ASP 228 CO 0.47 0.00 0.00 0.47 -3.12 0.00 0.00 179.24 177.06 3f5s n ASP 229 N -2.97 0.30 -0.99 6.45 8.00 -1.26 -1.94 116.55 124.15 3f5s n ASP 229 Ca 0.02 0.57 0.08 0.00 0.71 0.00 0.00 54.79 56.17 3f5s n ASP 229 Cb 0.34 -0.64 0.24 0.00 -0.02 0.00 0.00 41.12 41.05 3f5s n ASP 229 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3f5s n SER 230 N -1.83 3.46 -4.72 -2.24 3.41 -1.11 -4.97 113.62 105.62 3f5s n SER 230 Ca 0.03 -2.03 -0.38 0.00 -0.26 0.00 0.00 58.87 56.22 3f5s n SER 230 Cb 0.21 -0.36 0.05 0.00 -0.26 0.00 0.00 64.21 63.84 3f5s n SER 230 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 3f5s n ARG 231 N 1.02 1.49 -1.84 4.33 3.00 -0.82 -1.21 116.66 122.62 3f5s n ARG 231 Ca 0.18 0.55 -0.11 0.00 -0.00 0.00 0.00 57.85 58.47 3f5s n ARG 231 Cb 0.54 -2.49 -0.03 0.00 0.00 0.00 0.00 32.46 30.47 3f5s n ARG 231 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 3f5s n ARG 232 N -1.10 -1.72 -3.30 -0.14 1.74 -1.26 -4.93 116.66 105.95 3f5s n ARG 232 Ca 0.12 0.62 -0.40 0.00 -0.77 0.00 0.00 57.85 57.42 3f5s n ARG 232 Cb 0.45 -5.01 -0.08 0.00 -1.02 0.00 0.00 32.46 26.80 3f5s n ARG 232 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 3f5s s LYS 233 N -3.91 3.86 0.05 5.56 -0.14 -0.35 -5.09 119.74 119.72 3f5s s LYS 233 Ca 0.00 0.02 -0.08 0.00 -1.36 0.00 0.00 55.97 54.54 3f5s s LYS 233 Cb 0.00 -3.72 -0.00 0.00 -1.68 0.00 0.00 37.83 32.43 3f5s s LYS 233 CO 0.00 -0.44 0.17 -0.08 -0.76 0.00 0.00 175.35 174.24 3f5s s THR 234 N 2.24 0.12 -0.41 2.17 -1.32 -1.26 -4.48 115.64 112.70 3f5s s THR 234 Ca 0.18 -0.99 0.00 0.00 -1.21 0.00 0.00 61.69 59.67 3f5s s THR 234 Cb -0.16 -0.98 0.00 0.00 -1.51 0.00 0.00 72.50 69.86 3f5s s THR 234 CO 0.11 -0.55 0.00 0.61 -2.21 0.00 0.00 174.62 172.58 3f5s n GLY 235 N 0.59 0.67 3.65 6.08 0.00 0.15 -4.94 105.19 111.40 3f5s n GLY 235 Ca -0.18 -0.49 -0.23 0.00 0.00 0.00 0.00 46.02 45.11 3f5s n GLY 235 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3f5s s MET 236 N -1.81 2.33 -0.10 1.61 1.00 -1.25 -4.92 119.30 116.16 3f5s s MET 236 Ca 0.00 -1.36 0.03 0.00 0.00 0.00 0.00 55.69 54.36 3f5s s MET 236 Cb 0.00 -2.20 0.01 0.00 0.00 0.00 0.00 34.83 32.64 3f5s s MET 236 CO 0.00 0.38 -0.19 -0.08 0.00 0.00 0.00 175.02 175.13 3f5s s THR 237 N -2.22 1.73 0.04 2.05 -1.32 -1.26 -1.23 115.64 113.43 3f5s s THR 237 Ca 0.31 -0.81 0.08 0.00 -1.21 0.00 0.00 61.69 60.06 3f5s s THR 237 Cb -0.07 -1.54 -0.03 0.00 -1.51 0.00 0.00 72.50 69.36 3f5s s THR 237 CO 0.20 0.49 -0.22 -0.36 -2.21 0.00 0.00 174.62 172.51 3f5s s PHE 238 N 0.64 2.43 -0.22 9.09 0.08 -0.20 -4.97 117.98 124.83 3f5s s PHE 238 Ca -0.13 -0.34 -0.11 0.00 0.12 0.00 0.00 56.93 56.47 3f5s s PHE 238 Cb -0.16 -1.43 -0.05 0.00 -0.57 0.00 0.00 43.02 40.80 3f5s s PHE 238 CO 0.04 0.18 0.17 -0.51 -0.10 0.00 0.00 175.22 174.99 3f5s s ASP 239 N -1.29 6.18 0.51 1.36 1.01 -1.26 -0.24 116.67 122.95 3f5s s ASP 239 Ca 0.13 0.20 0.18 0.00 0.71 0.00 0.00 52.55 53.76 3f5s s ASP 239 Cb -0.10 -2.11 1.28 0.00 1.01 0.00 0.00 42.92 43.00 3f5s s ASP 239 CO 0.03 0.10 2.13 0.00 0.21 0.00 0.00 175.17 177.63 3f5s h ALA 240 N 7.18 1.85 0.00 5.23 0.00 -1.38 -3.48 119.26 128.66 3f5s h ALA 240 Ca -0.39 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.48 3f5s h ALA 240 Cb 1.16 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.95 3f5s h ALA 240 CO 0.70 0.06 0.00 0.00 0.00 0.00 0.00 179.25 180.01