#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 5fx2 s LYS 3 N 0.00 3.67 0.10 0.00 1.02 -1.26 -0.41 119.74 122.85 5fx2 s LYS 3 Ca 0.00 -0.47 0.10 0.00 0.02 0.00 0.00 55.97 55.61 5fx2 s LYS 3 Cb 0.00 -3.32 -0.03 0.00 -0.52 0.00 0.00 37.83 33.95 5fx2 s LYS 3 CO 0.00 -0.17 -0.25 0.00 -0.92 0.00 0.00 175.35 174.01 5fx2 s ALA 4 N 1.57 2.14 -0.25 5.17 0.00 0.01 -0.46 121.76 129.94 5fx2 s ALA 4 Ca 0.06 -1.33 -0.05 0.00 0.00 0.00 0.00 51.96 50.64 5fx2 s ALA 4 Cb -0.15 -0.36 -0.00 0.00 0.00 0.00 0.00 23.12 22.61 5fx2 s ALA 4 CO 0.04 0.48 0.02 -1.17 0.00 0.00 0.00 175.76 175.12 5fx2 s LEU 5 N -1.76 3.33 -0.34 0.00 2.96 -0.99 -2.55 118.68 119.32 5fx2 s LEU 5 Ca 0.11 -0.49 -0.09 0.00 -0.22 0.00 0.00 54.13 53.44 5fx2 s LEU 5 Cb -0.10 -1.81 0.02 0.00 0.50 0.00 0.00 46.19 44.80 5fx2 s LEU 5 CO 0.04 -0.08 0.15 -0.63 -1.32 0.00 0.00 176.35 174.50 5fx2 s ILE 6 N 1.50 4.23 -0.14 6.68 1.01 0.87 0.11 121.20 135.45 5fx2 s ILE 6 Ca 0.04 -0.86 -0.01 0.00 0.00 0.00 0.00 60.65 59.83 5fx2 s ILE 6 Cb -0.16 -3.31 -0.01 0.00 0.01 0.00 0.00 42.46 38.99 5fx2 s ILE 6 CO -0.00 -0.12 -0.11 -0.69 0.00 0.00 0.00 174.94 174.01 5fx2 s VAL 7 N 1.51 3.16 0.06 2.92 1.01 0.77 0.96 120.40 130.78 5fx2 s VAL 7 Ca 0.01 -0.62 0.05 0.00 0.00 0.00 0.00 61.98 61.42 5fx2 s VAL 7 Cb -0.19 -2.34 -0.03 0.00 0.00 0.00 0.00 36.38 33.82 5fx2 s VAL 7 CO 0.05 0.51 -0.13 -0.72 0.00 0.00 0.00 175.10 174.81 5fx2 s TYR 8 N 0.46 1.11 -0.25 5.22 -0.85 0.11 -1.21 117.35 121.94 5fx2 s TYR 8 Ca -0.08 -0.45 -0.01 0.00 -0.52 0.00 0.00 57.07 56.01 5fx2 s TYR 8 Cb -0.16 -0.63 0.03 0.00 0.38 0.00 0.00 41.96 41.59 5fx2 s TYR 8 CO 0.04 0.03 -0.07 0.20 -1.52 0.00 0.00 175.55 174.23 5fx2 s GLY 9 N -1.61 1.63 -0.03 5.49 0.00 -0.46 -0.36 107.32 111.98 5fx2 s GLY 9 Ca -0.03 -1.54 0.03 0.00 0.00 0.00 0.00 44.72 43.19 5fx2 s GLY 9 CO 0.02 0.54 -0.12 -0.45 0.00 0.00 0.00 173.10 173.09 5fx2 s SER 10 N 1.27 1.51 -0.23 1.64 0.15 -1.26 -3.51 113.70 113.28 5fx2 s SER 10 Ca -0.02 -0.24 -0.15 0.00 0.70 0.00 0.00 55.95 56.25 5fx2 s SER 10 Cb -0.17 -0.38 -0.09 0.00 -1.71 0.00 0.00 66.02 63.67 5fx2 s SER 10 CO -0.05 0.10 -0.34 0.41 1.20 0.00 0.00 173.24 174.57 5fx2 n THR 11 N 3.18 1.46 0.47 6.45 -1.04 -1.26 -4.66 114.28 118.88 5fx2 n THR 11 Ca -0.18 -0.16 0.10 0.00 -2.04 0.00 0.00 64.05 61.77 5fx2 n THR 11 Cb 0.54 -2.04 0.26 0.00 -1.82 0.00 0.00 70.33 67.27 5fx2 n THR 11 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 5fx2 n THR 12 N -4.28 0.56 -0.69 12.58 -2.24 -1.26 -5.02 114.28 113.94 5fx2 n THR 12 Ca -0.37 -0.66 0.00 0.00 -2.27 0.00 0.00 64.05 60.76 5fx2 n THR 12 Cb 0.72 0.53 0.00 0.00 -2.10 0.00 0.00 70.33 69.48 5fx2 n THR 12 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 5fx2 n GLY 13 N 1.36 0.63 0.05 3.38 0.00 -1.26 -5.00 105.19 104.35 5fx2 n GLY 13 Ca 0.18 -0.22 -0.01 0.00 0.00 0.00 0.00 46.02 45.97 5fx2 n GLY 13 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 5fx2 h ASN 14 N 0.00 0.00 -0.09 1.61 4.21 -1.95 -2.67 115.58 116.69 5fx2 h ASN 14 Ca 0.00 -0.01 -0.04 0.00 1.21 0.00 0.00 56.30 57.47 5fx2 h ASN 14 Cb 0.00 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.19 5fx2 h ASN 14 CO 0.00 0.56 -0.03 0.74 -1.29 0.00 0.00 177.43 177.41 5fx2 h THR 15 N -1.00 1.15 -0.19 2.81 2.02 -1.95 -2.13 112.91 113.62 5fx2 h THR 15 Ca -0.00 -0.60 0.00 0.00 0.77 0.00 0.00 66.41 66.58 5fx2 h THR 15 Cb 0.13 1.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.56 5fx2 h THR 15 CO -0.00 0.20 0.12 -0.08 0.37 0.00 0.00 175.52 176.13 5fx2 h GLU 16 N 0.30 0.26 -0.46 6.66 4.81 -1.87 -0.64 114.58 123.64 5fx2 h GLU 16 Ca 0.07 -0.02 0.07 0.00 -0.13 0.00 0.00 59.36 59.35 5fx2 h GLU 16 Cb 0.25 -0.06 -0.06 0.00 0.63 0.00 0.00 28.75 29.52 5fx2 h GLU 16 CO 0.01 0.19 0.10 -0.92 -0.73 0.00 0.00 179.01 177.67 5fx2 h TYR 17 N 0.24 0.17 0.70 0.92 3.20 -1.09 -2.75 116.97 118.35 5fx2 h TYR 17 Ca 0.07 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.93 5fx2 h TYR 17 Cb -0.00 -0.01 0.01 0.00 1.54 0.00 0.00 36.73 38.27 5fx2 h TYR 17 CO -0.06 0.02 -0.33 1.15 -1.64 0.00 0.00 178.16 177.30 5fx2 h THR 18 N 0.24 0.00 -0.28 1.81 2.02 -1.00 -2.41 112.91 113.29 5fx2 h THR 18 Ca 0.22 -0.05 0.08 0.00 0.77 0.00 0.00 66.41 67.44 5fx2 h THR 18 Cb 0.28 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.68 5fx2 h THR 18 CO -0.28 0.00 0.66 0.00 0.37 0.00 0.00 175.52 176.27 5fx2 h ALA 19 N -1.52 1.96 0.09 6.16 0.00 -1.11 -0.99 119.26 123.85 5fx2 h ALA 19 Ca -0.10 -0.01 -0.31 0.00 0.00 0.00 0.00 54.91 54.49 5fx2 h ALA 19 Cb 0.72 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 5fx2 h ALA 19 CO 0.16 -0.81 -1.64 0.93 0.00 0.00 0.00 179.25 177.88 5fx2 h GLU 20 N 0.00 0.19 -0.06 0.00 5.08 -1.15 -2.16 114.58 116.48 5fx2 h GLU 20 Ca 0.14 -0.33 -0.04 0.00 -1.00 0.00 0.00 59.36 58.13 5fx2 h GLU 20 Cb 1.46 0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.83 5fx2 h GLU 20 CO -0.00 1.00 -0.11 1.15 -1.00 0.00 0.00 179.01 180.05 5fx2 h THR 21 N 0.05 1.41 -0.96 1.13 2.02 -0.80 -2.84 112.91 112.92 5fx2 h THR 21 Ca -0.28 -1.38 0.00 0.00 0.77 0.00 0.00 66.41 65.52 5fx2 h THR 21 Cb 2.01 2.18 -0.05 0.00 -1.74 0.00 0.00 68.15 70.55 5fx2 h THR 21 CO 0.13 0.38 0.61 0.40 0.37 0.00 0.00 175.52 177.41 5fx2 h ILE 22 N -0.30 1.25 0.15 3.11 2.04 -1.36 -2.18 117.51 120.22 5fx2 h ILE 22 Ca 0.00 -0.50 0.01 0.00 1.00 0.00 0.00 64.86 65.37 5fx2 h ILE 22 Cb 0.67 -0.14 -0.02 0.00 -0.74 0.00 0.00 36.82 36.60 5fx2 h ILE 22 CO 0.02 0.25 -0.17 0.00 0.00 0.00 0.00 178.15 178.25 5fx2 h ALA 23 N 1.34 -0.33 -0.62 1.87 0.00 -1.16 -2.28 119.26 118.08 5fx2 h ALA 23 Ca 0.35 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 5fx2 h ALA 23 Cb -0.11 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 5fx2 h ALA 23 CO -0.07 -0.71 0.29 -0.09 0.00 0.00 0.00 179.25 178.67 5fx2 h ARG 24 N -0.37 0.89 -0.77 0.00 9.65 -1.53 0.27 114.38 122.53 5fx2 h ARG 24 Ca 0.01 -0.13 0.10 0.00 -1.10 0.00 0.00 59.98 58.86 5fx2 h ARG 24 Cb 0.36 -0.16 -0.12 0.00 -1.39 0.00 0.00 29.97 28.66 5fx2 h ARG 24 CO -0.06 0.72 -0.47 0.93 2.80 0.00 0.00 179.97 183.89 5fx2 h GLU 25 N 0.85 -0.13 0.76 0.20 4.39 -0.82 0.29 114.58 120.12 5fx2 h GLU 25 Ca 0.21 0.01 -0.04 0.00 0.34 0.00 0.00 59.36 59.88 5fx2 h GLU 25 Cb 0.13 0.03 0.01 0.00 -0.10 0.00 0.00 28.75 28.81 5fx2 h GLU 25 CO -0.03 -0.08 -0.36 -0.07 -1.16 0.00 0.00 179.01 177.31 5fx2 h LEU 26 N -0.13 -0.86 -2.04 1.33 3.38 -1.23 -3.27 115.31 112.49 5fx2 h LEU 26 Ca 0.21 0.03 0.13 0.00 0.09 0.00 0.00 57.88 58.33 5fx2 h LEU 26 Cb 0.54 0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.49 5fx2 h LEU 26 CO -0.81 -0.59 0.36 0.00 0.09 0.00 0.00 178.44 177.48 5fx2 h ALA 27 N -1.49 2.28 -0.00 1.53 0.00 0.24 -1.78 119.26 120.05 5fx2 h ALA 27 Ca -0.10 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.79 5fx2 h ALA 27 Cb 0.78 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.60 5fx2 h ALA 27 CO 0.17 -0.59 -0.13 -0.25 0.00 0.00 0.00 179.25 178.46 5fx2 n ASP 28 N -4.11 0.15 0.04 0.00 9.92 0.92 -3.47 116.55 120.00 5fx2 n ASP 28 Ca 0.08 0.24 0.11 0.00 -0.53 0.00 0.00 54.79 54.69 5fx2 n ASP 28 Cb 0.56 -0.29 0.03 0.00 -0.64 0.00 0.00 41.12 40.78 5fx2 n ASP 28 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 5fx2 n ALA 29 N -1.47 3.10 0.00 2.24 0.00 -0.68 -4.95 120.51 118.75 5fx2 n ALA 29 Ca 0.07 -0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.16 5fx2 n ALA 29 Cb 0.33 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.77 5fx2 n ALA 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 5fx2 n GLY 30 N 1.32 1.09 3.75 0.00 0.00 -1.23 -5.09 105.19 105.03 5fx2 n GLY 30 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 5fx2 n GLY 30 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 5fx2 s TYR 31 N -1.93 3.42 -0.28 1.61 2.02 -1.13 -4.36 117.35 116.70 5fx2 s TYR 31 Ca 0.00 1.51 -0.16 0.00 -0.37 0.00 0.00 57.07 58.06 5fx2 s TYR 31 Cb 0.00 -3.42 -0.03 0.00 -0.40 0.00 0.00 41.96 38.11 5fx2 s TYR 31 CO 0.00 -1.08 0.41 -1.21 -1.57 0.00 0.00 175.55 172.09 5fx2 s GLU 32 N -0.87 3.94 -0.07 -0.62 2.02 0.45 -4.11 118.70 119.44 5fx2 s GLU 32 Ca 0.49 0.02 0.00 0.00 0.02 0.00 0.00 54.97 55.50 5fx2 s GLU 32 Cb -0.33 -3.68 0.02 0.00 0.10 0.00 0.00 34.13 30.23 5fx2 s GLU 32 CO 0.40 -0.35 -0.05 0.08 0.02 0.00 0.00 175.26 175.37 5fx2 s VAL 33 N 2.13 0.66 -0.54 2.63 1.01 -1.26 -0.81 120.40 124.23 5fx2 s VAL 33 Ca 0.16 -0.12 -0.12 0.00 0.00 0.00 0.00 61.98 61.90 5fx2 s VAL 33 Cb -0.16 -0.72 0.14 0.00 0.00 0.00 0.00 36.38 35.64 5fx2 s VAL 33 CO 0.10 0.28 0.45 -0.62 0.00 0.00 0.00 175.10 175.31 5fx2 s ASP 34 N 1.42 5.95 -0.15 3.32 -1.08 -1.06 -5.00 116.67 120.07 5fx2 s ASP 34 Ca -0.02 -2.00 -0.08 0.00 -0.52 0.00 0.00 52.55 49.93 5fx2 s ASP 34 Cb -0.13 -2.09 -0.04 0.00 -1.46 0.00 0.00 42.92 39.19 5fx2 s ASP 34 CO -0.03 -0.72 0.11 -0.44 0.52 0.00 0.00 175.17 174.61 5fx2 s SER 35 N 2.83 6.08 -0.01 -0.34 0.01 -1.26 -0.09 113.70 120.92 5fx2 s SER 35 Ca 0.07 0.29 -0.03 0.00 1.31 0.00 0.00 55.95 57.59 5fx2 s SER 35 Cb -0.26 -2.00 -0.00 0.00 0.21 0.00 0.00 66.02 63.97 5fx2 s SER 35 CO -0.00 0.29 0.06 -0.13 0.41 0.00 0.00 173.24 173.86 5fx2 s ARG 36 N -0.30 0.20 0.13 12.44 0.52 0.27 -4.93 118.95 127.29 5fx2 s ARG 36 Ca 0.10 -0.16 -0.30 0.00 -0.52 0.00 0.00 55.73 54.86 5fx2 s ARG 36 Cb -0.12 0.08 -0.06 0.00 0.52 0.00 0.00 34.95 35.37 5fx2 s ARG 36 CO 0.01 -0.04 1.02 0.34 0.02 0.00 0.00 175.30 176.66 5fx2 s ASP 37 N -0.56 7.40 0.30 0.23 -1.08 -1.26 0.06 116.67 121.74 5fx2 s ASP 37 Ca -0.06 1.91 0.10 0.00 -0.52 0.00 0.00 52.55 53.98 5fx2 s ASP 37 Cb -0.04 -2.59 0.44 0.00 -1.46 0.00 0.00 42.92 39.27 5fx2 s ASP 37 CO 0.00 -0.14 1.67 0.00 0.52 0.00 0.00 175.17 177.22 5fx2 h ALA 38 N 5.46 1.08 -0.99 3.66 0.00 -1.00 -2.66 119.26 124.80 5fx2 h ALA 38 Ca -0.43 -0.49 0.34 0.00 0.00 0.00 0.00 54.91 54.33 5fx2 h ALA 38 Cb 1.21 -0.09 -0.16 0.00 0.00 0.00 0.00 17.79 18.75 5fx2 h ALA 38 CO 0.72 0.67 0.49 0.00 0.00 0.00 0.00 179.25 181.14 5fx2 h ALA 39 N 1.42 1.91 0.00 0.00 0.00 -1.79 -2.13 119.26 118.67 5fx2 h ALA 39 Ca -0.00 0.23 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 5fx2 h ALA 39 Cb 0.96 0.26 -0.00 0.00 0.00 0.00 0.00 17.79 19.01 5fx2 h ALA 39 CO 0.07 -0.69 -1.96 0.43 0.00 0.00 0.00 179.25 177.10 5fx2 n SER 40 N -5.17 0.25 -4.17 0.00 7.64 -1.05 -5.02 113.62 106.11 5fx2 n SER 40 Ca 0.32 0.00 -0.29 0.00 1.01 0.00 0.00 58.87 59.92 5fx2 n SER 40 Cb 1.04 1.93 0.27 0.00 -1.01 0.00 0.00 64.21 66.45 5fx2 n SER 40 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 5fx2 s VAL 41 N -3.43 1.77 -0.08 0.44 0.11 -0.80 -5.02 120.40 113.38 5fx2 s VAL 41 Ca -0.08 0.00 -0.04 0.00 -2.93 0.00 0.00 61.98 58.94 5fx2 s VAL 41 Cb 0.13 -2.02 0.04 0.00 -1.53 0.00 0.00 36.38 33.00 5fx2 s VAL 41 CO 0.86 0.00 0.18 -1.61 -3.33 0.00 0.00 175.10 171.20 5fx2 s GLU 42 N -4.58 0.11 0.54 1.54 2.02 -1.26 -5.02 118.70 112.04 5fx2 s GLU 42 Ca 0.69 0.49 0.23 0.00 0.02 0.00 0.00 54.97 56.39 5fx2 s GLU 42 Cb -0.22 -0.17 1.39 0.00 0.10 0.00 0.00 34.13 35.22 5fx2 s GLU 42 CO 0.64 -0.21 2.06 0.00 0.02 0.00 0.00 175.26 177.77 5fx2 h ALA 43 N 7.60 2.24 -0.58 5.21 0.00 -1.92 -3.40 119.26 128.42 5fx2 h ALA 43 Ca -0.33 -0.01 -0.40 0.00 0.00 0.00 0.00 54.91 54.17 5fx2 h ALA 43 Cb 1.14 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.90 5fx2 h ALA 43 CO 0.32 -0.39 1.53 0.41 0.00 0.00 0.00 179.25 181.12 5fx2 n GLY 44 N -1.58 -0.22 2.62 0.00 0.00 -1.26 -2.54 105.19 102.20 5fx2 n GLY 44 Ca 0.04 0.70 -0.09 0.00 0.00 0.00 0.00 46.02 46.67 5fx2 n GLY 44 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 5fx2 n GLY 45 N 6.23 -0.50 0.29 -0.02 0.00 -1.18 -4.86 105.19 105.15 5fx2 n GLY 45 Ca 0.54 0.01 0.08 0.00 0.00 0.00 0.00 46.02 46.65 5fx2 n GLY 45 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 5fx2 h LEU 46 N -0.12 -0.19 -0.88 0.99 5.85 -1.68 -1.02 115.31 118.26 5fx2 h LEU 46 Ca -0.19 0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.72 5fx2 h LEU 46 Cb 1.14 0.31 0.00 0.00 0.37 0.00 0.00 40.66 42.47 5fx2 h LEU 46 CO 0.23 -0.16 0.00 -0.26 -0.34 0.00 0.00 178.44 177.91 5fx2 h PHE 47 N 0.16 0.00 -2.03 1.25 -1.00 -1.87 -3.46 116.94 109.99 5fx2 h PHE 47 Ca 0.47 0.00 -0.59 0.00 2.81 0.00 0.00 57.97 60.66 5fx2 h PHE 47 Cb 0.87 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.43 5fx2 h PHE 47 CO -0.35 0.00 1.48 -1.21 -1.61 0.00 0.00 178.31 176.62 5fx2 s GLU 48 N -3.41 3.11 0.00 1.51 2.02 -0.39 -2.62 118.70 118.92 5fx2 s GLU 48 Ca 0.04 1.97 0.00 0.00 0.02 0.00 0.00 54.97 57.00 5fx2 s GLU 48 Cb 0.09 -4.37 0.00 0.00 0.10 0.00 0.00 34.13 29.95 5fx2 s GLU 48 CO 0.45 -2.13 0.00 0.41 0.02 0.00 0.00 175.26 174.01 5fx2 n GLY 49 N 5.76 1.23 3.38 -1.39 0.00 -1.26 -5.11 105.19 107.79 5fx2 n GLY 49 Ca 0.30 -0.18 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 5fx2 n GLY 49 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 5fx2 s PHE 50 N -2.15 2.30 -0.07 1.61 0.08 -1.08 -4.95 117.98 113.74 5fx2 s PHE 50 Ca 0.00 -0.39 0.14 0.00 0.12 0.00 0.00 56.93 56.80 5fx2 s PHE 50 Cb 0.00 -1.28 -0.16 0.00 -0.57 0.00 0.00 43.02 41.01 5fx2 s PHE 50 CO 0.00 0.28 0.87 -0.44 -0.10 0.00 0.00 175.22 175.83 5fx2 h ASP 51 N 4.13 0.00 -4.05 1.36 3.32 -1.11 -3.47 116.42 116.60 5fx2 h ASP 51 Ca -0.50 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 56.37 5fx2 h ASP 51 Cb 1.16 0.00 -0.25 0.00 0.22 0.00 0.00 39.33 40.46 5fx2 h ASP 51 CO 0.40 0.78 -0.54 -0.22 -1.72 0.00 0.00 179.24 177.95 5fx2 s LEU 52 N -6.06 1.48 -0.15 1.55 2.96 -1.17 -4.42 118.68 112.86 5fx2 s LEU 52 Ca -0.03 0.18 -0.00 0.00 -0.22 0.00 0.00 54.13 54.06 5fx2 s LEU 52 Cb 0.08 0.53 -0.01 0.00 0.50 0.00 0.00 46.19 47.30 5fx2 s LEU 52 CO 0.81 -0.12 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.89 5fx2 s VAL 53 N -0.25 2.86 -0.30 1.68 1.01 0.27 -2.35 120.40 123.32 5fx2 s VAL 53 Ca -0.03 -0.71 -0.07 0.00 0.00 0.00 0.00 61.98 61.16 5fx2 s VAL 53 Cb -0.03 -2.21 0.01 0.00 0.00 0.00 0.00 36.38 34.15 5fx2 s VAL 53 CO 0.00 0.51 0.10 -0.76 0.00 0.00 0.00 175.10 174.95 5fx2 s LEU 54 N 0.69 3.91 -0.34 3.92 1.43 0.29 -2.04 118.68 126.55 5fx2 s LEU 54 Ca -0.07 -0.67 0.00 0.00 -1.03 0.00 0.00 54.13 52.37 5fx2 s LEU 54 Cb -0.15 -1.91 0.08 0.00 0.03 0.00 0.00 46.19 44.24 5fx2 s LEU 54 CO 0.02 -0.19 0.06 -0.76 0.23 0.00 0.00 176.35 175.70 5fx2 s LEU 55 N 1.53 4.46 0.06 1.79 1.43 -0.86 -0.17 118.68 126.92 5fx2 s LEU 55 Ca 0.03 -1.74 0.03 0.00 -1.03 0.00 0.00 54.13 51.42 5fx2 s LEU 55 Cb -0.17 -1.70 -0.04 0.00 0.03 0.00 0.00 46.19 44.31 5fx2 s LEU 55 CO 0.03 -0.36 0.03 -0.83 0.23 0.00 0.00 176.35 175.44 5fx2 s GLY 56 N 1.31 1.94 -0.29 -3.19 0.00 -0.35 -2.20 107.32 104.54 5fx2 s GLY 56 Ca 0.02 -1.03 -0.23 0.00 0.00 0.00 0.00 44.72 43.48 5fx2 s GLY 56 CO -0.04 -0.98 1.15 0.00 0.00 0.00 0.00 173.10 173.23 5fx2 s SER 58 N 0.38 6.17 0.05 0.00 1.04 -1.23 -4.22 113.70 115.89 5fx2 s SER 58 Ca 0.02 1.32 0.02 0.00 0.48 0.00 0.00 55.95 57.80 5fx2 s SER 58 Cb -0.05 -2.39 -0.04 0.00 0.10 0.00 0.00 66.02 63.64 5fx2 s SER 58 CO -0.10 -0.86 0.05 -0.89 0.98 0.00 0.00 173.24 172.41 5fx2 s THR 59 N -3.13 4.40 0.38 2.02 2.01 -1.07 -1.76 115.64 118.50 5fx2 s THR 59 Ca 0.54 -0.71 0.04 0.00 0.31 0.00 0.00 61.69 61.87 5fx2 s THR 59 Cb -0.11 -3.07 -0.03 0.00 0.01 0.00 0.00 72.50 69.30 5fx2 s THR 59 CO 0.52 0.21 0.15 0.26 -0.69 0.00 0.00 174.62 175.08 5fx2 s TRP 60 N -1.28 1.76 0.00 4.92 0.52 -0.40 -4.89 118.94 119.57 5fx2 s TRP 60 Ca 0.26 -1.35 0.00 0.00 0.02 0.00 0.00 56.10 55.03 5fx2 s TRP 60 Cb -0.12 -1.05 0.00 0.00 -1.15 0.00 0.00 33.47 31.15 5fx2 s TRP 60 CO 0.18 -0.41 0.00 0.41 0.02 0.00 0.00 176.95 177.14 5fx2 n GLY 61 N -0.82 -0.34 0.82 0.98 0.00 -1.26 -2.67 105.19 101.89 5fx2 n GLY 61 Ca -0.03 -1.58 -0.06 0.00 0.00 0.00 0.00 46.02 44.36 5fx2 n GLY 61 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 5fx2 n ASP 62 N -0.89 0.62 0.07 1.61 -0.08 -1.26 -4.86 116.55 111.77 5fx2 n ASP 62 Ca 0.00 0.10 -0.23 0.00 -1.51 0.00 0.00 54.79 53.15 5fx2 n ASP 62 Cb 0.00 -0.23 -0.15 0.00 2.34 0.00 0.00 41.12 43.08 5fx2 n ASP 62 CO 0.00 0.00 0.00 0.44 0.12 0.00 0.00 177.20 177.76 5fx2 h ASP 63 N -0.22 0.61 -4.27 1.67 3.32 -2.05 -3.48 116.42 112.00 5fx2 h ASP 63 Ca -0.12 -0.92 -0.68 0.00 0.02 0.00 0.00 57.03 55.33 5fx2 h ASP 63 Cb 0.94 -0.20 -0.31 0.00 0.22 0.00 0.00 39.33 39.98 5fx2 h ASP 63 CO -0.07 1.73 -0.88 -0.55 -1.72 0.00 0.00 179.24 177.75 5fx2 s SER 64 N -7.29 2.92 -0.22 6.45 0.15 -1.26 -5.11 113.70 109.35 5fx2 s SER 64 Ca -0.16 -0.47 -0.29 0.00 0.70 0.00 0.00 55.95 55.73 5fx2 s SER 64 Cb 0.05 -0.58 0.01 0.00 -1.71 0.00 0.00 66.02 63.79 5fx2 s SER 64 CO 0.85 0.27 1.06 -0.63 1.20 0.00 0.00 173.24 175.99 5fx2 s ILE 65 N -0.35 4.65 0.02 6.45 1.01 -1.26 -4.18 121.20 127.55 5fx2 s ILE 65 Ca 0.03 1.99 0.08 0.00 0.00 0.00 0.00 60.65 62.75 5fx2 s ILE 65 Cb -0.12 -4.28 -0.02 0.00 0.01 0.00 0.00 42.46 38.05 5fx2 s ILE 65 CO 0.01 -0.16 -0.24 -1.61 0.00 0.00 0.00 174.94 172.94 5fx2 s GLU 66 N 3.14 1.73 -0.00 2.79 2.02 -1.09 -5.02 118.70 122.26 5fx2 s GLU 66 Ca 0.45 -0.97 -0.03 0.00 0.02 0.00 0.00 54.97 54.44 5fx2 s GLU 66 Cb -0.16 -1.80 -0.04 0.00 0.10 0.00 0.00 34.13 32.23 5fx2 s GLU 66 CO 0.08 0.48 0.20 -0.51 0.02 0.00 0.00 175.26 175.52 5fx2 s LEU 67 N -0.99 4.37 -0.21 1.80 1.43 -1.26 -1.27 118.68 122.55 5fx2 s LEU 67 Ca 0.10 0.39 -0.37 0.00 -1.03 0.00 0.00 54.13 53.21 5fx2 s LEU 67 Cb -0.09 -2.64 -0.17 0.00 0.03 0.00 0.00 46.19 43.32 5fx2 s LEU 67 CO 0.01 0.26 1.15 1.67 0.23 0.00 0.00 176.35 179.66 5fx2 n GLN 68 N 0.95 0.00 -0.30 1.70 0.00 -0.72 -4.62 117.38 114.40 5fx2 n GLN 68 Ca -0.11 0.00 0.06 0.00 -0.00 0.00 0.00 57.00 56.96 5fx2 n GLN 68 Cb 0.53 -1.29 0.14 0.00 0.00 0.00 0.00 30.24 29.61 5fx2 n GLN 68 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.06 173.59 5fx2 n ASP 69 N 2.35 -0.27 0.01 1.69 2.03 -1.26 -2.43 116.55 118.67 5fx2 n ASP 69 Ca 0.22 1.43 0.06 0.00 0.52 0.00 0.00 54.79 57.02 5fx2 n ASP 69 Cb 0.01 -0.45 0.47 0.00 -0.72 0.00 0.00 41.12 40.43 5fx2 n ASP 69 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 5fx2 h ASP 70 N 0.00 0.40 1.29 1.67 3.32 -1.93 -3.07 116.42 118.09 5fx2 h ASP 70 Ca 0.42 -0.01 -0.10 0.00 0.02 0.00 0.00 57.03 57.36 5fx2 h ASP 70 Cb 0.68 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 40.12 5fx2 h ASP 70 CO -0.85 0.28 -0.74 0.15 -1.72 0.00 0.00 179.24 176.36 5fx2 h PHE 71 N 0.46 0.00 -0.03 4.55 3.04 -1.77 -3.31 116.94 119.87 5fx2 h PHE 71 Ca 0.16 0.00 0.04 0.00 3.98 0.00 0.00 57.97 62.15 5fx2 h PHE 71 Cb 0.09 0.00 -0.05 0.00 2.56 0.00 0.00 35.95 38.54 5fx2 h PHE 71 CO -0.00 0.44 -0.34 0.82 -2.02 0.00 0.00 178.31 177.21 5fx2 h ILE 72 N 0.00 0.27 -0.07 1.41 2.04 -1.49 -1.03 117.51 118.64 5fx2 h ILE 72 Ca -0.05 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.83 5fx2 h ILE 72 Cb 1.37 0.27 -0.00 0.00 -0.74 0.00 0.00 36.82 37.72 5fx2 h ILE 72 CO 0.05 0.00 0.08 1.55 0.00 0.00 0.00 178.15 179.83 5fx2 h PRO 73 N -0.47 0.00 0.12 2.37 0.14 -1.78 0.15 132.00 132.53 5fx2 h PRO 73 Ca 0.07 0.00 -0.24 0.00 0.14 0.00 0.00 66.00 65.97 5fx2 h PRO 73 Cb 0.57 0.00 0.02 0.00 0.14 0.00 0.00 31.00 31.74 5fx2 h PRO 73 CO -0.30 0.00 -1.01 1.25 0.14 0.00 0.00 178.00 178.09 5fx2 h LEU 74 N 0.00 0.69 -0.78 1.56 5.85 -1.78 -3.27 115.31 117.58 5fx2 h LEU 74 Ca 0.03 -0.86 0.12 0.00 0.84 0.00 0.00 57.88 58.02 5fx2 h LEU 74 Cb 0.19 -0.22 -0.08 0.00 0.37 0.00 0.00 40.66 40.92 5fx2 h LEU 74 CO -0.00 1.48 0.38 0.15 -0.34 0.00 0.00 178.44 180.11 5fx2 h PHE 75 N -0.01 0.67 0.13 1.25 3.57 0.36 -2.57 116.94 120.34 5fx2 h PHE 75 Ca -0.16 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.37 5fx2 h PHE 75 Cb 1.74 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 40.30 5fx2 h PHE 75 CO 0.15 0.18 -0.06 -0.44 -2.23 0.00 0.00 178.31 175.91 5fx2 h ASP 76 N 0.59 -0.14 -0.94 0.41 3.32 -1.41 -3.25 116.42 114.99 5fx2 h ASP 76 Ca 0.41 -0.07 -0.61 0.00 0.02 0.00 0.00 57.03 56.78 5fx2 h ASP 76 Cb 0.53 0.04 -0.30 0.00 0.22 0.00 0.00 39.33 39.81 5fx2 h ASP 76 CO -0.33 -0.03 0.61 -1.54 -1.72 0.00 0.00 179.24 176.23 5fx2 n SER 77 N -5.13 6.43 0.11 6.45 3.41 -1.00 -4.78 113.62 119.10 5fx2 n SER 77 Ca -0.08 -3.75 0.13 0.00 -0.26 0.00 0.00 58.87 54.90 5fx2 n SER 77 Cb 0.13 -0.87 0.43 0.00 -0.26 0.00 0.00 64.21 63.64 5fx2 n SER 77 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 5fx2 n LEU 78 N -0.95 0.76 -0.17 1.04 7.94 -1.01 -2.77 117.00 121.84 5fx2 n LEU 78 Ca 0.59 0.60 0.13 0.00 -1.11 0.00 0.00 56.01 56.22 5fx2 n LEU 78 Cb 0.90 -0.39 0.46 0.00 0.53 0.00 0.00 43.42 44.92 5fx2 n LEU 78 CO 0.69 -0.28 0.72 -1.84 -1.11 0.00 0.00 177.39 175.58 5fx2 n GLU 79 N -2.24 0.68 0.03 1.96 0.28 -1.26 -3.57 120.64 116.52 5fx2 n GLU 79 Ca 0.05 -0.34 0.12 0.00 -0.16 0.00 0.00 57.16 56.83 5fx2 n GLU 79 Cb 0.37 -1.49 0.11 0.00 1.43 0.00 0.00 31.44 31.86 5fx2 n GLU 79 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 5fx2 n GLU 80 N -0.87 0.23 0.02 3.44 1.02 -1.12 -4.16 120.64 119.20 5fx2 n GLU 80 Ca 0.12 0.03 0.12 0.00 -0.02 0.00 0.00 57.16 57.41 5fx2 n GLU 80 Cb 0.32 -1.60 0.28 0.00 -0.02 0.00 0.00 31.44 30.41 5fx2 n GLU 80 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 5fx2 n THR 81 N -1.91 0.10 -2.35 2.62 -2.24 -1.23 -3.09 114.28 106.18 5fx2 n THR 81 Ca 0.03 -0.07 -0.02 0.00 -2.27 0.00 0.00 64.05 61.72 5fx2 n THR 81 Cb 0.42 0.05 0.00 0.00 -2.10 0.00 0.00 70.33 68.70 5fx2 n THR 81 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 5fx2 n GLY 82 N 1.46 -2.84 1.52 3.38 0.00 -1.26 -3.64 105.19 103.79 5fx2 n GLY 82 Ca 0.05 0.44 -0.12 0.00 0.00 0.00 0.00 46.02 46.40 5fx2 n GLY 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 5fx2 n ALA 83 N 0.17 4.78 -2.48 4.61 0.00 -1.26 -4.82 120.51 121.51 5fx2 n ALA 83 Ca 0.03 -3.17 -0.43 0.00 0.00 0.00 0.00 53.44 49.88 5fx2 n ALA 83 Cb 0.11 -0.93 -0.02 0.00 0.00 0.00 0.00 19.45 18.61 5fx2 n ALA 83 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 5fx2 s GLN 84 N -3.32 4.32 -0.59 0.00 2.00 -1.26 0.61 119.66 121.42 5fx2 s GLN 84 Ca 0.49 1.63 0.00 0.00 -2.00 0.00 0.00 55.36 55.48 5fx2 s GLN 84 Cb 0.43 -3.62 0.00 0.00 0.80 0.00 0.00 33.01 30.62 5fx2 s GLN 84 CO 0.02 -0.52 0.00 0.41 -0.50 0.00 0.00 175.29 174.70 5fx2 n GLY 85 N 3.41 0.26 3.84 2.59 0.00 -1.11 -4.81 105.19 109.37 5fx2 n GLY 85 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 5fx2 n GLY 85 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 5fx2 s ARG 86 N -3.21 3.51 -0.33 1.61 6.06 -1.12 -4.65 118.95 120.82 5fx2 s ARG 86 Ca 0.00 0.95 -0.09 0.00 -2.50 0.00 0.00 55.73 54.09 5fx2 s ARG 86 Cb 0.00 -2.07 0.02 0.00 0.06 0.00 0.00 34.95 32.96 5fx2 s ARG 86 CO 0.00 -0.64 0.14 0.15 -2.50 0.00 0.00 175.30 172.45 5fx2 s LYS 87 N -4.59 2.95 -0.01 5.12 1.02 -1.26 0.30 119.74 123.26 5fx2 s LYS 87 Ca 0.59 -0.98 0.00 0.00 0.02 0.00 0.00 55.97 55.60 5fx2 s LYS 87 Cb -0.12 -3.55 0.01 0.00 -0.52 0.00 0.00 37.83 33.65 5fx2 s LYS 87 CO 0.44 -0.57 -0.00 0.14 -0.92 0.00 0.00 175.35 174.43 5fx2 s VAL 88 N 1.52 0.10 -0.00 3.17 -7.23 -1.21 0.97 120.40 117.71 5fx2 s VAL 88 Ca 0.02 0.04 0.06 0.00 -1.81 0.00 0.00 61.98 60.29 5fx2 s VAL 88 Cb -0.18 -0.16 -0.02 0.00 0.56 0.00 0.00 36.38 36.58 5fx2 s VAL 88 CO 0.05 0.08 -0.19 0.00 -0.31 0.00 0.00 175.10 174.73 5fx2 s ALA 89 N 0.53 1.57 0.11 1.32 0.00 -0.86 -3.33 121.76 121.11 5fx2 s ALA 89 Ca -0.05 -0.84 0.06 0.00 0.00 0.00 0.00 51.96 51.13 5fx2 s ALA 89 Cb -0.07 -0.38 -0.04 0.00 0.00 0.00 0.00 23.12 22.62 5fx2 s ALA 89 CO -0.01 0.38 -0.03 0.00 0.00 0.00 0.00 175.76 176.10 5fx2 s PHE 91 N -1.37 0.81 -5.00 0.00 -0.71 -0.94 -2.05 117.98 108.72 5fx2 s PHE 91 Ca 0.25 -1.13 0.00 0.00 -1.04 0.00 0.00 56.93 55.00 5fx2 s PHE 91 Cb -0.11 0.10 0.00 0.00 -1.21 0.00 0.00 43.02 41.80 5fx2 s PHE 91 CO 0.17 -1.19 0.00 0.41 -1.34 0.00 0.00 175.22 173.27 5fx2 n GLY 92 N -0.53 -2.78 3.34 1.99 0.00 -0.94 -1.89 105.19 104.38 5fx2 n GLY 92 Ca -0.01 -1.36 -0.25 0.00 0.00 0.00 0.00 46.02 44.41 5fx2 n GLY 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 5fx2 n GLY 94 N 0.71 2.89 3.64 0.00 0.00 -0.77 -2.59 105.19 109.07 5fx2 n GLY 94 Ca -0.16 -0.46 -0.08 0.00 0.00 0.00 0.00 46.02 45.32 5fx2 n GLY 94 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 5fx2 s ASP 95 N 2.00 -0.81 0.00 1.61 -1.08 -1.26 -3.10 116.67 114.03 5fx2 s ASP 95 Ca 0.00 1.36 0.29 0.00 -0.52 0.00 0.00 52.55 53.68 5fx2 s ASP 95 Cb 0.00 1.35 1.25 0.00 -1.46 0.00 0.00 42.92 44.06 5fx2 s ASP 95 CO 0.00 -0.22 1.89 -1.54 0.52 0.00 0.00 175.17 175.82 5fx2 n SER 96 N 3.72 0.26 0.32 -0.34 3.41 -1.26 -3.07 113.62 116.66 5fx2 n SER 96 Ca -0.18 -0.24 0.22 0.00 -0.26 0.00 0.00 58.87 58.40 5fx2 n SER 96 Cb 0.58 -0.18 1.15 0.00 -0.26 0.00 0.00 64.21 65.50 5fx2 n SER 96 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 5fx2 h SER 97 N 0.26 0.00 -2.58 4.04 4.64 -2.02 -3.41 113.55 114.48 5fx2 h SER 97 Ca 0.00 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.82 5fx2 h SER 97 Cb 0.37 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.45 5fx2 h SER 97 CO 0.00 0.00 -0.36 -0.31 -0.87 0.00 0.00 176.83 175.29 5fx2 s TYR 98 N -4.09 3.48 0.11 4.77 1.51 -1.17 -5.05 117.35 116.90 5fx2 s TYR 98 Ca -0.05 0.19 -0.05 0.00 -1.01 0.00 0.00 57.07 56.16 5fx2 s TYR 98 Cb 0.12 -1.74 -0.17 0.00 -0.11 0.00 0.00 41.96 40.06 5fx2 s TYR 98 CO 0.38 0.37 1.23 1.49 -1.11 0.00 0.00 175.55 177.92 5fx2 h GLU 99 N 1.50 0.36 -2.19 -0.62 4.81 -1.88 -3.34 114.58 113.22 5fx2 h GLU 99 Ca -0.50 -0.47 -0.60 0.00 -0.13 0.00 0.00 59.36 57.66 5fx2 h GLU 99 Cb 1.21 0.15 -0.42 0.00 0.63 0.00 0.00 28.75 30.32 5fx2 h GLU 99 CO 0.64 1.16 -0.60 0.66 -0.73 0.00 0.00 179.01 180.14 5fx2 n TYR 100 N -3.67 3.63 -1.61 0.92 4.01 -1.26 -5.08 117.16 114.10 5fx2 n TYR 100 Ca -0.08 -4.14 -0.53 0.00 -0.16 0.00 0.00 57.90 53.00 5fx2 n TYR 100 Cb 0.91 -0.55 -0.06 0.00 -0.31 0.00 0.00 39.34 39.33 5fx2 n TYR 100 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 5fx2 n PHE 101 N 0.76 1.63 -3.57 -0.72 7.35 -1.26 -1.55 117.46 120.10 5fx2 n PHE 101 Ca 0.30 0.61 -0.24 0.00 -0.76 0.00 0.00 57.45 57.35 5fx2 n PHE 101 Cb 0.41 -2.36 -0.03 0.00 0.35 0.00 0.00 39.48 37.85 5fx2 n PHE 101 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 5fx2 n GLY 103 N -0.98 -0.89 0.17 0.00 0.00 -0.60 -1.52 105.19 101.37 5fx2 n GLY 103 Ca 0.04 0.20 -0.11 0.00 0.00 0.00 0.00 46.02 46.14 5fx2 n GLY 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 5fx2 h ALA 104 N 2.01 0.49 -0.71 4.61 0.00 -1.85 -2.97 119.26 120.84 5fx2 h ALA 104 Ca 0.00 -0.66 -0.03 0.00 0.00 0.00 0.00 54.91 54.23 5fx2 h ALA 104 Cb 0.02 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 5fx2 h ALA 104 CO 0.00 0.79 0.33 0.28 0.00 0.00 0.00 179.25 180.65 5fx2 h VAL 105 N 0.26 1.23 -0.85 0.00 2.07 -1.50 -2.12 116.25 115.34 5fx2 h VAL 105 Ca -0.05 -0.67 -0.03 0.00 0.82 0.00 0.00 66.70 66.77 5fx2 h VAL 105 Cb 1.43 0.37 -0.04 0.00 -1.52 0.00 0.00 31.29 31.53 5fx2 h VAL 105 CO 0.14 0.28 0.43 0.44 0.02 0.00 0.00 177.57 178.88 5fx2 h ASP 106 N 0.99 1.09 -0.05 0.57 5.19 -1.59 -2.43 116.42 120.18 5fx2 h ASP 106 Ca 0.24 -0.12 -0.11 0.00 -0.62 0.00 0.00 57.03 56.42 5fx2 h ASP 106 Cb 0.13 -0.28 0.01 0.00 0.18 0.00 0.00 39.33 39.37 5fx2 h ASP 106 CO -0.03 0.91 -0.39 0.00 -3.12 0.00 0.00 179.24 176.61 5fx2 h ALA 107 N 1.23 0.12 -0.45 3.45 0.00 -1.45 -3.10 119.26 119.06 5fx2 h ALA 107 Ca 0.29 -0.48 0.09 0.00 0.00 0.00 0.00 54.91 54.82 5fx2 h ALA 107 Cb 0.09 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 17.79 5fx2 h ALA 107 CO -0.04 0.23 -0.13 0.82 0.00 0.00 0.00 179.25 180.13 5fx2 h ILE 108 N -0.14 0.51 -0.37 0.00 2.04 -0.90 -2.53 117.51 116.11 5fx2 h ILE 108 Ca -0.03 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.81 5fx2 h ILE 108 Cb 1.06 0.51 -0.02 0.00 -0.74 0.00 0.00 36.82 37.63 5fx2 h ILE 108 CO 0.08 0.00 0.17 -0.33 0.00 0.00 0.00 178.15 178.06 5fx2 h GLU 109 N -0.02 0.52 0.01 2.37 5.08 -1.60 -1.63 114.58 119.30 5fx2 h GLU 109 Ca 0.22 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.49 5fx2 h GLU 109 Cb 0.36 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.51 5fx2 h GLU 109 CO -0.48 0.42 -0.11 1.49 -1.00 0.00 0.00 179.01 179.33 5fx2 h GLU 110 N 0.52 0.05 0.00 2.33 4.57 -1.38 -2.59 114.58 118.07 5fx2 h GLU 110 Ca 0.13 -0.07 -0.04 0.00 -1.18 0.00 0.00 59.36 58.20 5fx2 h GLU 110 Cb 0.08 0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.69 5fx2 h GLU 110 CO -0.02 0.97 -0.20 -0.22 -1.18 0.00 0.00 179.01 178.37 5fx2 h LYS 111 N -0.84 0.00 0.19 1.92 1.63 -1.32 -2.36 116.57 115.79 5fx2 h LYS 111 Ca -0.02 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.77 5fx2 h LYS 111 Cb 1.03 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.66 5fx2 h LYS 111 CO 0.02 0.20 -0.09 -0.07 -3.45 0.00 0.00 179.45 176.06 5fx2 h LEU 112 N 0.00 -0.21 -0.06 5.20 3.38 -1.30 -2.29 115.31 120.02 5fx2 h LEU 112 Ca -0.00 -0.30 0.03 0.00 0.09 0.00 0.00 57.88 57.70 5fx2 h LEU 112 Cb 0.55 0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.30 5fx2 h LEU 112 CO 0.03 0.23 -0.51 0.50 0.09 0.00 0.00 178.44 178.77 5fx2 h LYS 113 N -0.71 -0.59 0.00 1.13 3.64 -1.29 0.49 116.57 119.24 5fx2 h LYS 113 Ca -0.03 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 5fx2 h LYS 113 Cb 0.50 0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.45 5fx2 h LYS 113 CO 0.04 -0.39 0.00 0.09 -2.27 0.00 0.00 179.45 176.92 5fx2 n ASN 114 N -5.45 0.30 -0.10 4.20 4.13 -0.90 -1.35 115.26 116.09 5fx2 n ASN 114 Ca -0.06 0.62 -0.11 0.00 1.68 0.00 0.00 54.58 56.70 5fx2 n ASN 114 Cb 0.39 -0.67 -0.15 0.00 -1.54 0.00 0.00 39.78 37.81 5fx2 n ASN 114 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 5fx2 n LEU 115 N -1.88 0.53 0.00 3.41 4.77 0.10 -5.05 117.00 118.88 5fx2 n LEU 115 Ca 0.00 0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 5fx2 n LEU 115 Cb 0.07 0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.41 5fx2 n LEU 115 CO 0.08 0.56 0.00 0.61 -1.33 0.00 0.00 177.39 177.31 5fx2 n GLY 116 N 1.81 2.75 3.08 -0.72 0.00 0.13 -4.44 105.19 107.81 5fx2 n GLY 116 Ca -0.34 -0.49 -0.36 0.00 0.00 0.00 0.00 46.02 44.83 5fx2 n GLY 116 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 5fx2 n ALA 117 N 0.00 -5.10 -3.79 4.61 0.00 2.63 -2.74 120.51 116.13 5fx2 n ALA 117 Ca 0.00 -0.99 -0.34 0.00 0.00 0.00 0.00 53.44 52.11 5fx2 n ALA 117 Cb 0.00 -1.15 -0.15 0.00 0.00 0.00 0.00 19.45 18.16 5fx2 n ALA 117 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 5fx2 s GLU 118 N -2.38 2.81 -0.35 0.00 2.02 0.87 -4.52 118.70 117.16 5fx2 s GLU 118 Ca 0.43 -0.98 -0.26 0.00 0.02 0.00 0.00 54.97 54.17 5fx2 s GLU 118 Cb -0.08 -2.93 0.01 0.00 0.10 0.00 0.00 34.13 31.24 5fx2 s GLU 118 CO 0.73 -0.39 0.94 0.42 0.02 0.00 0.00 175.26 176.98 5fx2 s ILE 119 N 1.30 4.60 -0.12 -1.63 1.09 -1.26 -3.36 121.20 121.83 5fx2 s ILE 119 Ca 0.00 1.30 0.29 0.00 -1.10 0.00 0.00 60.65 61.15 5fx2 s ILE 119 Cb -0.16 -4.32 0.32 0.00 -1.06 0.00 0.00 42.46 37.24 5fx2 s ILE 119 CO -0.05 -0.48 1.88 -0.37 -0.10 0.00 0.00 174.94 175.81 5fx2 h VAL 120 N 5.77 0.00 -1.59 2.92 -1.51 -1.93 -3.45 116.25 116.46 5fx2 h VAL 120 Ca -0.23 -0.31 0.20 0.00 -1.23 0.00 0.00 66.70 65.13 5fx2 h VAL 120 Cb 1.08 1.16 -0.20 0.00 -2.13 0.00 0.00 31.29 31.20 5fx2 h VAL 120 CO 0.98 0.00 0.73 -1.58 -1.23 0.00 0.00 177.57 176.47 5fx2 s GLN 121 N -3.55 0.42 0.19 5.19 2.00 -1.26 -4.91 119.66 117.74 5fx2 s GLN 121 Ca 0.02 -0.09 -0.30 0.00 -2.00 0.00 0.00 55.36 52.98 5fx2 s GLN 121 Cb 0.09 0.19 -0.09 0.00 0.80 0.00 0.00 33.01 34.01 5fx2 s GLN 121 CO 0.44 -0.17 1.29 -0.51 -0.50 0.00 0.00 175.29 175.84 5fx2 s ASP 122 N -1.93 6.93 0.61 6.67 1.01 -1.26 -4.67 116.67 124.03 5fx2 s ASP 122 Ca 0.07 2.37 -0.19 0.00 0.71 0.00 0.00 52.55 55.51 5fx2 s ASP 122 Cb -0.01 -2.61 -0.03 0.00 1.01 0.00 0.00 42.92 41.28 5fx2 s ASP 122 CO -0.05 -0.50 1.16 0.61 0.21 0.00 0.00 175.17 176.61 5fx2 n GLY 123 N 2.33 0.21 3.46 0.21 0.00 -1.26 -4.91 105.19 105.24 5fx2 n GLY 123 Ca 0.06 -0.12 -0.43 0.00 0.00 0.00 0.00 46.02 45.52 5fx2 n GLY 123 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 5fx2 s LEU 124 N -3.23 5.03 -0.42 0.99 2.96 -0.87 -5.01 118.68 118.13 5fx2 s LEU 124 Ca 0.78 -0.83 -0.09 0.00 -0.22 0.00 0.00 54.13 53.77 5fx2 s LEU 124 Cb -0.40 -2.32 0.08 0.00 0.50 0.00 0.00 46.19 44.04 5fx2 s LEU 124 CO 0.44 -0.60 0.26 -0.13 -1.32 0.00 0.00 176.35 175.00 5fx2 s ARG 125 N 2.03 2.61 -0.14 1.98 0.52 -1.26 -2.21 118.95 122.48 5fx2 s ARG 125 Ca 0.10 -1.44 -0.18 0.00 -0.52 0.00 0.00 55.73 53.69 5fx2 s ARG 125 Cb -0.19 -3.78 -0.04 0.00 0.52 0.00 0.00 34.95 31.47 5fx2 s ARG 125 CO 0.12 -0.94 0.48 0.42 0.02 0.00 0.00 175.30 175.40 5fx2 s ILE 126 N 1.43 5.17 -0.56 1.52 1.01 -0.58 -5.03 121.20 124.16 5fx2 s ILE 126 Ca 0.03 0.94 -0.18 0.00 0.00 0.00 0.00 60.65 61.44 5fx2 s ILE 126 Cb -0.23 -3.82 0.10 0.00 0.01 0.00 0.00 42.46 38.52 5fx2 s ILE 126 CO 0.02 0.29 0.65 -0.62 0.00 0.00 0.00 174.94 175.28 5fx2 s ASP 127 N 0.77 6.19 0.00 3.58 -1.08 -1.26 -1.85 116.67 123.02 5fx2 s ASP 127 Ca 0.25 -1.38 0.00 0.00 -0.52 0.00 0.00 52.55 50.90 5fx2 s ASP 127 Cb -0.15 -2.28 0.00 0.00 -1.46 0.00 0.00 42.92 39.03 5fx2 s ASP 127 CO 0.10 -1.02 0.00 0.61 0.52 0.00 0.00 175.17 175.38 5fx2 n GLY 128 N 5.25 0.17 3.70 2.66 0.00 -1.18 -4.94 105.19 110.86 5fx2 n GLY 128 Ca -0.10 -2.26 -0.42 0.00 0.00 0.00 0.00 46.02 43.25 5fx2 n GLY 128 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 5fx2 s ASP 129 N -4.00 6.85 0.51 1.61 -1.08 -1.26 -4.75 116.67 114.55 5fx2 s ASP 129 Ca 0.00 2.22 0.19 0.00 -0.52 0.00 0.00 52.55 54.44 5fx2 s ASP 129 Cb 0.00 -2.57 1.29 0.00 -1.46 0.00 0.00 42.92 40.18 5fx2 s ASP 129 CO 0.00 -0.67 2.10 1.55 0.52 0.00 0.00 175.17 178.67 5fx2 h PRO 130 N 7.28 0.00 -0.02 4.34 0.13 -1.92 -3.08 132.00 138.72 5fx2 h PRO 130 Ca -0.40 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.73 5fx2 h PRO 130 Cb 1.20 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 5fx2 h PRO 130 CO 0.88 0.08 0.08 0.00 -0.23 0.00 0.00 178.00 178.80 5fx2 h ARG 131 N 0.00 0.00 -0.34 0.86 3.08 -1.94 -0.86 114.38 115.18 5fx2 h ARG 131 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 5fx2 h ARG 131 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.21 5fx2 h ARG 131 CO 0.01 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.91 5fx2 n ALA 132 N -2.12 2.27 -0.28 0.04 0.00 -1.16 -4.14 120.51 115.12 5fx2 n ALA 132 Ca -0.02 -1.06 0.00 0.00 0.00 0.00 0.00 53.44 52.35 5fx2 n ALA 132 Cb 0.15 -0.51 0.00 0.00 0.00 0.00 0.00 19.45 19.09 5fx2 n ALA 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 5fx2 n ALA 133 N 0.74 1.75 -0.50 0.00 0.00 -0.40 -4.90 120.51 117.20 5fx2 n ALA 133 Ca 0.13 -0.73 0.40 0.00 0.00 0.00 0.00 53.44 53.23 5fx2 n ALA 133 Cb 0.44 0.00 0.63 0.00 0.00 0.00 0.00 19.45 20.52 5fx2 n ALA 133 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 5fx2 n ARG 134 N -0.27 -0.01 0.10 0.00 0.63 -0.79 0.43 116.66 116.75 5fx2 n ARG 134 Ca 0.00 0.95 -0.19 0.00 -0.92 0.00 0.00 57.85 57.69 5fx2 n ARG 134 Cb 0.25 -2.05 -0.12 0.00 0.45 0.00 0.00 32.46 30.99 5fx2 n ARG 134 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 5fx2 h ASP 135 N 0.00 0.68 0.23 6.15 5.19 -1.90 -2.53 116.42 124.23 5fx2 h ASP 135 Ca 0.76 -0.66 -0.10 0.00 -0.62 0.00 0.00 57.03 56.40 5fx2 h ASP 135 Cb 2.79 -0.22 -0.01 0.00 0.18 0.00 0.00 39.33 42.07 5fx2 h ASP 135 CO -0.17 1.49 -0.40 0.44 -3.12 0.00 0.00 179.24 177.48 5fx2 h ASP 136 N 0.18 0.24 -0.01 6.45 3.32 -0.42 -2.82 116.42 123.38 5fx2 h ASP 136 Ca -0.17 -0.10 -0.01 0.00 0.02 0.00 0.00 57.03 56.77 5fx2 h ASP 136 Cb 1.93 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 41.41 5fx2 h ASP 136 CO 0.22 0.63 -0.03 0.40 -1.72 0.00 0.00 179.24 178.74 5fx2 h ILE 137 N 0.20 1.49 -0.53 0.35 2.04 -1.48 -2.90 117.51 116.67 5fx2 h ILE 137 Ca 0.02 -1.47 -0.01 0.00 1.00 0.00 0.00 64.86 64.40 5fx2 h ILE 137 Cb 0.80 2.46 -0.02 0.00 -0.74 0.00 0.00 36.82 39.31 5fx2 h ILE 137 CO 0.06 0.39 0.29 0.58 0.00 0.00 0.00 178.15 179.46 5fx2 h VAL 138 N -0.57 1.18 -0.38 1.67 2.07 -1.48 -2.65 116.25 116.10 5fx2 h VAL 138 Ca -0.00 -0.47 -0.07 0.00 0.82 0.00 0.00 66.70 66.98 5fx2 h VAL 138 Cb 0.65 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 5fx2 h VAL 138 CO 0.01 0.20 -0.04 1.23 0.02 0.00 0.00 177.57 178.98 5fx2 h GLY 139 N 0.71 0.68 1.17 2.17 0.00 -1.61 -2.91 103.07 103.28 5fx2 h GLY 139 Ca 0.19 -0.44 -0.22 0.00 0.00 0.00 0.00 47.33 46.85 5fx2 h GLY 139 CO -0.03 0.41 -0.75 -0.25 0.00 0.00 0.00 176.54 175.93 5fx2 h TRP 140 N 0.59 1.09 -0.55 5.60 7.01 -1.38 -0.87 115.95 127.44 5fx2 h TRP 140 Ca 0.12 -0.47 0.01 0.00 2.11 0.00 0.00 58.89 60.66 5fx2 h TRP 140 Cb 0.43 -0.17 -0.03 0.00 -2.10 0.00 0.00 29.16 27.29 5fx2 h TRP 140 CO 0.02 1.30 0.35 0.00 -2.79 0.00 0.00 178.44 177.32 5fx2 h ALA 141 N 0.57 0.70 -0.58 2.65 0.00 -1.48 -2.86 119.26 118.25 5fx2 h ALA 141 Ca -0.04 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 5fx2 h ALA 141 Cb 1.37 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 5fx2 h ALA 141 CO 0.16 0.10 0.30 1.25 0.00 0.00 0.00 179.25 181.06 5fx2 h HIS 142 N 0.71 0.79 0.00 0.00 -0.00 -1.52 -2.49 115.15 112.65 5fx2 h HIS 142 Ca 0.21 -0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.56 5fx2 h HIS 142 Cb -0.05 -0.25 0.00 0.00 -0.00 0.00 0.00 27.41 27.11 5fx2 h HIS 142 CO -0.05 0.56 -0.29 -0.44 -0.00 0.00 0.00 177.93 177.72 5fx2 h ASP 143 N 0.81 0.00 0.72 3.26 3.32 -1.03 -3.01 116.42 120.48 5fx2 h ASP 143 Ca 0.20 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.21 5fx2 h ASP 143 Cb 0.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.60 5fx2 h ASP 143 CO -0.03 0.02 -1.27 0.52 -1.72 0.00 0.00 179.24 176.76 5fx2 n VAL 144 N -2.58 0.44 -0.01 -1.35 0.31 -1.01 -3.88 118.33 110.26 5fx2 n VAL 144 Ca 0.04 -0.53 -0.00 0.00 -0.01 0.00 0.00 64.34 63.83 5fx2 n VAL 144 Cb 0.48 -0.24 -0.00 0.00 -0.91 0.00 0.00 33.84 33.18 5fx2 n VAL 144 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 5fx2 h ARG 145 N 0.00 -0.02 -1.99 5.55 3.08 -1.51 -3.22 114.38 116.26 5fx2 h ARG 145 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 5fx2 h ARG 145 Cb 0.99 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.05 5fx2 h ARG 145 CO 0.00 -0.01 0.00 0.41 -1.07 0.00 0.00 179.97 179.30 5fx2 n GLY 146 N 1.77 0.71 0.00 0.04 0.00 -1.14 -1.23 105.19 105.34 5fx2 n GLY 146 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 5fx2 n GLY 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 5fx2 n ALA 147 N 1.89 0.04 1.86 4.61 0.00 -1.22 -5.00 120.51 122.69 5fx2 n ALA 147 Ca 0.00 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.59 5fx2 n ALA 147 Cb 0.06 0.00 0.83 0.00 0.00 0.00 0.00 19.45 20.34 5fx2 n ALA 147 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94